USER MOD reduce.3.24.130724 H: found=0, std=0, add=1109, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1112 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 16 TYR OH : rot 50:sc= 0.0268 USER MOD Set 1.2: A 20 GLN : amide:sc= 0.973 K(o=3.2,f=-9.2!) USER MOD Set 1.3: A 52 GLN : amide:sc= 0.522! C(o=3.2!,f=-14!) USER MOD Set 1.4: A 107 LYS NZ :NH3+ 157:sc= 1.72 (180deg=0) USER MOD Set 2.1: A 8 GLN : amide:sc= 0 K(o=-0.015,f=-0.53) USER MOD Set 2.2: A 37 SER OG : rot 160:sc= -0.0148 USER MOD Single : A 6 TYR OH : rot 108:sc= 0.278 USER MOD Single : A 9 SER OG : rot -81:sc= 0.815 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot -75:sc= 0.888 USER MOD Single : A 36 THR OG1 : rot -91:sc= 0.789 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot 81:sc= -0.516! USER MOD Single : A 54 ASN : amide:sc= -0.0496 X(o=-0.05,f=-0.32) USER MOD Single : A 55 HIS : no HD1:sc= -0.0237 X(o=-0.024,f=0) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 GLN : amide:sc= -1.3 K(o=-1.3,f=-6.8!) USER MOD Single : A 62 MET CE :methyl -165:sc= -0.113 (180deg=-0.519) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ 179:sc= 0.983 (180deg=0.969) USER MOD Single : A 70 ASN :FLIP amide:sc= -0.847 F(o=-3!,f=-0.85) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 69:sc= 0.0661 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 81 MET CE :methyl 159:sc= 0 (180deg=-1.08) USER MOD Single : A 83 HIS :FLIP no HE2:sc= 0.296 F(o=-1,f=0.3) USER MOD Single : A 97 THR OG1 : rot 64:sc= 1.04 USER MOD Single : A 100 SER OG : rot 127:sc= -0.128 USER MOD Single : A 108 HIS : no HD1:sc= 0.829 K(o=0.83,f=-2.6!) USER MOD Single : A 110 LYS NZ :NH3+ 162:sc= 1.26 (180deg=0.423) USER MOD Single : A 111 THR OG1 : rot 72:sc= 1.23 USER MOD Single : A 113 ASN : amide:sc= -0.198 X(o=-0.2,f=0) USER MOD Single : A 114 GLN : amide:sc= -0.516 X(o=-0.52,f=-0.049) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 124 SER OG : rot 66:sc= 0.361 USER MOD Single : A 126 THR OG1 : rot 77:sc= -0.857 USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 GLN : amide:sc= -0.201 X(o=-0.2,f=-0.0067) USER MOD Single : A 151 HIS : no HD1:sc= -0.106 X(o=-0.11,f=0) USER MOD ----------------------------------------------------------------- ATOM 35 N ASP A 3 2.848 -3.335 -4.485 1.00 20.33 N ATOM 36 CA ASP A 3 3.554 -3.282 -5.770 1.00 34.45 C ATOM 37 C ASP A 3 2.611 -3.681 -6.916 1.00 71.14 C ATOM 38 O ASP A 3 1.559 -4.285 -6.683 1.00 63.04 O ATOM 39 CB ASP A 3 4.758 -4.231 -5.756 1.00 4.42 C ATOM 40 CG ASP A 3 5.722 -3.927 -4.629 1.00 63.43 C ATOM 41 OD1 ASP A 3 6.524 -2.985 -4.766 1.00 43.41 O ATOM 42 OD2 ASP A 3 5.691 -4.639 -3.606 1.00 11.43 O ATOM 0 HA ASP A 3 3.900 -2.260 -5.926 1.00 34.45 H new ATOM 0 HB2 ASP A 3 4.406 -5.258 -5.662 1.00 4.42 H new ATOM 0 HB3 ASP A 3 5.283 -4.160 -6.708 1.00 4.42 H new ATOM 47 N GLU A 4 2.995 -3.361 -8.148 1.00 5.33 N ATOM 48 CA GLU A 4 2.225 -3.768 -9.329 1.00 63.42 C ATOM 49 C GLU A 4 2.062 -5.298 -9.376 1.00 45.42 C ATOM 50 O GLU A 4 0.964 -5.820 -9.595 1.00 33.11 O ATOM 51 CB GLU A 4 2.925 -3.267 -10.600 1.00 55.44 C ATOM 52 CG GLU A 4 2.149 -3.532 -11.883 1.00 0.33 C ATOM 53 CD GLU A 4 2.875 -3.025 -13.119 1.00 54.13 C ATOM 54 OE1 GLU A 4 2.980 -1.794 -13.292 1.00 0.44 O ATOM 55 OE2 GLU A 4 3.337 -3.853 -13.930 1.00 14.05 O ATOM 0 H GLU A 4 3.834 -2.821 -8.359 1.00 5.33 H new ATOM 0 HA GLU A 4 1.231 -3.325 -9.268 1.00 63.42 H new ATOM 0 HB2 GLU A 4 3.098 -2.195 -10.508 1.00 55.44 H new ATOM 0 HB3 GLU A 4 3.903 -3.743 -10.675 1.00 55.44 H new ATOM 0 HG2 GLU A 4 1.973 -4.603 -11.983 1.00 0.33 H new ATOM 0 HG3 GLU A 4 1.172 -3.054 -11.818 1.00 0.33 H new ATOM 62 N LEU A 5 3.168 -6.006 -9.136 1.00 2.14 N ATOM 63 CA LEU A 5 3.162 -7.472 -9.050 1.00 51.53 C ATOM 64 C LEU A 5 2.231 -7.957 -7.924 1.00 61.12 C ATOM 65 O LEU A 5 1.523 -8.956 -8.070 1.00 35.21 O ATOM 66 CB LEU A 5 4.591 -7.988 -8.806 1.00 52.24 C ATOM 67 CG LEU A 5 4.732 -9.512 -8.633 1.00 13.12 C ATOM 68 CD1 LEU A 5 4.291 -10.250 -9.897 1.00 13.31 C ATOM 69 CD2 LEU A 5 6.170 -9.881 -8.266 1.00 71.42 C ATOM 0 H LEU A 5 4.087 -5.586 -8.997 1.00 2.14 H new ATOM 0 HA LEU A 5 2.789 -7.867 -9.995 1.00 51.53 H new ATOM 0 HB2 LEU A 5 5.217 -7.677 -9.642 1.00 52.24 H new ATOM 0 HB3 LEU A 5 4.985 -7.502 -7.914 1.00 52.24 H new ATOM 0 HG LEU A 5 4.078 -9.822 -7.817 1.00 13.12 H new ATOM 0 HD11 LEU A 5 4.401 -11.324 -9.748 1.00 13.31 H new ATOM 0 HD12 LEU A 5 3.247 -10.018 -10.109 1.00 13.31 H new ATOM 0 HD13 LEU A 5 4.910 -9.935 -10.737 1.00 13.31 H new ATOM 0 HD21 LEU A 5 6.250 -10.962 -8.148 1.00 71.42 H new ATOM 0 HD22 LEU A 5 6.843 -9.552 -9.057 1.00 71.42 H new ATOM 0 HD23 LEU A 5 6.443 -9.393 -7.331 1.00 71.42 H new ATOM 81 N TYR A 6 2.236 -7.231 -6.804 1.00 40.32 N ATOM 82 CA TYR A 6 1.400 -7.579 -5.651 1.00 1.41 C ATOM 83 C TYR A 6 -0.092 -7.468 -6.001 1.00 41.31 C ATOM 84 O TYR A 6 -0.879 -8.343 -5.664 1.00 43.51 O ATOM 85 CB TYR A 6 1.732 -6.671 -4.454 1.00 62.34 C ATOM 86 CG TYR A 6 1.071 -7.092 -3.147 1.00 40.12 C ATOM 87 CD1 TYR A 6 -0.269 -6.807 -2.892 1.00 62.12 C ATOM 88 CD2 TYR A 6 1.790 -7.773 -2.168 1.00 22.34 C ATOM 89 CE1 TYR A 6 -0.867 -7.187 -1.706 1.00 35.13 C ATOM 90 CE2 TYR A 6 1.196 -8.155 -0.979 1.00 63.12 C ATOM 91 CZ TYR A 6 -0.133 -7.860 -0.754 1.00 60.41 C ATOM 92 OH TYR A 6 -0.731 -8.240 0.426 1.00 23.04 O ATOM 0 H TYR A 6 2.809 -6.398 -6.670 1.00 40.32 H new ATOM 0 HA TYR A 6 1.613 -8.613 -5.379 1.00 1.41 H new ATOM 0 HB2 TYR A 6 2.813 -6.656 -4.313 1.00 62.34 H new ATOM 0 HB3 TYR A 6 1.427 -5.652 -4.690 1.00 62.34 H new ATOM 0 HD1 TYR A 6 -0.850 -6.280 -3.634 1.00 62.12 H new ATOM 0 HD2 TYR A 6 2.830 -8.007 -2.340 1.00 22.34 H new ATOM 0 HE1 TYR A 6 -1.907 -6.957 -1.526 1.00 35.13 H new ATOM 0 HE2 TYR A 6 1.769 -8.682 -0.230 1.00 63.12 H new ATOM 0 HH TYR A 6 -0.858 -9.212 0.430 1.00 23.04 H new ATOM 102 N ARG A 7 -0.476 -6.389 -6.683 1.00 53.31 N ATOM 103 CA ARG A 7 -1.882 -6.172 -7.053 1.00 11.20 C ATOM 104 C ARG A 7 -2.400 -7.258 -8.010 1.00 65.51 C ATOM 105 O ARG A 7 -3.513 -7.760 -7.842 1.00 71.14 O ATOM 106 CB ARG A 7 -2.072 -4.785 -7.683 1.00 72.45 C ATOM 107 CG ARG A 7 -1.772 -3.624 -6.736 1.00 62.00 C ATOM 108 CD ARG A 7 -2.617 -3.682 -5.463 1.00 2.11 C ATOM 109 NE ARG A 7 -4.055 -3.720 -5.738 1.00 54.10 N ATOM 110 CZ ARG A 7 -4.972 -3.259 -4.928 1.00 74.33 C ATOM 111 NH1 ARG A 7 -4.643 -2.685 -3.815 1.00 25.31 N ATOM 112 NH2 ARG A 7 -6.222 -3.369 -5.242 1.00 71.24 N ATOM 0 H ARG A 7 0.160 -5.653 -6.991 1.00 53.31 H new ATOM 0 HA ARG A 7 -2.465 -6.230 -6.134 1.00 11.20 H new ATOM 0 HB2 ARG A 7 -1.426 -4.703 -8.557 1.00 72.45 H new ATOM 0 HB3 ARG A 7 -3.099 -4.696 -8.036 1.00 72.45 H new ATOM 0 HG2 ARG A 7 -0.715 -3.639 -6.469 1.00 62.00 H new ATOM 0 HG3 ARG A 7 -1.958 -2.681 -7.250 1.00 62.00 H new ATOM 0 HD2 ARG A 7 -2.338 -4.565 -4.887 1.00 2.11 H new ATOM 0 HD3 ARG A 7 -2.393 -2.814 -4.844 1.00 2.11 H new ATOM 0 HE ARG A 7 -4.361 -4.133 -6.619 1.00 54.10 H new ATOM 0 HH11 ARG A 7 -3.660 -2.589 -3.562 1.00 25.31 H new ATOM 0 HH12 ARG A 7 -5.367 -2.329 -3.191 1.00 25.31 H new ATOM 0 HH21 ARG A 7 -6.490 -3.814 -6.120 1.00 71.24 H new ATOM 0 HH22 ARG A 7 -6.940 -3.010 -4.612 1.00 71.24 H new ATOM 126 N GLN A 8 -1.594 -7.616 -9.011 1.00 70.20 N ATOM 127 CA GLN A 8 -1.978 -8.666 -9.966 1.00 63.14 C ATOM 128 C GLN A 8 -2.205 -10.012 -9.257 1.00 75.32 C ATOM 129 O GLN A 8 -3.254 -10.641 -9.413 1.00 44.15 O ATOM 130 CB GLN A 8 -0.908 -8.823 -11.055 1.00 10.04 C ATOM 131 CG GLN A 8 -1.197 -9.966 -12.024 1.00 33.54 C ATOM 132 CD GLN A 8 -0.165 -10.095 -13.129 1.00 42.13 C ATOM 133 OE1 GLN A 8 0.438 -9.117 -13.554 1.00 31.23 O ATOM 134 NE2 GLN A 8 0.035 -11.304 -13.617 1.00 40.34 N ATOM 0 H GLN A 8 -0.679 -7.201 -9.184 1.00 70.20 H new ATOM 0 HA GLN A 8 -2.916 -8.361 -10.430 1.00 63.14 H new ATOM 0 HB2 GLN A 8 -0.830 -7.891 -11.616 1.00 10.04 H new ATOM 0 HB3 GLN A 8 0.060 -8.992 -10.582 1.00 10.04 H new ATOM 0 HG2 GLN A 8 -1.241 -10.902 -11.467 1.00 33.54 H new ATOM 0 HG3 GLN A 8 -2.180 -9.814 -12.471 1.00 33.54 H new ATOM 0 HE21 GLN A 8 -0.483 -12.098 -13.241 1.00 40.34 H new ATOM 0 HE22 GLN A 8 0.708 -11.445 -14.370 1.00 40.34 H new ATOM 143 N SER A 9 -1.220 -10.438 -8.471 1.00 15.40 N ATOM 144 CA SER A 9 -1.315 -11.691 -7.708 1.00 33.23 C ATOM 145 C SER A 9 -2.474 -11.643 -6.705 1.00 70.11 C ATOM 146 O SER A 9 -3.247 -12.596 -6.588 1.00 2.32 O ATOM 147 CB SER A 9 0.008 -11.970 -6.981 1.00 20.21 C ATOM 148 OG SER A 9 0.430 -10.848 -6.223 1.00 72.41 O ATOM 0 H SER A 9 -0.342 -9.936 -8.342 1.00 15.40 H new ATOM 0 HA SER A 9 -1.512 -12.501 -8.410 1.00 33.23 H new ATOM 0 HB2 SER A 9 -0.111 -12.831 -6.323 1.00 20.21 H new ATOM 0 HB3 SER A 9 0.777 -12.229 -7.709 1.00 20.21 H new ATOM 0 HG SER A 9 0.871 -10.202 -6.813 1.00 72.41 H new ATOM 154 N LEU A 10 -2.594 -10.519 -6.003 1.00 73.44 N ATOM 155 CA LEU A 10 -3.692 -10.295 -5.058 1.00 63.14 C ATOM 156 C LEU A 10 -5.063 -10.486 -5.727 1.00 44.43 C ATOM 157 O LEU A 10 -5.947 -11.128 -5.166 1.00 33.12 O ATOM 158 CB LEU A 10 -3.597 -8.885 -4.454 1.00 34.22 C ATOM 159 CG LEU A 10 -4.733 -8.501 -3.492 1.00 63.10 C ATOM 160 CD1 LEU A 10 -4.817 -9.486 -2.326 1.00 2.41 C ATOM 161 CD2 LEU A 10 -4.549 -7.072 -2.981 1.00 32.10 C ATOM 0 H LEU A 10 -1.939 -9.740 -6.070 1.00 73.44 H new ATOM 0 HA LEU A 10 -3.598 -11.036 -4.264 1.00 63.14 H new ATOM 0 HB2 LEU A 10 -2.649 -8.799 -3.922 1.00 34.22 H new ATOM 0 HB3 LEU A 10 -3.573 -8.160 -5.268 1.00 34.22 H new ATOM 0 HG LEU A 10 -5.673 -8.548 -4.042 1.00 63.10 H new ATOM 0 HD11 LEU A 10 -5.628 -9.193 -1.660 1.00 2.41 H new ATOM 0 HD12 LEU A 10 -5.007 -10.488 -2.710 1.00 2.41 H new ATOM 0 HD13 LEU A 10 -3.876 -9.480 -1.776 1.00 2.41 H new ATOM 0 HD21 LEU A 10 -5.364 -6.821 -2.302 1.00 32.10 H new ATOM 0 HD22 LEU A 10 -3.599 -6.994 -2.452 1.00 32.10 H new ATOM 0 HD23 LEU A 10 -4.553 -6.381 -3.824 1.00 32.10 H new ATOM 173 N GLU A 11 -5.233 -9.928 -6.926 1.00 73.35 N ATOM 174 CA GLU A 11 -6.492 -10.063 -7.669 1.00 32.00 C ATOM 175 C GLU A 11 -6.787 -11.538 -8.000 1.00 3.42 C ATOM 176 O GLU A 11 -7.882 -12.036 -7.738 1.00 31.02 O ATOM 177 CB GLU A 11 -6.443 -9.229 -8.960 1.00 3.33 C ATOM 178 CG GLU A 11 -7.745 -9.237 -9.761 1.00 10.30 C ATOM 179 CD GLU A 11 -8.906 -8.584 -9.018 1.00 74.50 C ATOM 180 OE1 GLU A 11 -9.063 -7.347 -9.115 1.00 22.14 O ATOM 181 OE2 GLU A 11 -9.669 -9.302 -8.335 1.00 63.32 O ATOM 0 H GLU A 11 -4.519 -9.379 -7.405 1.00 73.35 H new ATOM 0 HA GLU A 11 -7.297 -9.690 -7.036 1.00 32.00 H new ATOM 0 HB2 GLU A 11 -6.193 -8.199 -8.705 1.00 3.33 H new ATOM 0 HB3 GLU A 11 -5.638 -9.605 -9.592 1.00 3.33 H new ATOM 0 HG2 GLU A 11 -7.587 -8.717 -10.706 1.00 10.30 H new ATOM 0 HG3 GLU A 11 -8.009 -10.266 -10.004 1.00 10.30 H new ATOM 188 N ILE A 12 -5.795 -12.233 -8.561 1.00 74.34 N ATOM 189 CA ILE A 12 -5.940 -13.654 -8.915 1.00 53.31 C ATOM 190 C ILE A 12 -6.382 -14.486 -7.698 1.00 32.22 C ATOM 191 O ILE A 12 -7.374 -15.219 -7.750 1.00 74.43 O ATOM 192 CB ILE A 12 -4.608 -14.233 -9.465 1.00 24.34 C ATOM 193 CG1 ILE A 12 -4.114 -13.413 -10.668 1.00 34.34 C ATOM 194 CG2 ILE A 12 -4.774 -15.705 -9.851 1.00 51.53 C ATOM 195 CD1 ILE A 12 -2.755 -13.845 -11.186 1.00 33.32 C ATOM 0 H ILE A 12 -4.881 -11.838 -8.782 1.00 74.34 H new ATOM 0 HA ILE A 12 -6.705 -13.714 -9.689 1.00 53.31 H new ATOM 0 HB ILE A 12 -3.860 -14.169 -8.675 1.00 24.34 H new ATOM 0 HG12 ILE A 12 -4.843 -13.494 -11.475 1.00 34.34 H new ATOM 0 HG13 ILE A 12 -4.067 -12.362 -10.385 1.00 34.34 H new ATOM 0 HG21 ILE A 12 -3.829 -16.090 -10.234 1.00 51.53 H new ATOM 0 HG22 ILE A 12 -5.071 -16.280 -8.974 1.00 51.53 H new ATOM 0 HG23 ILE A 12 -5.541 -15.795 -10.621 1.00 51.53 H new ATOM 0 HD11 ILE A 12 -2.474 -13.221 -12.034 1.00 33.32 H new ATOM 0 HD12 ILE A 12 -2.013 -13.738 -10.395 1.00 33.32 H new ATOM 0 HD13 ILE A 12 -2.800 -14.887 -11.502 1.00 33.32 H new ATOM 207 N ILE A 13 -5.639 -14.348 -6.604 1.00 54.51 N ATOM 208 CA ILE A 13 -5.930 -15.067 -5.359 1.00 62.24 C ATOM 209 C ILE A 13 -7.278 -14.628 -4.759 1.00 35.43 C ATOM 210 O ILE A 13 -8.062 -15.457 -4.292 1.00 44.51 O ATOM 211 CB ILE A 13 -4.791 -14.843 -4.328 1.00 33.53 C ATOM 212 CG1 ILE A 13 -3.455 -15.333 -4.916 1.00 52.50 C ATOM 213 CG2 ILE A 13 -5.096 -15.547 -3.003 1.00 74.41 C ATOM 214 CD1 ILE A 13 -2.247 -15.014 -4.061 1.00 64.42 C ATOM 0 H ILE A 13 -4.822 -13.739 -6.551 1.00 54.51 H new ATOM 0 HA ILE A 13 -5.995 -16.129 -5.596 1.00 62.24 H new ATOM 0 HB ILE A 13 -4.716 -13.776 -4.119 1.00 33.53 H new ATOM 0 HG12 ILE A 13 -3.509 -16.412 -5.061 1.00 52.50 H new ATOM 0 HG13 ILE A 13 -3.318 -14.885 -5.900 1.00 52.50 H new ATOM 0 HG21 ILE A 13 -4.280 -15.372 -2.302 1.00 74.41 H new ATOM 0 HG22 ILE A 13 -6.023 -15.153 -2.587 1.00 74.41 H new ATOM 0 HG23 ILE A 13 -5.202 -16.618 -3.176 1.00 74.41 H new ATOM 0 HD11 ILE A 13 -1.348 -15.393 -4.546 1.00 64.42 H new ATOM 0 HD12 ILE A 13 -2.164 -13.934 -3.936 1.00 64.42 H new ATOM 0 HD13 ILE A 13 -2.358 -15.485 -3.084 1.00 64.42 H new ATOM 226 N SER A 14 -7.545 -13.321 -4.796 1.00 15.35 N ATOM 227 CA SER A 14 -8.809 -12.762 -4.289 1.00 20.33 C ATOM 228 C SER A 14 -10.019 -13.403 -4.975 1.00 54.11 C ATOM 229 O SER A 14 -10.984 -13.796 -4.312 1.00 1.04 O ATOM 230 CB SER A 14 -8.851 -11.239 -4.495 1.00 30.34 C ATOM 231 OG SER A 14 -10.071 -10.679 -4.025 1.00 63.42 O ATOM 0 H SER A 14 -6.903 -12.624 -5.173 1.00 15.35 H new ATOM 0 HA SER A 14 -8.856 -12.983 -3.223 1.00 20.33 H new ATOM 0 HB2 SER A 14 -8.013 -10.778 -3.972 1.00 30.34 H new ATOM 0 HB3 SER A 14 -8.730 -11.011 -5.554 1.00 30.34 H new ATOM 0 HG SER A 14 -10.063 -9.710 -4.170 1.00 63.42 H new ATOM 237 N ARG A 15 -9.959 -13.515 -6.304 1.00 64.23 N ATOM 238 CA ARG A 15 -11.046 -14.130 -7.069 1.00 75.12 C ATOM 239 C ARG A 15 -11.245 -15.597 -6.667 1.00 60.24 C ATOM 240 O ARG A 15 -12.344 -15.994 -6.288 1.00 52.15 O ATOM 241 CB ARG A 15 -10.785 -14.036 -8.583 1.00 52.03 C ATOM 242 CG ARG A 15 -10.627 -12.609 -9.104 1.00 62.33 C ATOM 243 CD ARG A 15 -10.733 -12.545 -10.627 1.00 70.03 C ATOM 244 NE ARG A 15 -12.085 -12.865 -11.078 1.00 70.32 N ATOM 245 CZ ARG A 15 -12.388 -13.372 -12.240 1.00 14.51 C ATOM 246 NH1 ARG A 15 -11.471 -13.645 -13.112 1.00 20.30 N ATOM 247 NH2 ARG A 15 -13.627 -13.594 -12.531 1.00 74.10 N ATOM 0 H ARG A 15 -9.175 -13.190 -6.870 1.00 64.23 H new ATOM 0 HA ARG A 15 -11.956 -13.577 -6.837 1.00 75.12 H new ATOM 0 HB2 ARG A 15 -9.883 -14.599 -8.820 1.00 52.03 H new ATOM 0 HB3 ARG A 15 -11.608 -14.515 -9.113 1.00 52.03 H new ATOM 0 HG2 ARG A 15 -11.393 -11.973 -8.659 1.00 62.33 H new ATOM 0 HG3 ARG A 15 -9.661 -12.212 -8.790 1.00 62.33 H new ATOM 0 HD2 ARG A 15 -10.459 -11.548 -10.971 1.00 70.03 H new ATOM 0 HD3 ARG A 15 -10.024 -13.242 -11.073 1.00 70.03 H new ATOM 0 HE ARG A 15 -12.852 -12.677 -10.433 1.00 70.32 H new ATOM 0 HH11 ARG A 15 -10.491 -13.464 -12.895 1.00 20.30 H new ATOM 0 HH12 ARG A 15 -11.729 -14.041 -14.016 1.00 20.30 H new ATOM 0 HH21 ARG A 15 -14.357 -13.373 -11.854 1.00 74.10 H new ATOM 0 HH22 ARG A 15 -13.875 -13.990 -13.438 1.00 74.10 H new ATOM 261 N TYR A 16 -10.170 -16.388 -6.721 1.00 75.44 N ATOM 262 CA TYR A 16 -10.242 -17.820 -6.396 1.00 14.51 C ATOM 263 C TYR A 16 -10.869 -18.063 -5.008 1.00 4.41 C ATOM 264 O TYR A 16 -11.688 -18.970 -4.834 1.00 20.33 O ATOM 265 CB TYR A 16 -8.842 -18.454 -6.468 1.00 22.45 C ATOM 266 CG TYR A 16 -8.810 -19.932 -6.105 1.00 72.30 C ATOM 267 CD1 TYR A 16 -9.617 -20.852 -6.769 1.00 24.12 C ATOM 268 CD2 TYR A 16 -7.973 -20.406 -5.099 1.00 24.51 C ATOM 269 CE1 TYR A 16 -9.592 -22.193 -6.438 1.00 13.34 C ATOM 270 CE2 TYR A 16 -7.942 -21.748 -4.765 1.00 4.12 C ATOM 271 CZ TYR A 16 -8.753 -22.636 -5.436 1.00 4.24 C ATOM 272 OH TYR A 16 -8.730 -23.974 -5.106 1.00 20.43 O ATOM 0 H TYR A 16 -9.240 -16.064 -6.986 1.00 75.44 H new ATOM 0 HA TYR A 16 -10.888 -18.293 -7.135 1.00 14.51 H new ATOM 0 HB2 TYR A 16 -8.450 -18.330 -7.478 1.00 22.45 H new ATOM 0 HB3 TYR A 16 -8.174 -17.912 -5.798 1.00 22.45 H new ATOM 0 HD1 TYR A 16 -10.274 -20.512 -7.556 1.00 24.12 H new ATOM 0 HD2 TYR A 16 -7.336 -19.713 -4.569 1.00 24.51 H new ATOM 0 HE1 TYR A 16 -10.227 -22.892 -6.962 1.00 13.34 H new ATOM 0 HE2 TYR A 16 -7.285 -22.098 -3.982 1.00 4.12 H new ATOM 0 HH TYR A 16 -8.624 -24.510 -5.920 1.00 20.43 H new ATOM 282 N LEU A 17 -10.488 -17.246 -4.025 1.00 22.13 N ATOM 283 CA LEU A 17 -11.056 -17.352 -2.674 1.00 71.12 C ATOM 284 C LEU A 17 -12.557 -17.006 -2.651 1.00 14.24 C ATOM 285 O LEU A 17 -13.347 -17.688 -1.994 1.00 41.44 O ATOM 286 CB LEU A 17 -10.284 -16.465 -1.680 1.00 12.12 C ATOM 287 CG LEU A 17 -9.074 -17.136 -1.001 1.00 52.32 C ATOM 288 CD1 LEU A 17 -8.037 -17.594 -2.025 1.00 44.42 C ATOM 289 CD2 LEU A 17 -8.444 -16.200 0.030 1.00 14.35 C ATOM 0 H LEU A 17 -9.793 -16.507 -4.134 1.00 22.13 H new ATOM 0 HA LEU A 17 -10.953 -18.392 -2.365 1.00 71.12 H new ATOM 0 HB2 LEU A 17 -9.937 -15.575 -2.206 1.00 12.12 H new ATOM 0 HB3 LEU A 17 -10.974 -16.129 -0.906 1.00 12.12 H new ATOM 0 HG LEU A 17 -9.437 -18.024 -0.483 1.00 52.32 H new ATOM 0 HD11 LEU A 17 -7.199 -18.062 -1.509 1.00 44.42 H new ATOM 0 HD12 LEU A 17 -8.491 -18.313 -2.706 1.00 44.42 H new ATOM 0 HD13 LEU A 17 -7.680 -16.734 -2.591 1.00 44.42 H new ATOM 0 HD21 LEU A 17 -7.592 -16.694 0.497 1.00 14.35 H new ATOM 0 HD22 LEU A 17 -8.109 -15.288 -0.464 1.00 14.35 H new ATOM 0 HD23 LEU A 17 -9.181 -15.950 0.793 1.00 14.35 H new ATOM 301 N ARG A 18 -12.953 -15.951 -3.368 1.00 43.12 N ATOM 302 CA ARG A 18 -14.372 -15.564 -3.449 1.00 21.14 C ATOM 303 C ARG A 18 -15.205 -16.619 -4.199 1.00 23.30 C ATOM 304 O ARG A 18 -16.330 -16.928 -3.801 1.00 3.22 O ATOM 305 CB ARG A 18 -14.524 -14.186 -4.118 1.00 24.25 C ATOM 306 CG ARG A 18 -14.055 -13.018 -3.249 1.00 12.23 C ATOM 307 CD ARG A 18 -14.895 -12.874 -1.979 1.00 31.21 C ATOM 308 NE ARG A 18 -16.300 -12.595 -2.278 1.00 13.35 N ATOM 309 CZ ARG A 18 -17.296 -12.875 -1.481 1.00 63.15 C ATOM 310 NH1 ARG A 18 -17.089 -13.427 -0.328 1.00 71.31 N ATOM 311 NH2 ARG A 18 -18.505 -12.593 -1.837 1.00 12.14 N ATOM 0 H ARG A 18 -12.321 -15.351 -3.898 1.00 43.12 H new ATOM 0 HA ARG A 18 -14.752 -15.502 -2.429 1.00 21.14 H new ATOM 0 HB2 ARG A 18 -13.959 -14.182 -5.050 1.00 24.25 H new ATOM 0 HB3 ARG A 18 -15.571 -14.034 -4.379 1.00 24.25 H new ATOM 0 HG2 ARG A 18 -13.010 -13.165 -2.977 1.00 12.23 H new ATOM 0 HG3 ARG A 18 -14.107 -12.094 -3.825 1.00 12.23 H new ATOM 0 HD2 ARG A 18 -14.824 -13.790 -1.392 1.00 31.21 H new ATOM 0 HD3 ARG A 18 -14.489 -12.070 -1.365 1.00 31.21 H new ATOM 0 HE ARG A 18 -16.516 -12.151 -3.171 1.00 13.35 H new ATOM 0 HH11 ARG A 18 -16.138 -13.649 -0.032 1.00 71.31 H new ATOM 0 HH12 ARG A 18 -17.877 -13.640 0.284 1.00 71.31 H new ATOM 0 HH21 ARG A 18 -18.681 -12.152 -2.740 1.00 12.14 H new ATOM 0 HH22 ARG A 18 -19.284 -12.811 -1.215 1.00 12.14 H new ATOM 325 N GLU A 19 -14.647 -17.171 -5.274 1.00 22.25 N ATOM 326 CA GLU A 19 -15.315 -18.226 -6.046 1.00 30.33 C ATOM 327 C GLU A 19 -15.556 -19.474 -5.181 1.00 42.24 C ATOM 328 O GLU A 19 -16.672 -19.997 -5.113 1.00 24.32 O ATOM 329 CB GLU A 19 -14.478 -18.595 -7.281 1.00 1.15 C ATOM 330 CG GLU A 19 -14.265 -17.434 -8.248 1.00 31.45 C ATOM 331 CD GLU A 19 -13.518 -17.845 -9.506 1.00 1.01 C ATOM 332 OE1 GLU A 19 -12.272 -17.867 -9.489 1.00 51.34 O ATOM 333 OE2 GLU A 19 -14.179 -18.163 -10.520 1.00 35.33 O ATOM 0 H GLU A 19 -13.730 -16.906 -5.635 1.00 22.25 H new ATOM 0 HA GLU A 19 -16.282 -17.844 -6.373 1.00 30.33 H new ATOM 0 HB2 GLU A 19 -13.507 -18.966 -6.953 1.00 1.15 H new ATOM 0 HB3 GLU A 19 -14.969 -19.412 -7.810 1.00 1.15 H new ATOM 0 HG2 GLU A 19 -15.233 -17.016 -8.526 1.00 31.45 H new ATOM 0 HG3 GLU A 19 -13.710 -16.644 -7.743 1.00 31.45 H new ATOM 340 N GLN A 20 -14.502 -19.939 -4.513 1.00 13.52 N ATOM 341 CA GLN A 20 -14.605 -21.076 -3.591 1.00 61.03 C ATOM 342 C GLN A 20 -15.596 -20.795 -2.450 1.00 13.20 C ATOM 343 O GLN A 20 -16.355 -21.673 -2.044 1.00 23.11 O ATOM 344 CB GLN A 20 -13.226 -21.416 -3.010 1.00 0.52 C ATOM 345 CG GLN A 20 -12.319 -22.172 -3.973 1.00 52.33 C ATOM 346 CD GLN A 20 -12.841 -23.564 -4.286 1.00 3.04 C ATOM 347 OE1 GLN A 20 -12.555 -24.517 -3.572 1.00 64.12 O ATOM 348 NE2 GLN A 20 -13.607 -23.694 -5.349 1.00 63.41 N ATOM 0 H GLN A 20 -13.564 -19.547 -4.591 1.00 13.52 H new ATOM 0 HA GLN A 20 -14.980 -21.927 -4.160 1.00 61.03 H new ATOM 0 HB2 GLN A 20 -12.731 -20.492 -2.710 1.00 0.52 H new ATOM 0 HB3 GLN A 20 -13.360 -22.013 -2.108 1.00 0.52 H new ATOM 0 HG2 GLN A 20 -12.224 -21.605 -4.899 1.00 52.33 H new ATOM 0 HG3 GLN A 20 -11.320 -22.249 -3.543 1.00 52.33 H new ATOM 0 HE21 GLN A 20 -13.826 -22.879 -5.923 1.00 63.41 H new ATOM 0 HE22 GLN A 20 -13.981 -24.609 -5.599 1.00 63.41 H new ATOM 357 N ALA A 21 -15.574 -19.569 -1.936 1.00 13.22 N ATOM 358 CA ALA A 21 -16.484 -19.161 -0.862 1.00 72.11 C ATOM 359 C ALA A 21 -17.949 -19.177 -1.318 1.00 74.02 C ATOM 360 O ALA A 21 -18.835 -19.639 -0.595 1.00 5.05 O ATOM 361 CB ALA A 21 -16.099 -17.774 -0.351 1.00 44.14 C ATOM 0 H ALA A 21 -14.935 -18.836 -2.245 1.00 13.22 H new ATOM 0 HA ALA A 21 -16.389 -19.883 -0.051 1.00 72.11 H new ATOM 0 HB1 ALA A 21 -16.780 -17.478 0.447 1.00 44.14 H new ATOM 0 HB2 ALA A 21 -15.079 -17.798 0.033 1.00 44.14 H new ATOM 0 HB3 ALA A 21 -16.163 -17.055 -1.168 1.00 44.14 H new ATOM 367 N THR A 22 -18.194 -18.682 -2.528 1.00 71.14 N ATOM 368 CA THR A 22 -19.556 -18.570 -3.067 1.00 15.21 C ATOM 369 C THR A 22 -20.000 -19.854 -3.782 1.00 13.04 C ATOM 370 O THR A 22 -21.162 -19.986 -4.171 1.00 2.01 O ATOM 371 CB THR A 22 -19.674 -17.374 -4.045 1.00 5.24 C ATOM 372 OG1 THR A 22 -18.755 -17.529 -5.141 1.00 24.24 O ATOM 373 CG2 THR A 22 -19.396 -16.053 -3.326 1.00 63.34 C ATOM 0 H THR A 22 -17.466 -18.349 -3.161 1.00 71.14 H new ATOM 0 HA THR A 22 -20.213 -18.405 -2.213 1.00 15.21 H new ATOM 0 HB THR A 22 -20.693 -17.356 -4.431 1.00 5.24 H new ATOM 0 HG1 THR A 22 -17.845 -17.332 -4.835 1.00 24.24 H new ATOM 0 HG21 THR A 22 -19.485 -15.228 -4.033 1.00 63.34 H new ATOM 0 HG22 THR A 22 -20.117 -15.919 -2.520 1.00 63.34 H new ATOM 0 HG23 THR A 22 -18.388 -16.069 -2.912 1.00 63.34 H new ATOM 381 N GLY A 23 -19.074 -20.799 -3.945 1.00 40.31 N ATOM 382 CA GLY A 23 -19.397 -22.073 -4.584 1.00 72.43 C ATOM 383 C GLY A 23 -19.739 -21.938 -6.066 1.00 54.14 C ATOM 384 O GLY A 23 -20.446 -22.781 -6.630 1.00 43.42 O ATOM 0 H GLY A 23 -18.103 -20.707 -3.646 1.00 40.31 H new ATOM 0 HA2 GLY A 23 -18.551 -22.751 -4.474 1.00 72.43 H new ATOM 0 HA3 GLY A 23 -20.240 -22.528 -4.064 1.00 72.43 H new ATOM 541 N GLY A 34 -3.412 -9.603 -18.758 1.00 4.41 N ATOM 542 CA GLY A 34 -4.600 -10.254 -19.309 1.00 71.22 C ATOM 543 C GLY A 34 -4.483 -11.773 -19.435 1.00 35.14 C ATOM 544 O GLY A 34 -5.297 -12.514 -18.874 1.00 35.14 O ATOM 0 HA2 GLY A 34 -5.456 -10.018 -18.676 1.00 71.22 H new ATOM 0 HA3 GLY A 34 -4.806 -9.834 -20.294 1.00 71.22 H new ATOM 548 N ALA A 35 -3.473 -12.240 -20.168 1.00 22.23 N ATOM 549 CA ALA A 35 -3.294 -13.676 -20.411 1.00 44.21 C ATOM 550 C ALA A 35 -2.701 -14.392 -19.191 1.00 23.23 C ATOM 551 O ALA A 35 -3.233 -15.407 -18.740 1.00 52.15 O ATOM 552 CB ALA A 35 -2.409 -13.900 -21.632 1.00 72.21 C ATOM 0 H ALA A 35 -2.766 -11.648 -20.604 1.00 22.23 H new ATOM 0 HA ALA A 35 -4.280 -14.102 -20.598 1.00 44.21 H new ATOM 0 HB1 ALA A 35 -2.285 -14.970 -21.800 1.00 72.21 H new ATOM 0 HB2 ALA A 35 -2.875 -13.447 -22.507 1.00 72.21 H new ATOM 0 HB3 ALA A 35 -1.434 -13.444 -21.463 1.00 72.21 H new ATOM 558 N THR A 36 -1.611 -13.847 -18.651 1.00 42.15 N ATOM 559 CA THR A 36 -0.903 -14.471 -17.521 1.00 4.32 C ATOM 560 C THR A 36 -1.832 -14.728 -16.327 1.00 21.25 C ATOM 561 O THR A 36 -1.850 -15.826 -15.767 1.00 0.15 O ATOM 562 CB THR A 36 0.295 -13.612 -17.050 1.00 65.32 C ATOM 563 OG1 THR A 36 1.224 -13.421 -18.128 1.00 0.13 O ATOM 564 CG2 THR A 36 1.016 -14.263 -15.872 1.00 23.12 C ATOM 0 H THR A 36 -1.195 -12.974 -18.975 1.00 42.15 H new ATOM 0 HA THR A 36 -0.535 -15.427 -17.892 1.00 4.32 H new ATOM 0 HB THR A 36 -0.097 -12.648 -16.728 1.00 65.32 H new ATOM 0 HG1 THR A 36 1.896 -14.134 -18.111 1.00 0.13 H new ATOM 0 HG21 THR A 36 1.852 -13.635 -15.565 1.00 23.12 H new ATOM 0 HG22 THR A 36 0.323 -14.377 -15.039 1.00 23.12 H new ATOM 0 HG23 THR A 36 1.389 -15.243 -16.170 1.00 23.12 H new ATOM 572 N SER A 37 -2.608 -13.722 -15.940 1.00 43.21 N ATOM 573 CA SER A 37 -3.534 -13.861 -14.809 1.00 1.21 C ATOM 574 C SER A 37 -4.678 -14.834 -15.134 1.00 54.34 C ATOM 575 O SER A 37 -5.150 -15.564 -14.261 1.00 4.35 O ATOM 576 CB SER A 37 -4.099 -12.493 -14.409 1.00 73.20 C ATOM 577 OG SER A 37 -3.064 -11.614 -14.004 1.00 52.33 O ATOM 0 H SER A 37 -2.619 -12.805 -16.386 1.00 43.21 H new ATOM 0 HA SER A 37 -2.973 -14.273 -13.970 1.00 1.21 H new ATOM 0 HB2 SER A 37 -4.641 -12.060 -15.250 1.00 73.20 H new ATOM 0 HB3 SER A 37 -4.816 -12.615 -13.597 1.00 73.20 H new ATOM 0 HG SER A 37 -3.380 -10.688 -14.063 1.00 52.33 H new ATOM 583 N ARG A 38 -5.119 -14.845 -16.393 1.00 50.20 N ATOM 584 CA ARG A 38 -6.154 -15.789 -16.842 1.00 3.22 C ATOM 585 C ARG A 38 -5.670 -17.246 -16.738 1.00 2.41 C ATOM 586 O ARG A 38 -6.318 -18.082 -16.102 1.00 34.20 O ATOM 587 CB ARG A 38 -6.593 -15.457 -18.287 1.00 13.41 C ATOM 588 CG ARG A 38 -7.264 -16.621 -19.034 1.00 2.43 C ATOM 589 CD ARG A 38 -6.278 -17.356 -19.949 1.00 44.21 C ATOM 590 NE ARG A 38 -6.669 -18.742 -20.203 1.00 10.52 N ATOM 591 CZ ARG A 38 -6.133 -19.497 -21.125 1.00 2.24 C ATOM 592 NH1 ARG A 38 -5.264 -19.014 -21.952 1.00 61.34 N ATOM 593 NH2 ARG A 38 -6.479 -20.736 -21.221 1.00 42.41 N ATOM 0 H ARG A 38 -4.780 -14.215 -17.120 1.00 50.20 H new ATOM 0 HA ARG A 38 -7.016 -15.683 -16.183 1.00 3.22 H new ATOM 0 HB2 ARG A 38 -7.284 -14.614 -18.259 1.00 13.41 H new ATOM 0 HB3 ARG A 38 -5.719 -15.134 -18.853 1.00 13.41 H new ATOM 0 HG2 ARG A 38 -7.682 -17.323 -18.312 1.00 2.43 H new ATOM 0 HG3 ARG A 38 -8.096 -16.241 -19.627 1.00 2.43 H new ATOM 0 HD2 ARG A 38 -6.204 -16.824 -20.898 1.00 44.21 H new ATOM 0 HD3 ARG A 38 -5.287 -17.340 -19.496 1.00 44.21 H new ATOM 0 HE ARG A 38 -7.406 -19.145 -19.624 1.00 10.52 H new ATOM 0 HH11 ARG A 38 -4.990 -18.034 -21.889 1.00 61.34 H new ATOM 0 HH12 ARG A 38 -4.853 -19.614 -22.667 1.00 61.34 H new ATOM 0 HH21 ARG A 38 -7.169 -21.124 -20.578 1.00 42.41 H new ATOM 0 HH22 ARG A 38 -6.062 -21.328 -21.940 1.00 42.41 H new ATOM 607 N LYS A 39 -4.532 -17.540 -17.365 1.00 41.42 N ATOM 608 CA LYS A 39 -3.973 -18.895 -17.366 1.00 71.44 C ATOM 609 C LYS A 39 -3.598 -19.341 -15.944 1.00 43.41 C ATOM 610 O LYS A 39 -3.778 -20.502 -15.579 1.00 42.11 O ATOM 611 CB LYS A 39 -2.760 -18.961 -18.311 1.00 32.12 C ATOM 612 CG LYS A 39 -1.627 -18.004 -17.943 1.00 62.22 C ATOM 613 CD LYS A 39 -0.612 -17.842 -19.074 1.00 31.21 C ATOM 614 CE LYS A 39 0.028 -19.164 -19.471 1.00 72.33 C ATOM 615 NZ LYS A 39 0.950 -19.005 -20.622 1.00 50.00 N ATOM 0 H LYS A 39 -3.976 -16.858 -17.881 1.00 41.42 H new ATOM 0 HA LYS A 39 -4.733 -19.586 -17.730 1.00 71.44 H new ATOM 0 HB2 LYS A 39 -2.373 -19.980 -18.316 1.00 32.12 H new ATOM 0 HB3 LYS A 39 -3.092 -18.741 -19.326 1.00 32.12 H new ATOM 0 HG2 LYS A 39 -2.045 -17.029 -17.691 1.00 62.22 H new ATOM 0 HG3 LYS A 39 -1.119 -18.372 -17.052 1.00 62.22 H new ATOM 0 HD2 LYS A 39 -1.106 -17.405 -19.942 1.00 31.21 H new ATOM 0 HD3 LYS A 39 0.165 -17.143 -18.764 1.00 31.21 H new ATOM 0 HE2 LYS A 39 0.574 -19.573 -18.621 1.00 72.33 H new ATOM 0 HE3 LYS A 39 -0.751 -19.883 -19.725 1.00 72.33 H new ATOM 0 HZ1 LYS A 39 1.367 -19.927 -20.863 1.00 50.00 H new ATOM 0 HZ2 LYS A 39 0.423 -18.638 -21.440 1.00 50.00 H new ATOM 0 HZ3 LYS A 39 1.707 -18.338 -20.371 1.00 50.00 H new ATOM 629 N ALA A 40 -3.097 -18.407 -15.138 1.00 63.23 N ATOM 630 CA ALA A 40 -2.783 -18.690 -13.735 1.00 45.52 C ATOM 631 C ALA A 40 -4.045 -19.066 -12.942 1.00 44.33 C ATOM 632 O ALA A 40 -4.052 -20.050 -12.204 1.00 23.10 O ATOM 633 CB ALA A 40 -2.092 -17.492 -13.095 1.00 22.23 C ATOM 0 H ALA A 40 -2.899 -17.450 -15.429 1.00 63.23 H new ATOM 0 HA ALA A 40 -2.106 -19.544 -13.710 1.00 45.52 H new ATOM 0 HB1 ALA A 40 -1.865 -17.717 -12.053 1.00 22.23 H new ATOM 0 HB2 ALA A 40 -1.167 -17.277 -13.630 1.00 22.23 H new ATOM 0 HB3 ALA A 40 -2.749 -16.624 -13.144 1.00 22.23 H new ATOM 639 N LEU A 41 -5.115 -18.283 -13.111 1.00 25.23 N ATOM 640 CA LEU A 41 -6.372 -18.514 -12.386 1.00 70.54 C ATOM 641 C LEU A 41 -6.985 -19.891 -12.705 1.00 74.52 C ATOM 642 O LEU A 41 -7.332 -20.649 -11.794 1.00 4.43 O ATOM 643 CB LEU A 41 -7.391 -17.408 -12.702 1.00 63.23 C ATOM 644 CG LEU A 41 -8.759 -17.556 -12.004 1.00 71.40 C ATOM 645 CD1 LEU A 41 -8.605 -17.517 -10.482 1.00 41.33 C ATOM 646 CD2 LEU A 41 -9.730 -16.476 -12.478 1.00 64.15 C ATOM 0 H LEU A 41 -5.138 -17.483 -13.743 1.00 25.23 H new ATOM 0 HA LEU A 41 -6.131 -18.494 -11.323 1.00 70.54 H new ATOM 0 HB2 LEU A 41 -6.960 -16.447 -12.420 1.00 63.23 H new ATOM 0 HB3 LEU A 41 -7.552 -17.382 -13.780 1.00 63.23 H new ATOM 0 HG LEU A 41 -9.171 -18.528 -12.276 1.00 71.40 H new ATOM 0 HD11 LEU A 41 -9.584 -17.623 -10.014 1.00 41.33 H new ATOM 0 HD12 LEU A 41 -7.959 -18.334 -10.161 1.00 41.33 H new ATOM 0 HD13 LEU A 41 -8.163 -16.566 -10.185 1.00 41.33 H new ATOM 0 HD21 LEU A 41 -10.688 -16.600 -11.972 1.00 64.15 H new ATOM 0 HD22 LEU A 41 -9.322 -15.492 -12.245 1.00 64.15 H new ATOM 0 HD23 LEU A 41 -9.874 -16.564 -13.555 1.00 64.15 H new ATOM 658 N GLU A 42 -7.126 -20.217 -13.994 1.00 40.24 N ATOM 659 CA GLU A 42 -7.736 -21.495 -14.385 1.00 54.12 C ATOM 660 C GLU A 42 -6.884 -22.691 -13.936 1.00 65.25 C ATOM 661 O GLU A 42 -7.421 -23.729 -13.544 1.00 1.25 O ATOM 662 CB GLU A 42 -8.010 -21.561 -15.895 1.00 30.52 C ATOM 663 CG GLU A 42 -6.778 -21.424 -16.780 1.00 14.41 C ATOM 664 CD GLU A 42 -7.084 -21.739 -18.237 1.00 12.20 C ATOM 665 OE1 GLU A 42 -7.854 -20.983 -18.869 1.00 0.42 O ATOM 666 OE2 GLU A 42 -6.586 -22.763 -18.751 1.00 10.22 O ATOM 0 H GLU A 42 -6.833 -19.627 -14.773 1.00 40.24 H new ATOM 0 HA GLU A 42 -8.695 -21.553 -13.871 1.00 54.12 H new ATOM 0 HB2 GLU A 42 -8.496 -22.510 -16.120 1.00 30.52 H new ATOM 0 HB3 GLU A 42 -8.716 -20.772 -16.156 1.00 30.52 H new ATOM 0 HG2 GLU A 42 -6.387 -20.409 -16.703 1.00 14.41 H new ATOM 0 HG3 GLU A 42 -5.997 -22.094 -16.421 1.00 14.41 H new ATOM 673 N THR A 43 -5.562 -22.544 -13.974 1.00 23.13 N ATOM 674 CA THR A 43 -4.669 -23.583 -13.452 1.00 14.41 C ATOM 675 C THR A 43 -4.832 -23.725 -11.929 1.00 62.42 C ATOM 676 O THR A 43 -4.989 -24.832 -11.414 1.00 43.31 O ATOM 677 CB THR A 43 -3.183 -23.299 -13.788 1.00 0.23 C ATOM 678 OG1 THR A 43 -3.022 -23.132 -15.204 1.00 72.14 O ATOM 679 CG2 THR A 43 -2.285 -24.440 -13.314 1.00 42.22 C ATOM 0 H THR A 43 -5.086 -21.726 -14.356 1.00 23.13 H new ATOM 0 HA THR A 43 -4.953 -24.516 -13.939 1.00 14.41 H new ATOM 0 HB THR A 43 -2.892 -22.384 -13.271 1.00 0.23 H new ATOM 0 HG1 THR A 43 -3.284 -22.222 -15.458 1.00 72.14 H new ATOM 0 HG21 THR A 43 -1.248 -24.214 -13.563 1.00 42.22 H new ATOM 0 HG22 THR A 43 -2.382 -24.555 -12.235 1.00 42.22 H new ATOM 0 HG23 THR A 43 -2.583 -25.366 -13.806 1.00 42.22 H new ATOM 687 N LEU A 44 -4.827 -22.591 -11.220 1.00 21.24 N ATOM 688 CA LEU A 44 -5.016 -22.571 -9.759 1.00 1.31 C ATOM 689 C LEU A 44 -6.298 -23.299 -9.329 1.00 4.13 C ATOM 690 O LEU A 44 -6.274 -24.141 -8.432 1.00 54.43 O ATOM 691 CB LEU A 44 -5.056 -21.120 -9.242 1.00 13.31 C ATOM 692 CG LEU A 44 -3.689 -20.436 -9.078 1.00 72.42 C ATOM 693 CD1 LEU A 44 -3.861 -18.953 -8.765 1.00 63.23 C ATOM 694 CD2 LEU A 44 -2.880 -21.123 -7.980 1.00 54.51 C ATOM 0 H LEU A 44 -4.694 -21.668 -11.634 1.00 21.24 H new ATOM 0 HA LEU A 44 -4.167 -23.097 -9.323 1.00 1.31 H new ATOM 0 HB2 LEU A 44 -5.660 -20.525 -9.927 1.00 13.31 H new ATOM 0 HB3 LEU A 44 -5.565 -21.110 -8.278 1.00 13.31 H new ATOM 0 HG LEU A 44 -3.146 -20.525 -10.019 1.00 72.42 H new ATOM 0 HD11 LEU A 44 -2.881 -18.489 -8.653 1.00 63.23 H new ATOM 0 HD12 LEU A 44 -4.401 -18.469 -9.579 1.00 63.23 H new ATOM 0 HD13 LEU A 44 -4.424 -18.840 -7.839 1.00 63.23 H new ATOM 0 HD21 LEU A 44 -1.915 -20.628 -7.875 1.00 54.51 H new ATOM 0 HD22 LEU A 44 -3.423 -21.063 -7.037 1.00 54.51 H new ATOM 0 HD23 LEU A 44 -2.724 -22.169 -8.243 1.00 54.51 H new ATOM 706 N ARG A 45 -7.417 -22.973 -9.970 1.00 34.22 N ATOM 707 CA ARG A 45 -8.712 -23.543 -9.586 1.00 23.04 C ATOM 708 C ARG A 45 -8.781 -25.060 -9.854 1.00 2.14 C ATOM 709 O ARG A 45 -9.276 -25.819 -9.018 1.00 15.12 O ATOM 710 CB ARG A 45 -9.857 -22.804 -10.307 1.00 44.24 C ATOM 711 CG ARG A 45 -9.900 -23.021 -11.820 1.00 64.02 C ATOM 712 CD ARG A 45 -10.794 -21.999 -12.518 1.00 14.33 C ATOM 713 NE ARG A 45 -12.134 -21.943 -11.938 1.00 52.14 N ATOM 714 CZ ARG A 45 -12.685 -20.850 -11.480 1.00 3.55 C ATOM 715 NH1 ARG A 45 -12.034 -19.731 -11.498 1.00 65.01 N ATOM 716 NH2 ARG A 45 -13.881 -20.874 -10.996 1.00 23.31 N ATOM 0 H ARG A 45 -7.457 -22.321 -10.754 1.00 34.22 H new ATOM 0 HA ARG A 45 -8.826 -23.405 -8.511 1.00 23.04 H new ATOM 0 HB2 ARG A 45 -10.806 -23.127 -9.880 1.00 44.24 H new ATOM 0 HB3 ARG A 45 -9.765 -21.736 -10.109 1.00 44.24 H new ATOM 0 HG2 ARG A 45 -8.890 -22.956 -12.225 1.00 64.02 H new ATOM 0 HG3 ARG A 45 -10.264 -24.026 -12.032 1.00 64.02 H new ATOM 0 HD2 ARG A 45 -10.332 -21.014 -12.455 1.00 14.33 H new ATOM 0 HD3 ARG A 45 -10.869 -22.249 -13.576 1.00 14.33 H new ATOM 0 HE ARG A 45 -12.671 -22.809 -11.888 1.00 52.14 H new ATOM 0 HH11 ARG A 45 -11.085 -19.699 -11.871 1.00 65.01 H new ATOM 0 HH12 ARG A 45 -12.470 -18.882 -11.139 1.00 65.01 H new ATOM 0 HH21 ARG A 45 -14.403 -21.750 -10.969 1.00 23.31 H new ATOM 0 HH22 ARG A 45 -14.305 -20.017 -10.640 1.00 23.31 H new ATOM 730 N ARG A 46 -8.255 -25.504 -10.999 1.00 25.31 N ATOM 731 CA ARG A 46 -8.336 -26.923 -11.380 1.00 51.24 C ATOM 732 C ARG A 46 -7.439 -27.815 -10.496 1.00 45.01 C ATOM 733 O ARG A 46 -7.856 -28.896 -10.068 1.00 1.53 O ATOM 734 CB ARG A 46 -7.989 -27.108 -12.869 1.00 55.32 C ATOM 735 CG ARG A 46 -6.535 -26.811 -13.228 1.00 21.42 C ATOM 736 CD ARG A 46 -6.265 -27.004 -14.717 1.00 73.23 C ATOM 737 NE ARG A 46 -6.565 -28.364 -15.158 1.00 20.52 N ATOM 738 CZ ARG A 46 -6.831 -28.693 -16.394 1.00 71.23 C ATOM 739 NH1 ARG A 46 -6.826 -27.803 -17.335 1.00 21.03 N ATOM 740 NH2 ARG A 46 -7.108 -29.920 -16.693 1.00 33.22 N ATOM 0 H ARG A 46 -7.773 -24.911 -11.674 1.00 25.31 H new ATOM 0 HA ARG A 46 -9.366 -27.241 -11.218 1.00 51.24 H new ATOM 0 HB2 ARG A 46 -8.217 -28.134 -13.156 1.00 55.32 H new ATOM 0 HB3 ARG A 46 -8.635 -26.460 -13.462 1.00 55.32 H new ATOM 0 HG2 ARG A 46 -6.293 -25.786 -12.945 1.00 21.42 H new ATOM 0 HG3 ARG A 46 -5.879 -27.464 -12.653 1.00 21.42 H new ATOM 0 HD2 ARG A 46 -6.866 -26.297 -15.289 1.00 73.23 H new ATOM 0 HD3 ARG A 46 -5.220 -26.777 -14.928 1.00 73.23 H new ATOM 0 HE ARG A 46 -6.567 -29.104 -14.456 1.00 20.52 H new ATOM 0 HH11 ARG A 46 -6.612 -26.830 -17.116 1.00 21.03 H new ATOM 0 HH12 ARG A 46 -7.036 -28.075 -18.295 1.00 21.03 H new ATOM 0 HH21 ARG A 46 -7.119 -30.633 -15.963 1.00 33.22 H new ATOM 0 HH22 ARG A 46 -7.315 -30.175 -17.658 1.00 33.22 H new ATOM 754 N VAL A 47 -6.212 -27.368 -10.216 1.00 74.33 N ATOM 755 CA VAL A 47 -5.292 -28.138 -9.363 1.00 71.45 C ATOM 756 C VAL A 47 -5.571 -27.892 -7.870 1.00 31.13 C ATOM 757 O VAL A 47 -5.427 -28.796 -7.042 1.00 34.24 O ATOM 758 CB VAL A 47 -3.803 -27.818 -9.672 1.00 4.31 C ATOM 759 CG1 VAL A 47 -3.476 -28.102 -11.137 1.00 22.54 C ATOM 760 CG2 VAL A 47 -3.457 -26.376 -9.306 1.00 13.14 C ATOM 0 H VAL A 47 -5.832 -26.487 -10.561 1.00 74.33 H new ATOM 0 HA VAL A 47 -5.472 -29.189 -9.590 1.00 71.45 H new ATOM 0 HB VAL A 47 -3.189 -28.473 -9.054 1.00 4.31 H new ATOM 0 HG11 VAL A 47 -2.428 -27.870 -11.328 1.00 22.54 H new ATOM 0 HG12 VAL A 47 -3.660 -29.154 -11.353 1.00 22.54 H new ATOM 0 HG13 VAL A 47 -4.106 -27.485 -11.777 1.00 22.54 H new ATOM 0 HG21 VAL A 47 -2.409 -26.184 -9.534 1.00 13.14 H new ATOM 0 HG22 VAL A 47 -4.084 -25.694 -9.881 1.00 13.14 H new ATOM 0 HG23 VAL A 47 -3.631 -26.219 -8.242 1.00 13.14 H new ATOM 770 N GLY A 48 -5.994 -26.670 -7.538 1.00 23.41 N ATOM 771 CA GLY A 48 -6.307 -26.322 -6.156 1.00 45.33 C ATOM 772 C GLY A 48 -7.450 -27.150 -5.587 1.00 15.12 C ATOM 773 O GLY A 48 -7.404 -27.571 -4.431 1.00 63.31 O ATOM 0 H GLY A 48 -6.126 -25.910 -8.206 1.00 23.41 H new ATOM 0 HA2 GLY A 48 -5.419 -26.464 -5.540 1.00 45.33 H new ATOM 0 HA3 GLY A 48 -6.567 -25.265 -6.102 1.00 45.33 H new ATOM 777 N ASP A 49 -8.478 -27.375 -6.407 1.00 31.40 N ATOM 778 CA ASP A 49 -9.593 -28.252 -6.038 1.00 51.12 C ATOM 779 C ASP A 49 -9.086 -29.653 -5.653 1.00 33.32 C ATOM 780 O ASP A 49 -9.469 -30.204 -4.620 1.00 53.33 O ATOM 781 CB ASP A 49 -10.582 -28.340 -7.208 1.00 3.35 C ATOM 782 CG ASP A 49 -11.722 -29.311 -6.950 1.00 42.22 C ATOM 783 OD1 ASP A 49 -12.731 -28.908 -6.335 1.00 42.34 O ATOM 784 OD2 ASP A 49 -11.623 -30.481 -7.380 1.00 33.02 O ATOM 0 H ASP A 49 -8.562 -26.960 -7.335 1.00 31.40 H new ATOM 0 HA ASP A 49 -10.100 -27.832 -5.169 1.00 51.12 H new ATOM 0 HB2 ASP A 49 -10.993 -27.350 -7.404 1.00 3.35 H new ATOM 0 HB3 ASP A 49 -10.047 -28.647 -8.107 1.00 3.35 H new ATOM 789 N GLY A 50 -8.210 -30.213 -6.488 1.00 21.51 N ATOM 790 CA GLY A 50 -7.623 -31.517 -6.197 1.00 50.34 C ATOM 791 C GLY A 50 -6.860 -31.536 -4.874 1.00 75.21 C ATOM 792 O GLY A 50 -6.995 -32.468 -4.077 1.00 0.51 O ATOM 0 H GLY A 50 -7.896 -29.789 -7.361 1.00 21.51 H new ATOM 0 HA2 GLY A 50 -8.412 -32.268 -6.168 1.00 50.34 H new ATOM 0 HA3 GLY A 50 -6.947 -31.796 -7.006 1.00 50.34 H new ATOM 796 N VAL A 51 -6.063 -30.494 -4.636 1.00 12.23 N ATOM 797 CA VAL A 51 -5.329 -30.350 -3.375 1.00 41.24 C ATOM 798 C VAL A 51 -6.288 -30.343 -2.176 1.00 61.21 C ATOM 799 O VAL A 51 -6.045 -31.015 -1.170 1.00 65.41 O ATOM 800 CB VAL A 51 -4.469 -29.059 -3.370 1.00 14.11 C ATOM 801 CG1 VAL A 51 -3.770 -28.862 -2.023 1.00 52.14 C ATOM 802 CG2 VAL A 51 -3.453 -29.100 -4.511 1.00 74.31 C ATOM 0 H VAL A 51 -5.908 -29.735 -5.300 1.00 12.23 H new ATOM 0 HA VAL A 51 -4.665 -31.210 -3.287 1.00 41.24 H new ATOM 0 HB VAL A 51 -5.131 -28.207 -3.522 1.00 14.11 H new ATOM 0 HG11 VAL A 51 -3.175 -27.949 -2.052 1.00 52.14 H new ATOM 0 HG12 VAL A 51 -4.517 -28.784 -1.233 1.00 52.14 H new ATOM 0 HG13 VAL A 51 -3.119 -29.713 -1.823 1.00 52.14 H new ATOM 0 HG21 VAL A 51 -2.855 -28.189 -4.498 1.00 74.31 H new ATOM 0 HG22 VAL A 51 -2.801 -29.964 -4.386 1.00 74.31 H new ATOM 0 HG23 VAL A 51 -3.978 -29.176 -5.463 1.00 74.31 H new ATOM 812 N GLN A 52 -7.389 -29.599 -2.296 1.00 12.53 N ATOM 813 CA GLN A 52 -8.412 -29.564 -1.246 1.00 5.21 C ATOM 814 C GLN A 52 -9.007 -30.959 -0.997 1.00 65.51 C ATOM 815 O GLN A 52 -9.197 -31.358 0.145 1.00 32.53 O ATOM 816 CB GLN A 52 -9.535 -28.580 -1.601 1.00 52.43 C ATOM 817 CG GLN A 52 -9.068 -27.137 -1.748 1.00 13.14 C ATOM 818 CD GLN A 52 -10.209 -26.172 -2.020 1.00 41.24 C ATOM 819 OE1 GLN A 52 -11.330 -26.367 -1.562 1.00 2.42 O ATOM 820 NE2 GLN A 52 -9.936 -25.126 -2.771 1.00 0.42 N ATOM 0 H GLN A 52 -7.596 -29.014 -3.106 1.00 12.53 H new ATOM 0 HA GLN A 52 -7.922 -29.226 -0.333 1.00 5.21 H new ATOM 0 HB2 GLN A 52 -10.001 -28.897 -2.534 1.00 52.43 H new ATOM 0 HB3 GLN A 52 -10.303 -28.626 -0.829 1.00 52.43 H new ATOM 0 HG2 GLN A 52 -8.551 -26.833 -0.838 1.00 13.14 H new ATOM 0 HG3 GLN A 52 -8.345 -27.075 -2.561 1.00 13.14 H new ATOM 0 HE21 GLN A 52 -8.993 -24.993 -3.137 1.00 0.42 H new ATOM 0 HE22 GLN A 52 -10.667 -24.449 -2.987 1.00 0.42 H new ATOM 829 N ARG A 53 -9.285 -31.701 -2.070 1.00 3.13 N ATOM 830 CA ARG A 53 -9.855 -33.055 -1.952 1.00 34.35 C ATOM 831 C ARG A 53 -8.992 -33.968 -1.061 1.00 0.04 C ATOM 832 O ARG A 53 -9.489 -34.579 -0.113 1.00 11.02 O ATOM 833 CB ARG A 53 -10.011 -33.700 -3.339 1.00 55.04 C ATOM 834 CG ARG A 53 -10.973 -32.969 -4.270 1.00 20.50 C ATOM 835 CD ARG A 53 -12.388 -32.899 -3.703 1.00 72.44 C ATOM 836 NE ARG A 53 -12.965 -34.226 -3.469 1.00 74.42 N ATOM 837 CZ ARG A 53 -14.206 -34.543 -3.735 1.00 71.34 C ATOM 838 NH1 ARG A 53 -14.980 -33.704 -4.345 1.00 51.12 N ATOM 839 NH2 ARG A 53 -14.659 -35.712 -3.416 1.00 11.54 N ATOM 0 H ARG A 53 -9.127 -31.394 -3.030 1.00 3.13 H new ATOM 0 HA ARG A 53 -10.834 -32.947 -1.485 1.00 34.35 H new ATOM 0 HB2 ARG A 53 -9.032 -33.750 -3.815 1.00 55.04 H new ATOM 0 HB3 ARG A 53 -10.357 -34.726 -3.212 1.00 55.04 H new ATOM 0 HG2 ARG A 53 -10.605 -31.959 -4.448 1.00 20.50 H new ATOM 0 HG3 ARG A 53 -10.996 -33.475 -5.235 1.00 20.50 H new ATOM 0 HD2 ARG A 53 -12.373 -32.342 -2.766 1.00 72.44 H new ATOM 0 HD3 ARG A 53 -13.025 -32.346 -4.393 1.00 72.44 H new ATOM 0 HE ARG A 53 -12.361 -34.947 -3.074 1.00 74.42 H new ATOM 0 HH11 ARG A 53 -14.623 -32.789 -4.621 1.00 51.12 H new ATOM 0 HH12 ARG A 53 -15.947 -33.958 -4.549 1.00 51.12 H new ATOM 0 HH21 ARG A 53 -14.048 -36.388 -2.957 1.00 11.54 H new ATOM 0 HH22 ARG A 53 -15.627 -35.958 -3.624 1.00 11.54 H new ATOM 853 N ASN A 54 -7.698 -34.052 -1.371 1.00 71.22 N ATOM 854 CA ASN A 54 -6.781 -34.933 -0.632 1.00 41.55 C ATOM 855 C ASN A 54 -6.414 -34.361 0.752 1.00 12.33 C ATOM 856 O ASN A 54 -6.198 -35.108 1.706 1.00 42.34 O ATOM 857 CB ASN A 54 -5.499 -35.171 -1.442 1.00 43.15 C ATOM 858 CG ASN A 54 -5.774 -35.677 -2.850 1.00 54.24 C ATOM 859 OD1 ASN A 54 -5.959 -36.869 -3.071 1.00 20.41 O ATOM 860 ND2 ASN A 54 -5.782 -34.778 -3.818 1.00 11.51 N ATOM 0 H ASN A 54 -7.258 -33.525 -2.125 1.00 71.22 H new ATOM 0 HA ASN A 54 -7.302 -35.878 -0.478 1.00 41.55 H new ATOM 0 HB2 ASN A 54 -4.934 -34.241 -1.500 1.00 43.15 H new ATOM 0 HB3 ASN A 54 -4.873 -35.893 -0.918 1.00 43.15 H new ATOM 0 HD21 ASN A 54 -5.945 -35.068 -4.782 1.00 11.51 H new ATOM 0 HD22 ASN A 54 -5.625 -33.794 -3.601 1.00 11.51 H new ATOM 867 N HIS A 55 -6.336 -33.037 0.849 1.00 3.32 N ATOM 868 CA HIS A 55 -5.903 -32.364 2.083 1.00 74.13 C ATOM 869 C HIS A 55 -7.059 -32.014 3.037 1.00 51.22 C ATOM 870 O HIS A 55 -6.815 -31.732 4.205 1.00 43.20 O ATOM 871 CB HIS A 55 -5.084 -31.113 1.759 1.00 11.42 C ATOM 872 CG HIS A 55 -3.691 -31.419 1.294 1.00 3.24 C ATOM 873 ND1 HIS A 55 -2.596 -31.361 2.129 1.00 51.53 N ATOM 874 CD2 HIS A 55 -3.213 -31.793 0.082 1.00 64.55 C ATOM 875 CE1 HIS A 55 -1.511 -31.682 1.457 1.00 72.44 C ATOM 876 NE2 HIS A 55 -1.855 -31.949 0.214 1.00 33.30 N ATOM 0 H HIS A 55 -6.567 -32.400 0.086 1.00 3.32 H new ATOM 0 HA HIS A 55 -5.278 -33.084 2.611 1.00 74.13 H new ATOM 0 HB2 HIS A 55 -5.599 -30.540 0.988 1.00 11.42 H new ATOM 0 HB3 HIS A 55 -5.033 -30.481 2.646 1.00 11.42 H new ATOM 0 HD2 HIS A 55 -3.791 -31.941 -0.818 1.00 64.55 H new ATOM 0 HE1 HIS A 55 -0.509 -31.720 1.857 1.00 72.44 H new ATOM 0 HE2 HIS A 55 -1.216 -32.227 -0.531 1.00 33.30 H new ATOM 885 N GLU A 56 -8.299 -32.003 2.546 1.00 20.24 N ATOM 886 CA GLU A 56 -9.461 -31.569 3.352 1.00 15.04 C ATOM 887 C GLU A 56 -9.491 -32.241 4.736 1.00 32.32 C ATOM 888 O GLU A 56 -9.621 -31.565 5.760 1.00 30.40 O ATOM 889 CB GLU A 56 -10.769 -31.882 2.604 1.00 41.42 C ATOM 890 CG GLU A 56 -12.033 -31.490 3.364 1.00 31.32 C ATOM 891 CD GLU A 56 -13.302 -31.809 2.590 1.00 62.02 C ATOM 892 OE1 GLU A 56 -13.761 -30.953 1.803 1.00 74.34 O ATOM 893 OE2 GLU A 56 -13.846 -32.920 2.757 1.00 50.43 O ATOM 0 H GLU A 56 -8.533 -32.288 1.595 1.00 20.24 H new ATOM 0 HA GLU A 56 -9.364 -30.494 3.503 1.00 15.04 H new ATOM 0 HB2 GLU A 56 -10.759 -31.363 1.645 1.00 41.42 H new ATOM 0 HB3 GLU A 56 -10.805 -32.950 2.388 1.00 41.42 H new ATOM 0 HG2 GLU A 56 -12.054 -32.012 4.321 1.00 31.32 H new ATOM 0 HG3 GLU A 56 -12.004 -30.423 3.584 1.00 31.32 H new ATOM 900 N THR A 57 -9.359 -33.566 4.760 1.00 71.32 N ATOM 901 CA THR A 57 -9.318 -34.327 6.022 1.00 11.33 C ATOM 902 C THR A 57 -8.205 -33.827 6.963 1.00 54.33 C ATOM 903 O THR A 57 -8.334 -33.893 8.185 1.00 24.41 O ATOM 904 CB THR A 57 -9.108 -35.840 5.757 1.00 32.13 C ATOM 905 OG1 THR A 57 -9.195 -36.590 6.981 1.00 3.20 O ATOM 906 CG2 THR A 57 -7.760 -36.104 5.087 1.00 0.34 C ATOM 0 H THR A 57 -9.278 -34.142 3.922 1.00 71.32 H new ATOM 0 HA THR A 57 -10.282 -34.170 6.506 1.00 11.33 H new ATOM 0 HB THR A 57 -9.900 -36.165 5.083 1.00 32.13 H new ATOM 0 HG1 THR A 57 -9.061 -37.542 6.791 1.00 3.20 H new ATOM 0 HG21 THR A 57 -7.643 -37.174 4.915 1.00 0.34 H new ATOM 0 HG22 THR A 57 -7.718 -35.576 4.134 1.00 0.34 H new ATOM 0 HG23 THR A 57 -6.957 -35.751 5.734 1.00 0.34 H new ATOM 914 N ALA A 58 -7.114 -33.331 6.379 1.00 52.25 N ATOM 915 CA ALA A 58 -5.979 -32.810 7.148 1.00 40.13 C ATOM 916 C ALA A 58 -6.226 -31.365 7.619 1.00 21.25 C ATOM 917 O ALA A 58 -6.027 -31.039 8.793 1.00 51.13 O ATOM 918 CB ALA A 58 -4.705 -32.886 6.314 1.00 10.23 C ATOM 0 H ALA A 58 -6.990 -33.278 5.368 1.00 52.25 H new ATOM 0 HA ALA A 58 -5.864 -33.430 8.037 1.00 40.13 H new ATOM 0 HB1 ALA A 58 -3.867 -32.497 6.893 1.00 10.23 H new ATOM 0 HB2 ALA A 58 -4.509 -33.923 6.044 1.00 10.23 H new ATOM 0 HB3 ALA A 58 -4.827 -32.292 5.408 1.00 10.23 H new ATOM 924 N PHE A 59 -6.660 -30.504 6.696 1.00 13.23 N ATOM 925 CA PHE A 59 -6.933 -29.095 7.010 1.00 50.30 C ATOM 926 C PHE A 59 -7.990 -28.954 8.114 1.00 12.35 C ATOM 927 O PHE A 59 -7.800 -28.194 9.065 1.00 25.12 O ATOM 928 CB PHE A 59 -7.388 -28.335 5.756 1.00 41.11 C ATOM 929 CG PHE A 59 -6.302 -28.109 4.727 1.00 72.44 C ATOM 930 CD1 PHE A 59 -4.975 -27.951 5.111 1.00 55.45 C ATOM 931 CD2 PHE A 59 -6.614 -28.028 3.377 1.00 71.24 C ATOM 932 CE1 PHE A 59 -3.988 -27.722 4.170 1.00 4.43 C ATOM 933 CE2 PHE A 59 -5.629 -27.801 2.434 1.00 64.34 C ATOM 934 CZ PHE A 59 -4.315 -27.647 2.831 1.00 1.24 C ATOM 0 H PHE A 59 -6.831 -30.756 5.723 1.00 13.23 H new ATOM 0 HA PHE A 59 -6.001 -28.661 7.373 1.00 50.30 H new ATOM 0 HB2 PHE A 59 -8.204 -28.887 5.289 1.00 41.11 H new ATOM 0 HB3 PHE A 59 -7.790 -27.368 6.059 1.00 41.11 H new ATOM 0 HD1 PHE A 59 -4.712 -28.008 6.157 1.00 55.45 H new ATOM 0 HD2 PHE A 59 -7.640 -28.144 3.059 1.00 71.24 H new ATOM 0 HE1 PHE A 59 -2.961 -27.602 4.483 1.00 4.43 H new ATOM 0 HE2 PHE A 59 -5.887 -27.744 1.387 1.00 64.34 H new ATOM 0 HZ PHE A 59 -3.545 -27.468 2.095 1.00 1.24 H new ATOM 944 N GLN A 60 -9.096 -29.695 7.987 1.00 40.24 N ATOM 945 CA GLN A 60 -10.167 -29.684 8.997 1.00 75.34 C ATOM 946 C GLN A 60 -9.621 -29.956 10.411 1.00 53.21 C ATOM 947 O GLN A 60 -10.159 -29.459 11.404 1.00 3.32 O ATOM 948 CB GLN A 60 -11.248 -30.721 8.640 1.00 3.31 C ATOM 949 CG GLN A 60 -12.070 -30.369 7.398 1.00 70.22 C ATOM 950 CD GLN A 60 -12.985 -29.165 7.598 1.00 24.11 C ATOM 951 OE1 GLN A 60 -12.694 -28.260 8.371 1.00 33.30 O ATOM 952 NE2 GLN A 60 -14.101 -29.144 6.896 1.00 32.22 N ATOM 0 H GLN A 60 -9.276 -30.312 7.195 1.00 40.24 H new ATOM 0 HA GLN A 60 -10.609 -28.687 8.997 1.00 75.34 H new ATOM 0 HB2 GLN A 60 -10.770 -31.688 8.483 1.00 3.31 H new ATOM 0 HB3 GLN A 60 -11.923 -30.833 9.489 1.00 3.31 H new ATOM 0 HG2 GLN A 60 -11.393 -30.167 6.568 1.00 70.22 H new ATOM 0 HG3 GLN A 60 -12.673 -31.231 7.114 1.00 70.22 H new ATOM 0 HE21 GLN A 60 -14.318 -29.911 6.260 1.00 32.22 H new ATOM 0 HE22 GLN A 60 -14.747 -28.361 6.989 1.00 32.22 H new ATOM 961 N GLY A 61 -8.540 -30.736 10.486 1.00 50.21 N ATOM 962 CA GLY A 61 -7.897 -31.019 11.765 1.00 14.00 C ATOM 963 C GLY A 61 -7.416 -29.760 12.483 1.00 51.22 C ATOM 964 O GLY A 61 -7.542 -29.646 13.700 1.00 41.14 O ATOM 0 H GLY A 61 -8.097 -31.178 9.681 1.00 50.21 H new ATOM 0 HA2 GLY A 61 -8.598 -31.552 12.408 1.00 14.00 H new ATOM 0 HA3 GLY A 61 -7.048 -31.683 11.600 1.00 14.00 H new ATOM 968 N MET A 62 -6.864 -28.808 11.728 1.00 71.42 N ATOM 969 CA MET A 62 -6.401 -27.544 12.309 1.00 33.41 C ATOM 970 C MET A 62 -7.523 -26.498 12.288 1.00 22.53 C ATOM 971 O MET A 62 -7.657 -25.687 13.203 1.00 40.53 O ATOM 972 CB MET A 62 -5.175 -27.016 11.550 1.00 3.44 C ATOM 973 CG MET A 62 -4.013 -28.002 11.497 1.00 12.31 C ATOM 974 SD MET A 62 -2.526 -27.304 10.741 1.00 22.35 S ATOM 975 CE MET A 62 -3.150 -26.768 9.147 1.00 41.42 C ATOM 0 H MET A 62 -6.727 -28.886 10.720 1.00 71.42 H new ATOM 0 HA MET A 62 -6.116 -27.731 13.344 1.00 33.41 H new ATOM 0 HB2 MET A 62 -5.471 -26.762 10.532 1.00 3.44 H new ATOM 0 HB3 MET A 62 -4.836 -26.094 12.023 1.00 3.44 H new ATOM 0 HG2 MET A 62 -3.778 -28.333 12.509 1.00 12.31 H new ATOM 0 HG3 MET A 62 -4.319 -28.885 10.936 1.00 12.31 H new ATOM 0 HE1 MET A 62 -2.314 -26.567 8.478 1.00 41.42 H new ATOM 0 HE2 MET A 62 -3.777 -27.551 8.720 1.00 41.42 H new ATOM 0 HE3 MET A 62 -3.740 -25.860 9.274 1.00 41.42 H new ATOM 985 N LEU A 63 -8.344 -26.547 11.245 1.00 23.43 N ATOM 986 CA LEU A 63 -9.403 -25.559 11.035 1.00 34.21 C ATOM 987 C LEU A 63 -10.380 -25.518 12.218 1.00 23.35 C ATOM 988 O LEU A 63 -10.864 -24.450 12.600 1.00 43.04 O ATOM 989 CB LEU A 63 -10.159 -25.869 9.736 1.00 71.12 C ATOM 990 CG LEU A 63 -10.899 -24.674 9.123 1.00 42.34 C ATOM 991 CD1 LEU A 63 -9.897 -23.603 8.702 1.00 12.52 C ATOM 992 CD2 LEU A 63 -11.766 -25.110 7.941 1.00 24.02 C ATOM 0 H LEU A 63 -8.298 -27.267 10.524 1.00 23.43 H new ATOM 0 HA LEU A 63 -8.935 -24.578 10.957 1.00 34.21 H new ATOM 0 HB2 LEU A 63 -9.451 -26.255 9.003 1.00 71.12 H new ATOM 0 HB3 LEU A 63 -10.879 -26.663 9.932 1.00 71.12 H new ATOM 0 HG LEU A 63 -11.564 -24.253 9.877 1.00 42.34 H new ATOM 0 HD11 LEU A 63 -10.430 -22.757 8.267 1.00 12.52 H new ATOM 0 HD12 LEU A 63 -9.334 -23.268 9.574 1.00 12.52 H new ATOM 0 HD13 LEU A 63 -9.210 -24.017 7.964 1.00 12.52 H new ATOM 0 HD21 LEU A 63 -12.279 -24.242 7.526 1.00 24.02 H new ATOM 0 HD22 LEU A 63 -11.136 -25.560 7.174 1.00 24.02 H new ATOM 0 HD23 LEU A 63 -12.502 -25.839 8.279 1.00 24.02 H new ATOM 1004 N ARG A 64 -10.656 -26.688 12.795 1.00 71.43 N ATOM 1005 CA ARG A 64 -11.549 -26.791 13.954 1.00 43.23 C ATOM 1006 C ARG A 64 -11.026 -25.979 15.155 1.00 22.50 C ATOM 1007 O ARG A 64 -11.803 -25.347 15.872 1.00 64.45 O ATOM 1008 CB ARG A 64 -11.732 -28.261 14.362 1.00 2.42 C ATOM 1009 CG ARG A 64 -10.445 -28.941 14.826 1.00 0.33 C ATOM 1010 CD ARG A 64 -10.689 -30.368 15.306 1.00 14.14 C ATOM 1011 NE ARG A 64 -11.131 -31.255 14.229 1.00 52.41 N ATOM 1012 CZ ARG A 64 -10.997 -32.556 14.254 1.00 44.33 C ATOM 1013 NH1 ARG A 64 -10.479 -33.146 15.283 1.00 31.41 N ATOM 1014 NH2 ARG A 64 -11.401 -33.267 13.253 1.00 40.20 N ATOM 0 H ARG A 64 -10.274 -27.580 12.480 1.00 71.43 H new ATOM 0 HA ARG A 64 -12.512 -26.373 13.658 1.00 43.23 H new ATOM 0 HB2 ARG A 64 -12.469 -28.316 15.163 1.00 2.42 H new ATOM 0 HB3 ARG A 64 -12.139 -28.815 13.516 1.00 2.42 H new ATOM 0 HG2 ARG A 64 -9.726 -28.953 14.007 1.00 0.33 H new ATOM 0 HG3 ARG A 64 -9.999 -28.359 15.633 1.00 0.33 H new ATOM 0 HD2 ARG A 64 -9.772 -30.762 15.743 1.00 14.14 H new ATOM 0 HD3 ARG A 64 -11.440 -30.359 16.096 1.00 14.14 H new ATOM 0 HE ARG A 64 -11.570 -30.834 13.410 1.00 52.41 H new ATOM 0 HH11 ARG A 64 -10.171 -32.596 16.085 1.00 31.41 H new ATOM 0 HH12 ARG A 64 -10.379 -34.161 15.292 1.00 31.41 H new ATOM 0 HH21 ARG A 64 -11.824 -32.814 12.443 1.00 40.20 H new ATOM 0 HH22 ARG A 64 -11.296 -34.281 13.273 1.00 40.20 H new ATOM 1028 N LYS A 65 -9.708 -26.002 15.372 1.00 22.04 N ATOM 1029 CA LYS A 65 -9.096 -25.282 16.498 1.00 75.43 C ATOM 1030 C LYS A 65 -8.667 -23.858 16.101 1.00 33.44 C ATOM 1031 O LYS A 65 -8.289 -23.052 16.956 1.00 14.23 O ATOM 1032 CB LYS A 65 -7.916 -26.093 17.079 1.00 4.10 C ATOM 1033 CG LYS A 65 -6.853 -26.519 16.061 1.00 71.35 C ATOM 1034 CD LYS A 65 -5.797 -25.439 15.820 1.00 35.21 C ATOM 1035 CE LYS A 65 -4.950 -25.191 17.065 1.00 23.24 C ATOM 1036 NZ LYS A 65 -3.935 -24.128 16.846 1.00 72.13 N ATOM 0 H LYS A 65 -9.044 -26.509 14.786 1.00 22.04 H new ATOM 0 HA LYS A 65 -9.850 -25.174 17.278 1.00 75.43 H new ATOM 0 HB2 LYS A 65 -7.435 -25.498 17.855 1.00 4.10 H new ATOM 0 HB3 LYS A 65 -8.313 -26.986 17.561 1.00 4.10 H new ATOM 0 HG2 LYS A 65 -6.364 -27.427 16.412 1.00 71.35 H new ATOM 0 HG3 LYS A 65 -7.338 -26.763 15.116 1.00 71.35 H new ATOM 0 HD2 LYS A 65 -5.152 -25.739 14.994 1.00 35.21 H new ATOM 0 HD3 LYS A 65 -6.286 -24.512 15.522 1.00 35.21 H new ATOM 0 HE2 LYS A 65 -5.599 -24.908 17.894 1.00 23.24 H new ATOM 0 HE3 LYS A 65 -4.450 -26.116 17.353 1.00 23.24 H new ATOM 0 HZ1 LYS A 65 -3.382 -23.992 17.716 1.00 72.13 H new ATOM 0 HZ2 LYS A 65 -3.299 -24.409 16.072 1.00 72.13 H new ATOM 0 HZ3 LYS A 65 -4.412 -23.238 16.596 1.00 72.13 H new ATOM 1050 N LEU A 66 -8.714 -23.559 14.801 1.00 73.31 N ATOM 1051 CA LEU A 66 -8.487 -22.194 14.308 1.00 70.22 C ATOM 1052 C LEU A 66 -9.772 -21.356 14.423 1.00 55.02 C ATOM 1053 O LEU A 66 -9.907 -20.536 15.330 1.00 75.35 O ATOM 1054 CB LEU A 66 -8.015 -22.210 12.843 1.00 20.44 C ATOM 1055 CG LEU A 66 -6.614 -22.791 12.593 1.00 64.21 C ATOM 1056 CD1 LEU A 66 -6.328 -22.871 11.095 1.00 71.10 C ATOM 1057 CD2 LEU A 66 -5.545 -21.960 13.304 1.00 42.11 C ATOM 0 H LEU A 66 -8.907 -24.242 14.069 1.00 73.31 H new ATOM 0 HA LEU A 66 -7.709 -21.744 14.925 1.00 70.22 H new ATOM 0 HB2 LEU A 66 -8.734 -22.782 12.257 1.00 20.44 H new ATOM 0 HB3 LEU A 66 -8.036 -21.188 12.464 1.00 20.44 H new ATOM 0 HG LEU A 66 -6.585 -23.800 13.003 1.00 64.21 H new ATOM 0 HD11 LEU A 66 -5.332 -23.285 10.936 1.00 71.10 H new ATOM 0 HD12 LEU A 66 -7.068 -23.513 10.617 1.00 71.10 H new ATOM 0 HD13 LEU A 66 -6.380 -21.873 10.661 1.00 71.10 H new ATOM 0 HD21 LEU A 66 -4.562 -22.391 13.112 1.00 42.11 H new ATOM 0 HD22 LEU A 66 -5.572 -20.936 12.930 1.00 42.11 H new ATOM 0 HD23 LEU A 66 -5.738 -21.960 14.377 1.00 42.11 H new ATOM 1069 N ASP A 67 -10.712 -21.604 13.504 1.00 54.13 N ATOM 1070 CA ASP A 67 -11.989 -20.874 13.429 1.00 51.03 C ATOM 1071 C ASP A 67 -11.797 -19.345 13.526 1.00 23.31 C ATOM 1072 O ASP A 67 -11.776 -18.768 14.615 1.00 31.15 O ATOM 1073 CB ASP A 67 -12.955 -21.380 14.508 1.00 50.14 C ATOM 1074 CG ASP A 67 -14.381 -20.918 14.267 1.00 51.04 C ATOM 1075 OD1 ASP A 67 -14.913 -21.179 13.166 1.00 24.45 O ATOM 1076 OD2 ASP A 67 -14.986 -20.323 15.183 1.00 74.51 O ATOM 0 H ASP A 67 -10.610 -22.321 12.785 1.00 54.13 H new ATOM 0 HA ASP A 67 -12.423 -21.072 12.449 1.00 51.03 H new ATOM 0 HB2 ASP A 67 -12.928 -22.469 14.535 1.00 50.14 H new ATOM 0 HB3 ASP A 67 -12.622 -21.029 15.485 1.00 50.14 H new ATOM 1081 N ILE A 68 -11.658 -18.699 12.372 1.00 62.40 N ATOM 1082 CA ILE A 68 -11.374 -17.261 12.313 1.00 70.31 C ATOM 1083 C ILE A 68 -12.627 -16.412 12.605 1.00 3.03 C ATOM 1084 O ILE A 68 -13.561 -16.353 11.802 1.00 43.33 O ATOM 1085 CB ILE A 68 -10.777 -16.859 10.932 1.00 70.14 C ATOM 1086 CG1 ILE A 68 -9.361 -17.447 10.739 1.00 1.43 C ATOM 1087 CG2 ILE A 68 -10.745 -15.338 10.769 1.00 34.10 C ATOM 1088 CD1 ILE A 68 -9.306 -18.962 10.654 1.00 13.22 C ATOM 0 H ILE A 68 -11.737 -19.147 11.459 1.00 62.40 H new ATOM 0 HA ILE A 68 -10.637 -17.058 13.090 1.00 70.31 H new ATOM 0 HB ILE A 68 -11.427 -17.276 10.163 1.00 70.14 H new ATOM 0 HG12 ILE A 68 -8.931 -17.030 9.828 1.00 1.43 H new ATOM 0 HG13 ILE A 68 -8.732 -17.121 11.567 1.00 1.43 H new ATOM 0 HG21 ILE A 68 -10.324 -15.085 9.796 1.00 34.10 H new ATOM 0 HG22 ILE A 68 -11.759 -14.943 10.839 1.00 34.10 H new ATOM 0 HG23 ILE A 68 -10.130 -14.901 11.556 1.00 34.10 H new ATOM 0 HD11 ILE A 68 -8.273 -19.282 10.519 1.00 13.22 H new ATOM 0 HD12 ILE A 68 -9.702 -19.393 11.574 1.00 13.22 H new ATOM 0 HD13 ILE A 68 -9.904 -19.301 9.808 1.00 13.22 H new ATOM 1100 N LYS A 69 -12.629 -15.752 13.760 1.00 75.14 N ATOM 1101 CA LYS A 69 -13.742 -14.879 14.167 1.00 4.24 C ATOM 1102 C LYS A 69 -13.412 -13.386 13.965 1.00 72.10 C ATOM 1103 O LYS A 69 -14.280 -12.531 14.129 1.00 14.54 O ATOM 1104 CB LYS A 69 -14.154 -15.166 15.625 1.00 34.00 C ATOM 1105 CG LYS A 69 -13.014 -15.475 16.553 1.00 52.52 C ATOM 1106 CD LYS A 69 -12.289 -14.228 16.999 1.00 14.32 C ATOM 1107 CE LYS A 69 -11.487 -14.547 18.222 1.00 23.40 C ATOM 1108 NZ LYS A 69 -10.329 -15.431 17.916 1.00 52.31 N ATOM 0 H LYS A 69 -11.870 -15.802 14.439 1.00 75.14 H new ATOM 0 HA LYS A 69 -14.589 -15.106 13.519 1.00 4.24 H new ATOM 0 HB2 LYS A 69 -14.695 -14.302 16.012 1.00 34.00 H new ATOM 0 HB3 LYS A 69 -14.848 -16.006 15.633 1.00 34.00 H new ATOM 0 HG2 LYS A 69 -13.392 -16.006 17.427 1.00 52.52 H new ATOM 0 HG3 LYS A 69 -12.312 -16.143 16.054 1.00 52.52 H new ATOM 0 HD2 LYS A 69 -11.637 -13.866 16.204 1.00 14.32 H new ATOM 0 HD3 LYS A 69 -13.003 -13.433 17.213 1.00 14.32 H new ATOM 0 HE2 LYS A 69 -11.127 -13.621 18.671 1.00 23.40 H new ATOM 0 HE3 LYS A 69 -12.128 -15.031 18.959 1.00 23.40 H new ATOM 0 HZ1 LYS A 69 -9.791 -15.613 18.787 1.00 52.31 H new ATOM 0 HZ2 LYS A 69 -10.673 -16.332 17.527 1.00 52.31 H new ATOM 0 HZ3 LYS A 69 -9.712 -14.966 17.219 1.00 52.31 H new ATOM 1122 N ASN A 70 -12.163 -13.079 13.603 1.00 73.04 N ATOM 1123 CA ASN A 70 -11.774 -11.704 13.241 1.00 42.24 C ATOM 1124 C ASN A 70 -10.414 -11.673 12.521 1.00 11.53 C ATOM 1125 O ASN A 70 -9.697 -12.675 12.485 1.00 23.20 O ATOM 1126 CB ASN A 70 -11.752 -10.778 14.472 1.00 23.34 C ATOM 1127 CG ASN A 70 -10.589 -11.019 15.425 1.00 21.13 C ATOM 1128 OD1 ASN A 70 -10.149 -12.251 15.564 1.00 23.40 O flip ATOM 1129 ND2 ASN A 70 -10.088 -10.088 16.045 1.00 53.32 N flip ATOM 0 H ASN A 70 -11.403 -13.758 13.551 1.00 73.04 H new ATOM 0 HA ASN A 70 -12.532 -11.332 12.552 1.00 42.24 H new ATOM 0 HB2 ASN A 70 -11.717 -9.743 14.131 1.00 23.34 H new ATOM 0 HB3 ASN A 70 -12.686 -10.902 15.020 1.00 23.34 H new ATOM 0 HD21 ASN A 70 -10.446 -9.141 15.921 1.00 53.32 H new ATOM 0 HD22 ASN A 70 -9.313 -10.260 16.685 1.00 53.32 H new ATOM 1136 N GLU A 71 -10.064 -10.513 11.962 1.00 15.11 N ATOM 1137 CA GLU A 71 -8.819 -10.350 11.189 1.00 23.21 C ATOM 1138 C GLU A 71 -7.570 -10.786 11.981 1.00 2.13 C ATOM 1139 O GLU A 71 -6.601 -11.280 11.404 1.00 21.13 O ATOM 1140 CB GLU A 71 -8.665 -8.889 10.738 1.00 42.23 C ATOM 1141 CG GLU A 71 -7.473 -8.651 9.815 1.00 63.22 C ATOM 1142 CD GLU A 71 -7.326 -7.192 9.405 1.00 63.04 C ATOM 1143 OE1 GLU A 71 -8.019 -6.762 8.458 1.00 60.31 O ATOM 1144 OE2 GLU A 71 -6.522 -6.470 10.035 1.00 13.31 O ATOM 0 H GLU A 71 -10.626 -9.664 12.028 1.00 15.11 H new ATOM 0 HA GLU A 71 -8.896 -11.002 10.319 1.00 23.21 H new ATOM 0 HB2 GLU A 71 -9.576 -8.579 10.227 1.00 42.23 H new ATOM 0 HB3 GLU A 71 -8.562 -8.256 11.619 1.00 42.23 H new ATOM 0 HG2 GLU A 71 -6.561 -8.977 10.316 1.00 63.22 H new ATOM 0 HG3 GLU A 71 -7.583 -9.265 8.921 1.00 63.22 H new ATOM 1151 N ASP A 72 -7.600 -10.609 13.300 1.00 4.33 N ATOM 1152 CA ASP A 72 -6.472 -10.994 14.157 1.00 11.33 C ATOM 1153 C ASP A 72 -6.108 -12.483 13.987 1.00 23.23 C ATOM 1154 O ASP A 72 -4.932 -12.858 14.039 1.00 73.04 O ATOM 1155 CB ASP A 72 -6.793 -10.684 15.623 1.00 11.22 C ATOM 1156 CG ASP A 72 -5.627 -10.999 16.544 1.00 12.40 C ATOM 1157 OD1 ASP A 72 -4.639 -10.237 16.539 1.00 31.52 O ATOM 1158 OD2 ASP A 72 -5.679 -12.023 17.253 1.00 64.11 O ATOM 0 H ASP A 72 -8.390 -10.203 13.801 1.00 4.33 H new ATOM 0 HA ASP A 72 -5.605 -10.409 13.850 1.00 11.33 H new ATOM 0 HB2 ASP A 72 -7.057 -9.631 15.721 1.00 11.22 H new ATOM 0 HB3 ASP A 72 -7.664 -11.261 15.932 1.00 11.22 H new ATOM 1163 N ASP A 73 -7.116 -13.326 13.768 1.00 13.01 N ATOM 1164 CA ASP A 73 -6.883 -14.753 13.529 1.00 45.21 C ATOM 1165 C ASP A 73 -6.198 -14.965 12.170 1.00 52.03 C ATOM 1166 O ASP A 73 -5.356 -15.850 12.015 1.00 52.51 O ATOM 1167 CB ASP A 73 -8.200 -15.528 13.579 1.00 15.35 C ATOM 1168 CG ASP A 73 -9.008 -15.216 14.824 1.00 52.32 C ATOM 1169 OD1 ASP A 73 -8.467 -15.340 15.940 1.00 52.23 O ATOM 1170 OD2 ASP A 73 -10.189 -14.841 14.691 1.00 70.02 O ATOM 0 H ASP A 73 -8.098 -13.049 13.751 1.00 13.01 H new ATOM 0 HA ASP A 73 -6.227 -15.128 14.315 1.00 45.21 H new ATOM 0 HB2 ASP A 73 -8.792 -15.290 12.696 1.00 15.35 H new ATOM 0 HB3 ASP A 73 -7.991 -16.597 13.543 1.00 15.35 H new ATOM 1175 N VAL A 74 -6.561 -14.135 11.192 1.00 52.35 N ATOM 1176 CA VAL A 74 -5.914 -14.154 9.876 1.00 41.30 C ATOM 1177 C VAL A 74 -4.426 -13.791 10.002 1.00 42.35 C ATOM 1178 O VAL A 74 -3.563 -14.404 9.370 1.00 24.20 O ATOM 1179 CB VAL A 74 -6.608 -13.178 8.890 1.00 54.20 C ATOM 1180 CG1 VAL A 74 -5.921 -13.199 7.527 1.00 32.45 C ATOM 1181 CG2 VAL A 74 -8.094 -13.514 8.757 1.00 50.34 C ATOM 0 H VAL A 74 -7.301 -13.439 11.285 1.00 52.35 H new ATOM 0 HA VAL A 74 -6.006 -15.165 9.480 1.00 41.30 H new ATOM 0 HB VAL A 74 -6.521 -12.169 9.293 1.00 54.20 H new ATOM 0 HG11 VAL A 74 -6.427 -12.506 6.854 1.00 32.45 H new ATOM 0 HG12 VAL A 74 -4.879 -12.900 7.640 1.00 32.45 H new ATOM 0 HG13 VAL A 74 -5.966 -14.206 7.112 1.00 32.45 H new ATOM 0 HG21 VAL A 74 -8.563 -12.819 8.061 1.00 50.34 H new ATOM 0 HG22 VAL A 74 -8.205 -14.532 8.383 1.00 50.34 H new ATOM 0 HG23 VAL A 74 -8.574 -13.432 9.732 1.00 50.34 H new ATOM 1191 N LYS A 75 -4.135 -12.800 10.844 1.00 4.15 N ATOM 1192 CA LYS A 75 -2.749 -12.426 11.161 1.00 34.44 C ATOM 1193 C LYS A 75 -1.985 -13.617 11.768 1.00 30.51 C ATOM 1194 O LYS A 75 -0.775 -13.762 11.581 1.00 42.45 O ATOM 1195 CB LYS A 75 -2.733 -11.241 12.136 1.00 11.20 C ATOM 1196 CG LYS A 75 -3.420 -9.990 11.596 1.00 64.11 C ATOM 1197 CD LYS A 75 -3.515 -8.900 12.658 1.00 42.02 C ATOM 1198 CE LYS A 75 -4.223 -7.658 12.133 1.00 13.42 C ATOM 1199 NZ LYS A 75 -4.431 -6.647 13.203 1.00 63.31 N ATOM 0 H LYS A 75 -4.839 -12.238 11.322 1.00 4.15 H new ATOM 0 HA LYS A 75 -2.253 -12.135 10.235 1.00 34.44 H new ATOM 0 HB2 LYS A 75 -3.220 -11.540 13.064 1.00 11.20 H new ATOM 0 HB3 LYS A 75 -1.699 -10.999 12.382 1.00 11.20 H new ATOM 0 HG2 LYS A 75 -2.867 -9.613 10.735 1.00 64.11 H new ATOM 0 HG3 LYS A 75 -4.420 -10.246 11.246 1.00 64.11 H new ATOM 0 HD2 LYS A 75 -4.051 -9.284 13.526 1.00 42.02 H new ATOM 0 HD3 LYS A 75 -2.513 -8.632 12.995 1.00 42.02 H new ATOM 0 HE2 LYS A 75 -3.636 -7.218 11.327 1.00 13.42 H new ATOM 0 HE3 LYS A 75 -5.186 -7.941 11.708 1.00 13.42 H new ATOM 0 HZ1 LYS A 75 -4.916 -5.817 12.807 1.00 63.31 H new ATOM 0 HZ2 LYS A 75 -5.013 -7.058 13.961 1.00 63.31 H new ATOM 0 HZ3 LYS A 75 -3.510 -6.358 13.591 1.00 63.31 H new ATOM 1213 N SER A 76 -2.705 -14.464 12.500 1.00 24.35 N ATOM 1214 CA SER A 76 -2.133 -15.701 13.048 1.00 43.30 C ATOM 1215 C SER A 76 -1.896 -16.732 11.935 1.00 54.24 C ATOM 1216 O SER A 76 -0.876 -17.425 11.923 1.00 64.10 O ATOM 1217 CB SER A 76 -3.058 -16.295 14.120 1.00 0.23 C ATOM 1218 OG SER A 76 -3.264 -15.384 15.191 1.00 22.01 O ATOM 0 H SER A 76 -3.688 -14.320 12.730 1.00 24.35 H new ATOM 0 HA SER A 76 -1.175 -15.454 13.505 1.00 43.30 H new ATOM 0 HB2 SER A 76 -4.017 -16.554 13.672 1.00 0.23 H new ATOM 0 HB3 SER A 76 -2.626 -17.219 14.504 1.00 0.23 H new ATOM 0 HG SER A 76 -3.794 -14.623 14.875 1.00 22.01 H new ATOM 1224 N LEU A 77 -2.843 -16.825 10.994 1.00 72.13 N ATOM 1225 CA LEU A 77 -2.702 -17.716 9.831 1.00 62.21 C ATOM 1226 C LEU A 77 -1.420 -17.401 9.049 1.00 14.11 C ATOM 1227 O LEU A 77 -0.786 -18.298 8.496 1.00 31.55 O ATOM 1228 CB LEU A 77 -3.914 -17.588 8.894 1.00 10.01 C ATOM 1229 CG LEU A 77 -5.269 -18.001 9.492 1.00 21.50 C ATOM 1230 CD1 LEU A 77 -6.386 -17.819 8.464 1.00 62.35 C ATOM 1231 CD2 LEU A 77 -5.224 -19.445 9.990 1.00 74.10 C ATOM 0 H LEU A 77 -3.715 -16.296 11.013 1.00 72.13 H new ATOM 0 HA LEU A 77 -2.646 -18.738 10.207 1.00 62.21 H new ATOM 0 HB2 LEU A 77 -3.985 -16.552 8.562 1.00 10.01 H new ATOM 0 HB3 LEU A 77 -3.730 -18.195 8.007 1.00 10.01 H new ATOM 0 HG LEU A 77 -5.478 -17.355 10.345 1.00 21.50 H new ATOM 0 HD11 LEU A 77 -7.338 -18.116 8.904 1.00 62.35 H new ATOM 0 HD12 LEU A 77 -6.436 -16.773 8.163 1.00 62.35 H new ATOM 0 HD13 LEU A 77 -6.181 -18.438 7.591 1.00 62.35 H new ATOM 0 HD21 LEU A 77 -6.193 -19.716 10.409 1.00 74.10 H new ATOM 0 HD22 LEU A 77 -4.990 -20.110 9.158 1.00 74.10 H new ATOM 0 HD23 LEU A 77 -4.457 -19.541 10.758 1.00 74.10 H new ATOM 1243 N SER A 78 -1.043 -16.120 9.022 1.00 23.41 N ATOM 1244 CA SER A 78 0.187 -15.674 8.344 1.00 61.12 C ATOM 1245 C SER A 78 1.406 -16.488 8.798 1.00 4.22 C ATOM 1246 O SER A 78 2.233 -16.897 7.982 1.00 11.32 O ATOM 1247 CB SER A 78 0.436 -14.181 8.618 1.00 31.11 C ATOM 1248 OG SER A 78 1.679 -13.750 8.084 1.00 74.53 O ATOM 0 H SER A 78 -1.572 -15.367 9.463 1.00 23.41 H new ATOM 0 HA SER A 78 0.048 -15.831 7.274 1.00 61.12 H new ATOM 0 HB2 SER A 78 -0.371 -13.591 8.183 1.00 31.11 H new ATOM 0 HB3 SER A 78 0.419 -14.000 9.693 1.00 31.11 H new ATOM 0 HG SER A 78 1.804 -12.797 8.275 1.00 74.53 H new ATOM 1254 N ARG A 79 1.493 -16.747 10.101 1.00 4.02 N ATOM 1255 CA ARG A 79 2.597 -17.531 10.662 1.00 41.23 C ATOM 1256 C ARG A 79 2.608 -18.960 10.089 1.00 13.22 C ATOM 1257 O ARG A 79 3.660 -19.489 9.730 1.00 2.03 O ATOM 1258 CB ARG A 79 2.493 -17.559 12.193 1.00 10.50 C ATOM 1259 CG ARG A 79 2.456 -16.166 12.822 1.00 72.50 C ATOM 1260 CD ARG A 79 3.740 -15.383 12.550 1.00 44.11 C ATOM 1261 NE ARG A 79 3.612 -13.971 12.913 1.00 41.22 N ATOM 1262 CZ ARG A 79 4.229 -13.406 13.916 1.00 72.04 C ATOM 1263 NH1 ARG A 79 4.967 -14.104 14.717 1.00 10.02 N ATOM 1264 NH2 ARG A 79 4.092 -12.138 14.123 1.00 42.55 N ATOM 0 H ARG A 79 0.813 -16.426 10.790 1.00 4.02 H new ATOM 0 HA ARG A 79 3.537 -17.056 10.382 1.00 41.23 H new ATOM 0 HB2 ARG A 79 1.593 -18.103 12.479 1.00 10.50 H new ATOM 0 HB3 ARG A 79 3.342 -18.111 12.598 1.00 10.50 H new ATOM 0 HG2 ARG A 79 1.603 -15.613 12.429 1.00 72.50 H new ATOM 0 HG3 ARG A 79 2.308 -16.257 13.898 1.00 72.50 H new ATOM 0 HD2 ARG A 79 4.561 -15.828 13.112 1.00 44.11 H new ATOM 0 HD3 ARG A 79 3.996 -15.463 11.494 1.00 44.11 H new ATOM 0 HE ARG A 79 2.999 -13.388 12.343 1.00 41.22 H new ATOM 0 HH11 ARG A 79 5.072 -15.108 14.569 1.00 10.02 H new ATOM 0 HH12 ARG A 79 5.444 -13.651 15.497 1.00 10.02 H new ATOM 0 HH21 ARG A 79 3.503 -11.581 13.504 1.00 42.55 H new ATOM 0 HH22 ARG A 79 4.573 -11.694 14.906 1.00 42.55 H new ATOM 1278 N VAL A 80 1.429 -19.572 9.991 1.00 51.32 N ATOM 1279 CA VAL A 80 1.299 -20.898 9.374 1.00 42.01 C ATOM 1280 C VAL A 80 1.691 -20.848 7.887 1.00 34.24 C ATOM 1281 O VAL A 80 2.426 -21.709 7.395 1.00 21.33 O ATOM 1282 CB VAL A 80 -0.147 -21.448 9.500 1.00 2.55 C ATOM 1283 CG1 VAL A 80 -0.275 -22.820 8.835 1.00 65.25 C ATOM 1284 CG2 VAL A 80 -0.583 -21.513 10.965 1.00 53.11 C ATOM 0 H VAL A 80 0.552 -19.176 10.328 1.00 51.32 H new ATOM 0 HA VAL A 80 1.975 -21.566 9.908 1.00 42.01 H new ATOM 0 HB VAL A 80 -0.811 -20.758 8.979 1.00 2.55 H new ATOM 0 HG11 VAL A 80 -1.298 -23.181 8.939 1.00 65.25 H new ATOM 0 HG12 VAL A 80 -0.025 -22.736 7.777 1.00 65.25 H new ATOM 0 HG13 VAL A 80 0.407 -23.522 9.314 1.00 65.25 H new ATOM 0 HG21 VAL A 80 -1.600 -21.902 11.025 1.00 53.11 H new ATOM 0 HG22 VAL A 80 0.090 -22.170 11.516 1.00 53.11 H new ATOM 0 HG23 VAL A 80 -0.550 -20.514 11.399 1.00 53.11 H new ATOM 1294 N MET A 81 1.212 -19.816 7.191 1.00 64.42 N ATOM 1295 CA MET A 81 1.496 -19.627 5.762 1.00 42.40 C ATOM 1296 C MET A 81 3.008 -19.596 5.484 1.00 31.35 C ATOM 1297 O MET A 81 3.478 -20.146 4.489 1.00 20.34 O ATOM 1298 CB MET A 81 0.832 -18.337 5.260 1.00 75.22 C ATOM 1299 CG MET A 81 -0.684 -18.363 5.381 1.00 34.43 C ATOM 1300 SD MET A 81 -1.411 -19.809 4.583 1.00 63.54 S ATOM 1301 CE MET A 81 -3.116 -19.663 5.100 1.00 12.42 C ATOM 0 H MET A 81 0.620 -19.091 7.596 1.00 64.42 H new ATOM 0 HA MET A 81 1.080 -20.478 5.222 1.00 42.40 H new ATOM 0 HB2 MET A 81 1.222 -17.491 5.825 1.00 75.22 H new ATOM 0 HB3 MET A 81 1.105 -18.176 4.217 1.00 75.22 H new ATOM 0 HG2 MET A 81 -0.962 -18.354 6.435 1.00 34.43 H new ATOM 0 HG3 MET A 81 -1.097 -17.458 4.935 1.00 34.43 H new ATOM 0 HE1 MET A 81 -3.752 -20.230 4.420 1.00 12.42 H new ATOM 0 HE2 MET A 81 -3.225 -20.056 6.111 1.00 12.42 H new ATOM 0 HE3 MET A 81 -3.412 -18.614 5.085 1.00 12.42 H new ATOM 1311 N ILE A 82 3.763 -18.957 6.376 1.00 45.04 N ATOM 1312 CA ILE A 82 5.228 -18.932 6.279 1.00 60.25 C ATOM 1313 C ILE A 82 5.817 -20.352 6.386 1.00 63.35 C ATOM 1314 O ILE A 82 6.700 -20.738 5.613 1.00 14.52 O ATOM 1315 CB ILE A 82 5.840 -18.033 7.386 1.00 14.32 C ATOM 1316 CG1 ILE A 82 5.291 -16.598 7.276 1.00 71.15 C ATOM 1317 CG2 ILE A 82 7.369 -18.034 7.311 1.00 4.52 C ATOM 1318 CD1 ILE A 82 5.731 -15.680 8.401 1.00 70.43 C ATOM 0 H ILE A 82 3.387 -18.448 7.176 1.00 45.04 H new ATOM 0 HA ILE A 82 5.482 -18.519 5.303 1.00 60.25 H new ATOM 0 HB ILE A 82 5.552 -18.442 8.355 1.00 14.32 H new ATOM 0 HG12 ILE A 82 5.610 -16.170 6.326 1.00 71.15 H new ATOM 0 HG13 ILE A 82 4.202 -16.637 7.258 1.00 71.15 H new ATOM 0 HG21 ILE A 82 7.772 -17.396 8.098 1.00 4.52 H new ATOM 0 HG22 ILE A 82 7.739 -19.051 7.443 1.00 4.52 H new ATOM 0 HG23 ILE A 82 7.686 -17.656 6.339 1.00 4.52 H new ATOM 0 HD11 ILE A 82 5.303 -14.689 8.251 1.00 70.43 H new ATOM 0 HD12 ILE A 82 5.388 -16.083 9.354 1.00 70.43 H new ATOM 0 HD13 ILE A 82 6.819 -15.608 8.408 1.00 70.43 H new ATOM 1330 N HIS A 83 5.309 -21.135 7.341 1.00 2.03 N ATOM 1331 CA HIS A 83 5.774 -22.515 7.543 1.00 33.31 C ATOM 1332 C HIS A 83 5.445 -23.415 6.339 1.00 54.23 C ATOM 1333 O HIS A 83 6.155 -24.388 6.077 1.00 43.01 O ATOM 1334 CB HIS A 83 5.189 -23.109 8.832 1.00 60.15 C ATOM 1335 CG HIS A 83 5.792 -22.536 10.078 1.00 53.24 C ATOM 1336 ND1 HIS A 83 5.343 -21.583 10.928 1.00 22.25 N flip ATOM 1337 CD2 HIS A 83 7.016 -22.938 10.576 1.00 44.12 C flip ATOM 1338 CE1 HIS A 83 6.293 -21.433 11.906 1.00 3.02 C flip ATOM 1339 NE2 HIS A 83 7.289 -22.260 11.672 1.00 11.43 N flip ATOM 0 H HIS A 83 4.577 -20.840 7.987 1.00 2.03 H new ATOM 0 HA HIS A 83 6.859 -22.476 7.638 1.00 33.31 H new ATOM 0 HB2 HIS A 83 4.113 -22.938 8.846 1.00 60.15 H new ATOM 0 HB3 HIS A 83 5.340 -24.188 8.827 1.00 60.15 H new ATOM 0 HD1 HIS A 83 4.463 -21.072 10.855 1.00 22.25 H new ATOM 0 HD2 HIS A 83 7.651 -23.692 10.135 1.00 44.12 H new ATOM 0 HE1 HIS A 83 6.233 -20.745 12.736 1.00 3.02 H new ATOM 1348 N VAL A 84 4.379 -23.086 5.609 1.00 52.23 N ATOM 1349 CA VAL A 84 4.007 -23.827 4.394 1.00 44.45 C ATOM 1350 C VAL A 84 5.143 -23.812 3.346 1.00 1.41 C ATOM 1351 O VAL A 84 5.192 -24.664 2.455 1.00 61.12 O ATOM 1352 CB VAL A 84 2.705 -23.256 3.764 1.00 11.51 C ATOM 1353 CG1 VAL A 84 2.317 -24.016 2.494 1.00 4.20 C ATOM 1354 CG2 VAL A 84 1.558 -23.292 4.774 1.00 12.42 C ATOM 0 H VAL A 84 3.755 -22.311 5.835 1.00 52.23 H new ATOM 0 HA VAL A 84 3.830 -24.859 4.696 1.00 44.45 H new ATOM 0 HB VAL A 84 2.900 -22.219 3.489 1.00 11.51 H new ATOM 0 HG11 VAL A 84 1.403 -23.590 2.080 1.00 4.20 H new ATOM 0 HG12 VAL A 84 3.120 -23.934 1.761 1.00 4.20 H new ATOM 0 HG13 VAL A 84 2.152 -25.066 2.735 1.00 4.20 H new ATOM 0 HG21 VAL A 84 0.656 -22.888 4.314 1.00 12.42 H new ATOM 0 HG22 VAL A 84 1.378 -24.321 5.084 1.00 12.42 H new ATOM 0 HG23 VAL A 84 1.821 -22.692 5.645 1.00 12.42 H new ATOM 1364 N PHE A 85 6.054 -22.841 3.457 1.00 1.14 N ATOM 1365 CA PHE A 85 7.212 -22.753 2.553 1.00 34.31 C ATOM 1366 C PHE A 85 8.524 -23.167 3.241 1.00 11.43 C ATOM 1367 O PHE A 85 9.566 -23.268 2.592 1.00 74.03 O ATOM 1368 CB PHE A 85 7.352 -21.328 2.003 1.00 64.51 C ATOM 1369 CG PHE A 85 6.195 -20.897 1.146 1.00 13.41 C ATOM 1370 CD1 PHE A 85 5.811 -21.658 0.052 1.00 43.23 C ATOM 1371 CD2 PHE A 85 5.496 -19.733 1.427 1.00 4.21 C ATOM 1372 CE1 PHE A 85 4.755 -21.267 -0.743 1.00 1.31 C ATOM 1373 CE2 PHE A 85 4.439 -19.336 0.634 1.00 43.42 C ATOM 1374 CZ PHE A 85 4.068 -20.105 -0.453 1.00 11.03 C ATOM 0 H PHE A 85 6.015 -22.104 4.162 1.00 1.14 H new ATOM 0 HA PHE A 85 7.029 -23.451 1.736 1.00 34.31 H new ATOM 0 HB2 PHE A 85 7.454 -20.634 2.837 1.00 64.51 H new ATOM 0 HB3 PHE A 85 8.270 -21.261 1.419 1.00 64.51 H new ATOM 0 HD1 PHE A 85 6.345 -22.567 -0.180 1.00 43.23 H new ATOM 0 HD2 PHE A 85 5.782 -19.130 2.276 1.00 4.21 H new ATOM 0 HE1 PHE A 85 4.465 -21.869 -1.592 1.00 1.31 H new ATOM 0 HE2 PHE A 85 3.903 -18.427 0.862 1.00 43.42 H new ATOM 0 HZ PHE A 85 3.241 -19.797 -1.075 1.00 11.03 H new ATOM 1458 N TRP A 92 6.555 -25.773 -6.706 1.00 42.42 N ATOM 1459 CA TRP A 92 5.481 -24.801 -6.980 1.00 14.21 C ATOM 1460 C TRP A 92 4.125 -25.303 -6.448 1.00 35.32 C ATOM 1461 O TRP A 92 3.204 -24.516 -6.224 1.00 11.14 O ATOM 1462 CB TRP A 92 5.377 -24.500 -8.486 1.00 11.14 C ATOM 1463 CG TRP A 92 6.510 -23.664 -9.017 1.00 33.24 C ATOM 1464 CD1 TRP A 92 7.578 -24.094 -9.748 1.00 35.05 C ATOM 1465 CD2 TRP A 92 6.680 -22.249 -8.860 1.00 5.12 C ATOM 1466 NE1 TRP A 92 8.401 -23.039 -10.051 1.00 12.44 N ATOM 1467 CE2 TRP A 92 7.873 -21.895 -9.517 1.00 25.04 C ATOM 1468 CE3 TRP A 92 5.940 -21.247 -8.227 1.00 52.43 C ATOM 1469 CZ2 TRP A 92 8.340 -20.584 -9.560 1.00 72.33 C ATOM 1470 CZ3 TRP A 92 6.404 -19.946 -8.268 1.00 12.42 C ATOM 1471 CH2 TRP A 92 7.596 -19.624 -8.930 1.00 4.52 C ATOM 0 HA TRP A 92 5.737 -23.879 -6.458 1.00 14.21 H new ATOM 0 HB2 TRP A 92 5.345 -25.442 -9.034 1.00 11.14 H new ATOM 0 HB3 TRP A 92 4.436 -23.986 -8.680 1.00 11.14 H new ATOM 0 HD1 TRP A 92 7.751 -25.118 -10.046 1.00 35.05 H new ATOM 0 HE1 TRP A 92 9.266 -23.098 -10.588 1.00 12.44 H new ATOM 0 HE3 TRP A 92 5.020 -21.485 -7.714 1.00 52.43 H new ATOM 0 HZ2 TRP A 92 9.257 -20.334 -10.073 1.00 72.33 H new ATOM 0 HZ3 TRP A 92 5.839 -19.165 -7.782 1.00 12.42 H new ATOM 0 HH2 TRP A 92 7.934 -18.598 -8.943 1.00 4.52 H new ATOM 1482 N GLY A 93 4.016 -26.616 -6.233 1.00 72.02 N ATOM 1483 CA GLY A 93 2.807 -27.190 -5.650 1.00 12.41 C ATOM 1484 C GLY A 93 2.472 -26.604 -4.281 1.00 44.30 C ATOM 1485 O GLY A 93 1.304 -26.545 -3.889 1.00 30.21 O ATOM 0 H GLY A 93 4.745 -27.295 -6.453 1.00 72.02 H new ATOM 0 HA2 GLY A 93 1.969 -27.023 -6.326 1.00 12.41 H new ATOM 0 HA3 GLY A 93 2.931 -28.269 -5.557 1.00 12.41 H new ATOM 1489 N ARG A 94 3.496 -26.162 -3.552 1.00 3.45 N ATOM 1490 CA ARG A 94 3.297 -25.516 -2.250 1.00 12.14 C ATOM 1491 C ARG A 94 2.656 -24.128 -2.411 1.00 35.42 C ATOM 1492 O ARG A 94 1.853 -23.709 -1.578 1.00 12.21 O ATOM 1493 CB ARG A 94 4.625 -25.414 -1.494 1.00 1.33 C ATOM 1494 CG ARG A 94 5.255 -26.769 -1.196 1.00 72.32 C ATOM 1495 CD ARG A 94 6.548 -26.625 -0.408 1.00 2.51 C ATOM 1496 NE ARG A 94 7.529 -25.800 -1.111 1.00 34.42 N ATOM 1497 CZ ARG A 94 8.430 -25.071 -0.516 1.00 41.33 C ATOM 1498 NH1 ARG A 94 8.496 -25.021 0.776 1.00 44.42 N ATOM 1499 NH2 ARG A 94 9.267 -24.391 -1.220 1.00 51.40 N ATOM 0 H ARG A 94 4.472 -26.238 -3.838 1.00 3.45 H new ATOM 0 HA ARG A 94 2.613 -26.134 -1.668 1.00 12.14 H new ATOM 0 HB2 ARG A 94 5.324 -24.817 -2.080 1.00 1.33 H new ATOM 0 HB3 ARG A 94 4.461 -24.883 -0.556 1.00 1.33 H new ATOM 0 HG2 ARG A 94 4.551 -27.382 -0.633 1.00 72.32 H new ATOM 0 HG3 ARG A 94 5.455 -27.291 -2.132 1.00 72.32 H new ATOM 0 HD2 ARG A 94 6.332 -26.182 0.564 1.00 2.51 H new ATOM 0 HD3 ARG A 94 6.971 -27.612 -0.222 1.00 2.51 H new ATOM 0 HE ARG A 94 7.507 -25.795 -2.131 1.00 34.42 H new ATOM 0 HH11 ARG A 94 7.837 -25.557 1.341 1.00 44.42 H new ATOM 0 HH12 ARG A 94 9.207 -24.446 1.228 1.00 44.42 H new ATOM 0 HH21 ARG A 94 9.223 -24.425 -2.238 1.00 51.40 H new ATOM 0 HH22 ARG A 94 9.974 -23.819 -0.759 1.00 51.40 H new ATOM 1513 N ILE A 95 3.005 -23.427 -3.495 1.00 0.24 N ATOM 1514 CA ILE A 95 2.346 -22.159 -3.841 1.00 1.42 C ATOM 1515 C ILE A 95 0.838 -22.396 -4.009 1.00 74.55 C ATOM 1516 O ILE A 95 0.004 -21.652 -3.485 1.00 2.35 O ATOM 1517 CB ILE A 95 2.915 -21.563 -5.159 1.00 44.12 C ATOM 1518 CG1 ILE A 95 4.444 -21.385 -5.072 1.00 21.01 C ATOM 1519 CG2 ILE A 95 2.233 -20.235 -5.491 1.00 15.12 C ATOM 1520 CD1 ILE A 95 4.896 -20.324 -4.091 1.00 50.24 C ATOM 0 H ILE A 95 3.736 -23.713 -4.146 1.00 0.24 H new ATOM 0 HA ILE A 95 2.533 -21.451 -3.034 1.00 1.42 H new ATOM 0 HB ILE A 95 2.704 -22.267 -5.964 1.00 44.12 H new ATOM 0 HG12 ILE A 95 4.893 -22.338 -4.790 1.00 21.01 H new ATOM 0 HG13 ILE A 95 4.825 -21.133 -6.062 1.00 21.01 H new ATOM 0 HG21 ILE A 95 2.646 -19.835 -6.417 1.00 15.12 H new ATOM 0 HG22 ILE A 95 1.162 -20.396 -5.611 1.00 15.12 H new ATOM 0 HG23 ILE A 95 2.404 -19.526 -4.681 1.00 15.12 H new ATOM 0 HD11 ILE A 95 5.984 -20.266 -4.094 1.00 50.24 H new ATOM 0 HD12 ILE A 95 4.480 -19.359 -4.381 1.00 50.24 H new ATOM 0 HD13 ILE A 95 4.549 -20.582 -3.090 1.00 50.24 H new ATOM 1532 N VAL A 96 0.508 -23.462 -4.736 1.00 24.14 N ATOM 1533 CA VAL A 96 -0.881 -23.897 -4.901 1.00 64.55 C ATOM 1534 C VAL A 96 -1.511 -24.253 -3.551 1.00 1.53 C ATOM 1535 O VAL A 96 -2.640 -23.873 -3.264 1.00 31.40 O ATOM 1536 CB VAL A 96 -0.979 -25.133 -5.825 1.00 4.14 C ATOM 1537 CG1 VAL A 96 -2.434 -25.553 -6.029 1.00 33.23 C ATOM 1538 CG2 VAL A 96 -0.293 -24.864 -7.158 1.00 54.23 C ATOM 0 H VAL A 96 1.188 -24.045 -5.224 1.00 24.14 H new ATOM 0 HA VAL A 96 -1.419 -23.063 -5.351 1.00 64.55 H new ATOM 0 HB VAL A 96 -0.462 -25.961 -5.340 1.00 4.14 H new ATOM 0 HG11 VAL A 96 -2.473 -26.424 -6.683 1.00 33.23 H new ATOM 0 HG12 VAL A 96 -2.879 -25.802 -5.066 1.00 33.23 H new ATOM 0 HG13 VAL A 96 -2.989 -24.733 -6.484 1.00 33.23 H new ATOM 0 HG21 VAL A 96 -0.373 -25.746 -7.793 1.00 54.23 H new ATOM 0 HG22 VAL A 96 -0.773 -24.018 -7.650 1.00 54.23 H new ATOM 0 HG23 VAL A 96 0.759 -24.635 -6.986 1.00 54.23 H new ATOM 1548 N THR A 97 -0.766 -24.991 -2.728 1.00 3.13 N ATOM 1549 CA THR A 97 -1.248 -25.416 -1.406 1.00 41.22 C ATOM 1550 C THR A 97 -1.550 -24.208 -0.506 1.00 62.33 C ATOM 1551 O THR A 97 -2.497 -24.226 0.280 1.00 60.44 O ATOM 1552 CB THR A 97 -0.221 -26.338 -0.698 1.00 33.34 C ATOM 1553 OG1 THR A 97 0.080 -27.471 -1.529 1.00 21.25 O ATOM 1554 CG2 THR A 97 -0.745 -26.829 0.649 1.00 2.34 C ATOM 0 H THR A 97 0.177 -25.310 -2.951 1.00 3.13 H new ATOM 0 HA THR A 97 -2.169 -25.974 -1.572 1.00 41.22 H new ATOM 0 HB THR A 97 0.682 -25.753 -0.525 1.00 33.34 H new ATOM 0 HG1 THR A 97 0.520 -27.167 -2.350 1.00 21.25 H new ATOM 0 HG21 THR A 97 0.000 -27.472 1.117 1.00 2.34 H new ATOM 0 HG22 THR A 97 -0.944 -25.974 1.296 1.00 2.34 H new ATOM 0 HG23 THR A 97 -1.666 -27.392 0.498 1.00 2.34 H new ATOM 1562 N LEU A 98 -0.742 -23.156 -0.640 1.00 3.30 N ATOM 1563 CA LEU A 98 -0.953 -21.909 0.105 1.00 3.40 C ATOM 1564 C LEU A 98 -2.295 -21.261 -0.276 1.00 13.35 C ATOM 1565 O LEU A 98 -3.148 -21.003 0.577 1.00 33.03 O ATOM 1566 CB LEU A 98 0.187 -20.920 -0.192 1.00 53.25 C ATOM 1567 CG LEU A 98 0.141 -19.611 0.613 1.00 72.14 C ATOM 1568 CD1 LEU A 98 0.565 -19.856 2.056 1.00 14.41 C ATOM 1569 CD2 LEU A 98 1.004 -18.532 -0.038 1.00 41.02 C ATOM 0 H LEU A 98 0.068 -23.140 -1.259 1.00 3.30 H new ATOM 0 HA LEU A 98 -0.967 -22.150 1.168 1.00 3.40 H new ATOM 0 HB2 LEU A 98 1.138 -21.416 0.004 1.00 53.25 H new ATOM 0 HB3 LEU A 98 0.168 -20.676 -1.254 1.00 53.25 H new ATOM 0 HG LEU A 98 -0.888 -19.251 0.616 1.00 72.14 H new ATOM 0 HD11 LEU A 98 0.526 -18.919 2.611 1.00 14.41 H new ATOM 0 HD12 LEU A 98 -0.110 -20.578 2.516 1.00 14.41 H new ATOM 0 HD13 LEU A 98 1.582 -20.247 2.075 1.00 14.41 H new ATOM 0 HD21 LEU A 98 0.952 -17.618 0.554 1.00 41.02 H new ATOM 0 HD22 LEU A 98 2.038 -18.874 -0.087 1.00 41.02 H new ATOM 0 HD23 LEU A 98 0.639 -18.333 -1.046 1.00 41.02 H new ATOM 1581 N ILE A 99 -2.477 -21.022 -1.573 1.00 23.40 N ATOM 1582 CA ILE A 99 -3.696 -20.388 -2.091 1.00 15.11 C ATOM 1583 C ILE A 99 -4.925 -21.302 -1.911 1.00 2.13 C ATOM 1584 O ILE A 99 -6.034 -20.836 -1.643 1.00 44.21 O ATOM 1585 CB ILE A 99 -3.523 -20.025 -3.591 1.00 34.22 C ATOM 1586 CG1 ILE A 99 -2.256 -19.172 -3.788 1.00 14.11 C ATOM 1587 CG2 ILE A 99 -4.754 -19.290 -4.121 1.00 2.32 C ATOM 1588 CD1 ILE A 99 -1.957 -18.833 -5.235 1.00 23.41 C ATOM 0 H ILE A 99 -1.793 -21.258 -2.292 1.00 23.40 H new ATOM 0 HA ILE A 99 -3.863 -19.476 -1.518 1.00 15.11 H new ATOM 0 HB ILE A 99 -3.414 -20.950 -4.158 1.00 34.22 H new ATOM 0 HG12 ILE A 99 -2.363 -18.246 -3.224 1.00 14.11 H new ATOM 0 HG13 ILE A 99 -1.403 -19.705 -3.367 1.00 14.11 H new ATOM 0 HG21 ILE A 99 -4.608 -19.047 -5.173 1.00 2.32 H new ATOM 0 HG22 ILE A 99 -5.632 -19.927 -4.014 1.00 2.32 H new ATOM 0 HG23 ILE A 99 -4.901 -18.371 -3.554 1.00 2.32 H new ATOM 0 HD11 ILE A 99 -1.050 -18.231 -5.288 1.00 23.41 H new ATOM 0 HD12 ILE A 99 -1.816 -19.753 -5.802 1.00 23.41 H new ATOM 0 HD13 ILE A 99 -2.790 -18.271 -5.657 1.00 23.41 H new ATOM 1600 N SER A 100 -4.706 -22.609 -2.048 1.00 34.54 N ATOM 1601 CA SER A 100 -5.770 -23.609 -1.874 1.00 24.20 C ATOM 1602 C SER A 100 -6.272 -23.638 -0.425 1.00 31.53 C ATOM 1603 O SER A 100 -7.479 -23.624 -0.175 1.00 53.25 O ATOM 1604 CB SER A 100 -5.272 -25.005 -2.278 1.00 23.33 C ATOM 1605 OG SER A 100 -6.272 -25.991 -2.081 1.00 42.20 O ATOM 0 H SER A 100 -3.796 -23.007 -2.281 1.00 34.54 H new ATOM 0 HA SER A 100 -6.599 -23.324 -2.522 1.00 24.20 H new ATOM 0 HB2 SER A 100 -4.970 -24.996 -3.325 1.00 23.33 H new ATOM 0 HB3 SER A 100 -4.388 -25.260 -1.694 1.00 23.33 H new ATOM 0 HG SER A 100 -6.399 -26.499 -2.910 1.00 42.20 H new ATOM 1611 N PHE A 101 -5.339 -23.667 0.532 1.00 31.15 N ATOM 1612 CA PHE A 101 -5.695 -23.619 1.953 1.00 30.44 C ATOM 1613 C PHE A 101 -6.392 -22.292 2.291 1.00 63.24 C ATOM 1614 O PHE A 101 -7.361 -22.265 3.054 1.00 50.45 O ATOM 1615 CB PHE A 101 -4.447 -23.809 2.832 1.00 63.22 C ATOM 1616 CG PHE A 101 -4.734 -23.811 4.318 1.00 3.15 C ATOM 1617 CD1 PHE A 101 -5.762 -24.588 4.838 1.00 41.33 C ATOM 1618 CD2 PHE A 101 -3.982 -23.036 5.191 1.00 33.52 C ATOM 1619 CE1 PHE A 101 -6.031 -24.590 6.194 1.00 31.22 C ATOM 1620 CE2 PHE A 101 -4.249 -23.035 6.548 1.00 63.10 C ATOM 1621 CZ PHE A 101 -5.275 -23.813 7.050 1.00 15.51 C ATOM 0 H PHE A 101 -4.337 -23.723 0.350 1.00 31.15 H new ATOM 0 HA PHE A 101 -6.388 -24.435 2.158 1.00 30.44 H new ATOM 0 HB2 PHE A 101 -3.967 -24.750 2.564 1.00 63.22 H new ATOM 0 HB3 PHE A 101 -3.735 -23.014 2.611 1.00 63.22 H new ATOM 0 HD1 PHE A 101 -6.358 -25.198 4.175 1.00 41.33 H new ATOM 0 HD2 PHE A 101 -3.178 -22.426 4.805 1.00 33.52 H new ATOM 0 HE1 PHE A 101 -6.833 -25.199 6.584 1.00 31.22 H new ATOM 0 HE2 PHE A 101 -3.656 -22.427 7.215 1.00 63.10 H new ATOM 0 HZ PHE A 101 -5.485 -23.813 8.109 1.00 15.51 H new ATOM 1631 N GLY A 102 -5.902 -21.197 1.707 1.00 65.42 N ATOM 1632 CA GLY A 102 -6.554 -19.904 1.876 1.00 50.20 C ATOM 1633 C GLY A 102 -8.015 -19.932 1.440 1.00 42.04 C ATOM 1634 O GLY A 102 -8.897 -19.448 2.152 1.00 44.20 O ATOM 0 H GLY A 102 -5.067 -21.182 1.121 1.00 65.42 H new ATOM 0 HA2 GLY A 102 -6.495 -19.604 2.922 1.00 50.20 H new ATOM 0 HA3 GLY A 102 -6.019 -19.151 1.297 1.00 50.20 H new ATOM 1638 N ALA A 103 -8.270 -20.521 0.271 1.00 74.31 N ATOM 1639 CA ALA A 103 -9.636 -20.691 -0.236 1.00 15.21 C ATOM 1640 C ALA A 103 -10.445 -21.662 0.637 1.00 23.13 C ATOM 1641 O ALA A 103 -11.654 -21.491 0.822 1.00 23.10 O ATOM 1642 CB ALA A 103 -9.603 -21.176 -1.682 1.00 20.40 C ATOM 0 H ALA A 103 -7.547 -20.890 -0.346 1.00 74.31 H new ATOM 0 HA ALA A 103 -10.132 -19.721 -0.197 1.00 15.21 H new ATOM 0 HB1 ALA A 103 -10.622 -21.299 -2.048 1.00 20.40 H new ATOM 0 HB2 ALA A 103 -9.081 -20.445 -2.299 1.00 20.40 H new ATOM 0 HB3 ALA A 103 -9.082 -22.132 -1.733 1.00 20.40 H new ATOM 1648 N PHE A 104 -9.769 -22.681 1.169 1.00 73.30 N ATOM 1649 CA PHE A 104 -10.406 -23.661 2.055 1.00 22.43 C ATOM 1650 C PHE A 104 -10.916 -22.991 3.343 1.00 24.40 C ATOM 1651 O PHE A 104 -11.993 -23.322 3.848 1.00 23.23 O ATOM 1652 CB PHE A 104 -9.421 -24.791 2.392 1.00 51.11 C ATOM 1653 CG PHE A 104 -10.051 -25.940 3.139 1.00 1.04 C ATOM 1654 CD1 PHE A 104 -10.721 -26.943 2.452 1.00 43.02 C ATOM 1655 CD2 PHE A 104 -9.981 -26.015 4.522 1.00 75.44 C ATOM 1656 CE1 PHE A 104 -11.306 -27.995 3.129 1.00 62.04 C ATOM 1657 CE2 PHE A 104 -10.565 -27.066 5.203 1.00 24.31 C ATOM 1658 CZ PHE A 104 -11.228 -28.057 4.506 1.00 62.21 C ATOM 0 H PHE A 104 -8.777 -22.851 1.002 1.00 73.30 H new ATOM 0 HA PHE A 104 -11.264 -24.085 1.533 1.00 22.43 H new ATOM 0 HB2 PHE A 104 -8.982 -25.167 1.468 1.00 51.11 H new ATOM 0 HB3 PHE A 104 -8.605 -24.384 2.990 1.00 51.11 H new ATOM 0 HD1 PHE A 104 -10.786 -26.900 1.375 1.00 43.02 H new ATOM 0 HD2 PHE A 104 -9.464 -25.243 5.073 1.00 75.44 H new ATOM 0 HE1 PHE A 104 -11.824 -28.769 2.582 1.00 62.04 H new ATOM 0 HE2 PHE A 104 -10.503 -27.112 6.280 1.00 24.31 H new ATOM 0 HZ PHE A 104 -11.685 -28.879 5.037 1.00 62.21 H new ATOM 1668 N VAL A 105 -10.137 -22.050 3.874 1.00 70.34 N ATOM 1669 CA VAL A 105 -10.558 -21.268 5.041 1.00 42.11 C ATOM 1670 C VAL A 105 -11.607 -20.215 4.639 1.00 1.35 C ATOM 1671 O VAL A 105 -12.578 -19.979 5.362 1.00 1.22 O ATOM 1672 CB VAL A 105 -9.352 -20.567 5.722 1.00 62.41 C ATOM 1673 CG1 VAL A 105 -9.785 -19.852 7.002 1.00 45.22 C ATOM 1674 CG2 VAL A 105 -8.238 -21.571 6.014 1.00 4.24 C ATOM 0 H VAL A 105 -9.212 -21.809 3.517 1.00 70.34 H new ATOM 0 HA VAL A 105 -11.000 -21.963 5.755 1.00 42.11 H new ATOM 0 HB VAL A 105 -8.965 -19.817 5.032 1.00 62.41 H new ATOM 0 HG11 VAL A 105 -8.921 -19.369 7.459 1.00 45.22 H new ATOM 0 HG12 VAL A 105 -10.536 -19.100 6.762 1.00 45.22 H new ATOM 0 HG13 VAL A 105 -10.207 -20.577 7.699 1.00 45.22 H new ATOM 0 HG21 VAL A 105 -7.402 -21.059 6.491 1.00 4.24 H new ATOM 0 HG22 VAL A 105 -8.614 -22.349 6.679 1.00 4.24 H new ATOM 0 HG23 VAL A 105 -7.901 -22.023 5.081 1.00 4.24 H new ATOM 1684 N ALA A 106 -11.410 -19.607 3.467 1.00 51.33 N ATOM 1685 CA ALA A 106 -12.319 -18.577 2.944 1.00 24.31 C ATOM 1686 C ALA A 106 -13.768 -19.081 2.820 1.00 32.10 C ATOM 1687 O ALA A 106 -14.713 -18.391 3.220 1.00 61.21 O ATOM 1688 CB ALA A 106 -11.819 -18.077 1.592 1.00 75.11 C ATOM 0 H ALA A 106 -10.621 -19.811 2.854 1.00 51.33 H new ATOM 0 HA ALA A 106 -12.324 -17.756 3.660 1.00 24.31 H new ATOM 0 HB1 ALA A 106 -12.499 -17.314 1.212 1.00 75.11 H new ATOM 0 HB2 ALA A 106 -10.823 -17.650 1.708 1.00 75.11 H new ATOM 0 HB3 ALA A 106 -11.778 -18.909 0.889 1.00 75.11 H new ATOM 1694 N LYS A 107 -13.946 -20.284 2.268 1.00 22.31 N ATOM 1695 CA LYS A 107 -15.287 -20.871 2.135 1.00 21.54 C ATOM 1696 C LYS A 107 -15.929 -21.096 3.513 1.00 32.40 C ATOM 1697 O LYS A 107 -17.140 -20.932 3.679 1.00 14.10 O ATOM 1698 CB LYS A 107 -15.242 -22.177 1.322 1.00 4.43 C ATOM 1699 CG LYS A 107 -14.377 -23.274 1.933 1.00 55.43 C ATOM 1700 CD LYS A 107 -14.322 -24.519 1.045 1.00 62.22 C ATOM 1701 CE LYS A 107 -13.668 -24.233 -0.308 1.00 63.40 C ATOM 1702 NZ LYS A 107 -13.615 -25.444 -1.171 1.00 32.13 N ATOM 0 H LYS A 107 -13.190 -20.867 1.909 1.00 22.31 H new ATOM 0 HA LYS A 107 -15.910 -20.163 1.589 1.00 21.54 H new ATOM 0 HB2 LYS A 107 -16.258 -22.554 1.208 1.00 4.43 H new ATOM 0 HB3 LYS A 107 -14.871 -21.954 0.322 1.00 4.43 H new ATOM 0 HG2 LYS A 107 -13.367 -22.895 2.090 1.00 55.43 H new ATOM 0 HG3 LYS A 107 -14.772 -23.544 2.913 1.00 55.43 H new ATOM 0 HD2 LYS A 107 -13.766 -25.304 1.557 1.00 62.22 H new ATOM 0 HD3 LYS A 107 -15.333 -24.895 0.886 1.00 62.22 H new ATOM 0 HE2 LYS A 107 -14.224 -23.448 -0.820 1.00 63.40 H new ATOM 0 HE3 LYS A 107 -12.657 -23.857 -0.149 1.00 63.40 H new ATOM 0 HZ1 LYS A 107 -13.542 -25.157 -2.168 1.00 32.13 H new ATOM 0 HZ2 LYS A 107 -12.786 -26.017 -0.914 1.00 32.13 H new ATOM 0 HZ3 LYS A 107 -14.480 -26.005 -1.035 1.00 32.13 H new ATOM 1716 N HIS A 108 -15.109 -21.446 4.508 1.00 0.33 N ATOM 1717 CA HIS A 108 -15.584 -21.553 5.891 1.00 30.31 C ATOM 1718 C HIS A 108 -16.005 -20.176 6.423 1.00 71.04 C ATOM 1719 O HIS A 108 -16.985 -20.056 7.160 1.00 62.21 O ATOM 1720 CB HIS A 108 -14.501 -22.155 6.798 1.00 51.23 C ATOM 1721 CG HIS A 108 -14.909 -22.251 8.240 1.00 31.52 C ATOM 1722 ND1 HIS A 108 -15.782 -23.205 8.715 1.00 24.42 N ATOM 1723 CD2 HIS A 108 -14.570 -21.494 9.312 1.00 64.00 C ATOM 1724 CE1 HIS A 108 -15.962 -23.032 10.010 1.00 63.51 C ATOM 1725 NE2 HIS A 108 -15.239 -22.002 10.396 1.00 54.20 N ATOM 0 H HIS A 108 -14.119 -21.659 4.384 1.00 0.33 H new ATOM 0 HA HIS A 108 -16.449 -22.216 5.898 1.00 30.31 H new ATOM 0 HB2 HIS A 108 -14.246 -23.150 6.434 1.00 51.23 H new ATOM 0 HB3 HIS A 108 -13.599 -21.548 6.724 1.00 51.23 H new ATOM 0 HD2 HIS A 108 -13.898 -20.648 9.312 1.00 64.00 H new ATOM 0 HE1 HIS A 108 -16.595 -23.633 10.646 1.00 63.51 H new ATOM 0 HE2 HIS A 108 -15.185 -21.640 11.348 1.00 54.20 H new ATOM 1734 N LEU A 109 -15.258 -19.140 6.041 1.00 4.33 N ATOM 1735 CA LEU A 109 -15.565 -17.772 6.464 1.00 30.43 C ATOM 1736 C LEU A 109 -16.944 -17.320 5.960 1.00 43.23 C ATOM 1737 O LEU A 109 -17.764 -16.847 6.742 1.00 44.12 O ATOM 1738 CB LEU A 109 -14.479 -16.802 5.982 1.00 0.34 C ATOM 1739 CG LEU A 109 -13.084 -17.016 6.596 1.00 75.23 C ATOM 1740 CD1 LEU A 109 -12.085 -16.013 6.031 1.00 71.31 C ATOM 1741 CD2 LEU A 109 -13.142 -16.921 8.119 1.00 41.51 C ATOM 0 H LEU A 109 -14.437 -19.221 5.441 1.00 4.33 H new ATOM 0 HA LEU A 109 -15.588 -17.763 7.554 1.00 30.43 H new ATOM 0 HB2 LEU A 109 -14.397 -16.884 4.898 1.00 0.34 H new ATOM 0 HB3 LEU A 109 -14.802 -15.784 6.201 1.00 0.34 H new ATOM 0 HG LEU A 109 -12.747 -18.018 6.330 1.00 75.23 H new ATOM 0 HD11 LEU A 109 -11.106 -16.183 6.479 1.00 71.31 H new ATOM 0 HD12 LEU A 109 -12.016 -16.137 4.950 1.00 71.31 H new ATOM 0 HD13 LEU A 109 -12.418 -15.000 6.259 1.00 71.31 H new ATOM 0 HD21 LEU A 109 -12.145 -17.075 8.531 1.00 41.51 H new ATOM 0 HD22 LEU A 109 -13.506 -15.935 8.408 1.00 41.51 H new ATOM 0 HD23 LEU A 109 -13.817 -17.685 8.506 1.00 41.51 H new ATOM 1753 N LYS A 110 -17.217 -17.487 4.665 1.00 32.22 N ATOM 1754 CA LYS A 110 -18.534 -17.122 4.120 1.00 62.43 C ATOM 1755 C LYS A 110 -19.642 -17.977 4.753 1.00 61.11 C ATOM 1756 O LYS A 110 -20.749 -17.495 5.002 1.00 11.34 O ATOM 1757 CB LYS A 110 -18.568 -17.258 2.590 1.00 74.22 C ATOM 1758 CG LYS A 110 -19.918 -16.873 1.975 1.00 12.10 C ATOM 1759 CD LYS A 110 -19.882 -16.899 0.450 1.00 13.30 C ATOM 1760 CE LYS A 110 -21.252 -16.621 -0.164 1.00 63.24 C ATOM 1761 NZ LYS A 110 -21.756 -15.260 0.158 1.00 61.34 N ATOM 0 H LYS A 110 -16.561 -17.865 3.982 1.00 32.22 H new ATOM 0 HA LYS A 110 -18.712 -16.076 4.370 1.00 62.43 H new ATOM 0 HB2 LYS A 110 -17.788 -16.630 2.159 1.00 74.22 H new ATOM 0 HB3 LYS A 110 -18.334 -18.287 2.319 1.00 74.22 H new ATOM 0 HG2 LYS A 110 -20.687 -17.559 2.331 1.00 12.10 H new ATOM 0 HG3 LYS A 110 -20.199 -15.876 2.314 1.00 12.10 H new ATOM 0 HD2 LYS A 110 -19.168 -16.157 0.092 1.00 13.30 H new ATOM 0 HD3 LYS A 110 -19.526 -17.872 0.113 1.00 13.30 H new ATOM 0 HE2 LYS A 110 -21.191 -16.736 -1.246 1.00 63.24 H new ATOM 0 HE3 LYS A 110 -21.965 -17.363 0.196 1.00 63.24 H new ATOM 0 HZ1 LYS A 110 -22.515 -15.005 -0.506 1.00 61.34 H new ATOM 0 HZ2 LYS A 110 -22.128 -15.248 1.129 1.00 61.34 H new ATOM 0 HZ3 LYS A 110 -20.979 -14.574 0.076 1.00 61.34 H new ATOM 1775 N THR A 111 -19.328 -19.242 5.029 1.00 3.31 N ATOM 1776 CA THR A 111 -20.260 -20.135 5.730 1.00 62.22 C ATOM 1777 C THR A 111 -20.683 -19.534 7.078 1.00 45.34 C ATOM 1778 O THR A 111 -21.855 -19.576 7.449 1.00 34.22 O ATOM 1779 CB THR A 111 -19.642 -21.539 5.965 1.00 24.42 C ATOM 1780 OG1 THR A 111 -19.357 -22.176 4.706 1.00 34.14 O ATOM 1781 CG2 THR A 111 -20.573 -22.432 6.778 1.00 74.50 C ATOM 0 H THR A 111 -18.438 -19.674 4.780 1.00 3.31 H new ATOM 0 HA THR A 111 -21.136 -20.245 5.091 1.00 62.22 H new ATOM 0 HB THR A 111 -18.718 -21.398 6.526 1.00 24.42 H new ATOM 0 HG1 THR A 111 -18.588 -21.739 4.285 1.00 34.14 H new ATOM 0 HG21 THR A 111 -20.107 -23.407 6.923 1.00 74.50 H new ATOM 0 HG22 THR A 111 -20.762 -21.973 7.748 1.00 74.50 H new ATOM 0 HG23 THR A 111 -21.516 -22.556 6.245 1.00 74.50 H new ATOM 1789 N ILE A 112 -19.722 -18.949 7.797 1.00 74.33 N ATOM 1790 CA ILE A 112 -19.996 -18.305 9.092 1.00 72.52 C ATOM 1791 C ILE A 112 -20.163 -16.775 8.956 1.00 2.45 C ATOM 1792 O ILE A 112 -20.032 -16.039 9.934 1.00 12.54 O ATOM 1793 CB ILE A 112 -18.883 -18.622 10.129 1.00 15.31 C ATOM 1794 CG1 ILE A 112 -17.515 -18.116 9.640 1.00 20.00 C ATOM 1795 CG2 ILE A 112 -18.831 -20.124 10.410 1.00 24.00 C ATOM 1796 CD1 ILE A 112 -16.384 -18.363 10.620 1.00 61.35 C ATOM 0 H ILE A 112 -18.745 -18.906 7.507 1.00 74.33 H new ATOM 0 HA ILE A 112 -20.939 -18.719 9.449 1.00 72.52 H new ATOM 0 HB ILE A 112 -19.123 -18.102 11.056 1.00 15.31 H new ATOM 0 HG12 ILE A 112 -17.276 -18.601 8.694 1.00 20.00 H new ATOM 0 HG13 ILE A 112 -17.584 -17.046 9.441 1.00 20.00 H new ATOM 0 HG21 ILE A 112 -18.047 -20.331 11.138 1.00 24.00 H new ATOM 0 HG22 ILE A 112 -19.791 -20.453 10.807 1.00 24.00 H new ATOM 0 HG23 ILE A 112 -18.618 -20.660 9.485 1.00 24.00 H new ATOM 0 HD11 ILE A 112 -15.452 -17.979 10.205 1.00 61.35 H new ATOM 0 HD12 ILE A 112 -16.599 -17.854 11.560 1.00 61.35 H new ATOM 0 HD13 ILE A 112 -16.286 -19.433 10.801 1.00 61.35 H new ATOM 1808 N ASN A 113 -20.462 -16.313 7.732 1.00 34.21 N ATOM 1809 CA ASN A 113 -20.778 -14.893 7.448 1.00 32.20 C ATOM 1810 C ASN A 113 -19.550 -13.958 7.532 1.00 44.01 C ATOM 1811 O ASN A 113 -19.676 -12.746 7.356 1.00 62.02 O ATOM 1812 CB ASN A 113 -21.885 -14.380 8.384 1.00 72.52 C ATOM 1813 CG ASN A 113 -23.158 -15.200 8.286 1.00 53.02 C ATOM 1814 OD1 ASN A 113 -24.024 -14.928 7.462 1.00 3.34 O ATOM 1815 ND2 ASN A 113 -23.292 -16.199 9.133 1.00 34.33 N ATOM 0 H ASN A 113 -20.493 -16.910 6.906 1.00 34.21 H new ATOM 0 HA ASN A 113 -21.126 -14.869 6.415 1.00 32.20 H new ATOM 0 HB2 ASN A 113 -21.524 -14.398 9.412 1.00 72.52 H new ATOM 0 HB3 ASN A 113 -22.107 -13.341 8.143 1.00 72.52 H new ATOM 0 HD21 ASN A 113 -24.135 -16.773 9.116 1.00 34.33 H new ATOM 0 HD22 ASN A 113 -22.553 -16.399 9.807 1.00 34.33 H new ATOM 1822 N GLN A 114 -18.372 -14.519 7.770 1.00 13.51 N ATOM 1823 CA GLN A 114 -17.134 -13.732 7.911 1.00 23.15 C ATOM 1824 C GLN A 114 -16.472 -13.417 6.550 1.00 34.32 C ATOM 1825 O GLN A 114 -15.250 -13.522 6.406 1.00 61.24 O ATOM 1826 CB GLN A 114 -16.152 -14.499 8.811 1.00 31.45 C ATOM 1827 CG GLN A 114 -16.641 -14.671 10.243 1.00 31.41 C ATOM 1828 CD GLN A 114 -16.583 -13.381 11.038 1.00 11.02 C ATOM 1829 OE1 GLN A 114 -17.515 -12.586 11.038 1.00 23.11 O ATOM 1830 NE2 GLN A 114 -15.485 -13.165 11.728 1.00 54.43 N ATOM 0 H GLN A 114 -18.238 -15.525 7.872 1.00 13.51 H new ATOM 0 HA GLN A 114 -17.396 -12.775 8.362 1.00 23.15 H new ATOM 0 HB2 GLN A 114 -15.969 -15.483 8.378 1.00 31.45 H new ATOM 0 HB3 GLN A 114 -15.197 -13.973 8.823 1.00 31.45 H new ATOM 0 HG2 GLN A 114 -17.667 -15.040 10.231 1.00 31.41 H new ATOM 0 HG3 GLN A 114 -16.036 -15.428 10.741 1.00 31.41 H new ATOM 0 HE21 GLN A 114 -14.727 -13.847 11.707 1.00 54.43 H new ATOM 0 HE22 GLN A 114 -15.391 -12.315 12.285 1.00 54.43 H new ATOM 1839 N GLU A 115 -17.269 -12.986 5.568 1.00 32.21 N ATOM 1840 CA GLU A 115 -16.747 -12.682 4.222 1.00 74.22 C ATOM 1841 C GLU A 115 -15.726 -11.532 4.243 1.00 44.44 C ATOM 1842 O GLU A 115 -14.769 -11.523 3.465 1.00 1.21 O ATOM 1843 CB GLU A 115 -17.885 -12.336 3.253 1.00 33.15 C ATOM 1844 CG GLU A 115 -18.826 -13.498 2.966 1.00 1.14 C ATOM 1845 CD GLU A 115 -19.842 -13.171 1.886 1.00 52.31 C ATOM 1846 OE1 GLU A 115 -20.841 -12.488 2.188 1.00 41.20 O ATOM 1847 OE2 GLU A 115 -19.644 -13.601 0.731 1.00 11.02 O ATOM 0 H GLU A 115 -18.273 -12.839 5.673 1.00 32.21 H new ATOM 0 HA GLU A 115 -16.240 -13.583 3.876 1.00 74.22 H new ATOM 0 HB2 GLU A 115 -18.461 -11.508 3.666 1.00 33.15 H new ATOM 0 HB3 GLU A 115 -17.456 -11.988 2.313 1.00 33.15 H new ATOM 0 HG2 GLU A 115 -18.243 -14.367 2.660 1.00 1.14 H new ATOM 0 HG3 GLU A 115 -19.350 -13.772 3.882 1.00 1.14 H new ATOM 1854 N SER A 116 -15.937 -10.566 5.133 1.00 30.22 N ATOM 1855 CA SER A 116 -15.014 -9.431 5.292 1.00 51.13 C ATOM 1856 C SER A 116 -13.600 -9.903 5.654 1.00 3.33 C ATOM 1857 O SER A 116 -12.620 -9.219 5.380 1.00 1.52 O ATOM 1858 CB SER A 116 -15.529 -8.460 6.363 1.00 40.53 C ATOM 1859 OG SER A 116 -16.802 -7.941 6.010 1.00 73.20 O ATOM 0 H SER A 116 -16.741 -10.541 5.760 1.00 30.22 H new ATOM 0 HA SER A 116 -14.966 -8.913 4.334 1.00 51.13 H new ATOM 0 HB2 SER A 116 -15.595 -8.973 7.322 1.00 40.53 H new ATOM 0 HB3 SER A 116 -14.820 -7.641 6.487 1.00 40.53 H new ATOM 0 HG SER A 116 -17.110 -7.326 6.708 1.00 73.20 H new ATOM 1865 N SER A 117 -13.506 -11.072 6.287 1.00 64.32 N ATOM 1866 CA SER A 117 -12.210 -11.662 6.661 1.00 64.54 C ATOM 1867 C SER A 117 -11.511 -12.317 5.452 1.00 72.40 C ATOM 1868 O SER A 117 -10.283 -12.405 5.407 1.00 34.55 O ATOM 1869 CB SER A 117 -12.394 -12.696 7.786 1.00 42.51 C ATOM 1870 OG SER A 117 -12.982 -12.108 8.942 1.00 10.13 O ATOM 0 H SER A 117 -14.313 -11.635 6.555 1.00 64.32 H new ATOM 0 HA SER A 117 -11.574 -10.852 7.018 1.00 64.54 H new ATOM 0 HB2 SER A 117 -13.023 -13.513 7.432 1.00 42.51 H new ATOM 0 HB3 SER A 117 -11.428 -13.127 8.047 1.00 42.51 H new ATOM 0 HG SER A 117 -13.088 -12.790 9.638 1.00 10.13 H new ATOM 1876 N ILE A 118 -12.302 -12.772 4.476 1.00 63.54 N ATOM 1877 CA ILE A 118 -11.775 -13.461 3.281 1.00 54.05 C ATOM 1878 C ILE A 118 -10.763 -12.602 2.500 1.00 34.51 C ATOM 1879 O ILE A 118 -9.695 -13.080 2.110 1.00 42.45 O ATOM 1880 CB ILE A 118 -12.926 -13.863 2.316 1.00 31.42 C ATOM 1881 CG1 ILE A 118 -13.909 -14.818 3.011 1.00 22.31 C ATOM 1882 CG2 ILE A 118 -12.373 -14.497 1.040 1.00 53.13 C ATOM 1883 CD1 ILE A 118 -15.082 -15.230 2.142 1.00 32.13 C ATOM 0 H ILE A 118 -13.318 -12.677 4.485 1.00 63.54 H new ATOM 0 HA ILE A 118 -11.264 -14.350 3.651 1.00 54.05 H new ATOM 0 HB ILE A 118 -13.465 -12.957 2.039 1.00 31.42 H new ATOM 0 HG12 ILE A 118 -13.371 -15.712 3.326 1.00 22.31 H new ATOM 0 HG13 ILE A 118 -14.288 -14.340 3.914 1.00 22.31 H new ATOM 0 HG21 ILE A 118 -13.198 -14.769 0.382 1.00 53.13 H new ATOM 0 HG22 ILE A 118 -11.723 -13.784 0.532 1.00 53.13 H new ATOM 0 HG23 ILE A 118 -11.803 -15.390 1.295 1.00 53.13 H new ATOM 0 HD11 ILE A 118 -15.731 -15.904 2.702 1.00 32.13 H new ATOM 0 HD12 ILE A 118 -15.646 -14.345 1.848 1.00 32.13 H new ATOM 0 HD13 ILE A 118 -14.714 -15.738 1.251 1.00 32.13 H new ATOM 1895 N GLU A 119 -11.104 -11.337 2.274 1.00 10.50 N ATOM 1896 CA GLU A 119 -10.282 -10.450 1.441 1.00 71.52 C ATOM 1897 C GLU A 119 -8.897 -10.157 2.071 1.00 23.50 C ATOM 1898 O GLU A 119 -7.872 -10.349 1.407 1.00 60.23 O ATOM 1899 CB GLU A 119 -11.061 -9.162 1.122 1.00 74.20 C ATOM 1900 CG GLU A 119 -12.379 -9.440 0.401 1.00 4.24 C ATOM 1901 CD GLU A 119 -13.171 -8.184 0.080 1.00 41.34 C ATOM 1902 OE1 GLU A 119 -12.826 -7.497 -0.903 1.00 45.12 O ATOM 1903 OE2 GLU A 119 -14.153 -7.891 0.796 1.00 12.33 O ATOM 0 H GLU A 119 -11.943 -10.898 2.654 1.00 10.50 H new ATOM 0 HA GLU A 119 -10.072 -10.966 0.504 1.00 71.52 H new ATOM 0 HB2 GLU A 119 -11.263 -8.625 2.048 1.00 74.20 H new ATOM 0 HB3 GLU A 119 -10.443 -8.511 0.504 1.00 74.20 H new ATOM 0 HG2 GLU A 119 -12.171 -9.976 -0.525 1.00 4.24 H new ATOM 0 HG3 GLU A 119 -12.990 -10.097 1.019 1.00 4.24 H new ATOM 1910 N PRO A 120 -8.818 -9.707 3.350 1.00 53.34 N ATOM 1911 CA PRO A 120 -7.524 -9.557 4.043 1.00 71.42 C ATOM 1912 C PRO A 120 -6.764 -10.894 4.150 1.00 72.30 C ATOM 1913 O PRO A 120 -5.531 -10.916 4.219 1.00 14.32 O ATOM 1914 CB PRO A 120 -7.902 -9.024 5.439 1.00 44.22 C ATOM 1915 CG PRO A 120 -9.355 -9.326 5.591 1.00 74.43 C ATOM 1916 CD PRO A 120 -9.939 -9.280 4.203 1.00 14.13 C ATOM 0 HA PRO A 120 -6.851 -8.891 3.503 1.00 71.42 H new ATOM 0 HB2 PRO A 120 -7.315 -9.510 6.218 1.00 44.22 H new ATOM 0 HB3 PRO A 120 -7.712 -7.954 5.517 1.00 44.22 H new ATOM 0 HG2 PRO A 120 -9.504 -10.306 6.044 1.00 74.43 H new ATOM 0 HG3 PRO A 120 -9.839 -8.597 6.242 1.00 74.43 H new ATOM 0 HD2 PRO A 120 -10.796 -9.947 4.105 1.00 14.13 H new ATOM 0 HD3 PRO A 120 -10.283 -8.279 3.944 1.00 14.13 H new ATOM 1924 N LEU A 121 -7.505 -12.007 4.166 1.00 22.13 N ATOM 1925 CA LEU A 121 -6.893 -13.342 4.125 1.00 72.22 C ATOM 1926 C LEU A 121 -6.168 -13.539 2.784 1.00 72.14 C ATOM 1927 O LEU A 121 -5.014 -13.967 2.747 1.00 54.21 O ATOM 1928 CB LEU A 121 -7.968 -14.430 4.342 1.00 54.15 C ATOM 1929 CG LEU A 121 -7.462 -15.843 4.717 1.00 32.21 C ATOM 1930 CD1 LEU A 121 -8.619 -16.709 5.210 1.00 21.24 C ATOM 1931 CD2 LEU A 121 -6.772 -16.525 3.537 1.00 5.44 C ATOM 0 H LEU A 121 -8.524 -12.012 4.207 1.00 22.13 H new ATOM 0 HA LEU A 121 -6.162 -13.429 4.929 1.00 72.22 H new ATOM 0 HB2 LEU A 121 -8.642 -14.090 5.129 1.00 54.15 H new ATOM 0 HB3 LEU A 121 -8.559 -14.511 3.429 1.00 54.15 H new ATOM 0 HG LEU A 121 -6.730 -15.727 5.517 1.00 32.21 H new ATOM 0 HD11 LEU A 121 -8.247 -17.700 5.470 1.00 21.24 H new ATOM 0 HD12 LEU A 121 -9.069 -16.248 6.089 1.00 21.24 H new ATOM 0 HD13 LEU A 121 -9.368 -16.798 4.423 1.00 21.24 H new ATOM 0 HD21 LEU A 121 -6.430 -17.515 3.838 1.00 5.44 H new ATOM 0 HD22 LEU A 121 -7.475 -16.620 2.710 1.00 5.44 H new ATOM 0 HD23 LEU A 121 -5.918 -15.927 3.220 1.00 5.44 H new ATOM 1943 N ALA A 122 -6.852 -13.210 1.685 1.00 53.34 N ATOM 1944 CA ALA A 122 -6.241 -13.240 0.350 1.00 62.10 C ATOM 1945 C ALA A 122 -4.982 -12.361 0.300 1.00 22.45 C ATOM 1946 O ALA A 122 -3.973 -12.729 -0.310 1.00 71.23 O ATOM 1947 CB ALA A 122 -7.248 -12.787 -0.703 1.00 72.32 C ATOM 0 H ALA A 122 -7.830 -12.919 1.692 1.00 53.34 H new ATOM 0 HA ALA A 122 -5.945 -14.267 0.135 1.00 62.10 H new ATOM 0 HB1 ALA A 122 -6.782 -12.814 -1.688 1.00 72.32 H new ATOM 0 HB2 ALA A 122 -8.111 -13.453 -0.692 1.00 72.32 H new ATOM 0 HB3 ALA A 122 -7.572 -11.770 -0.483 1.00 72.32 H new ATOM 1953 N GLU A 123 -5.048 -11.199 0.953 1.00 61.11 N ATOM 1954 CA GLU A 123 -3.886 -10.315 1.078 1.00 21.31 C ATOM 1955 C GLU A 123 -2.769 -10.984 1.890 1.00 62.34 C ATOM 1956 O GLU A 123 -1.599 -10.818 1.585 1.00 53.43 O ATOM 1957 CB GLU A 123 -4.278 -8.982 1.727 1.00 61.22 C ATOM 1958 CG GLU A 123 -5.284 -8.175 0.914 1.00 24.10 C ATOM 1959 CD GLU A 123 -5.562 -6.809 1.516 1.00 71.12 C ATOM 1960 OE1 GLU A 123 -4.822 -5.854 1.203 1.00 64.45 O ATOM 1961 OE2 GLU A 123 -6.515 -6.684 2.311 1.00 73.11 O ATOM 0 H GLU A 123 -5.893 -10.848 1.403 1.00 61.11 H new ATOM 0 HA GLU A 123 -3.514 -10.118 0.073 1.00 21.31 H new ATOM 0 HB2 GLU A 123 -4.696 -9.178 2.714 1.00 61.22 H new ATOM 0 HB3 GLU A 123 -3.380 -8.382 1.875 1.00 61.22 H new ATOM 0 HG2 GLU A 123 -4.908 -8.050 -0.101 1.00 24.10 H new ATOM 0 HG3 GLU A 123 -6.218 -8.733 0.842 1.00 24.10 H new ATOM 1968 N SER A 124 -3.141 -11.750 2.919 1.00 52.22 N ATOM 1969 CA SER A 124 -2.160 -12.497 3.731 1.00 62.42 C ATOM 1970 C SER A 124 -1.446 -13.566 2.894 1.00 31.34 C ATOM 1971 O SER A 124 -0.232 -13.737 2.994 1.00 41.21 O ATOM 1972 CB SER A 124 -2.837 -13.156 4.943 1.00 74.34 C ATOM 1973 OG SER A 124 -3.353 -12.180 5.839 1.00 64.42 O ATOM 0 H SER A 124 -4.110 -11.873 3.214 1.00 52.22 H new ATOM 0 HA SER A 124 -1.420 -11.780 4.086 1.00 62.42 H new ATOM 0 HB2 SER A 124 -3.645 -13.804 4.603 1.00 74.34 H new ATOM 0 HB3 SER A 124 -2.119 -13.788 5.465 1.00 74.34 H new ATOM 0 HG SER A 124 -4.085 -11.693 5.406 1.00 64.42 H new ATOM 1979 N ILE A 125 -2.212 -14.284 2.072 1.00 31.11 N ATOM 1980 CA ILE A 125 -1.643 -15.257 1.131 1.00 53.54 C ATOM 1981 C ILE A 125 -0.614 -14.580 0.210 1.00 71.30 C ATOM 1982 O ILE A 125 0.533 -15.019 0.100 1.00 12.45 O ATOM 1983 CB ILE A 125 -2.753 -15.916 0.266 1.00 10.44 C ATOM 1984 CG1 ILE A 125 -3.782 -16.638 1.155 1.00 43.21 C ATOM 1985 CG2 ILE A 125 -2.151 -16.883 -0.753 1.00 23.14 C ATOM 1986 CD1 ILE A 125 -3.199 -17.762 1.991 1.00 61.31 C ATOM 0 H ILE A 125 -3.229 -14.212 2.037 1.00 31.11 H new ATOM 0 HA ILE A 125 -1.149 -16.031 1.718 1.00 53.54 H new ATOM 0 HB ILE A 125 -3.267 -15.125 -0.280 1.00 10.44 H new ATOM 0 HG12 ILE A 125 -4.247 -15.909 1.819 1.00 43.21 H new ATOM 0 HG13 ILE A 125 -4.572 -17.042 0.522 1.00 43.21 H new ATOM 0 HG21 ILE A 125 -2.949 -17.331 -1.345 1.00 23.14 H new ATOM 0 HG22 ILE A 125 -1.471 -16.342 -1.411 1.00 23.14 H new ATOM 0 HG23 ILE A 125 -1.603 -17.667 -0.231 1.00 23.14 H new ATOM 0 HD11 ILE A 125 -3.988 -18.219 2.588 1.00 61.31 H new ATOM 0 HD12 ILE A 125 -2.760 -18.513 1.335 1.00 61.31 H new ATOM 0 HD13 ILE A 125 -2.429 -17.363 2.652 1.00 61.31 H new ATOM 1998 N THR A 126 -1.038 -13.494 -0.431 1.00 65.23 N ATOM 1999 CA THR A 126 -0.166 -12.710 -1.317 1.00 51.24 C ATOM 2000 C THR A 126 0.992 -12.065 -0.537 1.00 41.52 C ATOM 2001 O THR A 126 2.106 -11.947 -1.043 1.00 21.14 O ATOM 2002 CB THR A 126 -0.966 -11.595 -2.037 1.00 52.33 C ATOM 2003 OG1 THR A 126 -2.149 -12.146 -2.637 1.00 51.43 O ATOM 2004 CG2 THR A 126 -0.126 -10.912 -3.113 1.00 13.22 C ATOM 0 H THR A 126 -1.988 -13.130 -0.355 1.00 65.23 H new ATOM 0 HA THR A 126 0.241 -13.402 -2.054 1.00 51.24 H new ATOM 0 HB THR A 126 -1.242 -10.851 -1.290 1.00 52.33 H new ATOM 0 HG1 THR A 126 -2.823 -12.307 -1.944 1.00 51.43 H new ATOM 0 HG21 THR A 126 -0.718 -10.136 -3.598 1.00 13.22 H new ATOM 0 HG22 THR A 126 0.756 -10.464 -2.656 1.00 13.22 H new ATOM 0 HG23 THR A 126 0.184 -11.648 -3.855 1.00 13.22 H new ATOM 2012 N ASP A 127 0.717 -11.658 0.702 1.00 63.13 N ATOM 2013 CA ASP A 127 1.717 -11.013 1.560 1.00 32.13 C ATOM 2014 C ASP A 127 2.914 -11.938 1.808 1.00 11.41 C ATOM 2015 O ASP A 127 4.060 -11.556 1.575 1.00 33.05 O ATOM 2016 CB ASP A 127 1.076 -10.612 2.897 1.00 44.10 C ATOM 2017 CG ASP A 127 2.077 -10.034 3.880 1.00 74.20 C ATOM 2018 OD1 ASP A 127 2.300 -8.808 3.864 1.00 70.45 O ATOM 2019 OD2 ASP A 127 2.656 -10.804 4.674 1.00 44.01 O ATOM 0 H ASP A 127 -0.198 -11.764 1.139 1.00 63.13 H new ATOM 0 HA ASP A 127 2.080 -10.121 1.050 1.00 32.13 H new ATOM 0 HB2 ASP A 127 0.290 -9.879 2.713 1.00 44.10 H new ATOM 0 HB3 ASP A 127 0.599 -11.485 3.342 1.00 44.10 H new ATOM 2024 N VAL A 128 2.635 -13.159 2.265 1.00 4.14 N ATOM 2025 CA VAL A 128 3.683 -14.157 2.498 1.00 23.42 C ATOM 2026 C VAL A 128 4.370 -14.544 1.180 1.00 11.21 C ATOM 2027 O VAL A 128 5.597 -14.659 1.112 1.00 62.12 O ATOM 2028 CB VAL A 128 3.110 -15.426 3.184 1.00 21.32 C ATOM 2029 CG1 VAL A 128 4.207 -16.466 3.416 1.00 33.01 C ATOM 2030 CG2 VAL A 128 2.424 -15.058 4.501 1.00 13.24 C ATOM 0 H VAL A 128 1.692 -13.482 2.482 1.00 4.14 H new ATOM 0 HA VAL A 128 4.420 -13.707 3.164 1.00 23.42 H new ATOM 0 HB VAL A 128 2.367 -15.866 2.519 1.00 21.32 H new ATOM 0 HG11 VAL A 128 3.779 -17.345 3.898 1.00 33.01 H new ATOM 0 HG12 VAL A 128 4.644 -16.753 2.460 1.00 33.01 H new ATOM 0 HG13 VAL A 128 4.981 -16.042 4.056 1.00 33.01 H new ATOM 0 HG21 VAL A 128 2.028 -15.959 4.969 1.00 13.24 H new ATOM 0 HG22 VAL A 128 3.147 -14.590 5.169 1.00 13.24 H new ATOM 0 HG23 VAL A 128 1.608 -14.363 4.304 1.00 13.24 H new ATOM 2040 N LEU A 129 3.565 -14.715 0.134 1.00 14.32 N ATOM 2041 CA LEU A 129 4.070 -15.034 -1.206 1.00 63.32 C ATOM 2042 C LEU A 129 5.122 -14.006 -1.666 1.00 53.05 C ATOM 2043 O LEU A 129 6.241 -14.361 -2.041 1.00 13.11 O ATOM 2044 CB LEU A 129 2.893 -15.061 -2.195 1.00 62.14 C ATOM 2045 CG LEU A 129 3.231 -15.520 -3.622 1.00 23.51 C ATOM 2046 CD1 LEU A 129 3.711 -16.966 -3.622 1.00 50.52 C ATOM 2047 CD2 LEU A 129 2.025 -15.353 -4.543 1.00 74.34 C ATOM 0 H LEU A 129 2.549 -14.638 0.187 1.00 14.32 H new ATOM 0 HA LEU A 129 4.551 -16.011 -1.174 1.00 63.32 H new ATOM 0 HB2 LEU A 129 2.121 -15.719 -1.795 1.00 62.14 H new ATOM 0 HB3 LEU A 129 2.463 -14.061 -2.247 1.00 62.14 H new ATOM 0 HG LEU A 129 4.038 -14.892 -4.000 1.00 23.51 H new ATOM 0 HD11 LEU A 129 3.945 -17.272 -4.642 1.00 50.52 H new ATOM 0 HD12 LEU A 129 4.604 -17.053 -3.003 1.00 50.52 H new ATOM 0 HD13 LEU A 129 2.928 -17.609 -3.221 1.00 50.52 H new ATOM 0 HD21 LEU A 129 2.286 -15.684 -5.548 1.00 74.34 H new ATOM 0 HD22 LEU A 129 1.195 -15.952 -4.168 1.00 74.34 H new ATOM 0 HD23 LEU A 129 1.731 -14.304 -4.571 1.00 74.34 H new ATOM 2059 N VAL A 130 4.755 -12.730 -1.603 1.00 41.11 N ATOM 2060 CA VAL A 130 5.642 -11.629 -1.998 1.00 74.32 C ATOM 2061 C VAL A 130 6.740 -11.370 -0.945 1.00 1.21 C ATOM 2062 O VAL A 130 7.801 -10.825 -1.255 1.00 31.33 O ATOM 2063 CB VAL A 130 4.817 -10.335 -2.235 1.00 51.12 C ATOM 2064 CG1 VAL A 130 5.714 -9.149 -2.587 1.00 44.02 C ATOM 2065 CG2 VAL A 130 3.774 -10.562 -3.330 1.00 20.44 C ATOM 0 H VAL A 130 3.837 -12.425 -1.278 1.00 41.11 H new ATOM 0 HA VAL A 130 6.134 -11.921 -2.926 1.00 74.32 H new ATOM 0 HB VAL A 130 4.305 -10.094 -1.303 1.00 51.12 H new ATOM 0 HG11 VAL A 130 5.100 -8.263 -2.745 1.00 44.02 H new ATOM 0 HG12 VAL A 130 6.412 -8.966 -1.770 1.00 44.02 H new ATOM 0 HG13 VAL A 130 6.271 -9.372 -3.497 1.00 44.02 H new ATOM 0 HG21 VAL A 130 3.204 -9.646 -3.485 1.00 20.44 H new ATOM 0 HG22 VAL A 130 4.275 -10.839 -4.258 1.00 20.44 H new ATOM 0 HG23 VAL A 130 3.099 -11.363 -3.029 1.00 20.44 H new ATOM 2075 N ARG A 131 6.477 -11.763 0.297 1.00 72.10 N ATOM 2076 CA ARG A 131 7.425 -11.561 1.401 1.00 45.14 C ATOM 2077 C ARG A 131 8.668 -12.465 1.271 1.00 34.42 C ATOM 2078 O ARG A 131 9.802 -12.003 1.424 1.00 21.35 O ATOM 2079 CB ARG A 131 6.716 -11.820 2.741 1.00 62.43 C ATOM 2080 CG ARG A 131 7.560 -11.525 3.976 1.00 41.34 C ATOM 2081 CD ARG A 131 6.747 -11.668 5.262 1.00 50.01 C ATOM 2082 NE ARG A 131 5.560 -10.806 5.262 1.00 73.53 N ATOM 2083 CZ ARG A 131 5.478 -9.657 5.879 1.00 42.34 C ATOM 2084 NH1 ARG A 131 6.489 -9.187 6.543 1.00 33.41 N ATOM 2085 NH2 ARG A 131 4.381 -8.979 5.829 1.00 2.25 N ATOM 0 H ARG A 131 5.611 -12.227 0.571 1.00 72.10 H new ATOM 0 HA ARG A 131 7.773 -10.529 1.360 1.00 45.14 H new ATOM 0 HB2 ARG A 131 5.812 -11.212 2.782 1.00 62.43 H new ATOM 0 HB3 ARG A 131 6.400 -12.863 2.774 1.00 62.43 H new ATOM 0 HG2 ARG A 131 8.411 -12.205 4.006 1.00 41.34 H new ATOM 0 HG3 ARG A 131 7.962 -10.514 3.910 1.00 41.34 H new ATOM 0 HD2 ARG A 131 6.440 -12.707 5.383 1.00 50.01 H new ATOM 0 HD3 ARG A 131 7.375 -11.419 6.117 1.00 50.01 H new ATOM 0 HE ARG A 131 4.741 -11.126 4.744 1.00 73.53 H new ATOM 0 HH11 ARG A 131 7.360 -9.716 6.587 1.00 33.41 H new ATOM 0 HH12 ARG A 131 6.413 -8.289 7.020 1.00 33.41 H new ATOM 0 HH21 ARG A 131 3.581 -9.340 5.309 1.00 2.25 H new ATOM 0 HH22 ARG A 131 4.314 -8.082 6.310 1.00 2.25 H new ATOM 2099 N THR A 132 8.456 -13.753 0.989 1.00 54.35 N ATOM 2100 CA THR A 132 9.571 -14.718 0.913 1.00 21.34 C ATOM 2101 C THR A 132 9.885 -15.178 -0.525 1.00 31.43 C ATOM 2102 O THR A 132 11.046 -15.403 -0.869 1.00 75.30 O ATOM 2103 CB THR A 132 9.311 -15.964 1.798 1.00 4.41 C ATOM 2104 OG1 THR A 132 10.405 -16.888 1.691 1.00 52.43 O ATOM 2105 CG2 THR A 132 8.009 -16.663 1.417 1.00 53.53 C ATOM 0 H THR A 132 7.536 -14.155 0.810 1.00 54.35 H new ATOM 0 HA THR A 132 10.440 -14.176 1.288 1.00 21.34 H new ATOM 0 HB THR A 132 9.223 -15.621 2.829 1.00 4.41 H new ATOM 0 HG1 THR A 132 10.229 -17.670 2.256 1.00 52.43 H new ATOM 0 HG21 THR A 132 7.861 -17.531 2.059 1.00 53.53 H new ATOM 0 HG22 THR A 132 7.175 -15.972 1.543 1.00 53.53 H new ATOM 0 HG23 THR A 132 8.060 -16.985 0.377 1.00 53.53 H new ATOM 2113 N LYS A 133 8.861 -15.310 -1.369 1.00 0.32 N ATOM 2114 CA LYS A 133 9.052 -15.803 -2.747 1.00 31.14 C ATOM 2115 C LYS A 133 9.095 -14.653 -3.771 1.00 33.31 C ATOM 2116 O LYS A 133 8.935 -14.876 -4.971 1.00 14.22 O ATOM 2117 CB LYS A 133 7.935 -16.795 -3.114 1.00 12.44 C ATOM 2118 CG LYS A 133 7.898 -18.043 -2.234 1.00 12.54 C ATOM 2119 CD LYS A 133 9.159 -18.895 -2.391 1.00 75.21 C ATOM 2120 CE LYS A 133 9.156 -20.096 -1.447 1.00 10.22 C ATOM 2121 NZ LYS A 133 10.349 -20.964 -1.645 1.00 44.22 N ATOM 0 H LYS A 133 7.895 -15.086 -1.132 1.00 0.32 H new ATOM 0 HA LYS A 133 10.016 -16.311 -2.782 1.00 31.14 H new ATOM 0 HB2 LYS A 133 6.974 -16.286 -3.045 1.00 12.44 H new ATOM 0 HB3 LYS A 133 8.060 -17.099 -4.153 1.00 12.44 H new ATOM 0 HG2 LYS A 133 7.788 -17.747 -1.191 1.00 12.54 H new ATOM 0 HG3 LYS A 133 7.023 -18.641 -2.490 1.00 12.54 H new ATOM 0 HD2 LYS A 133 9.236 -19.243 -3.421 1.00 75.21 H new ATOM 0 HD3 LYS A 133 10.038 -18.281 -2.195 1.00 75.21 H new ATOM 0 HE2 LYS A 133 9.130 -19.746 -0.415 1.00 10.22 H new ATOM 0 HE3 LYS A 133 8.251 -20.682 -1.608 1.00 10.22 H new ATOM 0 HZ1 LYS A 133 10.308 -21.767 -0.985 1.00 44.22 H new ATOM 0 HZ2 LYS A 133 10.361 -21.319 -2.622 1.00 44.22 H new ATOM 0 HZ3 LYS A 133 11.213 -20.413 -1.466 1.00 44.22 H new ATOM 2135 N ARG A 134 9.346 -13.435 -3.282 1.00 40.30 N ATOM 2136 CA ARG A 134 9.404 -12.225 -4.124 1.00 45.15 C ATOM 2137 C ARG A 134 10.239 -12.435 -5.399 1.00 3.11 C ATOM 2138 O ARG A 134 9.735 -12.318 -6.518 1.00 42.22 O ATOM 2139 CB ARG A 134 10.011 -11.069 -3.313 1.00 33.03 C ATOM 2140 CG ARG A 134 10.146 -9.754 -4.083 1.00 31.31 C ATOM 2141 CD ARG A 134 8.791 -9.160 -4.450 1.00 41.44 C ATOM 2142 NE ARG A 134 8.931 -7.913 -5.196 1.00 30.30 N ATOM 2143 CZ ARG A 134 8.294 -6.808 -4.918 1.00 31.23 C ATOM 2144 NH1 ARG A 134 7.486 -6.745 -3.910 1.00 14.51 N ATOM 2145 NH2 ARG A 134 8.485 -5.758 -5.644 1.00 34.04 N ATOM 0 H ARG A 134 9.515 -13.255 -2.292 1.00 40.30 H new ATOM 0 HA ARG A 134 8.384 -11.993 -4.430 1.00 45.15 H new ATOM 0 HB2 ARG A 134 9.393 -10.897 -2.432 1.00 33.03 H new ATOM 0 HB3 ARG A 134 10.997 -11.370 -2.958 1.00 33.03 H new ATOM 0 HG2 ARG A 134 10.704 -9.037 -3.480 1.00 31.31 H new ATOM 0 HG3 ARG A 134 10.724 -9.924 -4.991 1.00 31.31 H new ATOM 0 HD2 ARG A 134 8.228 -9.879 -5.045 1.00 41.44 H new ATOM 0 HD3 ARG A 134 8.216 -8.978 -3.542 1.00 41.44 H new ATOM 0 HE ARG A 134 9.571 -7.905 -5.990 1.00 30.30 H new ATOM 0 HH11 ARG A 134 7.340 -7.565 -3.321 1.00 14.51 H new ATOM 0 HH12 ARG A 134 6.995 -5.875 -3.704 1.00 14.51 H new ATOM 0 HH21 ARG A 134 9.132 -5.793 -6.432 1.00 34.04 H new ATOM 0 HH22 ARG A 134 7.989 -4.893 -5.430 1.00 34.04 H new ATOM 2159 N ASP A 135 11.519 -12.733 -5.212 1.00 43.12 N ATOM 2160 CA ASP A 135 12.454 -12.888 -6.326 1.00 1.45 C ATOM 2161 C ASP A 135 12.059 -14.049 -7.251 1.00 3.42 C ATOM 2162 O ASP A 135 12.128 -13.927 -8.472 1.00 31.52 O ATOM 2163 CB ASP A 135 13.866 -13.087 -5.779 1.00 40.41 C ATOM 2164 CG ASP A 135 14.261 -11.953 -4.850 1.00 22.42 C ATOM 2165 OD1 ASP A 135 14.701 -10.896 -5.350 1.00 73.14 O ATOM 2166 OD2 ASP A 135 14.106 -12.104 -3.617 1.00 62.11 O ATOM 0 H ASP A 135 11.938 -12.874 -4.293 1.00 43.12 H new ATOM 0 HA ASP A 135 12.421 -11.980 -6.928 1.00 1.45 H new ATOM 0 HB2 ASP A 135 13.921 -14.035 -5.244 1.00 40.41 H new ATOM 0 HB3 ASP A 135 14.574 -13.146 -6.606 1.00 40.41 H new ATOM 2171 N TRP A 136 11.631 -15.167 -6.669 1.00 1.01 N ATOM 2172 CA TRP A 136 11.204 -16.333 -7.452 1.00 14.41 C ATOM 2173 C TRP A 136 10.029 -15.988 -8.382 1.00 30.53 C ATOM 2174 O TRP A 136 9.969 -16.453 -9.523 1.00 23.03 O ATOM 2175 CB TRP A 136 10.813 -17.488 -6.519 1.00 23.32 C ATOM 2176 CG TRP A 136 11.955 -18.001 -5.696 1.00 43.41 C ATOM 2177 CD1 TRP A 136 12.302 -17.613 -4.431 1.00 41.31 C ATOM 2178 CD2 TRP A 136 12.907 -18.996 -6.087 1.00 54.14 C ATOM 2179 NE1 TRP A 136 13.407 -18.310 -4.014 1.00 43.50 N ATOM 2180 CE2 TRP A 136 13.798 -19.163 -5.013 1.00 13.11 C ATOM 2181 CE3 TRP A 136 13.090 -19.762 -7.244 1.00 45.13 C ATOM 2182 CZ2 TRP A 136 14.857 -20.065 -5.060 1.00 52.23 C ATOM 2183 CZ3 TRP A 136 14.142 -20.657 -7.289 1.00 43.40 C ATOM 2184 CH2 TRP A 136 15.014 -20.801 -6.204 1.00 32.42 C ATOM 0 H TRP A 136 11.569 -15.294 -5.659 1.00 1.01 H new ATOM 0 HA TRP A 136 12.046 -16.641 -8.072 1.00 14.41 H new ATOM 0 HB2 TRP A 136 10.017 -17.154 -5.854 1.00 23.32 H new ATOM 0 HB3 TRP A 136 10.408 -18.306 -7.115 1.00 23.32 H new ATOM 0 HD1 TRP A 136 11.782 -16.868 -3.847 1.00 41.31 H new ATOM 0 HE1 TRP A 136 13.864 -18.210 -3.107 1.00 43.50 H new ATOM 0 HE3 TRP A 136 12.422 -19.656 -8.086 1.00 45.13 H new ATOM 0 HZ2 TRP A 136 15.531 -20.180 -4.224 1.00 52.23 H new ATOM 0 HZ3 TRP A 136 14.294 -21.255 -8.176 1.00 43.40 H new ATOM 0 HH2 TRP A 136 15.828 -21.508 -6.270 1.00 32.42 H new ATOM 2195 N LEU A 137 9.110 -15.157 -7.892 1.00 15.24 N ATOM 2196 CA LEU A 137 7.948 -14.726 -8.678 1.00 55.34 C ATOM 2197 C LEU A 137 8.365 -14.060 -10.003 1.00 63.12 C ATOM 2198 O LEU A 137 7.875 -14.427 -11.067 1.00 53.04 O ATOM 2199 CB LEU A 137 7.077 -13.767 -7.849 1.00 63.20 C ATOM 2200 CG LEU A 137 6.239 -14.425 -6.735 1.00 14.41 C ATOM 2201 CD1 LEU A 137 5.528 -13.362 -5.898 1.00 24.32 C ATOM 2202 CD2 LEU A 137 5.230 -15.407 -7.332 1.00 73.33 C ATOM 0 H LEU A 137 9.146 -14.766 -6.951 1.00 15.24 H new ATOM 0 HA LEU A 137 7.369 -15.615 -8.928 1.00 55.34 H new ATOM 0 HB2 LEU A 137 7.724 -13.016 -7.397 1.00 63.20 H new ATOM 0 HB3 LEU A 137 6.402 -13.241 -8.525 1.00 63.20 H new ATOM 0 HG LEU A 137 6.911 -14.980 -6.081 1.00 14.41 H new ATOM 0 HD11 LEU A 137 4.942 -13.846 -5.117 1.00 24.32 H new ATOM 0 HD12 LEU A 137 6.267 -12.704 -5.442 1.00 24.32 H new ATOM 0 HD13 LEU A 137 4.867 -12.777 -6.538 1.00 24.32 H new ATOM 0 HD21 LEU A 137 4.647 -15.862 -6.531 1.00 73.33 H new ATOM 0 HD22 LEU A 137 4.562 -14.875 -8.010 1.00 73.33 H new ATOM 0 HD23 LEU A 137 5.760 -16.185 -7.881 1.00 73.33 H new ATOM 2214 N VAL A 138 9.264 -13.082 -9.944 1.00 54.44 N ATOM 2215 CA VAL A 138 9.723 -12.403 -11.165 1.00 63.41 C ATOM 2216 C VAL A 138 10.759 -13.239 -11.949 1.00 11.02 C ATOM 2217 O VAL A 138 10.679 -13.351 -13.176 1.00 32.53 O ATOM 2218 CB VAL A 138 10.304 -10.997 -10.865 1.00 12.34 C ATOM 2219 CG1 VAL A 138 11.490 -11.073 -9.901 1.00 51.13 C ATOM 2220 CG2 VAL A 138 10.696 -10.294 -12.166 1.00 23.12 C ATOM 0 H VAL A 138 9.687 -12.741 -9.081 1.00 54.44 H new ATOM 0 HA VAL A 138 8.837 -12.287 -11.789 1.00 63.41 H new ATOM 0 HB VAL A 138 9.527 -10.409 -10.375 1.00 12.34 H new ATOM 0 HG11 VAL A 138 11.871 -10.069 -9.714 1.00 51.13 H new ATOM 0 HG12 VAL A 138 11.167 -11.520 -8.961 1.00 51.13 H new ATOM 0 HG13 VAL A 138 12.278 -11.684 -10.341 1.00 51.13 H new ATOM 0 HG21 VAL A 138 11.102 -9.308 -11.939 1.00 23.12 H new ATOM 0 HG22 VAL A 138 11.449 -10.886 -12.687 1.00 23.12 H new ATOM 0 HG23 VAL A 138 9.816 -10.187 -12.801 1.00 23.12 H new ATOM 2230 N LYS A 139 11.717 -13.834 -11.236 1.00 3.33 N ATOM 2231 CA LYS A 139 12.804 -14.600 -11.868 1.00 70.10 C ATOM 2232 C LYS A 139 12.280 -15.796 -12.669 1.00 12.12 C ATOM 2233 O LYS A 139 12.647 -15.984 -13.828 1.00 64.42 O ATOM 2234 CB LYS A 139 13.813 -15.082 -10.811 1.00 31.25 C ATOM 2235 CG LYS A 139 14.681 -13.966 -10.235 1.00 45.22 C ATOM 2236 CD LYS A 139 15.500 -13.278 -11.326 1.00 1.20 C ATOM 2237 CE LYS A 139 16.305 -12.105 -10.781 1.00 21.14 C ATOM 2238 NZ LYS A 139 17.073 -11.413 -11.850 1.00 45.20 N ATOM 0 H LYS A 139 11.766 -13.803 -10.218 1.00 3.33 H new ATOM 0 HA LYS A 139 13.303 -13.926 -12.565 1.00 70.10 H new ATOM 0 HB2 LYS A 139 13.271 -15.565 -9.998 1.00 31.25 H new ATOM 0 HB3 LYS A 139 14.459 -15.839 -11.257 1.00 31.25 H new ATOM 0 HG2 LYS A 139 14.049 -13.232 -9.735 1.00 45.22 H new ATOM 0 HG3 LYS A 139 15.351 -14.377 -9.480 1.00 45.22 H new ATOM 0 HD2 LYS A 139 16.176 -14.001 -11.782 1.00 1.20 H new ATOM 0 HD3 LYS A 139 14.833 -12.926 -12.112 1.00 1.20 H new ATOM 0 HE2 LYS A 139 15.632 -11.395 -10.301 1.00 21.14 H new ATOM 0 HE3 LYS A 139 16.992 -12.462 -10.014 1.00 21.14 H new ATOM 0 HZ1 LYS A 139 17.607 -10.622 -11.437 1.00 45.20 H new ATOM 0 HZ2 LYS A 139 17.734 -12.083 -12.292 1.00 45.20 H new ATOM 0 HZ3 LYS A 139 16.416 -11.050 -12.570 1.00 45.20 H new ATOM 2252 N GLN A 140 11.430 -16.610 -12.052 1.00 32.34 N ATOM 2253 CA GLN A 140 10.861 -17.783 -12.728 1.00 65.13 C ATOM 2254 C GLN A 140 9.499 -17.451 -13.357 1.00 12.45 C ATOM 2255 O GLN A 140 8.779 -18.340 -13.821 1.00 23.25 O ATOM 2256 CB GLN A 140 10.722 -18.944 -11.733 1.00 74.04 C ATOM 2257 CG GLN A 140 12.018 -19.291 -11.000 1.00 72.34 C ATOM 2258 CD GLN A 140 13.144 -19.706 -11.936 1.00 60.44 C ATOM 2259 OE1 GLN A 140 13.299 -20.877 -12.256 1.00 42.51 O ATOM 2260 NE2 GLN A 140 13.940 -18.749 -12.374 1.00 53.24 N ATOM 0 H GLN A 140 11.118 -16.485 -11.089 1.00 32.34 H new ATOM 0 HA GLN A 140 11.537 -18.080 -13.530 1.00 65.13 H new ATOM 0 HB2 GLN A 140 9.958 -18.690 -10.999 1.00 74.04 H new ATOM 0 HB3 GLN A 140 10.371 -19.827 -12.267 1.00 74.04 H new ATOM 0 HG2 GLN A 140 12.339 -18.429 -10.416 1.00 72.34 H new ATOM 0 HG3 GLN A 140 11.824 -20.099 -10.295 1.00 72.34 H new ATOM 0 HE21 GLN A 140 13.782 -17.783 -12.087 1.00 53.24 H new ATOM 0 HE22 GLN A 140 14.713 -18.975 -12.999 1.00 53.24 H new ATOM 2269 N ARG A 141 9.166 -16.156 -13.371 1.00 75.11 N ATOM 2270 CA ARG A 141 7.894 -15.662 -13.914 1.00 34.21 C ATOM 2271 C ARG A 141 6.686 -16.283 -13.191 1.00 1.14 C ATOM 2272 O ARG A 141 5.602 -16.374 -13.760 1.00 35.22 O ATOM 2273 CB ARG A 141 7.814 -15.920 -15.424 1.00 74.14 C ATOM 2274 CG ARG A 141 8.988 -15.339 -16.211 1.00 24.24 C ATOM 2275 CD ARG A 141 8.778 -15.489 -17.715 1.00 44.05 C ATOM 2276 NE ARG A 141 8.505 -16.877 -18.087 1.00 41.31 N ATOM 2277 CZ ARG A 141 7.726 -17.242 -19.067 1.00 11.31 C ATOM 2278 NH1 ARG A 141 7.164 -16.359 -19.826 1.00 3.23 N ATOM 2279 NH2 ARG A 141 7.521 -18.498 -19.292 1.00 5.13 N ATOM 0 H ARG A 141 9.770 -15.420 -13.006 1.00 75.11 H new ATOM 0 HA ARG A 141 7.860 -14.586 -13.742 1.00 34.21 H new ATOM 0 HB2 ARG A 141 7.769 -16.995 -15.598 1.00 74.14 H new ATOM 0 HB3 ARG A 141 6.886 -15.496 -15.807 1.00 74.14 H new ATOM 0 HG2 ARG A 141 9.109 -14.285 -15.962 1.00 24.24 H new ATOM 0 HG3 ARG A 141 9.909 -15.843 -15.919 1.00 24.24 H new ATOM 0 HD2 ARG A 141 7.948 -14.857 -18.031 1.00 44.05 H new ATOM 0 HD3 ARG A 141 9.665 -15.138 -18.243 1.00 44.05 H new ATOM 0 HE ARG A 141 8.956 -17.611 -17.541 1.00 41.31 H new ATOM 0 HH11 ARG A 141 7.328 -15.366 -19.661 1.00 3.23 H new ATOM 0 HH12 ARG A 141 6.556 -16.655 -20.590 1.00 3.23 H new ATOM 0 HH21 ARG A 141 7.968 -19.201 -18.704 1.00 5.13 H new ATOM 0 HH22 ARG A 141 6.912 -18.786 -20.058 1.00 5.13 H new ATOM 2293 N GLY A 142 6.915 -16.695 -11.934 1.00 11.53 N ATOM 2294 CA GLY A 142 5.878 -17.230 -11.038 1.00 61.24 C ATOM 2295 C GLY A 142 4.664 -17.841 -11.728 1.00 21.11 C ATOM 2296 O GLY A 142 4.569 -19.054 -11.862 1.00 44.54 O ATOM 0 H GLY A 142 7.840 -16.665 -11.505 1.00 11.53 H new ATOM 0 HA2 GLY A 142 6.331 -17.988 -10.399 1.00 61.24 H new ATOM 0 HA3 GLY A 142 5.537 -16.426 -10.386 1.00 61.24 H new ATOM 2300 N TRP A 143 3.748 -16.985 -12.174 1.00 12.41 N ATOM 2301 CA TRP A 143 2.485 -17.433 -12.784 1.00 13.23 C ATOM 2302 C TRP A 143 2.714 -18.057 -14.172 1.00 12.02 C ATOM 2303 O TRP A 143 2.176 -19.123 -14.482 1.00 14.41 O ATOM 2304 CB TRP A 143 1.498 -16.262 -12.882 1.00 22.14 C ATOM 2305 CG TRP A 143 1.294 -15.550 -11.575 1.00 21.44 C ATOM 2306 CD1 TRP A 143 1.452 -14.215 -11.333 1.00 70.34 C ATOM 2307 CD2 TRP A 143 0.919 -16.141 -10.323 1.00 45.41 C ATOM 2308 NE1 TRP A 143 1.192 -13.941 -10.014 1.00 25.54 N ATOM 2309 CE2 TRP A 143 0.862 -15.105 -9.373 1.00 32.43 C ATOM 2310 CE3 TRP A 143 0.619 -17.446 -9.913 1.00 55.43 C ATOM 2311 CZ2 TRP A 143 0.525 -15.332 -8.042 1.00 53.20 C ATOM 2312 CZ3 TRP A 143 0.285 -17.669 -8.590 1.00 33.12 C ATOM 2313 CH2 TRP A 143 0.238 -16.615 -7.668 1.00 31.13 C ATOM 0 H TRP A 143 3.852 -15.971 -12.127 1.00 12.41 H new ATOM 0 HA TRP A 143 2.061 -18.205 -12.141 1.00 13.23 H new ATOM 0 HB2 TRP A 143 1.861 -15.550 -13.623 1.00 22.14 H new ATOM 0 HB3 TRP A 143 0.538 -16.633 -13.240 1.00 22.14 H new ATOM 0 HD1 TRP A 143 1.740 -13.482 -12.072 1.00 70.34 H new ATOM 0 HE1 TRP A 143 1.237 -13.019 -9.581 1.00 25.54 H new ATOM 0 HE3 TRP A 143 0.648 -18.264 -10.618 1.00 55.43 H new ATOM 0 HZ2 TRP A 143 0.491 -14.522 -7.329 1.00 53.20 H new ATOM 0 HZ3 TRP A 143 0.057 -18.672 -8.262 1.00 33.12 H new ATOM 0 HH2 TRP A 143 -0.030 -16.820 -6.642 1.00 31.13 H new ATOM 2324 N ASP A 144 3.515 -17.394 -15.004 1.00 55.54 N ATOM 2325 CA ASP A 144 3.889 -17.939 -16.311 1.00 73.44 C ATOM 2326 C ASP A 144 4.661 -19.256 -16.136 1.00 74.23 C ATOM 2327 O ASP A 144 4.455 -20.222 -16.878 1.00 4.50 O ATOM 2328 CB ASP A 144 4.743 -16.930 -17.087 1.00 74.01 C ATOM 2329 CG ASP A 144 4.048 -15.592 -17.266 1.00 55.35 C ATOM 2330 OD1 ASP A 144 3.291 -15.434 -18.250 1.00 24.22 O ATOM 2331 OD2 ASP A 144 4.255 -14.691 -16.431 1.00 35.10 O ATOM 0 H ASP A 144 3.918 -16.480 -14.798 1.00 55.54 H new ATOM 0 HA ASP A 144 2.978 -18.135 -16.877 1.00 73.44 H new ATOM 0 HB2 ASP A 144 5.686 -16.778 -16.562 1.00 74.01 H new ATOM 0 HB3 ASP A 144 4.986 -17.343 -18.066 1.00 74.01 H new ATOM 2336 N GLY A 145 5.544 -19.284 -15.137 1.00 61.40 N ATOM 2337 CA GLY A 145 6.282 -20.502 -14.809 1.00 62.42 C ATOM 2338 C GLY A 145 5.398 -21.574 -14.172 1.00 22.43 C ATOM 2339 O GLY A 145 5.626 -22.769 -14.344 1.00 25.21 O ATOM 0 H GLY A 145 5.764 -18.483 -14.545 1.00 61.40 H new ATOM 0 HA2 GLY A 145 6.735 -20.902 -15.716 1.00 62.42 H new ATOM 0 HA3 GLY A 145 7.096 -20.256 -14.127 1.00 62.42 H new ATOM 2343 N PHE A 146 4.384 -21.131 -13.441 1.00 64.12 N ATOM 2344 CA PHE A 146 3.418 -22.021 -12.788 1.00 50.14 C ATOM 2345 C PHE A 146 2.614 -22.837 -13.816 1.00 44.24 C ATOM 2346 O PHE A 146 2.457 -24.053 -13.680 1.00 52.41 O ATOM 2347 CB PHE A 146 2.487 -21.164 -11.912 1.00 41.45 C ATOM 2348 CG PHE A 146 1.252 -21.857 -11.398 1.00 71.33 C ATOM 2349 CD1 PHE A 146 1.348 -23.010 -10.638 1.00 53.44 C ATOM 2350 CD2 PHE A 146 -0.010 -21.342 -11.671 1.00 71.24 C ATOM 2351 CE1 PHE A 146 0.212 -23.635 -10.162 1.00 64.20 C ATOM 2352 CE2 PHE A 146 -1.145 -21.963 -11.194 1.00 34.10 C ATOM 2353 CZ PHE A 146 -1.034 -23.113 -10.440 1.00 64.03 C ATOM 0 H PHE A 146 4.203 -20.140 -13.280 1.00 64.12 H new ATOM 0 HA PHE A 146 3.952 -22.742 -12.169 1.00 50.14 H new ATOM 0 HB2 PHE A 146 3.057 -20.798 -11.058 1.00 41.45 H new ATOM 0 HB3 PHE A 146 2.178 -20.291 -12.488 1.00 41.45 H new ATOM 0 HD1 PHE A 146 2.320 -23.425 -10.415 1.00 53.44 H new ATOM 0 HD2 PHE A 146 -0.103 -20.444 -12.264 1.00 71.24 H new ATOM 0 HE1 PHE A 146 0.300 -24.535 -9.571 1.00 64.20 H new ATOM 0 HE2 PHE A 146 -2.119 -21.550 -11.410 1.00 34.10 H new ATOM 0 HZ PHE A 146 -1.921 -23.604 -10.068 1.00 64.03 H new ATOM 2363 N VAL A 147 2.125 -22.160 -14.849 1.00 14.42 N ATOM 2364 CA VAL A 147 1.311 -22.801 -15.887 1.00 52.51 C ATOM 2365 C VAL A 147 2.123 -23.803 -16.733 1.00 53.34 C ATOM 2366 O VAL A 147 1.597 -24.843 -17.147 1.00 24.15 O ATOM 2367 CB VAL A 147 0.658 -21.739 -16.805 1.00 3.44 C ATOM 2368 CG1 VAL A 147 -0.161 -22.392 -17.919 1.00 31.41 C ATOM 2369 CG2 VAL A 147 -0.209 -20.794 -15.976 1.00 3.13 C ATOM 0 H VAL A 147 2.277 -21.162 -14.994 1.00 14.42 H new ATOM 0 HA VAL A 147 0.530 -23.362 -15.373 1.00 52.51 H new ATOM 0 HB VAL A 147 1.452 -21.163 -17.280 1.00 3.44 H new ATOM 0 HG11 VAL A 147 -0.606 -21.618 -18.545 1.00 31.41 H new ATOM 0 HG12 VAL A 147 0.489 -23.022 -18.527 1.00 31.41 H new ATOM 0 HG13 VAL A 147 -0.951 -23.002 -17.480 1.00 31.41 H new ATOM 0 HG21 VAL A 147 -0.664 -20.050 -16.630 1.00 3.13 H new ATOM 0 HG22 VAL A 147 -0.991 -21.364 -15.474 1.00 3.13 H new ATOM 0 HG23 VAL A 147 0.409 -20.293 -15.231 1.00 3.13 H new ATOM 2379 N GLU A 148 3.395 -23.492 -17.002 1.00 45.54 N ATOM 2380 CA GLU A 148 4.266 -24.424 -17.735 1.00 43.31 C ATOM 2381 C GLU A 148 4.689 -25.607 -16.844 1.00 42.50 C ATOM 2382 O GLU A 148 4.758 -26.746 -17.303 1.00 50.35 O ATOM 2383 CB GLU A 148 5.505 -23.710 -18.312 1.00 61.14 C ATOM 2384 CG GLU A 148 6.472 -23.165 -17.265 1.00 61.13 C ATOM 2385 CD GLU A 148 7.698 -22.496 -17.876 1.00 71.34 C ATOM 2386 OE1 GLU A 148 7.639 -21.280 -18.169 1.00 22.15 O ATOM 2387 OE2 GLU A 148 8.728 -23.177 -18.062 1.00 55.22 O ATOM 0 H GLU A 148 3.842 -22.617 -16.729 1.00 45.54 H new ATOM 0 HA GLU A 148 3.687 -24.815 -18.572 1.00 43.31 H new ATOM 0 HB2 GLU A 148 6.042 -24.407 -18.955 1.00 61.14 H new ATOM 0 HB3 GLU A 148 5.172 -22.886 -18.943 1.00 61.14 H new ATOM 0 HG2 GLU A 148 5.949 -22.446 -16.635 1.00 61.13 H new ATOM 0 HG3 GLU A 148 6.795 -23.980 -16.618 1.00 61.13 H new ATOM 2394 N PHE A 149 4.947 -25.329 -15.565 1.00 11.20 N ATOM 2395 CA PHE A 149 5.363 -26.364 -14.607 1.00 21.24 C ATOM 2396 C PHE A 149 4.287 -27.455 -14.454 1.00 60.33 C ATOM 2397 O PHE A 149 4.587 -28.648 -14.502 1.00 53.00 O ATOM 2398 CB PHE A 149 5.669 -25.717 -13.247 1.00 31.11 C ATOM 2399 CG PHE A 149 6.261 -26.660 -12.227 1.00 34.51 C ATOM 2400 CD1 PHE A 149 7.620 -26.952 -12.235 1.00 55.45 C ATOM 2401 CD2 PHE A 149 5.462 -27.248 -11.255 1.00 73.42 C ATOM 2402 CE1 PHE A 149 8.165 -27.807 -11.296 1.00 34.01 C ATOM 2403 CE2 PHE A 149 6.004 -28.103 -10.315 1.00 41.51 C ATOM 2404 CZ PHE A 149 7.357 -28.383 -10.335 1.00 33.42 C ATOM 0 H PHE A 149 4.876 -24.394 -15.164 1.00 11.20 H new ATOM 0 HA PHE A 149 6.264 -26.843 -14.990 1.00 21.24 H new ATOM 0 HB2 PHE A 149 6.359 -24.887 -13.400 1.00 31.11 H new ATOM 0 HB3 PHE A 149 4.748 -25.296 -12.843 1.00 31.11 H new ATOM 0 HD1 PHE A 149 8.257 -26.505 -12.984 1.00 55.45 H new ATOM 0 HD2 PHE A 149 4.404 -27.034 -11.234 1.00 73.42 H new ATOM 0 HE1 PHE A 149 9.223 -28.025 -11.314 1.00 34.01 H new ATOM 0 HE2 PHE A 149 5.370 -28.552 -9.565 1.00 41.51 H new ATOM 0 HZ PHE A 149 7.782 -29.051 -9.601 1.00 33.42 H new ATOM 2414 N PHE A 150 3.035 -27.038 -14.260 1.00 30.43 N ATOM 2415 CA PHE A 150 1.906 -27.981 -14.174 1.00 72.11 C ATOM 2416 C PHE A 150 1.395 -28.399 -15.564 1.00 52.43 C ATOM 2417 O PHE A 150 0.467 -29.203 -15.679 1.00 72.50 O ATOM 2418 CB PHE A 150 0.767 -27.373 -13.345 1.00 30.24 C ATOM 2419 CG PHE A 150 1.049 -27.358 -11.862 1.00 52.53 C ATOM 2420 CD1 PHE A 150 1.928 -26.435 -11.313 1.00 20.11 C ATOM 2421 CD2 PHE A 150 0.440 -28.276 -11.018 1.00 3.34 C ATOM 2422 CE1 PHE A 150 2.190 -26.427 -9.956 1.00 61.32 C ATOM 2423 CE2 PHE A 150 0.701 -28.272 -9.662 1.00 63.35 C ATOM 2424 CZ PHE A 150 1.576 -27.346 -9.131 1.00 25.13 C ATOM 0 H PHE A 150 2.772 -26.058 -14.159 1.00 30.43 H new ATOM 0 HA PHE A 150 2.269 -28.881 -13.678 1.00 72.11 H new ATOM 0 HB2 PHE A 150 0.585 -26.353 -13.683 1.00 30.24 H new ATOM 0 HB3 PHE A 150 -0.147 -27.937 -13.528 1.00 30.24 H new ATOM 0 HD1 PHE A 150 2.413 -25.714 -11.954 1.00 20.11 H new ATOM 0 HD2 PHE A 150 -0.247 -29.003 -11.427 1.00 3.34 H new ATOM 0 HE1 PHE A 150 2.875 -25.702 -9.542 1.00 61.32 H new ATOM 0 HE2 PHE A 150 0.221 -28.993 -9.017 1.00 63.35 H new ATOM 0 HZ PHE A 150 1.780 -27.341 -8.070 1.00 25.13 H new ATOM 2434 N HIS A 151 2.005 -27.840 -16.610 1.00 61.51 N ATOM 2435 CA HIS A 151 1.700 -28.199 -18.001 1.00 73.51 C ATOM 2436 C HIS A 151 0.209 -28.013 -18.344 1.00 44.50 C ATOM 2437 O HIS A 151 -0.538 -28.983 -18.476 1.00 51.41 O ATOM 2438 CB HIS A 151 2.147 -29.646 -18.281 1.00 35.54 C ATOM 2439 CG HIS A 151 2.080 -30.047 -19.726 1.00 55.05 C ATOM 2440 ND1 HIS A 151 3.153 -29.938 -20.584 1.00 71.33 N ATOM 2441 CD2 HIS A 151 1.068 -30.566 -20.465 1.00 1.31 C ATOM 2442 CE1 HIS A 151 2.808 -30.369 -21.780 1.00 24.45 C ATOM 2443 NE2 HIS A 151 1.552 -30.756 -21.736 1.00 72.42 N ATOM 0 H HIS A 151 2.726 -27.124 -16.519 1.00 61.51 H new ATOM 0 HA HIS A 151 2.257 -27.518 -18.645 1.00 73.51 H new ATOM 0 HB2 HIS A 151 3.171 -29.772 -17.929 1.00 35.54 H new ATOM 0 HB3 HIS A 151 1.524 -30.325 -17.699 1.00 35.54 H new ATOM 0 HD2 HIS A 151 0.069 -30.788 -20.119 1.00 1.31 H new ATOM 0 HE1 HIS A 151 3.448 -30.399 -22.649 1.00 24.45 H new ATOM 0 HE2 HIS A 151 1.022 -31.136 -22.520 1.00 72.42 H new ATOM 2452 N VAL A 152 -0.225 -26.761 -18.464 1.00 61.20 N ATOM 2453 CA VAL A 152 -1.594 -26.461 -18.910 1.00 41.41 C ATOM 2454 C VAL A 152 -1.604 -26.005 -20.377 1.00 11.40 C ATOM 2455 O VAL A 152 -2.109 -26.712 -21.249 1.00 54.20 O ATOM 2456 CB VAL A 152 -2.261 -25.391 -18.016 1.00 51.32 C ATOM 2457 CG1 VAL A 152 -3.672 -25.061 -18.510 1.00 24.20 C ATOM 2458 CG2 VAL A 152 -2.289 -25.864 -16.564 1.00 71.34 C ATOM 0 H VAL A 152 0.343 -25.938 -18.261 1.00 61.20 H new ATOM 0 HA VAL A 152 -2.172 -27.381 -18.824 1.00 41.41 H new ATOM 0 HB VAL A 152 -1.670 -24.477 -18.074 1.00 51.32 H new ATOM 0 HG11 VAL A 152 -4.117 -24.306 -17.862 1.00 24.20 H new ATOM 0 HG12 VAL A 152 -3.621 -24.680 -19.530 1.00 24.20 H new ATOM 0 HG13 VAL A 152 -4.285 -25.962 -18.490 1.00 24.20 H new ATOM 0 HG21 VAL A 152 -2.761 -25.103 -15.942 1.00 71.34 H new ATOM 0 HG22 VAL A 152 -2.856 -26.792 -16.495 1.00 71.34 H new ATOM 0 HG23 VAL A 152 -1.270 -26.035 -16.217 1.00 71.34 H new