USER MOD reduce.3.24.130724 H: found=0, std=0, add=1047, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1047 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 82 SER OG : rot 54:sc= 0.241 USER MOD Set 1.2: A 93 HIS : no HD1:sc= 0.0488 K(o=0.2,f=-6.7!) USER MOD Set 1.3: A 95 GLN : amide:sc= -0.0903 K(o=0.2,f=-3) USER MOD Set 2.1: A 53 THR OG1 : rot 118:sc= 1.34 USER MOD Set 2.2: A 60 THR OG1 : rot 180:sc= 1.14 USER MOD Set 3.1: A 40 THR OG1 : rot 1:sc= 1.57 USER MOD Set 3.2: A 128 TYR OH : rot -138:sc= 1.19 USER MOD Set 4.1: A 36 THR OG1 : rot -74:sc= 1.29 USER MOD Set 4.2: A 55 SER OG : rot -19:sc= -0.0202 USER MOD Set 5.1: A 20 MET CE :methyl 155:sc= -1.87 (180deg=-1.94) USER MOD Set 5.2: A 34 ASN : amide:sc= -1.81 K(o=-3.7,f=-4.8!) USER MOD Set 6.1: A 19 TYR OH : rot -125:sc= 0.618 USER MOD Set 6.2: A 102 THR OG1 : rot 48:sc= 2.12 USER MOD Set 7.1: A 14 LYS NZ :NH3+ 164:sc= 0.977 (180deg=-0.652) USER MOD Set 7.2: A 15 ASN : amide:sc= 1.05 K(o=2,f=-13!) USER MOD Set 8.1: A 9 LYS NZ :NH3+ -173:sc= 1.33 (180deg=0) USER MOD Set 8.2: A 39 THR OG1 : rot 137:sc= 0.899 USER MOD Single : A 1 VAL N :NH3+ -177:sc= -0.364 (180deg=-0.414) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot -114:sc= -0.674 USER MOD Single : A 21 LYS NZ :NH3+ 177:sc= 2 (180deg=1.9) USER MOD Single : A 22 SER OG : rot -51:sc= 1.2 USER MOD Single : A 29 THR OG1 : rot 73:sc= 0.598 USER MOD Single : A 31 GLN : amide:sc= 0.546 K(o=0.55,f=-1.7) USER MOD Single : A 35 MET CE :methyl 172:sc= 0 (180deg=-0.0579) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 ASN : amide:sc= 1.56 K(o=1.6,f=-0.19) USER MOD Single : A 48 THR OG1 : rot -85:sc= 1.26 USER MOD Single : A 52 LYS NZ :NH3+ -136:sc= 0.127! (180deg=-4.17!) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 163:sc= 1.1 (180deg=0.715) USER MOD Single : A 59 ASN : amide:sc= 1.12 K(o=1.1,f=-4.9!) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 173:sc= 1.08 (180deg=1) USER MOD Single : A 73 THR OG1 : rot 81:sc= 1.13 USER MOD Single : A 74 THR OG1 : rot -87:sc= 1.23 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ 165:sc= -0.0101 (180deg=-0.193) USER MOD Single : A 85 THR OG1 : rot 180:sc= -0.341 USER MOD Single : A 90 LYS NZ :NH3+ -143:sc= 2.12 (180deg=1.16!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 ASN : amide:sc= -1.59 K(o=-1.6,f=-3.1) USER MOD Single : A 100 GLN : amide:sc= 0.0563 K(o=0.056,f=-3.4!) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 108 MET CE :methyl 174:sc= 0 (180deg=-0.0615) USER MOD Single : A 112 LYS NZ :NH3+ 156:sc= 1.19 (180deg=0.685) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 HIS : no HE2:sc= 0.871 K(o=0.87,f=-3.6!) USER MOD Single : A 121 THR OG1 : rot 180:sc= 0.1 USER MOD Single : A 124 CYS SG : rot -120:sc= -0.654 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 THR OG1 : rot -160:sc= -0.086 USER MOD Single : A 130 LYS NZ :NH3+ 161:sc= 1.24 (180deg=1.13) USER MOD Single : A 131 GLN : amide:sc= 0.444 K(o=0.44,f=-0.2) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 12.503 -11.744 -6.575 1.00 0.00 N ATOM 2 CA VAL A 1 11.958 -11.159 -5.357 1.00 0.00 C ATOM 3 C VAL A 1 12.845 -10.020 -4.832 1.00 0.00 C ATOM 4 O VAL A 1 12.358 -9.134 -4.126 1.00 0.00 O ATOM 5 CB VAL A 1 11.726 -12.271 -4.317 1.00 0.00 C ATOM 6 CG1 VAL A 1 13.016 -13.011 -3.945 1.00 0.00 C ATOM 7 CG2 VAL A 1 11.063 -11.747 -3.038 1.00 0.00 C ATOM 0 H1 VAL A 1 11.854 -12.475 -6.930 1.00 0.00 H new ATOM 0 H2 VAL A 1 12.617 -11.003 -7.295 1.00 0.00 H new ATOM 0 H3 VAL A 1 13.428 -12.173 -6.370 1.00 0.00 H new ATOM 0 HA VAL A 1 10.994 -10.699 -5.575 1.00 0.00 H new ATOM 0 HB VAL A 1 11.049 -12.974 -4.803 1.00 0.00 H new ATOM 0 HG11 VAL A 1 12.793 -13.783 -3.209 1.00 0.00 H new ATOM 0 HG12 VAL A 1 13.441 -13.471 -4.837 1.00 0.00 H new ATOM 0 HG13 VAL A 1 13.732 -12.305 -3.525 1.00 0.00 H new ATOM 0 HG21 VAL A 1 10.922 -12.570 -2.338 1.00 0.00 H new ATOM 0 HG22 VAL A 1 11.700 -10.989 -2.583 1.00 0.00 H new ATOM 0 HG23 VAL A 1 10.095 -11.309 -3.283 1.00 0.00 H new ATOM 19 N ASP A 2 14.132 -10.057 -5.201 1.00 0.00 N ATOM 20 CA ASP A 2 15.294 -9.324 -4.703 1.00 0.00 C ATOM 21 C ASP A 2 15.248 -7.854 -5.126 1.00 0.00 C ATOM 22 O ASP A 2 16.188 -7.274 -5.678 1.00 0.00 O ATOM 23 CB ASP A 2 16.563 -10.006 -5.250 1.00 0.00 C ATOM 24 CG ASP A 2 16.520 -11.529 -5.152 1.00 0.00 C ATOM 25 OD1 ASP A 2 15.643 -12.100 -5.846 1.00 0.00 O ATOM 26 OD2 ASP A 2 17.334 -12.077 -4.382 1.00 0.00 O ATOM 0 H ASP A 2 14.414 -10.685 -5.954 1.00 0.00 H new ATOM 0 HA ASP A 2 15.296 -9.342 -3.613 1.00 0.00 H new ATOM 0 HB2 ASP A 2 16.700 -9.720 -6.293 1.00 0.00 H new ATOM 0 HB3 ASP A 2 17.430 -9.638 -4.702 1.00 0.00 H new ATOM 31 N ALA A 3 14.115 -7.232 -4.858 1.00 0.00 N ATOM 32 CA ALA A 3 13.618 -6.036 -5.491 1.00 0.00 C ATOM 33 C ALA A 3 12.587 -5.468 -4.528 1.00 0.00 C ATOM 34 O ALA A 3 12.712 -4.336 -4.065 1.00 0.00 O ATOM 35 CB ALA A 3 13.015 -6.421 -6.850 1.00 0.00 C ATOM 0 H ALA A 3 13.477 -7.578 -4.141 1.00 0.00 H new ATOM 0 HA ALA A 3 14.386 -5.288 -5.689 1.00 0.00 H new ATOM 0 HB1 ALA A 3 12.633 -5.528 -7.345 1.00 0.00 H new ATOM 0 HB2 ALA A 3 13.783 -6.880 -7.472 1.00 0.00 H new ATOM 0 HB3 ALA A 3 12.200 -7.129 -6.699 1.00 0.00 H new ATOM 41 N PHE A 4 11.618 -6.300 -4.146 1.00 0.00 N ATOM 42 CA PHE A 4 10.569 -5.961 -3.198 1.00 0.00 C ATOM 43 C PHE A 4 11.115 -6.071 -1.770 1.00 0.00 C ATOM 44 O PHE A 4 10.502 -6.701 -0.914 1.00 0.00 O ATOM 45 CB PHE A 4 9.388 -6.911 -3.452 1.00 0.00 C ATOM 46 CG PHE A 4 9.046 -7.079 -4.925 1.00 0.00 C ATOM 47 CD1 PHE A 4 8.867 -5.945 -5.742 1.00 0.00 C ATOM 48 CD2 PHE A 4 9.139 -8.351 -5.519 1.00 0.00 C ATOM 49 CE1 PHE A 4 8.811 -6.082 -7.139 1.00 0.00 C ATOM 50 CE2 PHE A 4 9.088 -8.486 -6.916 1.00 0.00 C ATOM 51 CZ PHE A 4 8.924 -7.352 -7.728 1.00 0.00 C ATOM 0 H PHE A 4 11.544 -7.254 -4.500 1.00 0.00 H new ATOM 0 HA PHE A 4 10.225 -4.935 -3.325 1.00 0.00 H new ATOM 0 HB2 PHE A 4 9.621 -7.888 -3.028 1.00 0.00 H new ATOM 0 HB3 PHE A 4 8.511 -6.536 -2.925 1.00 0.00 H new ATOM 0 HD1 PHE A 4 8.773 -4.967 -5.293 1.00 0.00 H new ATOM 0 HD2 PHE A 4 9.250 -9.228 -4.898 1.00 0.00 H new ATOM 0 HE1 PHE A 4 8.681 -5.209 -7.761 1.00 0.00 H new ATOM 0 HE2 PHE A 4 9.175 -9.464 -7.367 1.00 0.00 H new ATOM 0 HZ PHE A 4 8.885 -7.456 -8.802 1.00 0.00 H new ATOM 61 N VAL A 5 12.291 -5.488 -1.529 1.00 0.00 N ATOM 62 CA VAL A 5 13.026 -5.587 -0.280 1.00 0.00 C ATOM 63 C VAL A 5 13.770 -4.268 -0.045 1.00 0.00 C ATOM 64 O VAL A 5 14.969 -4.249 0.222 1.00 0.00 O ATOM 65 CB VAL A 5 13.905 -6.857 -0.316 1.00 0.00 C ATOM 66 CG1 VAL A 5 15.011 -6.831 -1.378 1.00 0.00 C ATOM 67 CG2 VAL A 5 14.509 -7.197 1.052 1.00 0.00 C ATOM 0 H VAL A 5 12.768 -4.916 -2.226 1.00 0.00 H new ATOM 0 HA VAL A 5 12.376 -5.714 0.585 1.00 0.00 H new ATOM 0 HB VAL A 5 13.208 -7.645 -0.600 1.00 0.00 H new ATOM 0 HG11 VAL A 5 15.580 -7.760 -1.334 1.00 0.00 H new ATOM 0 HG12 VAL A 5 14.564 -6.726 -2.366 1.00 0.00 H new ATOM 0 HG13 VAL A 5 15.677 -5.989 -1.189 1.00 0.00 H new ATOM 0 HG21 VAL A 5 15.117 -8.098 0.968 1.00 0.00 H new ATOM 0 HG22 VAL A 5 15.132 -6.369 1.390 1.00 0.00 H new ATOM 0 HG23 VAL A 5 13.708 -7.366 1.772 1.00 0.00 H new ATOM 77 N GLY A 6 13.063 -3.142 -0.173 1.00 0.00 N ATOM 78 CA GLY A 6 13.664 -1.839 0.051 1.00 0.00 C ATOM 79 C GLY A 6 12.858 -0.702 -0.569 1.00 0.00 C ATOM 80 O GLY A 6 11.687 -0.858 -0.920 1.00 0.00 O ATOM 0 H GLY A 6 12.076 -3.114 -0.430 1.00 0.00 H new ATOM 0 HA2 GLY A 6 13.760 -1.668 1.123 1.00 0.00 H new ATOM 0 HA3 GLY A 6 14.672 -1.832 -0.364 1.00 0.00 H new ATOM 84 N THR A 7 13.504 0.460 -0.669 1.00 0.00 N ATOM 85 CA THR A 7 12.901 1.699 -1.123 1.00 0.00 C ATOM 86 C THR A 7 12.985 1.829 -2.643 1.00 0.00 C ATOM 87 O THR A 7 14.035 1.580 -3.240 1.00 0.00 O ATOM 88 CB THR A 7 13.581 2.882 -0.419 1.00 0.00 C ATOM 89 OG1 THR A 7 13.867 2.517 0.923 1.00 0.00 O ATOM 90 CG2 THR A 7 12.666 4.114 -0.458 1.00 0.00 C ATOM 0 H THR A 7 14.490 0.561 -0.428 1.00 0.00 H new ATOM 0 HA THR A 7 11.842 1.697 -0.864 1.00 0.00 H new ATOM 0 HB THR A 7 14.510 3.132 -0.931 1.00 0.00 H new ATOM 0 HG1 THR A 7 14.303 3.266 1.380 1.00 0.00 H new ATOM 0 HG21 THR A 7 13.157 4.948 0.044 1.00 0.00 H new ATOM 0 HG22 THR A 7 12.462 4.383 -1.494 1.00 0.00 H new ATOM 0 HG23 THR A 7 11.728 3.887 0.049 1.00 0.00 H new ATOM 98 N TRP A 8 11.885 2.262 -3.253 1.00 0.00 N ATOM 99 CA TRP A 8 11.769 2.600 -4.657 1.00 0.00 C ATOM 100 C TRP A 8 11.459 4.089 -4.781 1.00 0.00 C ATOM 101 O TRP A 8 10.871 4.665 -3.862 1.00 0.00 O ATOM 102 CB TRP A 8 10.624 1.794 -5.267 1.00 0.00 C ATOM 103 CG TRP A 8 10.798 0.311 -5.240 1.00 0.00 C ATOM 104 CD1 TRP A 8 10.579 -0.498 -4.178 1.00 0.00 C ATOM 105 CD2 TRP A 8 11.254 -0.560 -6.314 1.00 0.00 C ATOM 106 NE1 TRP A 8 10.824 -1.806 -4.535 1.00 0.00 N ATOM 107 CE2 TRP A 8 11.232 -1.902 -5.848 1.00 0.00 C ATOM 108 CE3 TRP A 8 11.664 -0.351 -7.645 1.00 0.00 C ATOM 109 CZ2 TRP A 8 11.569 -2.981 -6.672 1.00 0.00 C ATOM 110 CZ3 TRP A 8 12.137 -1.412 -8.435 1.00 0.00 C ATOM 111 CH2 TRP A 8 12.069 -2.732 -7.956 1.00 0.00 C ATOM 0 H TRP A 8 11.008 2.391 -2.749 1.00 0.00 H new ATOM 0 HA TRP A 8 12.699 2.371 -5.177 1.00 0.00 H new ATOM 0 HB2 TRP A 8 9.704 2.044 -4.738 1.00 0.00 H new ATOM 0 HB3 TRP A 8 10.492 2.108 -6.302 1.00 0.00 H new ATOM 0 HD1 TRP A 8 10.261 -0.169 -3.200 1.00 0.00 H new ATOM 0 HE1 TRP A 8 10.717 -2.603 -3.907 1.00 0.00 H new ATOM 0 HE3 TRP A 8 11.614 0.642 -8.066 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 11.445 -3.995 -6.322 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 12.553 -1.213 -9.412 1.00 0.00 H new ATOM 0 HH2 TRP A 8 12.401 -3.551 -8.576 1.00 0.00 H new ATOM 122 N LYS A 9 11.820 4.695 -5.917 1.00 0.00 N ATOM 123 CA LYS A 9 11.365 6.028 -6.303 1.00 0.00 C ATOM 124 C LYS A 9 10.628 5.980 -7.639 1.00 0.00 C ATOM 125 O LYS A 9 10.874 5.086 -8.440 1.00 0.00 O ATOM 126 CB LYS A 9 12.533 7.022 -6.345 1.00 0.00 C ATOM 127 CG LYS A 9 13.039 7.333 -4.932 1.00 0.00 C ATOM 128 CD LYS A 9 13.998 8.532 -4.962 1.00 0.00 C ATOM 129 CE LYS A 9 14.430 8.984 -3.557 1.00 0.00 C ATOM 130 NZ LYS A 9 13.388 9.769 -2.856 1.00 0.00 N ATOM 0 H LYS A 9 12.444 4.266 -6.600 1.00 0.00 H new ATOM 0 HA LYS A 9 10.665 6.380 -5.545 1.00 0.00 H new ATOM 0 HB2 LYS A 9 13.345 6.610 -6.944 1.00 0.00 H new ATOM 0 HB3 LYS A 9 12.214 7.943 -6.832 1.00 0.00 H new ATOM 0 HG2 LYS A 9 12.196 7.549 -4.276 1.00 0.00 H new ATOM 0 HG3 LYS A 9 13.548 6.461 -4.520 1.00 0.00 H new ATOM 0 HD2 LYS A 9 14.883 8.270 -5.542 1.00 0.00 H new ATOM 0 HD3 LYS A 9 13.516 9.364 -5.474 1.00 0.00 H new ATOM 0 HE2 LYS A 9 14.680 8.107 -2.960 1.00 0.00 H new ATOM 0 HE3 LYS A 9 15.337 9.584 -3.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 13.776 10.146 -1.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 13.081 10.557 -3.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 12.574 9.156 -2.646 1.00 0.00 H new ATOM 144 N LEU A 10 9.709 6.925 -7.854 1.00 0.00 N ATOM 145 CA LEU A 10 8.883 7.034 -9.056 1.00 0.00 C ATOM 146 C LEU A 10 9.646 7.803 -10.136 1.00 0.00 C ATOM 147 O LEU A 10 10.222 8.843 -9.823 1.00 0.00 O ATOM 148 CB LEU A 10 7.584 7.736 -8.633 1.00 0.00 C ATOM 149 CG LEU A 10 6.530 8.070 -9.703 1.00 0.00 C ATOM 150 CD1 LEU A 10 5.220 8.404 -8.976 1.00 0.00 C ATOM 151 CD2 LEU A 10 6.887 9.309 -10.535 1.00 0.00 C ATOM 0 H LEU A 10 9.514 7.659 -7.173 1.00 0.00 H new ATOM 0 HA LEU A 10 8.644 6.061 -9.486 1.00 0.00 H new ATOM 0 HB2 LEU A 10 7.102 7.110 -7.882 1.00 0.00 H new ATOM 0 HB3 LEU A 10 7.860 8.669 -8.141 1.00 0.00 H new ATOM 0 HG LEU A 10 6.462 7.211 -10.370 1.00 0.00 H new ATOM 0 HD11 LEU A 10 4.449 8.646 -9.708 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.902 7.545 -8.385 1.00 0.00 H new ATOM 0 HD13 LEU A 10 5.377 9.259 -8.318 1.00 0.00 H new ATOM 0 HD21 LEU A 10 6.104 9.491 -11.271 1.00 0.00 H new ATOM 0 HD22 LEU A 10 6.976 10.175 -9.879 1.00 0.00 H new ATOM 0 HD23 LEU A 10 7.835 9.143 -11.047 1.00 0.00 H new ATOM 163 N VAL A 11 9.640 7.318 -11.389 1.00 0.00 N ATOM 164 CA VAL A 11 10.220 8.036 -12.530 1.00 0.00 C ATOM 165 C VAL A 11 9.147 8.560 -13.502 1.00 0.00 C ATOM 166 O VAL A 11 9.257 9.701 -13.943 1.00 0.00 O ATOM 167 CB VAL A 11 11.341 7.215 -13.200 1.00 0.00 C ATOM 168 CG1 VAL A 11 10.855 6.006 -14.001 1.00 0.00 C ATOM 169 CG2 VAL A 11 12.185 8.103 -14.124 1.00 0.00 C ATOM 0 H VAL A 11 9.232 6.416 -11.637 1.00 0.00 H new ATOM 0 HA VAL A 11 10.703 8.936 -12.149 1.00 0.00 H new ATOM 0 HB VAL A 11 11.934 6.830 -12.370 1.00 0.00 H new ATOM 0 HG11 VAL A 11 11.711 5.490 -14.436 1.00 0.00 H new ATOM 0 HG12 VAL A 11 10.317 5.325 -13.342 1.00 0.00 H new ATOM 0 HG13 VAL A 11 10.190 6.341 -14.798 1.00 0.00 H new ATOM 0 HG21 VAL A 11 12.970 7.505 -14.586 1.00 0.00 H new ATOM 0 HG22 VAL A 11 11.549 8.529 -14.900 1.00 0.00 H new ATOM 0 HG23 VAL A 11 12.637 8.907 -13.543 1.00 0.00 H new ATOM 179 N ASP A 12 8.096 7.780 -13.797 1.00 0.00 N ATOM 180 CA ASP A 12 6.926 8.260 -14.543 1.00 0.00 C ATOM 181 C ASP A 12 5.668 7.581 -13.997 1.00 0.00 C ATOM 182 O ASP A 12 5.768 6.549 -13.328 1.00 0.00 O ATOM 183 CB ASP A 12 7.085 8.072 -16.063 1.00 0.00 C ATOM 184 CG ASP A 12 5.838 8.505 -16.835 1.00 0.00 C ATOM 185 OD1 ASP A 12 5.210 9.495 -16.396 1.00 0.00 O ATOM 186 OD2 ASP A 12 5.487 7.811 -17.811 1.00 0.00 O ATOM 0 H ASP A 12 8.035 6.799 -13.524 1.00 0.00 H new ATOM 0 HA ASP A 12 6.832 9.336 -14.396 1.00 0.00 H new ATOM 0 HB2 ASP A 12 7.943 8.648 -16.410 1.00 0.00 H new ATOM 0 HB3 ASP A 12 7.297 7.024 -16.277 1.00 0.00 H new ATOM 191 N SER A 13 4.502 8.195 -14.223 1.00 0.00 N ATOM 192 CA SER A 13 3.238 7.942 -13.553 1.00 0.00 C ATOM 193 C SER A 13 2.135 8.769 -14.218 1.00 0.00 C ATOM 194 O SER A 13 2.137 9.993 -14.075 1.00 0.00 O ATOM 195 CB SER A 13 3.411 8.328 -12.079 1.00 0.00 C ATOM 196 OG SER A 13 2.198 8.298 -11.349 1.00 0.00 O ATOM 0 H SER A 13 4.419 8.929 -14.927 1.00 0.00 H new ATOM 0 HA SER A 13 2.953 6.892 -13.624 1.00 0.00 H new ATOM 0 HB2 SER A 13 4.125 7.648 -11.613 1.00 0.00 H new ATOM 0 HB3 SER A 13 3.839 9.329 -12.020 1.00 0.00 H new ATOM 0 HG SER A 13 1.965 9.206 -11.065 1.00 0.00 H new ATOM 202 N LYS A 14 1.184 8.114 -14.901 1.00 0.00 N ATOM 203 CA LYS A 14 0.159 8.820 -15.661 1.00 0.00 C ATOM 204 C LYS A 14 -1.132 8.007 -15.773 1.00 0.00 C ATOM 205 O LYS A 14 -1.097 6.778 -15.860 1.00 0.00 O ATOM 206 CB LYS A 14 0.703 9.208 -17.044 1.00 0.00 C ATOM 207 CG LYS A 14 1.259 8.009 -17.835 1.00 0.00 C ATOM 208 CD LYS A 14 1.847 8.415 -19.196 1.00 0.00 C ATOM 209 CE LYS A 14 0.837 8.413 -20.356 1.00 0.00 C ATOM 210 NZ LYS A 14 -0.315 9.308 -20.128 1.00 0.00 N ATOM 0 H LYS A 14 1.109 7.097 -14.938 1.00 0.00 H new ATOM 0 HA LYS A 14 -0.096 9.732 -15.120 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -0.093 9.679 -17.621 1.00 0.00 H new ATOM 0 HB3 LYS A 14 1.491 9.951 -16.922 1.00 0.00 H new ATOM 0 HG2 LYS A 14 2.030 7.516 -17.244 1.00 0.00 H new ATOM 0 HG3 LYS A 14 0.462 7.281 -17.991 1.00 0.00 H new ATOM 0 HD2 LYS A 14 2.277 9.413 -19.108 1.00 0.00 H new ATOM 0 HD3 LYS A 14 2.664 7.736 -19.441 1.00 0.00 H new ATOM 0 HE2 LYS A 14 1.346 8.713 -21.272 1.00 0.00 H new ATOM 0 HE3 LYS A 14 0.474 7.397 -20.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -0.809 9.474 -21.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -0.969 8.866 -19.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 0.020 10.215 -19.744 1.00 0.00 H new ATOM 224 N ASN A 15 -2.269 8.712 -15.764 1.00 0.00 N ATOM 225 CA ASN A 15 -3.632 8.204 -15.911 1.00 0.00 C ATOM 226 C ASN A 15 -4.130 7.553 -14.618 1.00 0.00 C ATOM 227 O ASN A 15 -5.284 7.136 -14.552 1.00 0.00 O ATOM 228 CB ASN A 15 -3.808 7.264 -17.120 1.00 0.00 C ATOM 229 CG ASN A 15 -3.510 7.925 -18.465 1.00 0.00 C ATOM 230 OD1 ASN A 15 -2.370 8.280 -18.766 1.00 0.00 O ATOM 231 ND2 ASN A 15 -4.528 8.067 -19.310 1.00 0.00 N ATOM 0 H ASN A 15 -2.257 9.725 -15.645 1.00 0.00 H new ATOM 0 HA ASN A 15 -4.256 9.074 -16.115 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -3.152 6.402 -16.996 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -4.831 6.888 -17.130 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -4.373 8.478 -20.231 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -5.463 7.765 -19.037 1.00 0.00 H new ATOM 238 N PHE A 16 -3.272 7.417 -13.603 1.00 0.00 N ATOM 239 CA PHE A 16 -3.583 6.838 -12.298 1.00 0.00 C ATOM 240 C PHE A 16 -4.376 7.880 -11.504 1.00 0.00 C ATOM 241 O PHE A 16 -5.350 7.587 -10.813 1.00 0.00 O ATOM 242 CB PHE A 16 -2.251 6.478 -11.620 1.00 0.00 C ATOM 243 CG PHE A 16 -2.286 5.425 -10.523 1.00 0.00 C ATOM 244 CD1 PHE A 16 -3.066 5.598 -9.365 1.00 0.00 C ATOM 245 CD2 PHE A 16 -1.434 4.309 -10.614 1.00 0.00 C ATOM 246 CE1 PHE A 16 -2.896 4.744 -8.262 1.00 0.00 C ATOM 247 CE2 PHE A 16 -1.217 3.493 -9.492 1.00 0.00 C ATOM 248 CZ PHE A 16 -1.941 3.717 -8.310 1.00 0.00 C ATOM 0 H PHE A 16 -2.301 7.721 -13.674 1.00 0.00 H new ATOM 0 HA PHE A 16 -4.186 5.933 -12.369 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -1.561 6.137 -12.392 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -1.831 7.391 -11.198 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -3.799 6.391 -9.324 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -0.946 4.079 -11.549 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -3.501 4.878 -7.377 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -0.493 2.693 -9.538 1.00 0.00 H new ATOM 0 HZ PHE A 16 -1.763 3.101 -7.441 1.00 0.00 H new ATOM 258 N ASP A 17 -3.922 9.125 -11.613 1.00 0.00 N ATOM 259 CA ASP A 17 -4.716 10.338 -11.500 1.00 0.00 C ATOM 260 C ASP A 17 -6.155 10.136 -12.014 1.00 0.00 C ATOM 261 O ASP A 17 -7.070 9.935 -11.209 1.00 0.00 O ATOM 262 CB ASP A 17 -3.966 11.446 -12.261 1.00 0.00 C ATOM 263 CG ASP A 17 -3.390 10.933 -13.578 1.00 0.00 C ATOM 264 OD1 ASP A 17 -2.330 10.264 -13.509 1.00 0.00 O ATOM 265 OD2 ASP A 17 -4.097 11.038 -14.597 1.00 0.00 O ATOM 0 H ASP A 17 -2.937 9.322 -11.792 1.00 0.00 H new ATOM 0 HA ASP A 17 -4.831 10.621 -10.454 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -4.645 12.276 -12.459 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -3.161 11.835 -11.638 1.00 0.00 H new ATOM 270 N ASP A 18 -6.372 10.193 -13.331 1.00 0.00 N ATOM 271 CA ASP A 18 -7.716 10.162 -13.894 1.00 0.00 C ATOM 272 C ASP A 18 -8.500 8.925 -13.460 1.00 0.00 C ATOM 273 O ASP A 18 -9.677 9.038 -13.131 1.00 0.00 O ATOM 274 CB ASP A 18 -7.669 10.265 -15.417 1.00 0.00 C ATOM 275 CG ASP A 18 -9.088 10.334 -15.955 1.00 0.00 C ATOM 276 OD1 ASP A 18 -9.746 11.362 -15.676 1.00 0.00 O ATOM 277 OD2 ASP A 18 -9.517 9.345 -16.581 1.00 0.00 O ATOM 0 H ASP A 18 -5.628 10.261 -14.026 1.00 0.00 H new ATOM 0 HA ASP A 18 -8.245 11.030 -13.501 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -7.110 11.151 -15.717 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -7.149 9.403 -15.836 1.00 0.00 H new ATOM 282 N TYR A 19 -7.838 7.763 -13.409 1.00 0.00 N ATOM 283 CA TYR A 19 -8.417 6.491 -12.985 1.00 0.00 C ATOM 284 C TYR A 19 -9.429 6.649 -11.856 1.00 0.00 C ATOM 285 O TYR A 19 -10.592 6.263 -11.970 1.00 0.00 O ATOM 286 CB TYR A 19 -7.299 5.566 -12.496 1.00 0.00 C ATOM 287 CG TYR A 19 -7.684 4.115 -12.377 1.00 0.00 C ATOM 288 CD1 TYR A 19 -7.924 3.412 -13.564 1.00 0.00 C ATOM 289 CD2 TYR A 19 -7.466 3.409 -11.179 1.00 0.00 C ATOM 290 CE1 TYR A 19 -7.754 2.028 -13.593 1.00 0.00 C ATOM 291 CE2 TYR A 19 -7.385 2.006 -11.196 1.00 0.00 C ATOM 292 CZ TYR A 19 -7.454 1.333 -12.423 1.00 0.00 C ATOM 293 OH TYR A 19 -7.057 0.048 -12.549 1.00 0.00 O ATOM 0 H TYR A 19 -6.855 7.684 -13.670 1.00 0.00 H new ATOM 0 HA TYR A 19 -8.936 6.075 -13.849 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -6.454 5.648 -13.180 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -6.956 5.917 -11.523 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -8.239 3.939 -14.453 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -7.361 3.945 -10.247 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -7.855 1.493 -14.526 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -7.271 1.454 -10.275 1.00 0.00 H new ATOM 0 HH TYR A 19 -7.631 -0.527 -12.001 1.00 0.00 H new ATOM 303 N MET A 20 -8.969 7.209 -10.738 1.00 0.00 N ATOM 304 CA MET A 20 -9.803 7.293 -9.556 1.00 0.00 C ATOM 305 C MET A 20 -10.963 8.275 -9.767 1.00 0.00 C ATOM 306 O MET A 20 -12.028 8.133 -9.160 1.00 0.00 O ATOM 307 CB MET A 20 -8.932 7.590 -8.337 1.00 0.00 C ATOM 308 CG MET A 20 -8.364 9.003 -8.322 1.00 0.00 C ATOM 309 SD MET A 20 -6.580 9.063 -8.432 1.00 0.00 S ATOM 310 CE MET A 20 -6.445 10.841 -8.232 1.00 0.00 C ATOM 0 H MET A 20 -8.035 7.605 -10.633 1.00 0.00 H new ATOM 0 HA MET A 20 -10.284 6.334 -9.364 1.00 0.00 H new ATOM 0 HB2 MET A 20 -9.522 7.435 -7.433 1.00 0.00 H new ATOM 0 HB3 MET A 20 -8.109 6.876 -8.307 1.00 0.00 H new ATOM 0 HG2 MET A 20 -8.789 9.565 -9.154 1.00 0.00 H new ATOM 0 HG3 MET A 20 -8.680 9.502 -7.406 1.00 0.00 H new ATOM 0 HE1 MET A 20 -5.463 11.088 -7.829 1.00 0.00 H new ATOM 0 HE2 MET A 20 -6.573 11.327 -9.199 1.00 0.00 H new ATOM 0 HE3 MET A 20 -7.217 11.190 -7.546 1.00 0.00 H new ATOM 320 N LYS A 21 -10.787 9.259 -10.655 1.00 0.00 N ATOM 321 CA LYS A 21 -11.832 10.187 -11.068 1.00 0.00 C ATOM 322 C LYS A 21 -12.788 9.498 -12.056 1.00 0.00 C ATOM 323 O LYS A 21 -13.080 10.033 -13.128 1.00 0.00 O ATOM 324 CB LYS A 21 -11.165 11.440 -11.661 1.00 0.00 C ATOM 325 CG LYS A 21 -12.124 12.636 -11.750 1.00 0.00 C ATOM 326 CD LYS A 21 -11.671 13.623 -12.838 1.00 0.00 C ATOM 327 CE LYS A 21 -12.325 13.346 -14.204 1.00 0.00 C ATOM 328 NZ LYS A 21 -12.071 11.984 -14.721 1.00 0.00 N ATOM 0 H LYS A 21 -9.893 9.432 -11.114 1.00 0.00 H new ATOM 0 HA LYS A 21 -12.437 10.496 -10.216 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -10.306 11.713 -11.049 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -10.786 11.208 -12.656 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -13.132 12.284 -11.970 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -12.167 13.145 -10.787 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -11.912 14.639 -12.524 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -10.587 13.570 -12.942 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -13.401 13.498 -14.119 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -11.957 14.074 -14.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -12.582 11.852 -15.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -11.051 11.858 -14.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -12.401 11.282 -14.028 1.00 0.00 H new ATOM 342 N SER A 22 -13.294 8.329 -11.660 1.00 0.00 N ATOM 343 CA SER A 22 -14.318 7.538 -12.327 1.00 0.00 C ATOM 344 C SER A 22 -14.765 6.448 -11.349 1.00 0.00 C ATOM 345 O SER A 22 -15.955 6.240 -11.134 1.00 0.00 O ATOM 346 CB SER A 22 -13.814 6.956 -13.656 1.00 0.00 C ATOM 347 OG SER A 22 -12.801 5.991 -13.462 1.00 0.00 O ATOM 0 H SER A 22 -12.972 7.882 -10.802 1.00 0.00 H new ATOM 0 HA SER A 22 -15.168 8.167 -12.593 1.00 0.00 H new ATOM 0 HB2 SER A 22 -14.648 6.503 -14.193 1.00 0.00 H new ATOM 0 HB3 SER A 22 -13.432 7.762 -14.283 1.00 0.00 H new ATOM 0 HG SER A 22 -12.102 6.362 -12.884 1.00 0.00 H new ATOM 353 N LEU A 23 -13.792 5.803 -10.694 1.00 0.00 N ATOM 354 CA LEU A 23 -14.011 4.784 -9.671 1.00 0.00 C ATOM 355 C LEU A 23 -14.773 5.280 -8.433 1.00 0.00 C ATOM 356 O LEU A 23 -15.153 4.457 -7.599 1.00 0.00 O ATOM 357 CB LEU A 23 -12.659 4.216 -9.215 1.00 0.00 C ATOM 358 CG LEU A 23 -11.904 3.401 -10.273 1.00 0.00 C ATOM 359 CD1 LEU A 23 -10.555 2.985 -9.677 1.00 0.00 C ATOM 360 CD2 LEU A 23 -12.696 2.150 -10.662 1.00 0.00 C ATOM 0 H LEU A 23 -12.804 5.984 -10.869 1.00 0.00 H new ATOM 0 HA LEU A 23 -14.635 4.024 -10.141 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -12.025 5.043 -8.895 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -12.824 3.584 -8.342 1.00 0.00 H new ATOM 0 HG LEU A 23 -11.764 4.006 -11.168 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -9.997 2.403 -10.411 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -9.985 3.875 -9.411 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -10.722 2.381 -8.785 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -12.142 1.587 -11.413 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -12.848 1.527 -9.781 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -13.663 2.444 -11.069 1.00 0.00 H new ATOM 372 N GLY A 24 -14.952 6.594 -8.261 1.00 0.00 N ATOM 373 CA GLY A 24 -15.630 7.154 -7.099 1.00 0.00 C ATOM 374 C GLY A 24 -14.643 7.285 -5.944 1.00 0.00 C ATOM 375 O GLY A 24 -14.778 6.619 -4.915 1.00 0.00 O ATOM 0 H GLY A 24 -14.629 7.295 -8.927 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -16.049 8.130 -7.345 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -16.463 6.514 -6.808 1.00 0.00 H new ATOM 379 N VAL A 25 -13.624 8.120 -6.158 1.00 0.00 N ATOM 380 CA VAL A 25 -12.517 8.369 -5.241 1.00 0.00 C ATOM 381 C VAL A 25 -11.742 9.623 -5.673 1.00 0.00 C ATOM 382 O VAL A 25 -11.254 10.368 -4.826 1.00 0.00 O ATOM 383 CB VAL A 25 -11.617 7.120 -5.081 1.00 0.00 C ATOM 384 CG1 VAL A 25 -11.614 6.188 -6.301 1.00 0.00 C ATOM 385 CG2 VAL A 25 -10.176 7.484 -4.685 1.00 0.00 C ATOM 0 H VAL A 25 -13.548 8.665 -7.017 1.00 0.00 H new ATOM 0 HA VAL A 25 -12.920 8.568 -4.248 1.00 0.00 H new ATOM 0 HB VAL A 25 -12.073 6.563 -4.263 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -10.959 5.338 -6.108 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -12.627 5.831 -6.489 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -11.254 6.732 -7.174 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -9.585 6.574 -4.585 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -9.737 8.119 -5.454 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -10.184 8.018 -3.735 1.00 0.00 H new ATOM 395 N GLY A 26 -11.602 9.860 -6.981 1.00 0.00 N ATOM 396 CA GLY A 26 -11.013 11.083 -7.507 1.00 0.00 C ATOM 397 C GLY A 26 -12.076 12.154 -7.735 1.00 0.00 C ATOM 398 O GLY A 26 -13.221 11.841 -8.055 1.00 0.00 O ATOM 0 H GLY A 26 -11.897 9.203 -7.703 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -10.261 11.456 -6.812 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -10.501 10.869 -8.445 1.00 0.00 H new ATOM 402 N PHE A 27 -11.679 13.420 -7.596 1.00 0.00 N ATOM 403 CA PHE A 27 -12.541 14.588 -7.745 1.00 0.00 C ATOM 404 C PHE A 27 -11.654 15.827 -7.885 1.00 0.00 C ATOM 405 O PHE A 27 -11.619 16.693 -7.011 1.00 0.00 O ATOM 406 CB PHE A 27 -13.542 14.684 -6.576 1.00 0.00 C ATOM 407 CG PHE A 27 -13.048 14.158 -5.236 1.00 0.00 C ATOM 408 CD1 PHE A 27 -12.181 14.926 -4.435 1.00 0.00 C ATOM 409 CD2 PHE A 27 -13.462 12.889 -4.791 1.00 0.00 C ATOM 410 CE1 PHE A 27 -11.669 14.394 -3.240 1.00 0.00 C ATOM 411 CE2 PHE A 27 -12.986 12.378 -3.573 1.00 0.00 C ATOM 412 CZ PHE A 27 -12.060 13.113 -2.816 1.00 0.00 C ATOM 0 H PHE A 27 -10.715 13.666 -7.369 1.00 0.00 H new ATOM 0 HA PHE A 27 -13.151 14.504 -8.645 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -13.828 15.729 -6.452 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -14.444 14.137 -6.849 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -11.909 15.926 -4.740 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -14.148 12.306 -5.388 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -10.974 14.970 -2.647 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -13.333 11.419 -3.218 1.00 0.00 H new ATOM 0 HZ PHE A 27 -11.649 12.694 -1.909 1.00 0.00 H new ATOM 422 N ALA A 28 -10.851 15.863 -8.957 1.00 0.00 N ATOM 423 CA ALA A 28 -9.980 16.978 -9.350 1.00 0.00 C ATOM 424 C ALA A 28 -8.827 17.283 -8.380 1.00 0.00 C ATOM 425 O ALA A 28 -7.849 17.915 -8.772 1.00 0.00 O ATOM 426 CB ALA A 28 -10.810 18.235 -9.632 1.00 0.00 C ATOM 0 H ALA A 28 -10.788 15.077 -9.605 1.00 0.00 H new ATOM 0 HA ALA A 28 -9.488 16.646 -10.264 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -10.148 19.051 -9.922 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -11.513 18.033 -10.441 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -11.361 18.516 -8.734 1.00 0.00 H new ATOM 432 N THR A 29 -8.923 16.840 -7.127 1.00 0.00 N ATOM 433 CA THR A 29 -8.033 17.200 -6.041 1.00 0.00 C ATOM 434 C THR A 29 -7.012 16.079 -5.839 1.00 0.00 C ATOM 435 O THR A 29 -5.805 16.298 -5.897 1.00 0.00 O ATOM 436 CB THR A 29 -8.899 17.444 -4.792 1.00 0.00 C ATOM 437 OG1 THR A 29 -10.030 18.230 -5.124 1.00 0.00 O ATOM 438 CG2 THR A 29 -8.118 18.181 -3.706 1.00 0.00 C ATOM 0 H THR A 29 -9.656 16.194 -6.836 1.00 0.00 H new ATOM 0 HA THR A 29 -7.471 18.109 -6.256 1.00 0.00 H new ATOM 0 HB THR A 29 -9.206 16.466 -4.420 1.00 0.00 H new ATOM 0 HG1 THR A 29 -10.668 17.687 -5.633 1.00 0.00 H new ATOM 0 HG21 THR A 29 -8.760 18.337 -2.839 1.00 0.00 H new ATOM 0 HG22 THR A 29 -7.252 17.587 -3.415 1.00 0.00 H new ATOM 0 HG23 THR A 29 -7.785 19.146 -4.089 1.00 0.00 H new ATOM 446 N ARG A 30 -7.497 14.846 -5.644 1.00 0.00 N ATOM 447 CA ARG A 30 -6.663 13.701 -5.296 1.00 0.00 C ATOM 448 C ARG A 30 -5.653 13.343 -6.396 1.00 0.00 C ATOM 449 O ARG A 30 -4.745 12.562 -6.140 1.00 0.00 O ATOM 450 CB ARG A 30 -7.564 12.536 -4.841 1.00 0.00 C ATOM 451 CG ARG A 30 -6.797 11.410 -4.123 1.00 0.00 C ATOM 452 CD ARG A 30 -7.755 10.486 -3.338 1.00 0.00 C ATOM 453 NE ARG A 30 -7.188 10.014 -2.057 1.00 0.00 N ATOM 454 CZ ARG A 30 -6.928 10.796 -0.995 1.00 0.00 C ATOM 455 NH1 ARG A 30 -7.149 12.113 -1.066 1.00 0.00 N ATOM 456 NH2 ARG A 30 -6.455 10.257 0.130 1.00 0.00 N ATOM 0 H ARG A 30 -8.488 14.619 -5.725 1.00 0.00 H new ATOM 0 HA ARG A 30 -6.025 13.962 -4.452 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -8.335 12.922 -4.174 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -8.074 12.121 -5.710 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -6.241 10.823 -4.854 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -6.066 11.844 -3.440 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -8.685 11.020 -3.142 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -8.006 9.624 -3.956 1.00 0.00 H new ATOM 0 HE ARG A 30 -6.978 9.019 -1.973 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -7.515 12.523 -1.925 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -6.952 12.707 -0.261 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -6.291 9.252 0.184 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -6.258 10.850 0.936 1.00 0.00 H new ATOM 470 N GLN A 31 -5.765 13.919 -7.601 1.00 0.00 N ATOM 471 CA GLN A 31 -4.684 13.871 -8.584 1.00 0.00 C ATOM 472 C GLN A 31 -3.388 14.442 -7.999 1.00 0.00 C ATOM 473 O GLN A 31 -2.332 13.825 -8.136 1.00 0.00 O ATOM 474 CB GLN A 31 -5.102 14.463 -9.943 1.00 0.00 C ATOM 475 CG GLN A 31 -5.680 15.886 -9.927 1.00 0.00 C ATOM 476 CD GLN A 31 -4.647 16.985 -9.695 1.00 0.00 C ATOM 477 OE1 GLN A 31 -3.472 16.826 -10.005 1.00 0.00 O ATOM 478 NE2 GLN A 31 -5.081 18.109 -9.138 1.00 0.00 N ATOM 0 H GLN A 31 -6.595 14.423 -7.914 1.00 0.00 H new ATOM 0 HA GLN A 31 -4.466 12.827 -8.811 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -4.232 14.457 -10.599 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -5.843 13.800 -10.390 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -6.182 16.071 -10.876 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -6.439 15.948 -9.147 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -6.066 18.209 -8.892 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -4.430 18.873 -8.956 1.00 0.00 H new ATOM 487 N VAL A 32 -3.458 15.569 -7.281 1.00 0.00 N ATOM 488 CA VAL A 32 -2.265 16.110 -6.645 1.00 0.00 C ATOM 489 C VAL A 32 -1.841 15.110 -5.566 1.00 0.00 C ATOM 490 O VAL A 32 -0.720 14.594 -5.569 1.00 0.00 O ATOM 491 CB VAL A 32 -2.499 17.567 -6.172 1.00 0.00 C ATOM 492 CG1 VAL A 32 -2.959 17.727 -4.716 1.00 0.00 C ATOM 493 CG2 VAL A 32 -1.238 18.421 -6.353 1.00 0.00 C ATOM 0 H VAL A 32 -4.310 16.109 -7.131 1.00 0.00 H new ATOM 0 HA VAL A 32 -1.429 16.212 -7.337 1.00 0.00 H new ATOM 0 HB VAL A 32 -3.316 17.906 -6.809 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -3.092 18.785 -4.491 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -3.905 17.204 -4.574 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -2.207 17.306 -4.049 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -1.435 19.437 -6.012 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -0.423 17.994 -5.769 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -0.959 18.439 -7.407 1.00 0.00 H new ATOM 503 N GLY A 33 -2.804 14.733 -4.717 1.00 0.00 N ATOM 504 CA GLY A 33 -2.639 13.771 -3.638 1.00 0.00 C ATOM 505 C GLY A 33 -2.575 12.318 -4.123 1.00 0.00 C ATOM 506 O GLY A 33 -3.127 11.436 -3.467 1.00 0.00 O ATOM 0 H GLY A 33 -3.751 15.107 -4.770 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -1.726 14.004 -3.090 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -3.467 13.876 -2.937 1.00 0.00 H new ATOM 510 N ASN A 34 -1.891 12.059 -5.243 1.00 0.00 N ATOM 511 CA ASN A 34 -1.592 10.716 -5.731 1.00 0.00 C ATOM 512 C ASN A 34 -0.542 10.725 -6.844 1.00 0.00 C ATOM 513 O ASN A 34 0.148 9.720 -7.034 1.00 0.00 O ATOM 514 CB ASN A 34 -2.847 9.915 -6.121 1.00 0.00 C ATOM 515 CG ASN A 34 -3.105 9.846 -7.625 1.00 0.00 C ATOM 516 OD1 ASN A 34 -2.923 10.798 -8.369 1.00 0.00 O ATOM 517 ND2 ASN A 34 -3.536 8.687 -8.109 1.00 0.00 N ATOM 0 H ASN A 34 -1.524 12.796 -5.845 1.00 0.00 H new ATOM 0 HA ASN A 34 -1.155 10.186 -4.885 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -2.752 8.901 -5.733 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -3.715 10.362 -5.635 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -3.717 8.587 -9.108 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -3.686 7.897 -7.482 1.00 0.00 H new ATOM 524 N MET A 35 -0.404 11.823 -7.594 1.00 0.00 N ATOM 525 CA MET A 35 0.792 12.041 -8.390 1.00 0.00 C ATOM 526 C MET A 35 1.970 12.171 -7.418 1.00 0.00 C ATOM 527 O MET A 35 3.043 11.635 -7.688 1.00 0.00 O ATOM 528 CB MET A 35 0.621 13.264 -9.303 1.00 0.00 C ATOM 529 CG MET A 35 1.654 13.311 -10.443 1.00 0.00 C ATOM 530 SD MET A 35 1.494 12.073 -11.778 1.00 0.00 S ATOM 531 CE MET A 35 -0.053 12.609 -12.555 1.00 0.00 C ATOM 0 H MET A 35 -1.102 12.564 -7.662 1.00 0.00 H new ATOM 0 HA MET A 35 0.982 11.204 -9.062 1.00 0.00 H new ATOM 0 HB2 MET A 35 -0.382 13.255 -9.729 1.00 0.00 H new ATOM 0 HB3 MET A 35 0.706 14.172 -8.705 1.00 0.00 H new ATOM 0 HG2 MET A 35 1.610 14.302 -10.896 1.00 0.00 H new ATOM 0 HG3 MET A 35 2.646 13.205 -10.003 1.00 0.00 H new ATOM 0 HE1 MET A 35 -0.215 12.043 -13.472 1.00 0.00 H new ATOM 0 HE2 MET A 35 -0.883 12.436 -11.870 1.00 0.00 H new ATOM 0 HE3 MET A 35 0.007 13.672 -12.790 1.00 0.00 H new ATOM 541 N THR A 36 1.738 12.807 -6.260 1.00 0.00 N ATOM 542 CA THR A 36 2.664 12.789 -5.132 1.00 0.00 C ATOM 543 C THR A 36 2.823 11.345 -4.606 1.00 0.00 C ATOM 544 O THR A 36 2.147 10.909 -3.673 1.00 0.00 O ATOM 545 CB THR A 36 2.245 13.860 -4.095 1.00 0.00 C ATOM 546 OG1 THR A 36 3.325 14.232 -3.263 1.00 0.00 O ATOM 547 CG2 THR A 36 1.060 13.490 -3.199 1.00 0.00 C ATOM 0 H THR A 36 0.893 13.351 -6.085 1.00 0.00 H new ATOM 0 HA THR A 36 3.672 13.079 -5.430 1.00 0.00 H new ATOM 0 HB THR A 36 1.921 14.692 -4.721 1.00 0.00 H new ATOM 0 HG1 THR A 36 3.509 13.512 -2.624 1.00 0.00 H new ATOM 0 HG21 THR A 36 0.853 14.311 -2.512 1.00 0.00 H new ATOM 0 HG22 THR A 36 0.181 13.303 -3.816 1.00 0.00 H new ATOM 0 HG23 THR A 36 1.301 12.592 -2.630 1.00 0.00 H new ATOM 555 N LYS A 37 3.693 10.574 -5.266 1.00 0.00 N ATOM 556 CA LYS A 37 4.245 9.309 -4.790 1.00 0.00 C ATOM 557 C LYS A 37 5.702 9.195 -5.268 1.00 0.00 C ATOM 558 O LYS A 37 6.029 8.271 -6.007 1.00 0.00 O ATOM 559 CB LYS A 37 3.399 8.122 -5.296 1.00 0.00 C ATOM 560 CG LYS A 37 2.014 8.058 -4.643 1.00 0.00 C ATOM 561 CD LYS A 37 1.263 6.782 -5.050 1.00 0.00 C ATOM 562 CE LYS A 37 -0.049 6.665 -4.253 1.00 0.00 C ATOM 563 NZ LYS A 37 -0.769 5.394 -4.498 1.00 0.00 N ATOM 0 H LYS A 37 4.045 10.830 -6.188 1.00 0.00 H new ATOM 0 HA LYS A 37 4.221 9.283 -3.701 1.00 0.00 H new ATOM 0 HB2 LYS A 37 3.283 8.200 -6.377 1.00 0.00 H new ATOM 0 HB3 LYS A 37 3.932 7.192 -5.099 1.00 0.00 H new ATOM 0 HG2 LYS A 37 2.119 8.090 -3.559 1.00 0.00 H new ATOM 0 HG3 LYS A 37 1.432 8.933 -4.933 1.00 0.00 H new ATOM 0 HD2 LYS A 37 1.048 6.802 -6.118 1.00 0.00 H new ATOM 0 HD3 LYS A 37 1.888 5.908 -4.867 1.00 0.00 H new ATOM 0 HE2 LYS A 37 0.171 6.751 -3.189 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -0.700 7.500 -4.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -1.642 5.375 -3.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -1.007 5.319 -5.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -0.163 4.594 -4.225 1.00 0.00 H new ATOM 577 N PRO A 38 6.595 10.119 -4.875 1.00 0.00 N ATOM 578 CA PRO A 38 7.963 10.163 -5.357 1.00 0.00 C ATOM 579 C PRO A 38 8.783 9.014 -4.773 1.00 0.00 C ATOM 580 O PRO A 38 9.849 8.694 -5.301 1.00 0.00 O ATOM 581 CB PRO A 38 8.509 11.516 -4.896 1.00 0.00 C ATOM 582 CG PRO A 38 7.774 11.743 -3.579 1.00 0.00 C ATOM 583 CD PRO A 38 6.404 11.119 -3.845 1.00 0.00 C ATOM 0 HA PRO A 38 8.015 10.054 -6.440 1.00 0.00 H new ATOM 0 HB2 PRO A 38 9.590 11.491 -4.757 1.00 0.00 H new ATOM 0 HB3 PRO A 38 8.299 12.305 -5.618 1.00 0.00 H new ATOM 0 HG2 PRO A 38 8.283 11.262 -2.744 1.00 0.00 H new ATOM 0 HG3 PRO A 38 7.696 12.803 -3.337 1.00 0.00 H new ATOM 0 HD2 PRO A 38 6.001 10.668 -2.938 1.00 0.00 H new ATOM 0 HD3 PRO A 38 5.690 11.876 -4.169 1.00 0.00 H new ATOM 591 N THR A 39 8.355 8.426 -3.649 1.00 0.00 N ATOM 592 CA THR A 39 9.085 7.366 -2.980 1.00 0.00 C ATOM 593 C THR A 39 8.095 6.353 -2.415 1.00 0.00 C ATOM 594 O THR A 39 6.933 6.676 -2.170 1.00 0.00 O ATOM 595 CB THR A 39 10.030 7.998 -1.945 1.00 0.00 C ATOM 596 OG1 THR A 39 10.856 8.930 -2.611 1.00 0.00 O ATOM 597 CG2 THR A 39 10.997 6.988 -1.354 1.00 0.00 C ATOM 0 H THR A 39 7.485 8.681 -3.182 1.00 0.00 H new ATOM 0 HA THR A 39 9.718 6.804 -3.666 1.00 0.00 H new ATOM 0 HB THR A 39 9.403 8.428 -1.164 1.00 0.00 H new ATOM 0 HG1 THR A 39 10.930 9.745 -2.072 1.00 0.00 H new ATOM 0 HG21 THR A 39 11.643 7.484 -0.629 1.00 0.00 H new ATOM 0 HG22 THR A 39 10.437 6.195 -0.859 1.00 0.00 H new ATOM 0 HG23 THR A 39 11.607 6.559 -2.149 1.00 0.00 H new ATOM 605 N THR A 40 8.514 5.094 -2.288 1.00 0.00 N ATOM 606 CA THR A 40 7.684 4.029 -1.748 1.00 0.00 C ATOM 607 C THR A 40 8.600 2.951 -1.173 1.00 0.00 C ATOM 608 O THR A 40 9.462 2.453 -1.891 1.00 0.00 O ATOM 609 CB THR A 40 6.794 3.451 -2.862 1.00 0.00 C ATOM 610 OG1 THR A 40 5.906 4.421 -3.391 1.00 0.00 O ATOM 611 CG2 THR A 40 5.948 2.271 -2.376 1.00 0.00 C ATOM 0 H THR A 40 9.448 4.787 -2.561 1.00 0.00 H new ATOM 0 HA THR A 40 7.035 4.412 -0.960 1.00 0.00 H new ATOM 0 HB THR A 40 7.487 3.117 -3.634 1.00 0.00 H new ATOM 0 HG1 THR A 40 6.048 5.277 -2.936 1.00 0.00 H new ATOM 0 HG21 THR A 40 5.337 1.898 -3.198 1.00 0.00 H new ATOM 0 HG22 THR A 40 6.603 1.476 -2.021 1.00 0.00 H new ATOM 0 HG23 THR A 40 5.300 2.598 -1.563 1.00 0.00 H new ATOM 619 N ILE A 41 8.416 2.569 0.093 1.00 0.00 N ATOM 620 CA ILE A 41 9.038 1.354 0.610 1.00 0.00 C ATOM 621 C ILE A 41 8.206 0.178 0.109 1.00 0.00 C ATOM 622 O ILE A 41 6.981 0.244 0.196 1.00 0.00 O ATOM 623 CB ILE A 41 9.129 1.387 2.148 1.00 0.00 C ATOM 624 CG1 ILE A 41 10.080 2.518 2.582 1.00 0.00 C ATOM 625 CG2 ILE A 41 9.609 0.033 2.698 1.00 0.00 C ATOM 626 CD1 ILE A 41 10.162 2.693 4.103 1.00 0.00 C ATOM 0 H ILE A 41 7.848 3.078 0.770 1.00 0.00 H new ATOM 0 HA ILE A 41 10.064 1.261 0.255 1.00 0.00 H new ATOM 0 HB ILE A 41 8.137 1.578 2.557 1.00 0.00 H new ATOM 0 HG12 ILE A 41 11.077 2.314 2.193 1.00 0.00 H new ATOM 0 HG13 ILE A 41 9.748 3.454 2.133 1.00 0.00 H new ATOM 0 HG21 ILE A 41 9.665 0.081 3.785 1.00 0.00 H new ATOM 0 HG22 ILE A 41 8.907 -0.748 2.405 1.00 0.00 H new ATOM 0 HG23 ILE A 41 10.595 -0.195 2.294 1.00 0.00 H new ATOM 0 HD11 ILE A 41 10.849 3.506 4.339 1.00 0.00 H new ATOM 0 HD12 ILE A 41 9.173 2.928 4.496 1.00 0.00 H new ATOM 0 HD13 ILE A 41 10.523 1.770 4.557 1.00 0.00 H new ATOM 638 N ILE A 42 8.856 -0.873 -0.406 1.00 0.00 N ATOM 639 CA ILE A 42 8.245 -2.172 -0.657 1.00 0.00 C ATOM 640 C ILE A 42 9.162 -3.203 0.004 1.00 0.00 C ATOM 641 O ILE A 42 10.255 -3.454 -0.504 1.00 0.00 O ATOM 642 CB ILE A 42 8.079 -2.436 -2.166 1.00 0.00 C ATOM 643 CG1 ILE A 42 7.315 -1.289 -2.848 1.00 0.00 C ATOM 644 CG2 ILE A 42 7.344 -3.769 -2.369 1.00 0.00 C ATOM 645 CD1 ILE A 42 7.058 -1.522 -4.340 1.00 0.00 C ATOM 0 H ILE A 42 9.842 -0.837 -0.663 1.00 0.00 H new ATOM 0 HA ILE A 42 7.238 -2.223 -0.242 1.00 0.00 H new ATOM 0 HB ILE A 42 9.066 -2.492 -2.625 1.00 0.00 H new ATOM 0 HG12 ILE A 42 6.360 -1.149 -2.341 1.00 0.00 H new ATOM 0 HG13 ILE A 42 7.880 -0.365 -2.726 1.00 0.00 H new ATOM 0 HG21 ILE A 42 7.224 -3.960 -3.435 1.00 0.00 H new ATOM 0 HG22 ILE A 42 7.922 -4.576 -1.919 1.00 0.00 H new ATOM 0 HG23 ILE A 42 6.363 -3.719 -1.897 1.00 0.00 H new ATOM 0 HD11 ILE A 42 6.515 -0.672 -4.753 1.00 0.00 H new ATOM 0 HD12 ILE A 42 8.009 -1.632 -4.860 1.00 0.00 H new ATOM 0 HD13 ILE A 42 6.466 -2.428 -4.470 1.00 0.00 H new ATOM 657 N GLU A 43 8.748 -3.758 1.146 1.00 0.00 N ATOM 658 CA GLU A 43 9.588 -4.593 1.994 1.00 0.00 C ATOM 659 C GLU A 43 8.925 -5.955 2.219 1.00 0.00 C ATOM 660 O GLU A 43 7.931 -6.059 2.943 1.00 0.00 O ATOM 661 CB GLU A 43 9.847 -3.846 3.309 1.00 0.00 C ATOM 662 CG GLU A 43 10.721 -4.622 4.300 1.00 0.00 C ATOM 663 CD GLU A 43 10.611 -4.002 5.685 1.00 0.00 C ATOM 664 OE1 GLU A 43 9.528 -4.185 6.287 1.00 0.00 O ATOM 665 OE2 GLU A 43 11.587 -3.341 6.096 1.00 0.00 O ATOM 0 H GLU A 43 7.803 -3.635 1.509 1.00 0.00 H new ATOM 0 HA GLU A 43 10.547 -4.788 1.513 1.00 0.00 H new ATOM 0 HB2 GLU A 43 10.326 -2.893 3.086 1.00 0.00 H new ATOM 0 HB3 GLU A 43 8.891 -3.620 3.782 1.00 0.00 H new ATOM 0 HG2 GLU A 43 10.409 -5.666 4.334 1.00 0.00 H new ATOM 0 HG3 GLU A 43 11.759 -4.611 3.969 1.00 0.00 H new ATOM 672 N VAL A 44 9.474 -7.007 1.603 1.00 0.00 N ATOM 673 CA VAL A 44 9.102 -8.383 1.888 1.00 0.00 C ATOM 674 C VAL A 44 9.311 -8.659 3.382 1.00 0.00 C ATOM 675 O VAL A 44 10.428 -8.588 3.889 1.00 0.00 O ATOM 676 CB VAL A 44 9.834 -9.361 0.947 1.00 0.00 C ATOM 677 CG1 VAL A 44 11.350 -9.411 1.158 1.00 0.00 C ATOM 678 CG2 VAL A 44 9.262 -10.776 1.081 1.00 0.00 C ATOM 0 H VAL A 44 10.195 -6.919 0.887 1.00 0.00 H new ATOM 0 HA VAL A 44 8.044 -8.545 1.683 1.00 0.00 H new ATOM 0 HB VAL A 44 9.663 -8.974 -0.058 1.00 0.00 H new ATOM 0 HG11 VAL A 44 11.791 -10.121 0.459 1.00 0.00 H new ATOM 0 HG12 VAL A 44 11.774 -8.422 0.986 1.00 0.00 H new ATOM 0 HG13 VAL A 44 11.565 -9.726 2.179 1.00 0.00 H new ATOM 0 HG21 VAL A 44 9.794 -11.449 0.408 1.00 0.00 H new ATOM 0 HG22 VAL A 44 9.382 -11.121 2.108 1.00 0.00 H new ATOM 0 HG23 VAL A 44 8.203 -10.766 0.823 1.00 0.00 H new ATOM 688 N ASN A 45 8.214 -8.922 4.089 1.00 0.00 N ATOM 689 CA ASN A 45 8.187 -9.266 5.502 1.00 0.00 C ATOM 690 C ASN A 45 8.050 -10.781 5.629 1.00 0.00 C ATOM 691 O ASN A 45 7.800 -11.455 4.634 1.00 0.00 O ATOM 692 CB ASN A 45 7.033 -8.518 6.186 1.00 0.00 C ATOM 693 CG ASN A 45 7.495 -7.153 6.685 1.00 0.00 C ATOM 694 OD1 ASN A 45 7.496 -6.908 7.887 1.00 0.00 O ATOM 695 ND2 ASN A 45 7.921 -6.278 5.780 1.00 0.00 N ATOM 0 H ASN A 45 7.283 -8.899 3.672 1.00 0.00 H new ATOM 0 HA ASN A 45 9.109 -8.964 5.999 1.00 0.00 H new ATOM 0 HB2 ASN A 45 6.208 -8.394 5.485 1.00 0.00 H new ATOM 0 HB3 ASN A 45 6.656 -9.107 7.022 1.00 0.00 H new ATOM 0 HD21 ASN A 45 8.265 -5.365 6.076 1.00 0.00 H new ATOM 0 HD22 ASN A 45 7.904 -6.520 4.789 1.00 0.00 H new ATOM 702 N GLY A 46 8.227 -11.306 6.848 1.00 0.00 N ATOM 703 CA GLY A 46 8.300 -12.730 7.179 1.00 0.00 C ATOM 704 C GLY A 46 7.643 -13.663 6.160 1.00 0.00 C ATOM 705 O GLY A 46 8.328 -14.462 5.522 1.00 0.00 O ATOM 0 H GLY A 46 8.328 -10.714 7.673 1.00 0.00 H new ATOM 0 HA2 GLY A 46 9.348 -13.010 7.284 1.00 0.00 H new ATOM 0 HA3 GLY A 46 7.830 -12.887 8.150 1.00 0.00 H new ATOM 709 N ASP A 47 6.320 -13.561 6.014 1.00 0.00 N ATOM 710 CA ASP A 47 5.520 -14.334 5.077 1.00 0.00 C ATOM 711 C ASP A 47 4.841 -13.439 4.031 1.00 0.00 C ATOM 712 O ASP A 47 4.018 -13.946 3.269 1.00 0.00 O ATOM 713 CB ASP A 47 4.430 -15.053 5.883 1.00 0.00 C ATOM 714 CG ASP A 47 3.371 -14.058 6.337 1.00 0.00 C ATOM 715 OD1 ASP A 47 3.789 -13.003 6.869 1.00 0.00 O ATOM 716 OD2 ASP A 47 2.184 -14.336 6.068 1.00 0.00 O ATOM 0 H ASP A 47 5.761 -12.912 6.568 1.00 0.00 H new ATOM 0 HA ASP A 47 6.171 -15.032 4.550 1.00 0.00 H new ATOM 0 HB2 ASP A 47 3.971 -15.832 5.274 1.00 0.00 H new ATOM 0 HB3 ASP A 47 4.873 -15.545 6.749 1.00 0.00 H new ATOM 721 N THR A 48 5.121 -12.135 4.020 1.00 0.00 N ATOM 722 CA THR A 48 4.251 -11.079 3.502 1.00 0.00 C ATOM 723 C THR A 48 5.086 -10.027 2.769 1.00 0.00 C ATOM 724 O THR A 48 6.289 -10.193 2.590 1.00 0.00 O ATOM 725 CB THR A 48 3.491 -10.448 4.692 1.00 0.00 C ATOM 726 OG1 THR A 48 4.229 -10.573 5.907 1.00 0.00 O ATOM 727 CG2 THR A 48 2.071 -11.019 4.811 1.00 0.00 C ATOM 0 H THR A 48 5.999 -11.770 4.388 1.00 0.00 H new ATOM 0 HA THR A 48 3.535 -11.491 2.791 1.00 0.00 H new ATOM 0 HB THR A 48 3.388 -9.381 4.496 1.00 0.00 H new ATOM 0 HG1 THR A 48 4.047 -11.446 6.312 1.00 0.00 H new ATOM 0 HG21 THR A 48 1.562 -10.556 5.657 1.00 0.00 H new ATOM 0 HG22 THR A 48 1.517 -10.810 3.896 1.00 0.00 H new ATOM 0 HG23 THR A 48 2.124 -12.097 4.965 1.00 0.00 H new ATOM 735 N VAL A 49 4.475 -8.915 2.359 1.00 0.00 N ATOM 736 CA VAL A 49 5.193 -7.731 1.920 1.00 0.00 C ATOM 737 C VAL A 49 4.397 -6.502 2.351 1.00 0.00 C ATOM 738 O VAL A 49 3.171 -6.498 2.231 1.00 0.00 O ATOM 739 CB VAL A 49 5.479 -7.816 0.409 1.00 0.00 C ATOM 740 CG1 VAL A 49 4.226 -8.101 -0.415 1.00 0.00 C ATOM 741 CG2 VAL A 49 6.145 -6.549 -0.144 1.00 0.00 C ATOM 0 H VAL A 49 3.460 -8.816 2.324 1.00 0.00 H new ATOM 0 HA VAL A 49 6.174 -7.654 2.389 1.00 0.00 H new ATOM 0 HB VAL A 49 6.170 -8.654 0.311 1.00 0.00 H new ATOM 0 HG11 VAL A 49 4.489 -8.150 -1.472 1.00 0.00 H new ATOM 0 HG12 VAL A 49 3.795 -9.052 -0.104 1.00 0.00 H new ATOM 0 HG13 VAL A 49 3.499 -7.304 -0.258 1.00 0.00 H new ATOM 0 HG21 VAL A 49 6.322 -6.668 -1.213 1.00 0.00 H new ATOM 0 HG22 VAL A 49 5.492 -5.692 0.023 1.00 0.00 H new ATOM 0 HG23 VAL A 49 7.095 -6.386 0.365 1.00 0.00 H new ATOM 751 N ILE A 50 5.083 -5.487 2.886 1.00 0.00 N ATOM 752 CA ILE A 50 4.487 -4.204 3.245 1.00 0.00 C ATOM 753 C ILE A 50 4.880 -3.173 2.188 1.00 0.00 C ATOM 754 O ILE A 50 6.011 -3.200 1.700 1.00 0.00 O ATOM 755 CB ILE A 50 4.860 -3.803 4.685 1.00 0.00 C ATOM 756 CG1 ILE A 50 3.997 -2.627 5.171 1.00 0.00 C ATOM 757 CG2 ILE A 50 6.346 -3.471 4.829 1.00 0.00 C ATOM 758 CD1 ILE A 50 4.188 -2.352 6.664 1.00 0.00 C ATOM 0 H ILE A 50 6.082 -5.538 3.083 1.00 0.00 H new ATOM 0 HA ILE A 50 3.399 -4.271 3.249 1.00 0.00 H new ATOM 0 HB ILE A 50 4.658 -4.669 5.315 1.00 0.00 H new ATOM 0 HG12 ILE A 50 4.251 -1.732 4.603 1.00 0.00 H new ATOM 0 HG13 ILE A 50 2.947 -2.843 4.974 1.00 0.00 H new ATOM 0 HG21 ILE A 50 6.559 -3.194 5.862 1.00 0.00 H new ATOM 0 HG22 ILE A 50 6.942 -4.342 4.557 1.00 0.00 H new ATOM 0 HG23 ILE A 50 6.598 -2.639 4.171 1.00 0.00 H new ATOM 0 HD11 ILE A 50 3.559 -1.513 6.963 1.00 0.00 H new ATOM 0 HD12 ILE A 50 3.909 -3.237 7.236 1.00 0.00 H new ATOM 0 HD13 ILE A 50 5.233 -2.109 6.859 1.00 0.00 H new ATOM 770 N ILE A 51 3.938 -2.301 1.818 1.00 0.00 N ATOM 771 CA ILE A 51 4.116 -1.215 0.869 1.00 0.00 C ATOM 772 C ILE A 51 3.701 0.096 1.548 1.00 0.00 C ATOM 773 O ILE A 51 2.596 0.186 2.086 1.00 0.00 O ATOM 774 CB ILE A 51 3.367 -1.505 -0.449 1.00 0.00 C ATOM 775 CG1 ILE A 51 3.550 -0.332 -1.428 1.00 0.00 C ATOM 776 CG2 ILE A 51 1.876 -1.811 -0.245 1.00 0.00 C ATOM 777 CD1 ILE A 51 3.224 -0.715 -2.876 1.00 0.00 C ATOM 0 H ILE A 51 2.990 -2.341 2.193 1.00 0.00 H new ATOM 0 HA ILE A 51 5.163 -1.119 0.581 1.00 0.00 H new ATOM 0 HB ILE A 51 3.808 -2.408 -0.871 1.00 0.00 H new ATOM 0 HG12 ILE A 51 2.909 0.495 -1.122 1.00 0.00 H new ATOM 0 HG13 ILE A 51 4.579 0.025 -1.373 1.00 0.00 H new ATOM 0 HG21 ILE A 51 1.409 -2.006 -1.211 1.00 0.00 H new ATOM 0 HG22 ILE A 51 1.769 -2.688 0.393 1.00 0.00 H new ATOM 0 HG23 ILE A 51 1.391 -0.957 0.227 1.00 0.00 H new ATOM 0 HD11 ILE A 51 3.370 0.150 -3.523 1.00 0.00 H new ATOM 0 HD12 ILE A 51 3.882 -1.523 -3.196 1.00 0.00 H new ATOM 0 HD13 ILE A 51 2.187 -1.045 -2.940 1.00 0.00 H new ATOM 789 N LYS A 52 4.595 1.093 1.551 1.00 0.00 N ATOM 790 CA LYS A 52 4.400 2.357 2.253 1.00 0.00 C ATOM 791 C LYS A 52 4.799 3.513 1.337 1.00 0.00 C ATOM 792 O LYS A 52 5.985 3.739 1.093 1.00 0.00 O ATOM 793 CB LYS A 52 5.214 2.340 3.552 1.00 0.00 C ATOM 794 CG LYS A 52 4.732 3.397 4.549 1.00 0.00 C ATOM 795 CD LYS A 52 5.571 3.294 5.831 1.00 0.00 C ATOM 796 CE LYS A 52 4.931 4.064 7.000 1.00 0.00 C ATOM 797 NZ LYS A 52 4.866 3.250 8.234 1.00 0.00 N ATOM 0 H LYS A 52 5.486 1.038 1.057 1.00 0.00 H new ATOM 0 HA LYS A 52 3.351 2.494 2.517 1.00 0.00 H new ATOM 0 HB2 LYS A 52 5.145 1.353 4.009 1.00 0.00 H new ATOM 0 HB3 LYS A 52 6.266 2.512 3.322 1.00 0.00 H new ATOM 0 HG2 LYS A 52 4.826 4.393 4.117 1.00 0.00 H new ATOM 0 HG3 LYS A 52 3.677 3.247 4.777 1.00 0.00 H new ATOM 0 HD2 LYS A 52 5.686 2.246 6.106 1.00 0.00 H new ATOM 0 HD3 LYS A 52 6.571 3.685 5.643 1.00 0.00 H new ATOM 0 HE2 LYS A 52 5.505 4.970 7.194 1.00 0.00 H new ATOM 0 HE3 LYS A 52 3.925 4.377 6.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 3.933 3.367 8.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 5.013 2.248 7.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 5.606 3.562 8.895 1.00 0.00 H new ATOM 811 N THR A 53 3.814 4.240 0.811 1.00 0.00 N ATOM 812 CA THR A 53 3.945 5.077 -0.378 1.00 0.00 C ATOM 813 C THR A 53 4.495 6.482 -0.075 1.00 0.00 C ATOM 814 O THR A 53 4.025 7.469 -0.638 1.00 0.00 O ATOM 815 CB THR A 53 2.569 5.093 -1.082 1.00 0.00 C ATOM 816 OG1 THR A 53 1.670 4.177 -0.474 1.00 0.00 O ATOM 817 CG2 THR A 53 2.723 4.683 -2.545 1.00 0.00 C ATOM 0 H THR A 53 2.877 4.263 1.213 1.00 0.00 H new ATOM 0 HA THR A 53 4.695 4.655 -1.047 1.00 0.00 H new ATOM 0 HB THR A 53 2.176 6.106 -1.000 1.00 0.00 H new ATOM 0 HG1 THR A 53 0.902 4.665 -0.110 1.00 0.00 H new ATOM 0 HG21 THR A 53 1.748 4.698 -3.032 1.00 0.00 H new ATOM 0 HG22 THR A 53 3.391 5.381 -3.050 1.00 0.00 H new ATOM 0 HG23 THR A 53 3.140 3.678 -2.599 1.00 0.00 H new ATOM 825 N GLN A 54 5.458 6.574 0.846 1.00 0.00 N ATOM 826 CA GLN A 54 5.878 7.812 1.502 1.00 0.00 C ATOM 827 C GLN A 54 6.031 9.005 0.544 1.00 0.00 C ATOM 828 O GLN A 54 6.827 8.957 -0.394 1.00 0.00 O ATOM 829 CB GLN A 54 7.172 7.571 2.283 1.00 0.00 C ATOM 830 CG GLN A 54 7.002 6.479 3.347 1.00 0.00 C ATOM 831 CD GLN A 54 8.243 6.371 4.222 1.00 0.00 C ATOM 832 OE1 GLN A 54 9.190 5.676 3.878 1.00 0.00 O ATOM 833 NE2 GLN A 54 8.251 7.053 5.363 1.00 0.00 N ATOM 0 H GLN A 54 5.984 5.760 1.165 1.00 0.00 H new ATOM 0 HA GLN A 54 5.076 8.090 2.186 1.00 0.00 H new ATOM 0 HB2 GLN A 54 7.965 7.285 1.592 1.00 0.00 H new ATOM 0 HB3 GLN A 54 7.486 8.499 2.762 1.00 0.00 H new ATOM 0 HG2 GLN A 54 6.134 6.703 3.967 1.00 0.00 H new ATOM 0 HG3 GLN A 54 6.810 5.522 2.863 1.00 0.00 H new ATOM 0 HE21 GLN A 54 7.446 7.624 5.622 1.00 0.00 H new ATOM 0 HE22 GLN A 54 9.062 7.006 5.980 1.00 0.00 H new ATOM 842 N SER A 55 5.283 10.088 0.802 1.00 0.00 N ATOM 843 CA SER A 55 5.257 11.265 -0.057 1.00 0.00 C ATOM 844 C SER A 55 5.183 12.530 0.793 1.00 0.00 C ATOM 845 O SER A 55 4.208 13.274 0.714 1.00 0.00 O ATOM 846 CB SER A 55 4.083 11.158 -1.036 1.00 0.00 C ATOM 847 OG SER A 55 4.296 12.037 -2.116 1.00 0.00 O ATOM 0 H SER A 55 4.678 10.165 1.619 1.00 0.00 H new ATOM 0 HA SER A 55 6.175 11.321 -0.642 1.00 0.00 H new ATOM 0 HB2 SER A 55 3.989 10.134 -1.398 1.00 0.00 H new ATOM 0 HB3 SER A 55 3.149 11.404 -0.530 1.00 0.00 H new ATOM 0 HG SER A 55 4.956 12.715 -1.861 1.00 0.00 H new ATOM 853 N THR A 56 6.229 12.742 1.597 1.00 0.00 N ATOM 854 CA THR A 56 6.372 13.871 2.507 1.00 0.00 C ATOM 855 C THR A 56 5.432 13.700 3.704 1.00 0.00 C ATOM 856 O THR A 56 4.236 13.466 3.544 1.00 0.00 O ATOM 857 CB THR A 56 6.173 15.211 1.777 1.00 0.00 C ATOM 858 OG1 THR A 56 6.861 15.194 0.541 1.00 0.00 O ATOM 859 CG2 THR A 56 6.740 16.374 2.592 1.00 0.00 C ATOM 0 H THR A 56 7.026 12.106 1.630 1.00 0.00 H new ATOM 0 HA THR A 56 7.392 13.890 2.892 1.00 0.00 H new ATOM 0 HB THR A 56 5.101 15.344 1.632 1.00 0.00 H new ATOM 0 HG1 THR A 56 6.729 16.049 0.081 1.00 0.00 H new ATOM 0 HG21 THR A 56 6.585 17.307 2.051 1.00 0.00 H new ATOM 0 HG22 THR A 56 6.233 16.424 3.555 1.00 0.00 H new ATOM 0 HG23 THR A 56 7.807 16.220 2.751 1.00 0.00 H new ATOM 867 N PHE A 57 5.981 13.759 4.921 1.00 0.00 N ATOM 868 CA PHE A 57 5.255 13.585 6.177 1.00 0.00 C ATOM 869 C PHE A 57 4.858 12.121 6.411 1.00 0.00 C ATOM 870 O PHE A 57 5.136 11.565 7.476 1.00 0.00 O ATOM 871 CB PHE A 57 4.039 14.523 6.281 1.00 0.00 C ATOM 872 CG PHE A 57 4.273 15.946 5.804 1.00 0.00 C ATOM 873 CD1 PHE A 57 5.187 16.777 6.476 1.00 0.00 C ATOM 874 CD2 PHE A 57 3.580 16.436 4.681 1.00 0.00 C ATOM 875 CE1 PHE A 57 5.407 18.091 6.027 1.00 0.00 C ATOM 876 CE2 PHE A 57 3.793 17.752 4.239 1.00 0.00 C ATOM 877 CZ PHE A 57 4.707 18.580 4.911 1.00 0.00 C ATOM 0 H PHE A 57 6.976 13.935 5.061 1.00 0.00 H new ATOM 0 HA PHE A 57 5.943 13.866 6.974 1.00 0.00 H new ATOM 0 HB2 PHE A 57 3.220 14.094 5.704 1.00 0.00 H new ATOM 0 HB3 PHE A 57 3.714 14.555 7.321 1.00 0.00 H new ATOM 0 HD1 PHE A 57 5.721 16.405 7.338 1.00 0.00 H new ATOM 0 HD2 PHE A 57 2.883 15.798 4.158 1.00 0.00 H new ATOM 0 HE1 PHE A 57 6.115 18.725 6.540 1.00 0.00 H new ATOM 0 HE2 PHE A 57 3.254 18.127 3.382 1.00 0.00 H new ATOM 0 HZ PHE A 57 4.872 19.592 4.570 1.00 0.00 H new ATOM 887 N LYS A 58 4.176 11.488 5.453 1.00 0.00 N ATOM 888 CA LYS A 58 3.716 10.110 5.532 1.00 0.00 C ATOM 889 C LYS A 58 3.261 9.693 4.127 1.00 0.00 C ATOM 890 O LYS A 58 3.575 10.373 3.150 1.00 0.00 O ATOM 891 CB LYS A 58 2.577 10.016 6.574 1.00 0.00 C ATOM 892 CG LYS A 58 2.468 8.635 7.246 1.00 0.00 C ATOM 893 CD LYS A 58 2.211 8.714 8.760 1.00 0.00 C ATOM 894 CE LYS A 58 3.476 8.929 9.613 1.00 0.00 C ATOM 895 NZ LYS A 58 4.035 10.296 9.529 1.00 0.00 N ATOM 0 H LYS A 58 3.923 11.940 4.574 1.00 0.00 H new ATOM 0 HA LYS A 58 4.506 9.433 5.858 1.00 0.00 H new ATOM 0 HB2 LYS A 58 2.735 10.773 7.342 1.00 0.00 H new ATOM 0 HB3 LYS A 58 1.630 10.249 6.087 1.00 0.00 H new ATOM 0 HG2 LYS A 58 1.661 8.073 6.776 1.00 0.00 H new ATOM 0 HG3 LYS A 58 3.389 8.079 7.069 1.00 0.00 H new ATOM 0 HD2 LYS A 58 1.514 9.529 8.955 1.00 0.00 H new ATOM 0 HD3 LYS A 58 1.724 7.794 9.081 1.00 0.00 H new ATOM 0 HE2 LYS A 58 3.241 8.707 10.654 1.00 0.00 H new ATOM 0 HE3 LYS A 58 4.239 8.216 9.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 4.688 10.453 10.323 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 4.549 10.407 8.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 3.262 10.990 9.573 1.00 0.00 H new ATOM 909 N ASN A 59 2.502 8.599 4.040 1.00 0.00 N ATOM 910 CA ASN A 59 1.499 8.345 3.014 1.00 0.00 C ATOM 911 C ASN A 59 0.711 7.116 3.473 1.00 0.00 C ATOM 912 O ASN A 59 0.887 6.678 4.612 1.00 0.00 O ATOM 913 CB ASN A 59 2.109 8.125 1.620 1.00 0.00 C ATOM 914 CG ASN A 59 1.144 8.521 0.501 1.00 0.00 C ATOM 915 OD1 ASN A 59 -0.065 8.581 0.699 1.00 0.00 O ATOM 916 ND2 ASN A 59 1.669 8.803 -0.684 1.00 0.00 N ATOM 0 H ASN A 59 2.576 7.836 4.713 1.00 0.00 H new ATOM 0 HA ASN A 59 0.855 9.217 2.904 1.00 0.00 H new ATOM 0 HB2 ASN A 59 3.026 8.707 1.530 1.00 0.00 H new ATOM 0 HB3 ASN A 59 2.384 7.076 1.507 1.00 0.00 H new ATOM 0 HD21 ASN A 59 1.064 9.078 -1.458 1.00 0.00 H new ATOM 0 HD22 ASN A 59 2.678 8.745 -0.822 1.00 0.00 H new ATOM 923 N THR A 60 -0.109 6.545 2.593 1.00 0.00 N ATOM 924 CA THR A 60 -0.774 5.269 2.774 1.00 0.00 C ATOM 925 C THR A 60 0.239 4.163 3.094 1.00 0.00 C ATOM 926 O THR A 60 1.366 4.189 2.592 1.00 0.00 O ATOM 927 CB THR A 60 -1.513 4.952 1.467 1.00 0.00 C ATOM 928 OG1 THR A 60 -0.653 5.232 0.380 1.00 0.00 O ATOM 929 CG2 THR A 60 -2.764 5.811 1.308 1.00 0.00 C ATOM 0 H THR A 60 -0.333 6.982 1.699 1.00 0.00 H new ATOM 0 HA THR A 60 -1.469 5.321 3.612 1.00 0.00 H new ATOM 0 HB THR A 60 -1.806 3.902 1.490 1.00 0.00 H new ATOM 0 HG1 THR A 60 -1.114 5.032 -0.462 1.00 0.00 H new ATOM 0 HG21 THR A 60 -3.262 5.559 0.371 1.00 0.00 H new ATOM 0 HG22 THR A 60 -3.442 5.624 2.141 1.00 0.00 H new ATOM 0 HG23 THR A 60 -2.483 6.864 1.298 1.00 0.00 H new ATOM 937 N GLU A 61 -0.194 3.189 3.899 1.00 0.00 N ATOM 938 CA GLU A 61 0.561 2.012 4.286 1.00 0.00 C ATOM 939 C GLU A 61 -0.381 0.818 4.150 1.00 0.00 C ATOM 940 O GLU A 61 -1.462 0.840 4.736 1.00 0.00 O ATOM 941 CB GLU A 61 1.052 2.202 5.727 1.00 0.00 C ATOM 942 CG GLU A 61 1.964 1.060 6.192 1.00 0.00 C ATOM 943 CD GLU A 61 2.809 1.475 7.385 1.00 0.00 C ATOM 944 OE1 GLU A 61 2.435 2.428 8.106 1.00 0.00 O ATOM 945 OE2 GLU A 61 3.948 0.968 7.498 1.00 0.00 O ATOM 0 H GLU A 61 -1.126 3.208 4.314 1.00 0.00 H new ATOM 0 HA GLU A 61 1.438 1.848 3.660 1.00 0.00 H new ATOM 0 HB2 GLU A 61 1.591 3.147 5.802 1.00 0.00 H new ATOM 0 HB3 GLU A 61 0.193 2.271 6.394 1.00 0.00 H new ATOM 0 HG2 GLU A 61 1.358 0.194 6.457 1.00 0.00 H new ATOM 0 HG3 GLU A 61 2.614 0.755 5.372 1.00 0.00 H new ATOM 952 N ILE A 62 -0.006 -0.181 3.347 1.00 0.00 N ATOM 953 CA ILE A 62 -0.778 -1.398 3.123 1.00 0.00 C ATOM 954 C ILE A 62 0.215 -2.555 3.217 1.00 0.00 C ATOM 955 O ILE A 62 1.413 -2.351 3.035 1.00 0.00 O ATOM 956 CB ILE A 62 -1.488 -1.343 1.749 1.00 0.00 C ATOM 957 CG1 ILE A 62 -2.502 -0.186 1.669 1.00 0.00 C ATOM 958 CG2 ILE A 62 -2.217 -2.652 1.408 1.00 0.00 C ATOM 959 CD1 ILE A 62 -1.905 1.047 0.985 1.00 0.00 C ATOM 0 H ILE A 62 0.868 -0.161 2.822 1.00 0.00 H new ATOM 0 HA ILE A 62 -1.570 -1.522 3.862 1.00 0.00 H new ATOM 0 HB ILE A 62 -0.691 -1.182 1.023 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -3.385 -0.514 1.121 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -2.831 0.079 2.674 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -2.697 -2.558 0.434 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -1.499 -3.472 1.381 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -2.972 -2.856 2.167 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -2.652 1.840 0.949 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -1.037 1.391 1.548 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -1.600 0.789 -0.029 1.00 0.00 H new ATOM 971 N SER A 63 -0.255 -3.773 3.486 1.00 0.00 N ATOM 972 CA SER A 63 0.544 -4.972 3.298 1.00 0.00 C ATOM 973 C SER A 63 -0.270 -5.967 2.489 1.00 0.00 C ATOM 974 O SER A 63 -1.487 -5.825 2.388 1.00 0.00 O ATOM 975 CB SER A 63 1.003 -5.537 4.648 1.00 0.00 C ATOM 976 OG SER A 63 -0.092 -5.659 5.534 1.00 0.00 O ATOM 0 H SER A 63 -1.196 -3.950 3.838 1.00 0.00 H new ATOM 0 HA SER A 63 1.455 -4.742 2.746 1.00 0.00 H new ATOM 0 HB2 SER A 63 1.469 -6.511 4.501 1.00 0.00 H new ATOM 0 HB3 SER A 63 1.759 -4.884 5.084 1.00 0.00 H new ATOM 0 HG SER A 63 0.218 -6.022 6.390 1.00 0.00 H new ATOM 982 N PHE A 64 0.408 -6.929 1.867 1.00 0.00 N ATOM 983 CA PHE A 64 -0.210 -7.964 1.065 1.00 0.00 C ATOM 984 C PHE A 64 0.701 -9.186 1.057 1.00 0.00 C ATOM 985 O PHE A 64 1.761 -9.182 1.688 1.00 0.00 O ATOM 986 CB PHE A 64 -0.535 -7.428 -0.339 1.00 0.00 C ATOM 987 CG PHE A 64 0.648 -6.981 -1.179 1.00 0.00 C ATOM 988 CD1 PHE A 64 1.316 -7.901 -2.004 1.00 0.00 C ATOM 989 CD2 PHE A 64 1.054 -5.634 -1.173 1.00 0.00 C ATOM 990 CE1 PHE A 64 2.355 -7.474 -2.847 1.00 0.00 C ATOM 991 CE2 PHE A 64 2.143 -5.221 -1.960 1.00 0.00 C ATOM 992 CZ PHE A 64 2.808 -6.146 -2.783 1.00 0.00 C ATOM 0 H PHE A 64 1.424 -7.006 1.912 1.00 0.00 H new ATOM 0 HA PHE A 64 -1.164 -8.271 1.493 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -1.069 -8.205 -0.886 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -1.218 -6.585 -0.234 1.00 0.00 H new ATOM 0 HD1 PHE A 64 1.029 -8.942 -1.990 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.528 -4.915 -0.562 1.00 0.00 H new ATOM 0 HE1 PHE A 64 2.805 -8.166 -3.544 1.00 0.00 H new ATOM 0 HE2 PHE A 64 2.469 -4.192 -1.932 1.00 0.00 H new ATOM 0 HZ PHE A 64 3.664 -5.837 -3.364 1.00 0.00 H new ATOM 1002 N LYS A 65 0.275 -10.245 0.366 1.00 0.00 N ATOM 1003 CA LYS A 65 0.980 -11.510 0.325 1.00 0.00 C ATOM 1004 C LYS A 65 0.785 -12.113 -1.059 1.00 0.00 C ATOM 1005 O LYS A 65 -0.344 -12.230 -1.529 1.00 0.00 O ATOM 1006 CB LYS A 65 0.413 -12.417 1.425 1.00 0.00 C ATOM 1007 CG LYS A 65 1.319 -13.595 1.793 1.00 0.00 C ATOM 1008 CD LYS A 65 1.261 -14.776 0.814 1.00 0.00 C ATOM 1009 CE LYS A 65 1.621 -16.094 1.513 1.00 0.00 C ATOM 1010 NZ LYS A 65 2.968 -16.062 2.118 1.00 0.00 N ATOM 0 H LYS A 65 -0.583 -10.239 -0.186 1.00 0.00 H new ATOM 0 HA LYS A 65 2.048 -11.386 0.503 1.00 0.00 H new ATOM 0 HB2 LYS A 65 0.233 -11.818 2.318 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -0.553 -12.803 1.100 1.00 0.00 H new ATOM 0 HG2 LYS A 65 2.348 -13.240 1.853 1.00 0.00 H new ATOM 0 HG3 LYS A 65 1.046 -13.950 2.787 1.00 0.00 H new ATOM 0 HD2 LYS A 65 0.261 -14.849 0.387 1.00 0.00 H new ATOM 0 HD3 LYS A 65 1.949 -14.600 -0.013 1.00 0.00 H new ATOM 0 HE2 LYS A 65 0.883 -16.305 2.287 1.00 0.00 H new ATOM 0 HE3 LYS A 65 1.569 -16.910 0.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 3.118 -16.926 2.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 3.685 -16.007 1.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 3.051 -15.230 2.737 1.00 0.00 H new ATOM 1024 N LEU A 66 1.884 -12.491 -1.709 1.00 0.00 N ATOM 1025 CA LEU A 66 1.878 -13.251 -2.950 1.00 0.00 C ATOM 1026 C LEU A 66 1.275 -14.643 -2.712 1.00 0.00 C ATOM 1027 O LEU A 66 2.000 -15.630 -2.628 1.00 0.00 O ATOM 1028 CB LEU A 66 3.302 -13.310 -3.538 1.00 0.00 C ATOM 1029 CG LEU A 66 4.399 -13.628 -2.498 1.00 0.00 C ATOM 1030 CD1 LEU A 66 5.394 -14.675 -3.013 1.00 0.00 C ATOM 1031 CD2 LEU A 66 5.188 -12.361 -2.133 1.00 0.00 C ATOM 0 H LEU A 66 2.823 -12.271 -1.377 1.00 0.00 H new ATOM 0 HA LEU A 66 1.248 -12.754 -3.687 1.00 0.00 H new ATOM 0 HB2 LEU A 66 3.329 -14.067 -4.322 1.00 0.00 H new ATOM 0 HB3 LEU A 66 3.529 -12.354 -4.010 1.00 0.00 H new ATOM 0 HG LEU A 66 3.885 -14.023 -1.621 1.00 0.00 H new ATOM 0 HD11 LEU A 66 6.147 -14.868 -2.249 1.00 0.00 H new ATOM 0 HD12 LEU A 66 4.864 -15.600 -3.241 1.00 0.00 H new ATOM 0 HD13 LEU A 66 5.879 -14.303 -3.915 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.955 -12.609 -1.399 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.660 -11.956 -3.028 1.00 0.00 H new ATOM 0 HD23 LEU A 66 4.510 -11.619 -1.712 1.00 0.00 H new ATOM 1043 N GLY A 67 -0.054 -14.711 -2.589 1.00 0.00 N ATOM 1044 CA GLY A 67 -0.827 -15.941 -2.481 1.00 0.00 C ATOM 1045 C GLY A 67 -1.748 -15.906 -1.263 1.00 0.00 C ATOM 1046 O GLY A 67 -1.619 -16.759 -0.388 1.00 0.00 O ATOM 0 H GLY A 67 -0.639 -13.876 -2.561 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.419 -16.082 -3.385 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -0.152 -16.793 -2.406 1.00 0.00 H new ATOM 1050 N VAL A 68 -2.660 -14.929 -1.190 1.00 0.00 N ATOM 1051 CA VAL A 68 -3.680 -14.853 -0.140 1.00 0.00 C ATOM 1052 C VAL A 68 -4.719 -13.793 -0.524 1.00 0.00 C ATOM 1053 O VAL A 68 -4.471 -13.014 -1.448 1.00 0.00 O ATOM 1054 CB VAL A 68 -3.030 -14.612 1.250 1.00 0.00 C ATOM 1055 CG1 VAL A 68 -3.180 -13.183 1.788 1.00 0.00 C ATOM 1056 CG2 VAL A 68 -3.569 -15.598 2.293 1.00 0.00 C ATOM 0 H VAL A 68 -2.710 -14.164 -1.863 1.00 0.00 H new ATOM 0 HA VAL A 68 -4.203 -15.805 -0.054 1.00 0.00 H new ATOM 0 HB VAL A 68 -1.965 -14.775 1.083 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -2.696 -13.108 2.762 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -2.712 -12.483 1.096 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -4.238 -12.941 1.889 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -3.095 -15.404 3.255 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -4.648 -15.474 2.388 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -3.348 -16.618 1.978 1.00 0.00 H new ATOM 1066 N GLU A 69 -5.856 -13.741 0.185 1.00 0.00 N ATOM 1067 CA GLU A 69 -6.815 -12.648 0.086 1.00 0.00 C ATOM 1068 C GLU A 69 -7.186 -12.124 1.475 1.00 0.00 C ATOM 1069 O GLU A 69 -7.071 -12.858 2.456 1.00 0.00 O ATOM 1070 CB GLU A 69 -8.037 -13.054 -0.754 1.00 0.00 C ATOM 1071 CG GLU A 69 -9.029 -14.045 -0.136 1.00 0.00 C ATOM 1072 CD GLU A 69 -10.343 -13.984 -0.913 1.00 0.00 C ATOM 1073 OE1 GLU A 69 -10.449 -14.698 -1.932 1.00 0.00 O ATOM 1074 OE2 GLU A 69 -11.200 -13.163 -0.514 1.00 0.00 O ATOM 0 H GLU A 69 -6.132 -14.466 0.847 1.00 0.00 H new ATOM 0 HA GLU A 69 -6.347 -11.819 -0.444 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -8.585 -12.147 -1.010 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -7.674 -13.481 -1.689 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -8.620 -15.055 -0.166 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -9.200 -13.802 0.913 1.00 0.00 H new ATOM 1081 N PHE A 70 -7.568 -10.844 1.566 1.00 0.00 N ATOM 1082 CA PHE A 70 -7.802 -10.136 2.824 1.00 0.00 C ATOM 1083 C PHE A 70 -8.402 -8.751 2.533 1.00 0.00 C ATOM 1084 O PHE A 70 -8.387 -8.297 1.388 1.00 0.00 O ATOM 1085 CB PHE A 70 -6.500 -10.025 3.640 1.00 0.00 C ATOM 1086 CG PHE A 70 -5.414 -9.212 2.964 1.00 0.00 C ATOM 1087 CD1 PHE A 70 -4.671 -9.762 1.904 1.00 0.00 C ATOM 1088 CD2 PHE A 70 -5.240 -7.861 3.305 1.00 0.00 C ATOM 1089 CE1 PHE A 70 -3.842 -8.942 1.125 1.00 0.00 C ATOM 1090 CE2 PHE A 70 -4.450 -7.030 2.498 1.00 0.00 C ATOM 1091 CZ PHE A 70 -3.786 -7.563 1.384 1.00 0.00 C ATOM 0 H PHE A 70 -7.726 -10.260 0.745 1.00 0.00 H new ATOM 0 HA PHE A 70 -8.513 -10.702 3.426 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -6.727 -9.576 4.607 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -6.120 -11.028 3.836 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -4.739 -10.818 1.690 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -5.715 -7.462 4.189 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -3.249 -9.369 0.330 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -4.353 -5.981 2.734 1.00 0.00 H new ATOM 0 HZ PHE A 70 -3.231 -6.912 0.725 1.00 0.00 H new ATOM 1101 N ASP A 71 -8.984 -8.102 3.552 1.00 0.00 N ATOM 1102 CA ASP A 71 -9.547 -6.758 3.416 1.00 0.00 C ATOM 1103 C ASP A 71 -8.424 -5.727 3.297 1.00 0.00 C ATOM 1104 O ASP A 71 -7.458 -5.768 4.057 1.00 0.00 O ATOM 1105 CB ASP A 71 -10.466 -6.421 4.595 1.00 0.00 C ATOM 1106 CG ASP A 71 -11.165 -5.079 4.375 1.00 0.00 C ATOM 1107 OD1 ASP A 71 -10.493 -4.035 4.540 1.00 0.00 O ATOM 1108 OD2 ASP A 71 -12.367 -5.128 4.033 1.00 0.00 O ATOM 0 H ASP A 71 -9.076 -8.495 4.489 1.00 0.00 H new ATOM 0 HA ASP A 71 -10.149 -6.730 2.507 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -11.210 -7.208 4.718 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -9.885 -6.386 5.516 1.00 0.00 H new ATOM 1113 N GLU A 72 -8.550 -4.830 2.324 1.00 0.00 N ATOM 1114 CA GLU A 72 -7.596 -3.801 1.971 1.00 0.00 C ATOM 1115 C GLU A 72 -8.328 -2.458 2.060 1.00 0.00 C ATOM 1116 O GLU A 72 -8.880 -1.958 1.082 1.00 0.00 O ATOM 1117 CB GLU A 72 -7.070 -4.130 0.569 1.00 0.00 C ATOM 1118 CG GLU A 72 -6.070 -3.110 0.006 1.00 0.00 C ATOM 1119 CD GLU A 72 -5.618 -3.494 -1.394 1.00 0.00 C ATOM 1120 OE1 GLU A 72 -6.300 -4.347 -2.013 1.00 0.00 O ATOM 1121 OE2 GLU A 72 -4.558 -3.003 -1.829 1.00 0.00 O ATOM 0 H GLU A 72 -9.377 -4.807 1.727 1.00 0.00 H new ATOM 0 HA GLU A 72 -6.734 -3.748 2.636 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -6.594 -5.110 0.595 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -7.916 -4.205 -0.114 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -6.529 -2.122 -0.016 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -5.204 -3.045 0.665 1.00 0.00 H new ATOM 1128 N THR A 73 -8.340 -1.878 3.258 1.00 0.00 N ATOM 1129 CA THR A 73 -8.901 -0.561 3.504 1.00 0.00 C ATOM 1130 C THR A 73 -7.818 0.503 3.299 1.00 0.00 C ATOM 1131 O THR A 73 -6.910 0.592 4.122 1.00 0.00 O ATOM 1132 CB THR A 73 -9.518 -0.547 4.909 1.00 0.00 C ATOM 1133 OG1 THR A 73 -10.619 -1.423 4.972 1.00 0.00 O ATOM 1134 CG2 THR A 73 -10.113 0.804 5.266 1.00 0.00 C ATOM 0 H THR A 73 -7.954 -2.319 4.093 1.00 0.00 H new ATOM 0 HA THR A 73 -9.698 -0.327 2.798 1.00 0.00 H new ATOM 0 HB THR A 73 -8.704 -0.820 5.580 1.00 0.00 H new ATOM 0 HG1 THR A 73 -10.300 -2.342 5.093 1.00 0.00 H new ATOM 0 HG21 THR A 73 -10.537 0.761 6.269 1.00 0.00 H new ATOM 0 HG22 THR A 73 -9.333 1.565 5.233 1.00 0.00 H new ATOM 0 HG23 THR A 73 -10.897 1.057 4.552 1.00 0.00 H new ATOM 1142 N THR A 74 -7.905 1.303 2.224 1.00 0.00 N ATOM 1143 CA THR A 74 -6.938 2.368 1.939 1.00 0.00 C ATOM 1144 C THR A 74 -7.621 3.695 1.596 1.00 0.00 C ATOM 1145 O THR A 74 -8.774 3.733 1.161 1.00 0.00 O ATOM 1146 CB THR A 74 -5.949 1.932 0.847 1.00 0.00 C ATOM 1147 OG1 THR A 74 -4.952 2.924 0.683 1.00 0.00 O ATOM 1148 CG2 THR A 74 -6.629 1.641 -0.492 1.00 0.00 C ATOM 0 H THR A 74 -8.649 1.227 1.530 1.00 0.00 H new ATOM 0 HA THR A 74 -6.369 2.545 2.852 1.00 0.00 H new ATOM 0 HB THR A 74 -5.497 0.997 1.177 1.00 0.00 H new ATOM 0 HG1 THR A 74 -5.260 3.593 0.037 1.00 0.00 H new ATOM 0 HG21 THR A 74 -5.879 1.338 -1.223 1.00 0.00 H new ATOM 0 HG22 THR A 74 -7.356 0.839 -0.364 1.00 0.00 H new ATOM 0 HG23 THR A 74 -7.137 2.538 -0.845 1.00 0.00 H new ATOM 1156 N ALA A 75 -6.885 4.799 1.774 1.00 0.00 N ATOM 1157 CA ALA A 75 -7.368 6.170 1.643 1.00 0.00 C ATOM 1158 C ALA A 75 -7.444 6.607 0.176 1.00 0.00 C ATOM 1159 O ALA A 75 -6.980 7.691 -0.192 1.00 0.00 O ATOM 1160 CB ALA A 75 -6.477 7.102 2.471 1.00 0.00 C ATOM 0 H ALA A 75 -5.897 4.754 2.023 1.00 0.00 H new ATOM 0 HA ALA A 75 -8.386 6.224 2.029 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -6.835 8.127 2.376 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -6.511 6.802 3.518 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -5.451 7.041 2.109 1.00 0.00 H new ATOM 1166 N ASP A 76 -8.062 5.770 -0.653 1.00 0.00 N ATOM 1167 CA ASP A 76 -8.129 5.914 -2.096 1.00 0.00 C ATOM 1168 C ASP A 76 -9.097 4.850 -2.616 1.00 0.00 C ATOM 1169 O ASP A 76 -10.286 5.134 -2.760 1.00 0.00 O ATOM 1170 CB ASP A 76 -6.726 5.862 -2.730 1.00 0.00 C ATOM 1171 CG ASP A 76 -5.892 4.686 -2.241 1.00 0.00 C ATOM 1172 OD1 ASP A 76 -5.277 4.806 -1.160 1.00 0.00 O ATOM 1173 OD2 ASP A 76 -5.942 3.650 -2.931 1.00 0.00 O ATOM 0 H ASP A 76 -8.549 4.939 -0.318 1.00 0.00 H new ATOM 0 HA ASP A 76 -8.512 6.893 -2.383 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -6.826 5.803 -3.814 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -6.199 6.790 -2.508 1.00 0.00 H new ATOM 1178 N ASP A 77 -8.655 3.612 -2.840 1.00 0.00 N ATOM 1179 CA ASP A 77 -9.565 2.557 -3.259 1.00 0.00 C ATOM 1180 C ASP A 77 -10.471 2.032 -2.139 1.00 0.00 C ATOM 1181 O ASP A 77 -11.249 1.109 -2.373 1.00 0.00 O ATOM 1182 CB ASP A 77 -8.855 1.481 -4.091 1.00 0.00 C ATOM 1183 CG ASP A 77 -8.851 1.842 -5.574 1.00 0.00 C ATOM 1184 OD1 ASP A 77 -9.947 2.205 -6.064 1.00 0.00 O ATOM 1185 OD2 ASP A 77 -7.778 1.702 -6.202 1.00 0.00 O ATOM 0 H ASP A 77 -7.682 3.322 -2.739 1.00 0.00 H new ATOM 0 HA ASP A 77 -10.280 3.015 -3.943 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -7.830 1.364 -3.740 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -9.352 0.521 -3.949 1.00 0.00 H new ATOM 1190 N ARG A 78 -10.485 2.698 -0.978 1.00 0.00 N ATOM 1191 CA ARG A 78 -11.524 2.558 0.036 1.00 0.00 C ATOM 1192 C ARG A 78 -11.407 1.177 0.686 1.00 0.00 C ATOM 1193 O ARG A 78 -10.313 0.617 0.711 1.00 0.00 O ATOM 1194 CB ARG A 78 -12.910 2.899 -0.560 1.00 0.00 C ATOM 1195 CG ARG A 78 -12.982 4.357 -1.054 1.00 0.00 C ATOM 1196 CD ARG A 78 -13.605 4.505 -2.453 1.00 0.00 C ATOM 1197 NE ARG A 78 -12.727 3.990 -3.522 1.00 0.00 N ATOM 1198 CZ ARG A 78 -13.175 3.598 -4.729 1.00 0.00 C ATOM 1199 NH1 ARG A 78 -14.393 3.994 -5.105 1.00 0.00 N ATOM 1200 NH2 ARG A 78 -12.442 2.870 -5.581 1.00 0.00 N ATOM 0 H ARG A 78 -9.756 3.362 -0.717 1.00 0.00 H new ATOM 0 HA ARG A 78 -11.392 3.279 0.843 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -13.124 2.224 -1.389 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -13.680 2.733 0.194 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -13.563 4.944 -0.343 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -11.976 4.777 -1.067 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -14.556 3.973 -2.481 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -13.822 5.557 -2.641 1.00 0.00 H new ATOM 0 HE ARG A 78 -11.726 3.928 -3.336 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -14.954 4.576 -4.484 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -14.762 3.714 -6.014 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -11.496 2.586 -5.326 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -12.830 2.599 -6.485 1.00 0.00 H new ATOM 1214 N LYS A 79 -12.500 0.638 1.241 1.00 0.00 N ATOM 1215 CA LYS A 79 -12.540 -0.732 1.729 1.00 0.00 C ATOM 1216 C LYS A 79 -12.670 -1.660 0.526 1.00 0.00 C ATOM 1217 O LYS A 79 -13.772 -2.103 0.200 1.00 0.00 O ATOM 1218 CB LYS A 79 -13.688 -0.920 2.729 1.00 0.00 C ATOM 1219 CG LYS A 79 -13.590 -2.314 3.375 1.00 0.00 C ATOM 1220 CD LYS A 79 -14.858 -2.733 4.123 1.00 0.00 C ATOM 1221 CE LYS A 79 -16.004 -3.020 3.141 1.00 0.00 C ATOM 1222 NZ LYS A 79 -17.152 -3.659 3.811 1.00 0.00 N ATOM 0 H LYS A 79 -13.377 1.145 1.361 1.00 0.00 H new ATOM 0 HA LYS A 79 -11.623 -0.972 2.267 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -13.644 -0.148 3.498 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -14.647 -0.810 2.222 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -13.375 -3.050 2.600 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -12.749 -2.326 4.068 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -14.655 -3.621 4.721 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -15.155 -1.944 4.814 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -16.327 -2.088 2.677 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -15.644 -3.667 2.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -17.905 -3.837 3.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -16.850 -4.560 4.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -17.512 -3.031 4.558 1.00 0.00 H new ATOM 1236 N VAL A 80 -11.547 -1.946 -0.127 1.00 0.00 N ATOM 1237 CA VAL A 80 -11.485 -2.922 -1.199 1.00 0.00 C ATOM 1238 C VAL A 80 -11.004 -4.251 -0.609 1.00 0.00 C ATOM 1239 O VAL A 80 -10.545 -4.278 0.529 1.00 0.00 O ATOM 1240 CB VAL A 80 -10.639 -2.349 -2.347 1.00 0.00 C ATOM 1241 CG1 VAL A 80 -9.225 -1.894 -1.972 1.00 0.00 C ATOM 1242 CG2 VAL A 80 -10.548 -3.321 -3.515 1.00 0.00 C ATOM 0 H VAL A 80 -10.652 -1.502 0.078 1.00 0.00 H new ATOM 0 HA VAL A 80 -12.457 -3.132 -1.645 1.00 0.00 H new ATOM 0 HB VAL A 80 -11.184 -1.448 -2.630 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -8.720 -1.508 -2.858 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -9.283 -1.110 -1.217 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -8.664 -2.740 -1.574 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -9.942 -2.882 -4.308 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -10.088 -4.251 -3.180 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -11.548 -3.528 -3.895 1.00 0.00 H new ATOM 1252 N LYS A 81 -11.141 -5.370 -1.326 1.00 0.00 N ATOM 1253 CA LYS A 81 -10.555 -6.637 -0.918 1.00 0.00 C ATOM 1254 C LYS A 81 -9.383 -6.965 -1.838 1.00 0.00 C ATOM 1255 O LYS A 81 -9.527 -6.979 -3.062 1.00 0.00 O ATOM 1256 CB LYS A 81 -11.608 -7.754 -0.907 1.00 0.00 C ATOM 1257 CG LYS A 81 -11.144 -8.877 0.029 1.00 0.00 C ATOM 1258 CD LYS A 81 -12.169 -10.013 0.126 1.00 0.00 C ATOM 1259 CE LYS A 81 -11.834 -10.967 1.281 1.00 0.00 C ATOM 1260 NZ LYS A 81 -12.010 -10.343 2.609 1.00 0.00 N ATOM 0 H LYS A 81 -11.661 -5.417 -2.202 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.182 -6.554 0.103 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -12.569 -7.361 -0.574 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -11.754 -8.142 -1.915 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -10.195 -9.276 -0.329 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -10.963 -8.467 1.023 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -13.165 -9.596 0.273 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -12.191 -10.567 -0.812 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -12.469 -11.850 1.213 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -10.803 -11.307 1.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -12.021 -11.082 3.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -11.224 -9.687 2.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -12.909 -9.821 2.631 1.00 0.00 H new ATOM 1274 N SER A 82 -8.232 -7.258 -1.233 1.00 0.00 N ATOM 1275 CA SER A 82 -7.090 -7.805 -1.934 1.00 0.00 C ATOM 1276 C SER A 82 -7.326 -9.289 -2.135 1.00 0.00 C ATOM 1277 O SER A 82 -7.652 -9.973 -1.168 1.00 0.00 O ATOM 1278 CB SER A 82 -5.830 -7.646 -1.076 1.00 0.00 C ATOM 1279 OG SER A 82 -5.042 -6.579 -1.542 1.00 0.00 O ATOM 0 H SER A 82 -8.073 -7.118 -0.235 1.00 0.00 H new ATOM 0 HA SER A 82 -6.962 -7.287 -2.884 1.00 0.00 H new ATOM 0 HB2 SER A 82 -6.111 -7.470 -0.038 1.00 0.00 H new ATOM 0 HB3 SER A 82 -5.251 -8.569 -1.098 1.00 0.00 H new ATOM 0 HG SER A 82 -5.589 -5.768 -1.597 1.00 0.00 H new ATOM 1285 N ILE A 83 -7.063 -9.782 -3.344 1.00 0.00 N ATOM 1286 CA ILE A 83 -6.693 -11.163 -3.597 1.00 0.00 C ATOM 1287 C ILE A 83 -5.420 -11.102 -4.451 1.00 0.00 C ATOM 1288 O ILE A 83 -5.425 -10.516 -5.535 1.00 0.00 O ATOM 1289 CB ILE A 83 -7.873 -11.962 -4.192 1.00 0.00 C ATOM 1290 CG1 ILE A 83 -7.359 -13.238 -4.882 1.00 0.00 C ATOM 1291 CG2 ILE A 83 -8.777 -11.112 -5.093 1.00 0.00 C ATOM 1292 CD1 ILE A 83 -8.459 -14.284 -5.093 1.00 0.00 C ATOM 0 H ILE A 83 -7.104 -9.215 -4.191 1.00 0.00 H new ATOM 0 HA ILE A 83 -6.469 -11.723 -2.689 1.00 0.00 H new ATOM 0 HB ILE A 83 -8.517 -12.269 -3.368 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -6.925 -12.974 -5.847 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -6.560 -13.674 -4.282 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -9.588 -11.729 -5.481 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -9.194 -10.287 -4.516 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -8.193 -10.715 -5.924 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -8.037 -15.161 -5.583 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -8.876 -14.573 -4.128 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -9.247 -13.863 -5.718 1.00 0.00 H new ATOM 1304 N VAL A 84 -4.300 -11.594 -3.909 1.00 0.00 N ATOM 1305 CA VAL A 84 -2.967 -11.357 -4.451 1.00 0.00 C ATOM 1306 C VAL A 84 -2.218 -12.679 -4.610 1.00 0.00 C ATOM 1307 O VAL A 84 -2.344 -13.579 -3.774 1.00 0.00 O ATOM 1308 CB VAL A 84 -2.197 -10.384 -3.541 1.00 0.00 C ATOM 1309 CG1 VAL A 84 -0.837 -10.023 -4.143 1.00 0.00 C ATOM 1310 CG2 VAL A 84 -2.952 -9.073 -3.338 1.00 0.00 C ATOM 0 H VAL A 84 -4.299 -12.175 -3.071 1.00 0.00 H new ATOM 0 HA VAL A 84 -3.055 -10.903 -5.438 1.00 0.00 H new ATOM 0 HB VAL A 84 -2.078 -10.901 -2.589 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.316 -9.334 -3.478 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -0.242 -10.928 -4.267 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -0.983 -9.549 -5.114 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -2.372 -8.416 -2.689 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -3.105 -8.588 -4.302 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -3.918 -9.277 -2.877 1.00 0.00 H new ATOM 1320 N THR A 85 -1.440 -12.793 -5.690 1.00 0.00 N ATOM 1321 CA THR A 85 -0.674 -13.977 -6.062 1.00 0.00 C ATOM 1322 C THR A 85 0.476 -13.502 -6.954 1.00 0.00 C ATOM 1323 O THR A 85 0.506 -12.325 -7.309 1.00 0.00 O ATOM 1324 CB THR A 85 -1.603 -14.980 -6.778 1.00 0.00 C ATOM 1325 OG1 THR A 85 -2.844 -15.055 -6.113 1.00 0.00 O ATOM 1326 CG2 THR A 85 -1.053 -16.405 -6.780 1.00 0.00 C ATOM 0 H THR A 85 -1.325 -12.028 -6.355 1.00 0.00 H new ATOM 0 HA THR A 85 -0.262 -14.494 -5.195 1.00 0.00 H new ATOM 0 HB THR A 85 -1.693 -14.612 -7.800 1.00 0.00 H new ATOM 0 HG1 THR A 85 -3.426 -15.693 -6.577 1.00 0.00 H new ATOM 0 HG21 THR A 85 -1.751 -17.064 -7.298 1.00 0.00 H new ATOM 0 HG22 THR A 85 -0.090 -16.423 -7.291 1.00 0.00 H new ATOM 0 HG23 THR A 85 -0.925 -16.747 -5.753 1.00 0.00 H new ATOM 1334 N LEU A 86 1.414 -14.374 -7.337 1.00 0.00 N ATOM 1335 CA LEU A 86 2.288 -14.115 -8.470 1.00 0.00 C ATOM 1336 C LEU A 86 2.222 -15.273 -9.448 1.00 0.00 C ATOM 1337 O LEU A 86 2.000 -16.409 -9.030 1.00 0.00 O ATOM 1338 CB LEU A 86 3.711 -13.753 -8.013 1.00 0.00 C ATOM 1339 CG LEU A 86 4.588 -14.885 -7.449 1.00 0.00 C ATOM 1340 CD1 LEU A 86 5.304 -15.690 -8.540 1.00 0.00 C ATOM 1341 CD2 LEU A 86 5.706 -14.251 -6.620 1.00 0.00 C ATOM 0 H LEU A 86 1.583 -15.266 -6.873 1.00 0.00 H new ATOM 0 HA LEU A 86 1.938 -13.234 -9.008 1.00 0.00 H new ATOM 0 HB2 LEU A 86 4.235 -13.313 -8.862 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.632 -12.978 -7.251 1.00 0.00 H new ATOM 0 HG LEU A 86 3.927 -15.543 -6.885 1.00 0.00 H new ATOM 0 HD11 LEU A 86 5.906 -16.473 -8.079 1.00 0.00 H new ATOM 0 HD12 LEU A 86 4.566 -16.143 -9.202 1.00 0.00 H new ATOM 0 HD13 LEU A 86 5.950 -15.028 -9.116 1.00 0.00 H new ATOM 0 HD21 LEU A 86 6.343 -15.034 -6.208 1.00 0.00 H new ATOM 0 HD22 LEU A 86 6.302 -13.595 -7.254 1.00 0.00 H new ATOM 0 HD23 LEU A 86 5.271 -13.672 -5.806 1.00 0.00 H new ATOM 1353 N ASP A 87 2.386 -14.962 -10.736 1.00 0.00 N ATOM 1354 CA ASP A 87 2.345 -15.922 -11.827 1.00 0.00 C ATOM 1355 C ASP A 87 3.716 -15.940 -12.496 1.00 0.00 C ATOM 1356 O ASP A 87 4.117 -14.951 -13.114 1.00 0.00 O ATOM 1357 CB ASP A 87 1.239 -15.532 -12.812 1.00 0.00 C ATOM 1358 CG ASP A 87 1.131 -16.518 -13.969 1.00 0.00 C ATOM 1359 OD1 ASP A 87 1.845 -17.543 -13.925 1.00 0.00 O ATOM 1360 OD2 ASP A 87 0.322 -16.227 -14.875 1.00 0.00 O ATOM 0 H ASP A 87 2.555 -14.007 -11.051 1.00 0.00 H new ATOM 0 HA ASP A 87 2.118 -16.923 -11.460 1.00 0.00 H new ATOM 0 HB2 ASP A 87 0.285 -15.484 -12.286 1.00 0.00 H new ATOM 0 HB3 ASP A 87 1.437 -14.534 -13.203 1.00 0.00 H new ATOM 1365 N GLY A 88 4.468 -17.028 -12.305 1.00 0.00 N ATOM 1366 CA GLY A 88 5.809 -17.211 -12.840 1.00 0.00 C ATOM 1367 C GLY A 88 6.825 -16.306 -12.142 1.00 0.00 C ATOM 1368 O GLY A 88 7.702 -16.780 -11.425 1.00 0.00 O ATOM 0 H GLY A 88 4.146 -17.826 -11.757 1.00 0.00 H new ATOM 0 HA2 GLY A 88 6.109 -18.252 -12.723 1.00 0.00 H new ATOM 0 HA3 GLY A 88 5.806 -16.998 -13.909 1.00 0.00 H new ATOM 1372 N GLY A 89 6.706 -14.998 -12.360 1.00 0.00 N ATOM 1373 CA GLY A 89 7.568 -13.980 -11.791 1.00 0.00 C ATOM 1374 C GLY A 89 6.965 -12.624 -12.126 1.00 0.00 C ATOM 1375 O GLY A 89 7.557 -11.847 -12.866 1.00 0.00 O ATOM 0 H GLY A 89 5.978 -14.610 -12.960 1.00 0.00 H new ATOM 0 HA2 GLY A 89 7.649 -14.107 -10.711 1.00 0.00 H new ATOM 0 HA3 GLY A 89 8.576 -14.061 -12.198 1.00 0.00 H new ATOM 1379 N LYS A 90 5.742 -12.389 -11.652 1.00 0.00 N ATOM 1380 CA LYS A 90 4.955 -11.187 -11.882 1.00 0.00 C ATOM 1381 C LYS A 90 3.858 -11.240 -10.828 1.00 0.00 C ATOM 1382 O LYS A 90 3.060 -12.176 -10.854 1.00 0.00 O ATOM 1383 CB LYS A 90 4.366 -11.210 -13.307 1.00 0.00 C ATOM 1384 CG LYS A 90 5.088 -10.223 -14.234 1.00 0.00 C ATOM 1385 CD LYS A 90 5.078 -10.632 -15.714 1.00 0.00 C ATOM 1386 CE LYS A 90 5.964 -11.846 -16.040 1.00 0.00 C ATOM 1387 NZ LYS A 90 7.349 -11.693 -15.543 1.00 0.00 N ATOM 0 H LYS A 90 5.253 -13.068 -11.069 1.00 0.00 H new ATOM 0 HA LYS A 90 5.542 -10.272 -11.805 1.00 0.00 H new ATOM 0 HB2 LYS A 90 4.443 -12.217 -13.717 1.00 0.00 H new ATOM 0 HB3 LYS A 90 3.305 -10.962 -13.267 1.00 0.00 H new ATOM 0 HG2 LYS A 90 4.623 -9.242 -14.136 1.00 0.00 H new ATOM 0 HG3 LYS A 90 6.122 -10.120 -13.903 1.00 0.00 H new ATOM 0 HD2 LYS A 90 4.053 -10.855 -16.011 1.00 0.00 H new ATOM 0 HD3 LYS A 90 5.407 -9.785 -16.315 1.00 0.00 H new ATOM 0 HE2 LYS A 90 5.522 -12.741 -15.602 1.00 0.00 H new ATOM 0 HE3 LYS A 90 5.984 -11.996 -17.119 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 8.012 -12.110 -16.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 7.565 -10.683 -15.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 7.445 -12.178 -14.628 1.00 0.00 H new ATOM 1401 N LEU A 91 3.860 -10.310 -9.867 1.00 0.00 N ATOM 1402 CA LEU A 91 2.912 -10.357 -8.763 1.00 0.00 C ATOM 1403 C LEU A 91 1.658 -9.580 -9.146 1.00 0.00 C ATOM 1404 O LEU A 91 1.738 -8.396 -9.476 1.00 0.00 O ATOM 1405 CB LEU A 91 3.521 -9.959 -7.411 1.00 0.00 C ATOM 1406 CG LEU A 91 4.309 -8.651 -7.434 1.00 0.00 C ATOM 1407 CD1 LEU A 91 4.136 -7.934 -6.091 1.00 0.00 C ATOM 1408 CD2 LEU A 91 5.801 -8.885 -7.697 1.00 0.00 C ATOM 0 H LEU A 91 4.506 -9.522 -9.836 1.00 0.00 H new ATOM 0 HA LEU A 91 2.621 -11.394 -8.596 1.00 0.00 H new ATOM 0 HB2 LEU A 91 2.720 -9.873 -6.677 1.00 0.00 H new ATOM 0 HB3 LEU A 91 4.179 -10.759 -7.073 1.00 0.00 H new ATOM 0 HG LEU A 91 3.920 -8.039 -8.248 1.00 0.00 H new ATOM 0 HD11 LEU A 91 4.697 -6.999 -6.103 1.00 0.00 H new ATOM 0 HD12 LEU A 91 3.080 -7.721 -5.925 1.00 0.00 H new ATOM 0 HD13 LEU A 91 4.508 -8.570 -5.288 1.00 0.00 H new ATOM 0 HD21 LEU A 91 6.323 -7.928 -7.705 1.00 0.00 H new ATOM 0 HD22 LEU A 91 6.214 -9.518 -6.911 1.00 0.00 H new ATOM 0 HD23 LEU A 91 5.928 -9.376 -8.662 1.00 0.00 H new ATOM 1420 N VAL A 92 0.518 -10.274 -9.140 1.00 0.00 N ATOM 1421 CA VAL A 92 -0.774 -9.780 -9.568 1.00 0.00 C ATOM 1422 C VAL A 92 -1.614 -9.509 -8.324 1.00 0.00 C ATOM 1423 O VAL A 92 -1.705 -10.361 -7.439 1.00 0.00 O ATOM 1424 CB VAL A 92 -1.440 -10.768 -10.555 1.00 0.00 C ATOM 1425 CG1 VAL A 92 -0.417 -11.379 -11.528 1.00 0.00 C ATOM 1426 CG2 VAL A 92 -2.209 -11.916 -9.882 1.00 0.00 C ATOM 0 H VAL A 92 0.479 -11.242 -8.819 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.670 -8.845 -10.119 1.00 0.00 H new ATOM 0 HB VAL A 92 -2.162 -10.154 -11.093 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -0.924 -12.067 -12.204 1.00 0.00 H new ATOM 0 HG12 VAL A 92 0.055 -10.584 -12.106 1.00 0.00 H new ATOM 0 HG13 VAL A 92 0.344 -11.919 -10.964 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -2.644 -12.560 -10.646 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -1.526 -12.498 -9.263 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -3.004 -11.506 -9.259 1.00 0.00 H new ATOM 1436 N HIS A 93 -2.206 -8.317 -8.249 1.00 0.00 N ATOM 1437 CA HIS A 93 -3.174 -7.946 -7.230 1.00 0.00 C ATOM 1438 C HIS A 93 -4.498 -7.763 -7.950 1.00 0.00 C ATOM 1439 O HIS A 93 -4.682 -6.778 -8.666 1.00 0.00 O ATOM 1440 CB HIS A 93 -2.699 -6.678 -6.506 1.00 0.00 C ATOM 1441 CG HIS A 93 -3.704 -5.897 -5.681 1.00 0.00 C ATOM 1442 ND1 HIS A 93 -3.673 -4.521 -5.540 1.00 0.00 N ATOM 1443 CD2 HIS A 93 -4.647 -6.378 -4.808 1.00 0.00 C ATOM 1444 CE1 HIS A 93 -4.550 -4.172 -4.590 1.00 0.00 C ATOM 1445 NE2 HIS A 93 -5.151 -5.280 -4.133 1.00 0.00 N ATOM 0 H HIS A 93 -2.017 -7.567 -8.914 1.00 0.00 H new ATOM 0 HA HIS A 93 -3.287 -8.706 -6.457 1.00 0.00 H new ATOM 0 HB2 HIS A 93 -1.877 -6.960 -5.848 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -2.289 -6.002 -7.256 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -4.938 -7.409 -4.674 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -4.741 -3.165 -4.249 1.00 0.00 H new ATOM 0 HE2 HIS A 93 -5.865 -5.309 -3.405 1.00 0.00 H new ATOM 1454 N VAL A 94 -5.392 -8.731 -7.760 1.00 0.00 N ATOM 1455 CA VAL A 94 -6.792 -8.589 -8.092 1.00 0.00 C ATOM 1456 C VAL A 94 -7.398 -7.851 -6.896 1.00 0.00 C ATOM 1457 O VAL A 94 -7.173 -8.211 -5.738 1.00 0.00 O ATOM 1458 CB VAL A 94 -7.381 -9.979 -8.386 1.00 0.00 C ATOM 1459 CG1 VAL A 94 -8.910 -9.986 -8.450 1.00 0.00 C ATOM 1460 CG2 VAL A 94 -6.836 -10.488 -9.725 1.00 0.00 C ATOM 0 H VAL A 94 -5.154 -9.642 -7.367 1.00 0.00 H new ATOM 0 HA VAL A 94 -7.001 -8.016 -8.996 1.00 0.00 H new ATOM 0 HB VAL A 94 -7.084 -10.626 -7.560 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -9.261 -10.996 -8.661 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -9.316 -9.653 -7.495 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -9.244 -9.314 -9.240 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -7.252 -11.473 -9.936 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -7.119 -9.797 -10.519 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -5.749 -10.556 -9.673 1.00 0.00 H new ATOM 1470 N GLN A 95 -8.055 -6.733 -7.183 1.00 0.00 N ATOM 1471 CA GLN A 95 -8.414 -5.715 -6.219 1.00 0.00 C ATOM 1472 C GLN A 95 -9.922 -5.502 -6.359 1.00 0.00 C ATOM 1473 O GLN A 95 -10.377 -4.752 -7.221 1.00 0.00 O ATOM 1474 CB GLN A 95 -7.548 -4.493 -6.546 1.00 0.00 C ATOM 1475 CG GLN A 95 -7.903 -3.274 -5.707 1.00 0.00 C ATOM 1476 CD GLN A 95 -7.032 -2.062 -6.003 1.00 0.00 C ATOM 1477 OE1 GLN A 95 -5.879 -2.182 -6.410 1.00 0.00 O ATOM 1478 NE2 GLN A 95 -7.622 -0.895 -5.800 1.00 0.00 N ATOM 0 H GLN A 95 -8.361 -6.508 -8.130 1.00 0.00 H new ATOM 0 HA GLN A 95 -8.228 -5.966 -5.175 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -6.499 -4.744 -6.387 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -7.660 -4.246 -7.602 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -8.947 -3.013 -5.882 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -7.811 -3.529 -4.651 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -8.583 -0.862 -5.460 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -7.116 -0.029 -5.983 1.00 0.00 H new ATOM 1487 N LYS A 96 -10.691 -6.238 -5.554 1.00 0.00 N ATOM 1488 CA LYS A 96 -12.116 -6.475 -5.738 1.00 0.00 C ATOM 1489 C LYS A 96 -12.880 -5.728 -4.648 1.00 0.00 C ATOM 1490 O LYS A 96 -12.736 -6.080 -3.480 1.00 0.00 O ATOM 1491 CB LYS A 96 -12.335 -7.993 -5.627 1.00 0.00 C ATOM 1492 CG LYS A 96 -13.774 -8.445 -5.914 1.00 0.00 C ATOM 1493 CD LYS A 96 -14.106 -9.747 -5.162 1.00 0.00 C ATOM 1494 CE LYS A 96 -13.148 -10.900 -5.512 1.00 0.00 C ATOM 1495 NZ LYS A 96 -13.396 -12.111 -4.695 1.00 0.00 N ATOM 0 H LYS A 96 -10.319 -6.701 -4.725 1.00 0.00 H new ATOM 0 HA LYS A 96 -12.472 -6.120 -6.705 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -11.663 -8.497 -6.321 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -12.058 -8.316 -4.623 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -14.471 -7.662 -5.616 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -13.904 -8.597 -6.986 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -14.066 -9.561 -4.089 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -15.128 -10.046 -5.396 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -13.255 -11.150 -6.568 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -12.119 -10.571 -5.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -12.726 -12.858 -4.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -13.268 -11.883 -3.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -14.369 -12.444 -4.854 1.00 0.00 H new ATOM 1509 N TRP A 97 -13.678 -4.710 -4.991 1.00 0.00 N ATOM 1510 CA TRP A 97 -14.402 -3.946 -3.977 1.00 0.00 C ATOM 1511 C TRP A 97 -15.803 -4.514 -3.773 1.00 0.00 C ATOM 1512 O TRP A 97 -16.161 -4.872 -2.653 1.00 0.00 O ATOM 1513 CB TRP A 97 -14.379 -2.437 -4.267 1.00 0.00 C ATOM 1514 CG TRP A 97 -14.374 -2.017 -5.701 1.00 0.00 C ATOM 1515 CD1 TRP A 97 -15.453 -1.974 -6.508 1.00 0.00 C ATOM 1516 CD2 TRP A 97 -13.254 -1.546 -6.512 1.00 0.00 C ATOM 1517 NE1 TRP A 97 -15.071 -1.566 -7.764 1.00 0.00 N ATOM 1518 CE2 TRP A 97 -13.720 -1.316 -7.836 1.00 0.00 C ATOM 1519 CE3 TRP A 97 -11.901 -1.252 -6.250 1.00 0.00 C ATOM 1520 CZ2 TRP A 97 -12.877 -0.875 -8.865 1.00 0.00 C ATOM 1521 CZ3 TRP A 97 -11.057 -0.763 -7.263 1.00 0.00 C ATOM 1522 CH2 TRP A 97 -11.536 -0.588 -8.572 1.00 0.00 C ATOM 0 H TRP A 97 -13.836 -4.402 -5.950 1.00 0.00 H new ATOM 0 HA TRP A 97 -13.883 -4.056 -3.025 1.00 0.00 H new ATOM 0 HB2 TRP A 97 -15.248 -1.987 -3.786 1.00 0.00 H new ATOM 0 HB3 TRP A 97 -13.496 -2.014 -3.788 1.00 0.00 H new ATOM 0 HD1 TRP A 97 -16.462 -2.222 -6.213 1.00 0.00 H new ATOM 0 HE1 TRP A 97 -15.713 -1.461 -8.550 1.00 0.00 H new ATOM 0 HE3 TRP A 97 -11.506 -1.405 -5.256 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 -13.255 -0.758 -9.870 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 -10.030 -0.520 -7.032 1.00 0.00 H new ATOM 0 HH2 TRP A 97 -10.875 -0.234 -9.349 1.00 0.00 H new ATOM 1533 N ASN A 98 -16.595 -4.625 -4.844 1.00 0.00 N ATOM 1534 CA ASN A 98 -17.962 -5.127 -4.749 1.00 0.00 C ATOM 1535 C ASN A 98 -18.539 -5.391 -6.137 1.00 0.00 C ATOM 1536 O ASN A 98 -18.377 -6.489 -6.660 1.00 0.00 O ATOM 1537 CB ASN A 98 -18.871 -4.253 -3.853 1.00 0.00 C ATOM 1538 CG ASN A 98 -18.886 -2.764 -4.197 1.00 0.00 C ATOM 1539 OD1 ASN A 98 -17.885 -2.071 -4.066 1.00 0.00 O ATOM 1540 ND2 ASN A 98 -20.020 -2.252 -4.669 1.00 0.00 N ATOM 0 H ASN A 98 -16.308 -4.372 -5.789 1.00 0.00 H new ATOM 0 HA ASN A 98 -17.924 -6.087 -4.234 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -19.890 -4.634 -3.915 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -18.551 -4.367 -2.817 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -20.066 -1.267 -4.929 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -20.844 -2.845 -4.771 1.00 0.00 H new ATOM 1547 N GLY A 99 -19.204 -4.409 -6.751 1.00 0.00 N ATOM 1548 CA GLY A 99 -19.846 -4.603 -8.040 1.00 0.00 C ATOM 1549 C GLY A 99 -18.819 -4.748 -9.157 1.00 0.00 C ATOM 1550 O GLY A 99 -19.131 -5.288 -10.213 1.00 0.00 O ATOM 0 H GLY A 99 -19.308 -3.469 -6.368 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -20.475 -5.492 -8.005 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -20.501 -3.758 -8.253 1.00 0.00 H new ATOM 1554 N GLN A 100 -17.608 -4.220 -8.946 1.00 0.00 N ATOM 1555 CA GLN A 100 -16.510 -4.333 -9.883 1.00 0.00 C ATOM 1556 C GLN A 100 -15.203 -4.568 -9.119 1.00 0.00 C ATOM 1557 O GLN A 100 -15.193 -4.713 -7.890 1.00 0.00 O ATOM 1558 CB GLN A 100 -16.416 -3.113 -10.825 1.00 0.00 C ATOM 1559 CG GLN A 100 -17.654 -2.206 -10.921 1.00 0.00 C ATOM 1560 CD GLN A 100 -17.708 -1.240 -9.744 1.00 0.00 C ATOM 1561 OE1 GLN A 100 -16.824 -0.400 -9.609 1.00 0.00 O ATOM 1562 NE2 GLN A 100 -18.676 -1.372 -8.844 1.00 0.00 N ATOM 0 H GLN A 100 -17.371 -3.696 -8.103 1.00 0.00 H new ATOM 0 HA GLN A 100 -16.697 -5.192 -10.527 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -15.573 -2.502 -10.504 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -16.184 -3.476 -11.826 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -17.629 -1.646 -11.856 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -18.557 -2.816 -10.939 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -19.402 -2.077 -8.975 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -18.694 -0.769 -8.022 1.00 0.00 H new ATOM 1571 N GLU A 101 -14.115 -4.589 -9.887 1.00 0.00 N ATOM 1572 CA GLU A 101 -12.772 -4.955 -9.494 1.00 0.00 C ATOM 1573 C GLU A 101 -11.821 -4.088 -10.324 1.00 0.00 C ATOM 1574 O GLU A 101 -12.244 -3.434 -11.286 1.00 0.00 O ATOM 1575 CB GLU A 101 -12.648 -6.474 -9.747 1.00 0.00 C ATOM 1576 CG GLU A 101 -11.249 -7.112 -9.708 1.00 0.00 C ATOM 1577 CD GLU A 101 -10.509 -7.067 -11.046 1.00 0.00 C ATOM 1578 OE1 GLU A 101 -10.935 -6.290 -11.927 1.00 0.00 O ATOM 1579 OE2 GLU A 101 -9.511 -7.806 -11.167 1.00 0.00 O ATOM 0 H GLU A 101 -14.162 -4.330 -10.872 1.00 0.00 H new ATOM 0 HA GLU A 101 -12.528 -4.779 -8.446 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -13.266 -6.985 -9.009 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -13.081 -6.684 -10.725 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -10.649 -6.602 -8.955 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -11.343 -8.151 -9.391 1.00 0.00 H new ATOM 1586 N THR A 102 -10.548 -4.053 -9.940 1.00 0.00 N ATOM 1587 CA THR A 102 -9.454 -3.715 -10.833 1.00 0.00 C ATOM 1588 C THR A 102 -8.375 -4.783 -10.695 1.00 0.00 C ATOM 1589 O THR A 102 -8.261 -5.412 -9.642 1.00 0.00 O ATOM 1590 CB THR A 102 -8.924 -2.306 -10.541 1.00 0.00 C ATOM 1591 OG1 THR A 102 -7.798 -2.042 -11.341 1.00 0.00 O ATOM 1592 CG2 THR A 102 -8.463 -2.081 -9.102 1.00 0.00 C ATOM 0 H THR A 102 -10.248 -4.262 -8.988 1.00 0.00 H new ATOM 0 HA THR A 102 -9.800 -3.698 -11.866 1.00 0.00 H new ATOM 0 HB THR A 102 -9.772 -1.652 -10.746 1.00 0.00 H new ATOM 0 HG1 THR A 102 -7.990 -2.292 -12.269 1.00 0.00 H new ATOM 0 HG21 THR A 102 -8.105 -1.057 -8.990 1.00 0.00 H new ATOM 0 HG22 THR A 102 -9.298 -2.250 -8.422 1.00 0.00 H new ATOM 0 HG23 THR A 102 -7.657 -2.775 -8.866 1.00 0.00 H new ATOM 1600 N SER A 103 -7.582 -4.968 -11.751 1.00 0.00 N ATOM 1601 CA SER A 103 -6.420 -5.830 -11.739 1.00 0.00 C ATOM 1602 C SER A 103 -5.200 -4.946 -11.985 1.00 0.00 C ATOM 1603 O SER A 103 -5.232 -4.025 -12.810 1.00 0.00 O ATOM 1604 CB SER A 103 -6.586 -6.943 -12.780 1.00 0.00 C ATOM 1605 OG SER A 103 -7.082 -6.433 -14.002 1.00 0.00 O ATOM 0 H SER A 103 -7.740 -4.511 -12.649 1.00 0.00 H new ATOM 0 HA SER A 103 -6.293 -6.336 -10.782 1.00 0.00 H new ATOM 0 HB2 SER A 103 -5.626 -7.431 -12.950 1.00 0.00 H new ATOM 0 HB3 SER A 103 -7.267 -7.703 -12.397 1.00 0.00 H new ATOM 0 HG SER A 103 -7.176 -7.164 -14.647 1.00 0.00 H new ATOM 1611 N LEU A 104 -4.126 -5.205 -11.239 1.00 0.00 N ATOM 1612 CA LEU A 104 -2.860 -4.525 -11.423 1.00 0.00 C ATOM 1613 C LEU A 104 -1.737 -5.515 -11.161 1.00 0.00 C ATOM 1614 O LEU A 104 -1.947 -6.514 -10.466 1.00 0.00 O ATOM 1615 CB LEU A 104 -2.793 -3.265 -10.546 1.00 0.00 C ATOM 1616 CG LEU A 104 -2.793 -3.521 -9.029 1.00 0.00 C ATOM 1617 CD1 LEU A 104 -1.398 -3.812 -8.478 1.00 0.00 C ATOM 1618 CD2 LEU A 104 -3.270 -2.272 -8.298 1.00 0.00 C ATOM 0 H LEU A 104 -4.118 -5.896 -10.489 1.00 0.00 H new ATOM 0 HA LEU A 104 -2.752 -4.171 -12.448 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -1.891 -2.710 -10.804 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -3.642 -2.626 -10.790 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.442 -4.382 -8.871 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -1.460 -3.985 -7.404 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -0.992 -4.699 -8.965 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -0.745 -2.961 -8.672 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -3.269 -2.456 -7.224 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -2.602 -1.441 -8.524 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -4.281 -2.024 -8.623 1.00 0.00 H new ATOM 1630 N VAL A 105 -0.558 -5.245 -11.725 1.00 0.00 N ATOM 1631 CA VAL A 105 0.604 -6.113 -11.594 1.00 0.00 C ATOM 1632 C VAL A 105 1.833 -5.295 -11.205 1.00 0.00 C ATOM 1633 O VAL A 105 1.912 -4.107 -11.530 1.00 0.00 O ATOM 1634 CB VAL A 105 0.841 -6.921 -12.884 1.00 0.00 C ATOM 1635 CG1 VAL A 105 -0.319 -7.882 -13.169 1.00 0.00 C ATOM 1636 CG2 VAL A 105 1.023 -6.025 -14.113 1.00 0.00 C ATOM 0 H VAL A 105 -0.386 -4.412 -12.288 1.00 0.00 H new ATOM 0 HA VAL A 105 0.413 -6.832 -10.797 1.00 0.00 H new ATOM 0 HB VAL A 105 1.760 -7.481 -12.709 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -0.117 -8.435 -14.086 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -0.424 -8.581 -12.340 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -1.242 -7.314 -13.284 1.00 0.00 H new ATOM 0 HG21 VAL A 105 1.187 -6.645 -14.994 1.00 0.00 H new ATOM 0 HG22 VAL A 105 0.129 -5.419 -14.257 1.00 0.00 H new ATOM 0 HG23 VAL A 105 1.883 -5.373 -13.963 1.00 0.00 H new ATOM 1646 N ARG A 106 2.776 -5.942 -10.511 1.00 0.00 N ATOM 1647 CA ARG A 106 4.115 -5.434 -10.251 1.00 0.00 C ATOM 1648 C ARG A 106 5.134 -6.450 -10.774 1.00 0.00 C ATOM 1649 O ARG A 106 4.949 -7.660 -10.616 1.00 0.00 O ATOM 1650 CB ARG A 106 4.307 -5.162 -8.752 1.00 0.00 C ATOM 1651 CG ARG A 106 3.658 -3.842 -8.329 1.00 0.00 C ATOM 1652 CD ARG A 106 3.805 -3.630 -6.816 1.00 0.00 C ATOM 1653 NE ARG A 106 2.921 -4.528 -6.049 1.00 0.00 N ATOM 1654 CZ ARG A 106 1.618 -4.302 -5.811 1.00 0.00 C ATOM 1655 NH1 ARG A 106 1.035 -3.228 -6.351 1.00 0.00 N ATOM 1656 NH2 ARG A 106 0.910 -5.134 -5.040 1.00 0.00 N ATOM 0 H ARG A 106 2.616 -6.864 -10.104 1.00 0.00 H new ATOM 0 HA ARG A 106 4.262 -4.486 -10.768 1.00 0.00 H new ATOM 0 HB2 ARG A 106 3.876 -5.981 -8.175 1.00 0.00 H new ATOM 0 HB3 ARG A 106 5.372 -5.135 -8.520 1.00 0.00 H new ATOM 0 HG2 ARG A 106 4.122 -3.014 -8.865 1.00 0.00 H new ATOM 0 HG3 ARG A 106 2.602 -3.846 -8.601 1.00 0.00 H new ATOM 0 HD2 ARG A 106 4.841 -3.803 -6.524 1.00 0.00 H new ATOM 0 HD3 ARG A 106 3.573 -2.594 -6.570 1.00 0.00 H new ATOM 0 HE ARG A 106 3.329 -5.383 -5.672 1.00 0.00 H new ATOM 0 HH11 ARG A 106 1.578 -2.592 -6.935 1.00 0.00 H new ATOM 0 HH12 ARG A 106 0.047 -3.044 -6.179 1.00 0.00 H new ATOM 0 HH21 ARG A 106 1.358 -5.951 -4.625 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -0.079 -4.952 -4.867 1.00 0.00 H new ATOM 1670 N GLU A 107 6.188 -5.938 -11.414 1.00 0.00 N ATOM 1671 CA GLU A 107 7.245 -6.681 -12.083 1.00 0.00 C ATOM 1672 C GLU A 107 8.462 -5.763 -12.120 1.00 0.00 C ATOM 1673 O GLU A 107 8.276 -4.555 -12.250 1.00 0.00 O ATOM 1674 CB GLU A 107 6.759 -7.004 -13.503 1.00 0.00 C ATOM 1675 CG GLU A 107 7.843 -7.381 -14.525 1.00 0.00 C ATOM 1676 CD GLU A 107 8.604 -8.650 -14.181 1.00 0.00 C ATOM 1677 OE1 GLU A 107 9.164 -8.699 -13.065 1.00 0.00 O ATOM 1678 OE2 GLU A 107 8.593 -9.551 -15.048 1.00 0.00 O ATOM 0 H GLU A 107 6.330 -4.930 -11.480 1.00 0.00 H new ATOM 0 HA GLU A 107 7.498 -7.613 -11.578 1.00 0.00 H new ATOM 0 HB2 GLU A 107 6.046 -7.826 -13.442 1.00 0.00 H new ATOM 0 HB3 GLU A 107 6.216 -6.139 -13.884 1.00 0.00 H new ATOM 0 HG2 GLU A 107 7.378 -7.503 -15.503 1.00 0.00 H new ATOM 0 HG3 GLU A 107 8.551 -6.557 -14.609 1.00 0.00 H new ATOM 1685 N MET A 108 9.677 -6.308 -12.031 1.00 0.00 N ATOM 1686 CA MET A 108 10.909 -5.573 -12.271 1.00 0.00 C ATOM 1687 C MET A 108 11.821 -6.405 -13.164 1.00 0.00 C ATOM 1688 O MET A 108 12.263 -7.482 -12.772 1.00 0.00 O ATOM 1689 CB MET A 108 11.631 -5.205 -10.962 1.00 0.00 C ATOM 1690 CG MET A 108 12.851 -4.302 -11.229 1.00 0.00 C ATOM 1691 SD MET A 108 14.407 -4.749 -10.411 1.00 0.00 S ATOM 1692 CE MET A 108 14.838 -6.291 -11.255 1.00 0.00 C ATOM 0 H MET A 108 9.829 -7.286 -11.786 1.00 0.00 H new ATOM 0 HA MET A 108 10.655 -4.636 -12.766 1.00 0.00 H new ATOM 0 HB2 MET A 108 10.938 -4.695 -10.293 1.00 0.00 H new ATOM 0 HB3 MET A 108 11.953 -6.114 -10.454 1.00 0.00 H new ATOM 0 HG2 MET A 108 13.028 -4.282 -12.304 1.00 0.00 H new ATOM 0 HG3 MET A 108 12.592 -3.286 -10.930 1.00 0.00 H new ATOM 0 HE1 MET A 108 15.824 -6.621 -10.928 1.00 0.00 H new ATOM 0 HE2 MET A 108 14.101 -7.056 -11.013 1.00 0.00 H new ATOM 0 HE3 MET A 108 14.849 -6.125 -12.332 1.00 0.00 H new ATOM 1702 N VAL A 109 12.194 -5.833 -14.306 1.00 0.00 N ATOM 1703 CA VAL A 109 13.363 -6.237 -15.069 1.00 0.00 C ATOM 1704 C VAL A 109 14.253 -5.001 -15.178 1.00 0.00 C ATOM 1705 O VAL A 109 13.890 -3.942 -14.653 1.00 0.00 O ATOM 1706 CB VAL A 109 12.955 -6.855 -16.416 1.00 0.00 C ATOM 1707 CG1 VAL A 109 12.158 -8.145 -16.180 1.00 0.00 C ATOM 1708 CG2 VAL A 109 12.136 -5.889 -17.280 1.00 0.00 C ATOM 0 H VAL A 109 11.680 -5.062 -14.732 1.00 0.00 H new ATOM 0 HA VAL A 109 13.927 -7.031 -14.579 1.00 0.00 H new ATOM 0 HB VAL A 109 13.873 -7.078 -16.959 1.00 0.00 H new ATOM 0 HG11 VAL A 109 11.872 -8.577 -17.139 1.00 0.00 H new ATOM 0 HG12 VAL A 109 12.773 -8.857 -15.630 1.00 0.00 H new ATOM 0 HG13 VAL A 109 11.261 -7.918 -15.603 1.00 0.00 H new ATOM 0 HG21 VAL A 109 11.874 -6.375 -18.220 1.00 0.00 H new ATOM 0 HG22 VAL A 109 11.226 -5.609 -16.750 1.00 0.00 H new ATOM 0 HG23 VAL A 109 12.726 -4.996 -17.486 1.00 0.00 H new ATOM 1718 N ASP A 110 15.437 -5.141 -15.781 1.00 0.00 N ATOM 1719 CA ASP A 110 16.468 -4.115 -15.700 1.00 0.00 C ATOM 1720 C ASP A 110 16.667 -3.783 -14.209 1.00 0.00 C ATOM 1721 O ASP A 110 16.963 -4.684 -13.423 1.00 0.00 O ATOM 1722 CB ASP A 110 16.077 -2.947 -16.625 1.00 0.00 C ATOM 1723 CG ASP A 110 17.041 -1.776 -16.552 1.00 0.00 C ATOM 1724 OD1 ASP A 110 18.108 -1.862 -17.191 1.00 0.00 O ATOM 1725 OD2 ASP A 110 16.684 -0.834 -15.807 1.00 0.00 O ATOM 0 H ASP A 110 15.701 -5.959 -16.331 1.00 0.00 H new ATOM 0 HA ASP A 110 17.445 -4.431 -16.066 1.00 0.00 H new ATOM 0 HB2 ASP A 110 16.030 -3.307 -17.653 1.00 0.00 H new ATOM 0 HB3 ASP A 110 15.077 -2.603 -16.361 1.00 0.00 H new ATOM 1730 N GLY A 111 16.404 -2.549 -13.783 1.00 0.00 N ATOM 1731 CA GLY A 111 16.384 -2.129 -12.393 1.00 0.00 C ATOM 1732 C GLY A 111 15.095 -1.373 -12.079 1.00 0.00 C ATOM 1733 O GLY A 111 15.020 -0.703 -11.046 1.00 0.00 O ATOM 0 H GLY A 111 16.191 -1.787 -14.427 1.00 0.00 H new ATOM 0 HA2 GLY A 111 16.469 -3.000 -11.743 1.00 0.00 H new ATOM 0 HA3 GLY A 111 17.245 -1.493 -12.187 1.00 0.00 H new ATOM 1737 N LYS A 112 14.083 -1.473 -12.954 1.00 0.00 N ATOM 1738 CA LYS A 112 12.915 -0.606 -12.921 1.00 0.00 C ATOM 1739 C LYS A 112 11.640 -1.434 -12.818 1.00 0.00 C ATOM 1740 O LYS A 112 11.496 -2.462 -13.477 1.00 0.00 O ATOM 1741 CB LYS A 112 12.923 0.358 -14.117 1.00 0.00 C ATOM 1742 CG LYS A 112 14.205 1.207 -14.064 1.00 0.00 C ATOM 1743 CD LYS A 112 14.040 2.641 -14.596 1.00 0.00 C ATOM 1744 CE LYS A 112 15.045 3.524 -13.838 1.00 0.00 C ATOM 1745 NZ LYS A 112 14.946 4.967 -14.123 1.00 0.00 N ATOM 0 H LYS A 112 14.060 -2.163 -13.704 1.00 0.00 H new ATOM 0 HA LYS A 112 12.950 0.017 -12.027 1.00 0.00 H new ATOM 0 HB2 LYS A 112 12.879 -0.201 -15.052 1.00 0.00 H new ATOM 0 HB3 LYS A 112 12.043 1.001 -14.089 1.00 0.00 H new ATOM 0 HG2 LYS A 112 14.553 1.253 -13.032 1.00 0.00 H new ATOM 0 HG3 LYS A 112 14.982 0.706 -14.641 1.00 0.00 H new ATOM 0 HD2 LYS A 112 14.228 2.678 -15.669 1.00 0.00 H new ATOM 0 HD3 LYS A 112 13.021 2.995 -14.439 1.00 0.00 H new ATOM 0 HE2 LYS A 112 14.906 3.370 -12.768 1.00 0.00 H new ATOM 0 HE3 LYS A 112 16.054 3.190 -14.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 15.336 5.506 -13.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 15.484 5.188 -14.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 13.948 5.226 -14.262 1.00 0.00 H new ATOM 1759 N LEU A 113 10.756 -1.005 -11.919 1.00 0.00 N ATOM 1760 CA LEU A 113 9.552 -1.704 -11.512 1.00 0.00 C ATOM 1761 C LEU A 113 8.378 -1.130 -12.294 1.00 0.00 C ATOM 1762 O LEU A 113 8.060 0.051 -12.161 1.00 0.00 O ATOM 1763 CB LEU A 113 9.406 -1.589 -9.989 1.00 0.00 C ATOM 1764 CG LEU A 113 8.005 -1.720 -9.378 1.00 0.00 C ATOM 1765 CD1 LEU A 113 7.328 -3.042 -9.730 1.00 0.00 C ATOM 1766 CD2 LEU A 113 8.130 -1.633 -7.854 1.00 0.00 C ATOM 0 H LEU A 113 10.872 -0.115 -11.434 1.00 0.00 H new ATOM 0 HA LEU A 113 9.593 -2.769 -11.739 1.00 0.00 H new ATOM 0 HB2 LEU A 113 10.038 -2.353 -9.536 1.00 0.00 H new ATOM 0 HB3 LEU A 113 9.810 -0.622 -9.689 1.00 0.00 H new ATOM 0 HG LEU A 113 7.392 -0.916 -9.785 1.00 0.00 H new ATOM 0 HD11 LEU A 113 6.340 -3.079 -9.271 1.00 0.00 H new ATOM 0 HD12 LEU A 113 7.228 -3.123 -10.812 1.00 0.00 H new ATOM 0 HD13 LEU A 113 7.932 -3.870 -9.359 1.00 0.00 H new ATOM 0 HD21 LEU A 113 7.142 -1.724 -7.402 1.00 0.00 H new ATOM 0 HD22 LEU A 113 8.769 -2.439 -7.495 1.00 0.00 H new ATOM 0 HD23 LEU A 113 8.567 -0.673 -7.579 1.00 0.00 H new ATOM 1778 N ILE A 114 7.752 -1.962 -13.122 1.00 0.00 N ATOM 1779 CA ILE A 114 6.615 -1.585 -13.937 1.00 0.00 C ATOM 1780 C ILE A 114 5.356 -1.769 -13.088 1.00 0.00 C ATOM 1781 O ILE A 114 5.091 -2.878 -12.622 1.00 0.00 O ATOM 1782 CB ILE A 114 6.577 -2.449 -15.213 1.00 0.00 C ATOM 1783 CG1 ILE A 114 7.943 -2.563 -15.919 1.00 0.00 C ATOM 1784 CG2 ILE A 114 5.507 -1.917 -16.176 1.00 0.00 C ATOM 1785 CD1 ILE A 114 8.606 -1.222 -16.247 1.00 0.00 C ATOM 0 H ILE A 114 8.031 -2.935 -13.243 1.00 0.00 H new ATOM 0 HA ILE A 114 6.685 -0.545 -14.257 1.00 0.00 H new ATOM 0 HB ILE A 114 6.318 -3.461 -14.900 1.00 0.00 H new ATOM 0 HG12 ILE A 114 8.617 -3.141 -15.287 1.00 0.00 H new ATOM 0 HG13 ILE A 114 7.813 -3.125 -16.844 1.00 0.00 H new ATOM 0 HG21 ILE A 114 5.487 -2.534 -17.075 1.00 0.00 H new ATOM 0 HG22 ILE A 114 4.531 -1.951 -15.691 1.00 0.00 H new ATOM 0 HG23 ILE A 114 5.741 -0.888 -16.447 1.00 0.00 H new ATOM 0 HD11 ILE A 114 9.561 -1.400 -16.742 1.00 0.00 H new ATOM 0 HD12 ILE A 114 7.957 -0.647 -16.907 1.00 0.00 H new ATOM 0 HD13 ILE A 114 8.773 -0.664 -15.326 1.00 0.00 H new ATOM 1797 N LEU A 115 4.589 -0.693 -12.885 1.00 0.00 N ATOM 1798 CA LEU A 115 3.242 -0.753 -12.336 1.00 0.00 C ATOM 1799 C LEU A 115 2.295 -0.630 -13.521 1.00 0.00 C ATOM 1800 O LEU A 115 2.231 0.444 -14.116 1.00 0.00 O ATOM 1801 CB LEU A 115 2.998 0.425 -11.374 1.00 0.00 C ATOM 1802 CG LEU A 115 3.300 0.172 -9.892 1.00 0.00 C ATOM 1803 CD1 LEU A 115 2.273 -0.780 -9.269 1.00 0.00 C ATOM 1804 CD2 LEU A 115 4.732 -0.321 -9.680 1.00 0.00 C ATOM 0 H LEU A 115 4.896 0.255 -13.102 1.00 0.00 H new ATOM 0 HA LEU A 115 3.091 -1.679 -11.781 1.00 0.00 H new ATOM 0 HB2 LEU A 115 3.604 1.268 -11.706 1.00 0.00 H new ATOM 0 HB3 LEU A 115 1.955 0.727 -11.463 1.00 0.00 H new ATOM 0 HG LEU A 115 3.215 1.128 -9.375 1.00 0.00 H new ATOM 0 HD11 LEU A 115 2.515 -0.939 -8.218 1.00 0.00 H new ATOM 0 HD12 LEU A 115 1.277 -0.345 -9.350 1.00 0.00 H new ATOM 0 HD13 LEU A 115 2.296 -1.734 -9.795 1.00 0.00 H new ATOM 0 HD21 LEU A 115 4.906 -0.488 -8.617 1.00 0.00 H new ATOM 0 HD22 LEU A 115 4.880 -1.254 -10.223 1.00 0.00 H new ATOM 0 HD23 LEU A 115 5.433 0.428 -10.049 1.00 0.00 H new ATOM 1816 N THR A 116 1.541 -1.684 -13.835 1.00 0.00 N ATOM 1817 CA THR A 116 0.456 -1.622 -14.806 1.00 0.00 C ATOM 1818 C THR A 116 -0.845 -1.795 -14.028 1.00 0.00 C ATOM 1819 O THR A 116 -0.951 -2.721 -13.221 1.00 0.00 O ATOM 1820 CB THR A 116 0.648 -2.688 -15.891 1.00 0.00 C ATOM 1821 OG1 THR A 116 1.942 -2.566 -16.441 1.00 0.00 O ATOM 1822 CG2 THR A 116 -0.356 -2.531 -17.036 1.00 0.00 C ATOM 0 H THR A 116 1.669 -2.607 -13.420 1.00 0.00 H new ATOM 0 HA THR A 116 0.437 -0.667 -15.331 1.00 0.00 H new ATOM 0 HB THR A 116 0.499 -3.659 -15.419 1.00 0.00 H new ATOM 0 HG1 THR A 116 2.069 -3.247 -17.134 1.00 0.00 H new ATOM 0 HG21 THR A 116 -0.182 -3.307 -17.781 1.00 0.00 H new ATOM 0 HG22 THR A 116 -1.370 -2.622 -16.646 1.00 0.00 H new ATOM 0 HG23 THR A 116 -0.232 -1.551 -17.497 1.00 0.00 H new ATOM 1830 N LEU A 117 -1.791 -0.869 -14.226 1.00 0.00 N ATOM 1831 CA LEU A 117 -2.974 -0.683 -13.398 1.00 0.00 C ATOM 1832 C LEU A 117 -4.156 -0.416 -14.330 1.00 0.00 C ATOM 1833 O LEU A 117 -4.194 0.638 -14.968 1.00 0.00 O ATOM 1834 CB LEU A 117 -2.680 0.498 -12.457 1.00 0.00 C ATOM 1835 CG LEU A 117 -3.885 0.985 -11.632 1.00 0.00 C ATOM 1836 CD1 LEU A 117 -3.620 0.847 -10.138 1.00 0.00 C ATOM 1837 CD2 LEU A 117 -4.224 2.444 -11.942 1.00 0.00 C ATOM 0 H LEU A 117 -1.745 -0.206 -15.000 1.00 0.00 H new ATOM 0 HA LEU A 117 -3.221 -1.555 -12.792 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -1.883 0.208 -11.772 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -2.304 1.331 -13.050 1.00 0.00 H new ATOM 0 HG LEU A 117 -4.731 0.356 -11.910 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -4.488 1.199 -9.580 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -3.433 -0.199 -9.897 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -2.749 1.443 -9.866 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -5.079 2.754 -11.342 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -3.367 3.075 -11.706 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -4.467 2.544 -13.000 1.00 0.00 H new ATOM 1849 N THR A 118 -5.078 -1.380 -14.465 1.00 0.00 N ATOM 1850 CA THR A 118 -6.139 -1.313 -15.467 1.00 0.00 C ATOM 1851 C THR A 118 -7.518 -1.612 -14.871 1.00 0.00 C ATOM 1852 O THR A 118 -7.692 -2.520 -14.056 1.00 0.00 O ATOM 1853 CB THR A 118 -5.797 -2.254 -16.630 1.00 0.00 C ATOM 1854 OG1 THR A 118 -4.546 -1.870 -17.167 1.00 0.00 O ATOM 1855 CG2 THR A 118 -6.833 -2.194 -17.757 1.00 0.00 C ATOM 0 H THR A 118 -5.106 -2.219 -13.886 1.00 0.00 H new ATOM 0 HA THR A 118 -6.197 -0.293 -15.846 1.00 0.00 H new ATOM 0 HB THR A 118 -5.781 -3.270 -16.237 1.00 0.00 H new ATOM 0 HG1 THR A 118 -4.313 -2.464 -17.911 1.00 0.00 H new ATOM 0 HG21 THR A 118 -6.543 -2.878 -18.554 1.00 0.00 H new ATOM 0 HG22 THR A 118 -7.810 -2.482 -17.369 1.00 0.00 H new ATOM 0 HG23 THR A 118 -6.884 -1.179 -18.151 1.00 0.00 H new ATOM 1863 N HIS A 119 -8.512 -0.831 -15.306 1.00 0.00 N ATOM 1864 CA HIS A 119 -9.919 -1.036 -15.012 1.00 0.00 C ATOM 1865 C HIS A 119 -10.691 -0.732 -16.293 1.00 0.00 C ATOM 1866 O HIS A 119 -11.041 0.419 -16.556 1.00 0.00 O ATOM 1867 CB HIS A 119 -10.353 -0.137 -13.847 1.00 0.00 C ATOM 1868 CG HIS A 119 -11.826 -0.224 -13.538 1.00 0.00 C ATOM 1869 ND1 HIS A 119 -12.466 -1.244 -12.857 1.00 0.00 N ATOM 1870 CD2 HIS A 119 -12.767 0.694 -13.917 1.00 0.00 C ATOM 1871 CE1 HIS A 119 -13.776 -0.942 -12.821 1.00 0.00 C ATOM 1872 NE2 HIS A 119 -13.982 0.230 -13.454 1.00 0.00 N ATOM 0 H HIS A 119 -8.345 -0.013 -15.892 1.00 0.00 H new ATOM 0 HA HIS A 119 -10.119 -2.061 -14.699 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -9.786 -0.410 -12.957 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -10.099 0.897 -14.082 1.00 0.00 H new ATOM 0 HD1 HIS A 119 -12.026 -2.072 -12.456 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -12.593 1.605 -14.471 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -14.543 -1.544 -12.357 1.00 0.00 H new ATOM 1881 N GLY A 120 -10.928 -1.769 -17.098 1.00 0.00 N ATOM 1882 CA GLY A 120 -11.613 -1.650 -18.373 1.00 0.00 C ATOM 1883 C GLY A 120 -10.887 -0.667 -19.289 1.00 0.00 C ATOM 1884 O GLY A 120 -9.729 -0.880 -19.638 1.00 0.00 O ATOM 0 H GLY A 120 -10.644 -2.723 -16.875 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -11.670 -2.627 -18.853 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -12.637 -1.314 -18.211 1.00 0.00 H new ATOM 1888 N THR A 121 -11.569 0.414 -19.666 1.00 0.00 N ATOM 1889 CA THR A 121 -11.066 1.436 -20.564 1.00 0.00 C ATOM 1890 C THR A 121 -9.830 2.127 -19.984 1.00 0.00 C ATOM 1891 O THR A 121 -8.868 2.400 -20.702 1.00 0.00 O ATOM 1892 CB THR A 121 -12.200 2.448 -20.779 1.00 0.00 C ATOM 1893 OG1 THR A 121 -12.870 2.649 -19.547 1.00 0.00 O ATOM 1894 CG2 THR A 121 -13.227 1.917 -21.780 1.00 0.00 C ATOM 0 H THR A 121 -12.517 0.602 -19.340 1.00 0.00 H new ATOM 0 HA THR A 121 -10.760 0.988 -21.510 1.00 0.00 H new ATOM 0 HB THR A 121 -11.766 3.373 -21.159 1.00 0.00 H new ATOM 0 HG1 THR A 121 -13.596 3.295 -19.671 1.00 0.00 H new ATOM 0 HG21 THR A 121 -14.019 2.654 -21.914 1.00 0.00 H new ATOM 0 HG22 THR A 121 -12.740 1.730 -22.737 1.00 0.00 H new ATOM 0 HG23 THR A 121 -13.655 0.988 -21.404 1.00 0.00 H new ATOM 1902 N ALA A 122 -9.868 2.455 -18.691 1.00 0.00 N ATOM 1903 CA ALA A 122 -8.887 3.340 -18.085 1.00 0.00 C ATOM 1904 C ALA A 122 -7.584 2.595 -17.776 1.00 0.00 C ATOM 1905 O ALA A 122 -7.211 2.428 -16.618 1.00 0.00 O ATOM 1906 CB ALA A 122 -9.503 4.014 -16.855 1.00 0.00 C ATOM 0 H ALA A 122 -10.578 2.114 -18.043 1.00 0.00 H new ATOM 0 HA ALA A 122 -8.615 4.126 -18.790 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -8.769 4.678 -16.398 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -10.377 4.591 -17.156 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -9.801 3.253 -16.134 1.00 0.00 H new ATOM 1912 N VAL A 123 -6.855 2.183 -18.812 1.00 0.00 N ATOM 1913 CA VAL A 123 -5.503 1.650 -18.678 1.00 0.00 C ATOM 1914 C VAL A 123 -4.621 2.731 -18.041 1.00 0.00 C ATOM 1915 O VAL A 123 -4.766 3.914 -18.353 1.00 0.00 O ATOM 1916 CB VAL A 123 -4.977 1.236 -20.062 1.00 0.00 C ATOM 1917 CG1 VAL A 123 -3.521 0.760 -19.965 1.00 0.00 C ATOM 1918 CG2 VAL A 123 -5.824 0.116 -20.687 1.00 0.00 C ATOM 0 H VAL A 123 -7.190 2.211 -19.775 1.00 0.00 H new ATOM 0 HA VAL A 123 -5.493 0.766 -18.041 1.00 0.00 H new ATOM 0 HB VAL A 123 -5.040 2.118 -20.700 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -3.166 0.471 -20.954 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -2.899 1.567 -19.578 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -3.462 -0.097 -19.294 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -5.417 -0.146 -21.664 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -5.804 -0.760 -20.039 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -6.852 0.459 -20.802 1.00 0.00 H new ATOM 1928 N CYS A 124 -3.764 2.387 -17.072 1.00 0.00 N ATOM 1929 CA CYS A 124 -2.854 3.344 -16.449 1.00 0.00 C ATOM 1930 C CYS A 124 -1.542 2.656 -16.091 1.00 0.00 C ATOM 1931 O CYS A 124 -1.501 1.429 -15.970 1.00 0.00 O ATOM 1932 CB CYS A 124 -3.458 3.939 -15.172 1.00 0.00 C ATOM 1933 SG CYS A 124 -5.225 4.295 -15.343 1.00 0.00 S ATOM 0 H CYS A 124 -3.685 1.440 -16.702 1.00 0.00 H new ATOM 0 HA CYS A 124 -2.679 4.147 -17.165 1.00 0.00 H new ATOM 0 HB2 CYS A 124 -3.309 3.244 -14.345 1.00 0.00 H new ATOM 0 HB3 CYS A 124 -2.929 4.857 -14.917 1.00 0.00 H new ATOM 0 HG CYS A 124 -5.433 5.564 -15.151 1.00 0.00 H new ATOM 1939 N THR A 125 -0.486 3.450 -15.890 1.00 0.00 N ATOM 1940 CA THR A 125 0.829 2.935 -15.551 1.00 0.00 C ATOM 1941 C THR A 125 1.524 3.846 -14.537 1.00 0.00 C ATOM 1942 O THR A 125 1.256 5.051 -14.479 1.00 0.00 O ATOM 1943 CB THR A 125 1.685 2.798 -16.822 1.00 0.00 C ATOM 1944 OG1 THR A 125 1.590 3.975 -17.599 1.00 0.00 O ATOM 1945 CG2 THR A 125 1.250 1.625 -17.702 1.00 0.00 C ATOM 0 H THR A 125 -0.527 4.467 -15.959 1.00 0.00 H new ATOM 0 HA THR A 125 0.709 1.951 -15.098 1.00 0.00 H new ATOM 0 HB THR A 125 2.707 2.624 -16.486 1.00 0.00 H new ATOM 0 HG1 THR A 125 2.139 3.880 -18.405 1.00 0.00 H new ATOM 0 HG21 THR A 125 1.888 1.576 -18.584 1.00 0.00 H new ATOM 0 HG22 THR A 125 1.337 0.696 -17.139 1.00 0.00 H new ATOM 0 HG23 THR A 125 0.214 1.766 -18.011 1.00 0.00 H new ATOM 1953 N ARG A 126 2.448 3.260 -13.767 1.00 0.00 N ATOM 1954 CA ARG A 126 3.584 3.978 -13.213 1.00 0.00 C ATOM 1955 C ARG A 126 4.842 3.153 -13.458 1.00 0.00 C ATOM 1956 O ARG A 126 4.774 1.984 -13.841 1.00 0.00 O ATOM 1957 CB ARG A 126 3.442 4.302 -11.715 1.00 0.00 C ATOM 1958 CG ARG A 126 2.100 4.921 -11.325 1.00 0.00 C ATOM 1959 CD ARG A 126 2.194 5.541 -9.922 1.00 0.00 C ATOM 1960 NE ARG A 126 0.891 6.063 -9.475 1.00 0.00 N ATOM 1961 CZ ARG A 126 0.651 7.223 -8.844 1.00 0.00 C ATOM 1962 NH1 ARG A 126 1.555 8.200 -8.792 1.00 0.00 N ATOM 1963 NH2 ARG A 126 -0.522 7.413 -8.241 1.00 0.00 N ATOM 0 H ARG A 126 2.422 2.272 -13.514 1.00 0.00 H new ATOM 0 HA ARG A 126 3.641 4.943 -13.718 1.00 0.00 H new ATOM 0 HB2 ARG A 126 3.585 3.385 -11.143 1.00 0.00 H new ATOM 0 HB3 ARG A 126 4.241 4.986 -11.427 1.00 0.00 H new ATOM 0 HG2 ARG A 126 1.818 5.684 -12.050 1.00 0.00 H new ATOM 0 HG3 ARG A 126 1.320 4.160 -11.343 1.00 0.00 H new ATOM 0 HD2 ARG A 126 2.549 4.791 -9.215 1.00 0.00 H new ATOM 0 HD3 ARG A 126 2.928 6.347 -9.927 1.00 0.00 H new ATOM 0 HE ARG A 126 0.079 5.476 -9.667 1.00 0.00 H new ATOM 0 HH11 ARG A 126 2.463 8.079 -9.241 1.00 0.00 H new ATOM 0 HH12 ARG A 126 1.339 9.069 -8.304 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -1.230 6.679 -8.261 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -0.711 8.292 -7.759 1.00 0.00 H new ATOM 1977 N THR A 127 5.985 3.778 -13.207 1.00 0.00 N ATOM 1978 CA THR A 127 7.300 3.220 -13.431 1.00 0.00 C ATOM 1979 C THR A 127 8.159 3.679 -12.260 1.00 0.00 C ATOM 1980 O THR A 127 8.284 4.883 -12.019 1.00 0.00 O ATOM 1981 CB THR A 127 7.839 3.688 -14.795 1.00 0.00 C ATOM 1982 OG1 THR A 127 7.069 4.756 -15.315 1.00 0.00 O ATOM 1983 CG2 THR A 127 7.785 2.547 -15.811 1.00 0.00 C ATOM 0 H THR A 127 6.016 4.724 -12.827 1.00 0.00 H new ATOM 0 HA THR A 127 7.295 2.131 -13.472 1.00 0.00 H new ATOM 0 HB THR A 127 8.866 4.015 -14.634 1.00 0.00 H new ATOM 0 HG1 THR A 127 7.215 4.824 -16.282 1.00 0.00 H new ATOM 0 HG21 THR A 127 8.170 2.895 -16.770 1.00 0.00 H new ATOM 0 HG22 THR A 127 8.393 1.715 -15.456 1.00 0.00 H new ATOM 0 HG23 THR A 127 6.753 2.216 -15.932 1.00 0.00 H new ATOM 1991 N TYR A 128 8.673 2.715 -11.497 1.00 0.00 N ATOM 1992 CA TYR A 128 9.465 2.909 -10.295 1.00 0.00 C ATOM 1993 C TYR A 128 10.904 2.445 -10.556 1.00 0.00 C ATOM 1994 O TYR A 128 11.166 1.721 -11.514 1.00 0.00 O ATOM 1995 CB TYR A 128 8.839 2.108 -9.142 1.00 0.00 C ATOM 1996 CG TYR A 128 7.706 2.732 -8.341 1.00 0.00 C ATOM 1997 CD1 TYR A 128 6.902 3.776 -8.845 1.00 0.00 C ATOM 1998 CD2 TYR A 128 7.423 2.203 -7.069 1.00 0.00 C ATOM 1999 CE1 TYR A 128 5.897 4.346 -8.040 1.00 0.00 C ATOM 2000 CE2 TYR A 128 6.396 2.748 -6.284 1.00 0.00 C ATOM 2001 CZ TYR A 128 5.683 3.867 -6.739 1.00 0.00 C ATOM 2002 OH TYR A 128 4.783 4.476 -5.916 1.00 0.00 O ATOM 0 H TYR A 128 8.538 1.728 -11.717 1.00 0.00 H new ATOM 0 HA TYR A 128 9.481 3.964 -10.022 1.00 0.00 H new ATOM 0 HB2 TYR A 128 8.472 1.169 -9.555 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.637 1.858 -8.443 1.00 0.00 H new ATOM 0 HD1 TYR A 128 7.058 4.139 -9.850 1.00 0.00 H new ATOM 0 HD2 TYR A 128 8.001 1.371 -6.694 1.00 0.00 H new ATOM 0 HE1 TYR A 128 5.290 5.153 -8.425 1.00 0.00 H new ATOM 0 HE2 TYR A 128 6.154 2.306 -5.329 1.00 0.00 H new ATOM 0 HH TYR A 128 5.158 4.542 -5.013 1.00 0.00 H new ATOM 2012 N GLU A 129 11.826 2.858 -9.687 1.00 0.00 N ATOM 2013 CA GLU A 129 13.265 2.655 -9.763 1.00 0.00 C ATOM 2014 C GLU A 129 13.747 2.184 -8.391 1.00 0.00 C ATOM 2015 O GLU A 129 13.473 2.864 -7.399 1.00 0.00 O ATOM 2016 CB GLU A 129 13.886 4.010 -10.118 1.00 0.00 C ATOM 2017 CG GLU A 129 15.416 4.009 -10.156 1.00 0.00 C ATOM 2018 CD GLU A 129 15.906 5.386 -10.569 1.00 0.00 C ATOM 2019 OE1 GLU A 129 15.873 5.650 -11.795 1.00 0.00 O ATOM 2020 OE2 GLU A 129 16.239 6.157 -9.644 1.00 0.00 O ATOM 0 H GLU A 129 11.563 3.381 -8.852 1.00 0.00 H new ATOM 0 HA GLU A 129 13.544 1.911 -10.509 1.00 0.00 H new ATOM 0 HB2 GLU A 129 13.510 4.325 -11.091 1.00 0.00 H new ATOM 0 HB3 GLU A 129 13.552 4.751 -9.392 1.00 0.00 H new ATOM 0 HG2 GLU A 129 15.816 3.746 -9.177 1.00 0.00 H new ATOM 0 HG3 GLU A 129 15.774 3.257 -10.859 1.00 0.00 H new ATOM 2027 N LYS A 130 14.417 1.025 -8.318 1.00 0.00 N ATOM 2028 CA LYS A 130 14.903 0.485 -7.051 1.00 0.00 C ATOM 2029 C LYS A 130 15.981 1.422 -6.508 1.00 0.00 C ATOM 2030 O LYS A 130 17.060 1.513 -7.086 1.00 0.00 O ATOM 2031 CB LYS A 130 15.445 -0.945 -7.232 1.00 0.00 C ATOM 2032 CG LYS A 130 15.698 -1.621 -5.875 1.00 0.00 C ATOM 2033 CD LYS A 130 16.341 -3.006 -6.055 1.00 0.00 C ATOM 2034 CE LYS A 130 16.570 -3.677 -4.689 1.00 0.00 C ATOM 2035 NZ LYS A 130 17.252 -4.989 -4.797 1.00 0.00 N ATOM 0 H LYS A 130 14.633 0.445 -9.129 1.00 0.00 H new ATOM 0 HA LYS A 130 14.082 0.423 -6.337 1.00 0.00 H new ATOM 0 HB2 LYS A 130 14.733 -1.536 -7.808 1.00 0.00 H new ATOM 0 HB3 LYS A 130 16.372 -0.915 -7.805 1.00 0.00 H new ATOM 0 HG2 LYS A 130 16.348 -0.991 -5.268 1.00 0.00 H new ATOM 0 HG3 LYS A 130 14.757 -1.722 -5.335 1.00 0.00 H new ATOM 0 HD2 LYS A 130 15.698 -3.634 -6.672 1.00 0.00 H new ATOM 0 HD3 LYS A 130 17.290 -2.907 -6.582 1.00 0.00 H new ATOM 0 HE2 LYS A 130 17.165 -3.015 -4.060 1.00 0.00 H new ATOM 0 HE3 LYS A 130 15.610 -3.812 -4.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 17.664 -5.243 -3.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 16.564 -5.716 -5.080 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 18.007 -4.930 -5.510 1.00 0.00 H new ATOM 2049 N GLN A 131 15.689 2.118 -5.409 1.00 0.00 N ATOM 2050 CA GLN A 131 16.567 3.136 -4.859 1.00 0.00 C ATOM 2051 C GLN A 131 17.404 2.564 -3.711 1.00 0.00 C ATOM 2052 O GLN A 131 18.550 2.964 -3.527 1.00 0.00 O ATOM 2053 CB GLN A 131 15.722 4.339 -4.419 1.00 0.00 C ATOM 2054 CG GLN A 131 16.503 5.652 -4.579 1.00 0.00 C ATOM 2055 CD GLN A 131 16.736 6.116 -6.022 1.00 0.00 C ATOM 2056 OE1 GLN A 131 17.551 7.007 -6.236 1.00 0.00 O ATOM 2057 NE2 GLN A 131 16.023 5.571 -7.005 1.00 0.00 N ATOM 0 H GLN A 131 14.829 1.986 -4.876 1.00 0.00 H new ATOM 0 HA GLN A 131 17.271 3.472 -5.620 1.00 0.00 H new ATOM 0 HB2 GLN A 131 14.808 4.381 -5.011 1.00 0.00 H new ATOM 0 HB3 GLN A 131 15.422 4.215 -3.378 1.00 0.00 H new ATOM 0 HG2 GLN A 131 15.969 6.438 -4.046 1.00 0.00 H new ATOM 0 HG3 GLN A 131 17.472 5.539 -4.092 1.00 0.00 H new ATOM 0 HE21 GLN A 131 15.352 4.831 -6.799 1.00 0.00 H new ATOM 0 HE22 GLN A 131 16.148 5.893 -7.965 1.00 0.00 H new ATOM 2066 N ALA A 132 16.837 1.633 -2.935 1.00 0.00 N ATOM 2067 CA ALA A 132 17.541 0.917 -1.879 1.00 0.00 C ATOM 2068 C ALA A 132 17.057 -0.530 -1.819 1.00 0.00 C ATOM 2069 O ALA A 132 16.178 -0.931 -2.580 1.00 0.00 O ATOM 2070 CB ALA A 132 17.335 1.626 -0.536 1.00 0.00 C ATOM 2071 OXT ALA A 132 17.612 -1.397 -0.900 1.00 0.00 O ATOM 0 H ALA A 132 15.860 1.356 -3.029 1.00 0.00 H new ATOM 0 HA ALA A 132 18.609 0.910 -2.097 1.00 0.00 H new ATOM 0 HB1 ALA A 132 17.865 1.083 0.247 1.00 0.00 H new ATOM 0 HB2 ALA A 132 17.722 2.643 -0.598 1.00 0.00 H new ATOM 0 HB3 ALA A 132 16.271 1.656 -0.300 1.00 0.00 H new