USER MOD reduce.3.24.130724 H: found=0, std=0, add=1367, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1367 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 157 HIS : no HD1:sc= -0.0749 X(o=-0.093,f=-0.056) USER MOD Set 1.2: A 158 HIS : no HD1:sc= -0.0183 X(o=-0.093,f=-0.056) USER MOD Set 2.1: A 122 GLN : amide:sc= -0.194 K(o=0.66,f=-0.48) USER MOD Set 2.2: A 134 THR OG1 : rot -135:sc= 0.853 USER MOD Set 3.1: A 34 SER OG : rot -46:sc= 1.01 USER MOD Set 3.2: A 85 THR OG1 : rot 145:sc= 1.97 USER MOD Set 4.1: A 3 GLN : amide:sc= -0.715 K(o=0.47,f=-10!) USER MOD Set 4.2: A 151 LYS NZ :NH3+ -178:sc= 1.19 (180deg=-0.00863) USER MOD Single : A 1 MET CE :methyl 161:sc= -0.14 (180deg=-0.645) USER MOD Single : A 1 MET N :NH3+ -177:sc= 1.15 (180deg=1.12) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0424 USER MOD Single : A 9 SER OG : rot -113:sc= 0.0816 USER MOD Single : A 10 SER OG : rot -113:sc= 0.0696 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 141:sc= -1.93! (180deg=-4.52!) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 33 TYR OH : rot 180:sc=-0.000708 USER MOD Single : A 36 GLN : amide:sc= -0.0117 X(o=-0.012,f=-0.012) USER MOD Single : A 39 LYS NZ :NH3+ -100:sc= -0.712 (180deg=-2.61!) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 GLN : amide:sc= 0.978 K(o=0.98,f=0) USER MOD Single : A 57 THR OG1 : rot 38:sc= 0.127 USER MOD Single : A 61 LYS NZ :NH3+ 146:sc= 0.00276 (180deg=-2.24!) USER MOD Single : A 67 ASN : amide:sc= 0.165 K(o=0.16,f=-1.7) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 GLN : amide:sc= -0.141 X(o=-0.14,f=-0.0051) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0.135 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ -140:sc= 1.47 (180deg=-0.421) USER MOD Single : A 100 LYS NZ :NH3+ -177:sc= 1.6 (180deg=1.53) USER MOD Single : A 110 TYR OH : rot 180:sc= -0.0332 USER MOD Single : A 111 ASN : amide:sc= -1.81 K(o=-1.8,f=-8!) USER MOD Single : A 112 ASN : amide:sc= -2.03 K(o=-2,f=-9.4!) USER MOD Single : A 113 LYS NZ :NH3+ -171:sc= -0.0186 (180deg=-0.153) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 GLN :FLIP amide:sc= 0 F(o=-0.79,f=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0.437 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ 175:sc= 1.25 (180deg=1.23) USER MOD Single : A 144 GLN : amide:sc= -0.195 K(o=-0.19,f=-2.6!) USER MOD Single : A 154 SER OG : rot 87:sc= 0.424 USER MOD Single : A 159 HIS : no HD1:sc= -0.145 K(o=-0.14,f=-1.7) USER MOD Single : A 160 HIS : no HD1:sc= 0.139 K(o=0.14,f=-3.2!) USER MOD Single : A 161 HIS : no HD1:sc= -0.0898 X(o=-0.09,f=-0.09) USER MOD Single : A 162 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -4.191 -2.399 18.991 1.00 12.31 N ATOM 2 CA MET A 1 -3.794 -3.826 19.142 1.00 41.40 C ATOM 3 C MET A 1 -3.412 -4.465 17.794 1.00 4.31 C ATOM 4 O MET A 1 -2.515 -5.304 17.736 1.00 32.31 O ATOM 5 CB MET A 1 -4.928 -4.633 19.798 1.00 21.41 C ATOM 6 CG MET A 1 -6.206 -4.702 18.965 1.00 34.25 C ATOM 7 SD MET A 1 -7.522 -5.641 19.770 1.00 44.53 S ATOM 8 CE MET A 1 -7.770 -4.682 21.265 1.00 4.22 C ATOM 0 H1 MET A 1 -4.391 -1.993 19.927 1.00 12.31 H new ATOM 0 H2 MET A 1 -3.417 -1.869 18.542 1.00 12.31 H new ATOM 0 H3 MET A 1 -5.043 -2.337 18.398 1.00 12.31 H new ATOM 0 HA MET A 1 -2.913 -3.848 19.784 1.00 41.40 H new ATOM 0 HB2 MET A 1 -4.575 -5.647 19.988 1.00 21.41 H new ATOM 0 HB3 MET A 1 -5.162 -4.190 20.766 1.00 21.41 H new ATOM 0 HG2 MET A 1 -6.559 -3.690 18.766 1.00 34.25 H new ATOM 0 HG3 MET A 1 -5.980 -5.157 18.000 1.00 34.25 H new ATOM 0 HE1 MET A 1 -8.744 -4.919 21.692 1.00 4.22 H new ATOM 0 HE2 MET A 1 -6.989 -4.924 21.986 1.00 4.22 H new ATOM 0 HE3 MET A 1 -7.727 -3.619 21.027 1.00 4.22 H new ATOM 20 N SER A 2 -4.095 -4.064 16.716 1.00 61.43 N ATOM 21 CA SER A 2 -3.862 -4.645 15.381 1.00 44.42 C ATOM 22 C SER A 2 -3.324 -3.590 14.409 1.00 43.54 C ATOM 23 O SER A 2 -4.030 -2.651 14.053 1.00 72.14 O ATOM 24 CB SER A 2 -5.168 -5.242 14.830 1.00 13.53 C ATOM 25 OG SER A 2 -5.722 -6.188 15.733 1.00 35.43 O ATOM 0 H SER A 2 -4.814 -3.341 16.738 1.00 61.43 H new ATOM 0 HA SER A 2 -3.117 -5.434 15.480 1.00 44.42 H new ATOM 0 HB2 SER A 2 -5.888 -4.444 14.649 1.00 13.53 H new ATOM 0 HB3 SER A 2 -4.975 -5.721 13.870 1.00 13.53 H new ATOM 0 HG SER A 2 -6.552 -6.550 15.359 1.00 35.43 H new ATOM 31 N GLN A 3 -2.077 -3.755 13.974 1.00 13.15 N ATOM 32 CA GLN A 3 -1.401 -2.756 13.130 1.00 34.54 C ATOM 33 C GLN A 3 -1.277 -3.247 11.677 1.00 52.40 C ATOM 34 O GLN A 3 -0.753 -4.331 11.424 1.00 25.30 O ATOM 35 CB GLN A 3 -0.018 -2.451 13.741 1.00 42.45 C ATOM 36 CG GLN A 3 0.760 -1.292 13.102 1.00 14.23 C ATOM 37 CD GLN A 3 1.688 -1.723 11.971 1.00 51.42 C ATOM 38 OE1 GLN A 3 2.818 -2.135 12.207 1.00 24.11 O ATOM 39 NE2 GLN A 3 1.251 -1.574 10.739 1.00 15.23 N ATOM 0 H GLN A 3 -1.507 -4.573 14.190 1.00 13.15 H new ATOM 0 HA GLN A 3 -1.993 -1.841 13.101 1.00 34.54 H new ATOM 0 HB2 GLN A 3 -0.151 -2.232 14.800 1.00 42.45 H new ATOM 0 HB3 GLN A 3 0.592 -3.352 13.676 1.00 42.45 H new ATOM 0 HG2 GLN A 3 0.051 -0.559 12.718 1.00 14.23 H new ATOM 0 HG3 GLN A 3 1.348 -0.793 13.872 1.00 14.23 H new ATOM 0 HE21 GLN A 3 0.306 -1.229 10.571 1.00 15.23 H new ATOM 0 HE22 GLN A 3 1.857 -1.803 9.952 1.00 15.23 H new ATOM 48 N ILE A 4 -1.749 -2.441 10.722 1.00 22.41 N ATOM 49 CA ILE A 4 -1.685 -2.810 9.298 1.00 61.41 C ATOM 50 C ILE A 4 -0.697 -1.910 8.533 1.00 75.12 C ATOM 51 O ILE A 4 -0.676 -0.687 8.710 1.00 5.42 O ATOM 52 CB ILE A 4 -3.086 -2.753 8.623 1.00 61.13 C ATOM 53 CG1 ILE A 4 -3.010 -3.260 7.169 1.00 41.10 C ATOM 54 CG2 ILE A 4 -3.664 -1.336 8.672 1.00 13.44 C ATOM 55 CD1 ILE A 4 -4.360 -3.444 6.502 1.00 5.13 C ATOM 0 H ILE A 4 -2.178 -1.533 10.903 1.00 22.41 H new ATOM 0 HA ILE A 4 -1.328 -3.839 9.255 1.00 61.41 H new ATOM 0 HB ILE A 4 -3.755 -3.408 9.181 1.00 61.13 H new ATOM 0 HG12 ILE A 4 -2.420 -2.557 6.581 1.00 41.10 H new ATOM 0 HG13 ILE A 4 -2.478 -4.211 7.155 1.00 41.10 H new ATOM 0 HG21 ILE A 4 -4.643 -1.326 8.193 1.00 13.44 H new ATOM 0 HG22 ILE A 4 -3.764 -1.020 9.710 1.00 13.44 H new ATOM 0 HG23 ILE A 4 -2.996 -0.652 8.147 1.00 13.44 H new ATOM 0 HD11 ILE A 4 -4.216 -3.803 5.483 1.00 5.13 H new ATOM 0 HD12 ILE A 4 -4.947 -4.171 7.063 1.00 5.13 H new ATOM 0 HD13 ILE A 4 -4.888 -2.491 6.480 1.00 5.13 H new ATOM 67 N PHE A 5 0.141 -2.534 7.710 1.00 55.42 N ATOM 68 CA PHE A 5 1.190 -1.826 6.966 1.00 2.35 C ATOM 69 C PHE A 5 0.767 -1.589 5.511 1.00 3.43 C ATOM 70 O PHE A 5 0.487 -2.537 4.772 1.00 40.10 O ATOM 71 CB PHE A 5 2.487 -2.647 7.016 1.00 4.23 C ATOM 72 CG PHE A 5 3.687 -1.985 6.381 1.00 65.32 C ATOM 73 CD1 PHE A 5 4.443 -1.064 7.090 1.00 63.12 C ATOM 74 CD2 PHE A 5 4.068 -2.300 5.087 1.00 2.20 C ATOM 75 CE1 PHE A 5 5.548 -0.467 6.519 1.00 70.20 C ATOM 76 CE2 PHE A 5 5.177 -1.707 4.512 1.00 25.53 C ATOM 77 CZ PHE A 5 5.917 -0.789 5.228 1.00 0.22 C ATOM 0 H PHE A 5 0.116 -3.539 7.537 1.00 55.42 H new ATOM 0 HA PHE A 5 1.355 -0.853 7.428 1.00 2.35 H new ATOM 0 HB2 PHE A 5 2.721 -2.866 8.058 1.00 4.23 H new ATOM 0 HB3 PHE A 5 2.314 -3.602 6.521 1.00 4.23 H new ATOM 0 HD1 PHE A 5 4.163 -0.811 8.102 1.00 63.12 H new ATOM 0 HD2 PHE A 5 3.492 -3.017 4.521 1.00 2.20 H new ATOM 0 HE1 PHE A 5 6.124 0.252 7.082 1.00 70.20 H new ATOM 0 HE2 PHE A 5 5.464 -1.962 3.503 1.00 25.53 H new ATOM 0 HZ PHE A 5 6.782 -0.323 4.780 1.00 0.22 H new ATOM 87 N VAL A 6 0.724 -0.323 5.101 1.00 41.21 N ATOM 88 CA VAL A 6 0.323 0.030 3.738 1.00 44.13 C ATOM 89 C VAL A 6 1.305 1.032 3.100 1.00 63.43 C ATOM 90 O VAL A 6 1.712 2.015 3.726 1.00 64.42 O ATOM 91 CB VAL A 6 -1.116 0.609 3.709 1.00 34.33 C ATOM 92 CG1 VAL A 6 -1.213 1.899 4.520 1.00 63.03 C ATOM 93 CG2 VAL A 6 -1.596 0.822 2.271 1.00 34.23 C ATOM 0 H VAL A 6 0.961 0.475 5.691 1.00 41.21 H new ATOM 0 HA VAL A 6 0.342 -0.889 3.152 1.00 44.13 H new ATOM 0 HB VAL A 6 -1.775 -0.123 4.176 1.00 34.33 H new ATOM 0 HG11 VAL A 6 -2.234 2.279 4.479 1.00 63.03 H new ATOM 0 HG12 VAL A 6 -0.942 1.698 5.556 1.00 63.03 H new ATOM 0 HG13 VAL A 6 -0.533 2.642 4.104 1.00 63.03 H new ATOM 0 HG21 VAL A 6 -2.607 1.228 2.281 1.00 34.23 H new ATOM 0 HG22 VAL A 6 -0.930 1.520 1.765 1.00 34.23 H new ATOM 0 HG23 VAL A 6 -1.593 -0.131 1.742 1.00 34.23 H new ATOM 103 N VAL A 7 1.694 0.762 1.855 1.00 74.22 N ATOM 104 CA VAL A 7 2.618 1.622 1.109 1.00 4.53 C ATOM 105 C VAL A 7 1.928 2.264 -0.099 1.00 72.13 C ATOM 106 O VAL A 7 1.265 1.584 -0.875 1.00 53.34 O ATOM 107 CB VAL A 7 3.850 0.824 0.607 1.00 74.12 C ATOM 108 CG1 VAL A 7 4.765 1.707 -0.241 1.00 44.51 C ATOM 109 CG2 VAL A 7 4.617 0.219 1.778 1.00 64.41 C ATOM 0 H VAL A 7 1.380 -0.057 1.334 1.00 74.22 H new ATOM 0 HA VAL A 7 2.945 2.401 1.798 1.00 4.53 H new ATOM 0 HB VAL A 7 3.490 0.010 -0.022 1.00 74.12 H new ATOM 0 HG11 VAL A 7 5.621 1.124 -0.580 1.00 44.51 H new ATOM 0 HG12 VAL A 7 4.214 2.079 -1.105 1.00 44.51 H new ATOM 0 HG13 VAL A 7 5.114 2.549 0.357 1.00 44.51 H new ATOM 0 HG21 VAL A 7 5.477 -0.336 1.402 1.00 64.41 H new ATOM 0 HG22 VAL A 7 4.960 1.015 2.439 1.00 64.41 H new ATOM 0 HG23 VAL A 7 3.964 -0.455 2.331 1.00 64.41 H new ATOM 119 N PHE A 8 2.086 3.572 -0.258 1.00 40.11 N ATOM 120 CA PHE A 8 1.559 4.281 -1.430 1.00 21.44 C ATOM 121 C PHE A 8 2.712 4.778 -2.317 1.00 63.22 C ATOM 122 O PHE A 8 3.603 5.489 -1.854 1.00 31.11 O ATOM 123 CB PHE A 8 0.679 5.464 -0.991 1.00 1.41 C ATOM 124 CG PHE A 8 -0.582 5.062 -0.255 1.00 63.53 C ATOM 125 CD1 PHE A 8 -0.541 4.718 1.088 1.00 61.32 C ATOM 126 CD2 PHE A 8 -1.810 5.037 -0.905 1.00 45.51 C ATOM 127 CE1 PHE A 8 -1.693 4.358 1.764 1.00 64.10 C ATOM 128 CE2 PHE A 8 -2.964 4.677 -0.233 1.00 0.34 C ATOM 129 CZ PHE A 8 -2.905 4.336 1.103 1.00 73.34 C ATOM 0 H PHE A 8 2.575 4.169 0.408 1.00 40.11 H new ATOM 0 HA PHE A 8 0.948 3.587 -2.007 1.00 21.44 H new ATOM 0 HB2 PHE A 8 1.267 6.121 -0.349 1.00 1.41 H new ATOM 0 HB3 PHE A 8 0.403 6.043 -1.872 1.00 1.41 H new ATOM 0 HD1 PHE A 8 0.403 4.731 1.613 1.00 61.32 H new ATOM 0 HD2 PHE A 8 -1.864 5.303 -1.950 1.00 45.51 H new ATOM 0 HE1 PHE A 8 -1.644 4.094 2.810 1.00 64.10 H new ATOM 0 HE2 PHE A 8 -3.910 4.663 -0.753 1.00 0.34 H new ATOM 0 HZ PHE A 8 -3.804 4.053 1.630 1.00 73.34 H new ATOM 139 N SER A 9 2.712 4.388 -3.587 1.00 14.51 N ATOM 140 CA SER A 9 3.763 4.816 -4.522 1.00 53.31 C ATOM 141 C SER A 9 3.197 5.111 -5.911 1.00 5.43 C ATOM 142 O SER A 9 2.503 4.282 -6.499 1.00 13.33 O ATOM 143 CB SER A 9 4.863 3.752 -4.634 1.00 31.34 C ATOM 144 OG SER A 9 5.883 4.162 -5.537 1.00 0.14 O ATOM 0 H SER A 9 2.003 3.780 -3.997 1.00 14.51 H new ATOM 0 HA SER A 9 4.190 5.735 -4.121 1.00 53.31 H new ATOM 0 HB2 SER A 9 5.296 3.568 -3.651 1.00 31.34 H new ATOM 0 HB3 SER A 9 4.430 2.811 -4.973 1.00 31.34 H new ATOM 0 HG SER A 9 5.872 3.583 -6.328 1.00 0.14 H new ATOM 150 N SER A 10 3.504 6.292 -6.434 1.00 62.44 N ATOM 151 CA SER A 10 3.063 6.686 -7.780 1.00 75.31 C ATOM 152 C SER A 10 4.003 6.147 -8.868 1.00 34.34 C ATOM 153 O SER A 10 3.723 6.280 -10.063 1.00 22.23 O ATOM 154 CB SER A 10 2.957 8.215 -7.883 1.00 42.32 C ATOM 155 OG SER A 10 4.133 8.854 -7.404 1.00 40.42 O ATOM 0 H SER A 10 4.057 7.000 -5.951 1.00 62.44 H new ATOM 0 HA SER A 10 2.079 6.247 -7.943 1.00 75.31 H new ATOM 0 HB2 SER A 10 2.785 8.499 -8.921 1.00 42.32 H new ATOM 0 HB3 SER A 10 2.096 8.560 -7.311 1.00 42.32 H new ATOM 0 HG SER A 10 3.923 9.357 -6.589 1.00 40.42 H new ATOM 161 N ASP A 11 5.119 5.541 -8.456 1.00 44.14 N ATOM 162 CA ASP A 11 6.062 4.920 -9.394 1.00 53.52 C ATOM 163 C ASP A 11 5.976 3.381 -9.331 1.00 0.31 C ATOM 164 O ASP A 11 6.399 2.764 -8.348 1.00 34.15 O ATOM 165 CB ASP A 11 7.497 5.378 -9.098 1.00 33.54 C ATOM 166 CG ASP A 11 7.691 6.868 -9.327 1.00 53.35 C ATOM 167 OD1 ASP A 11 7.311 7.360 -10.412 1.00 2.24 O ATOM 168 OD2 ASP A 11 8.245 7.550 -8.439 1.00 73.54 O ATOM 0 H ASP A 11 5.394 5.466 -7.477 1.00 44.14 H new ATOM 0 HA ASP A 11 5.789 5.238 -10.400 1.00 53.52 H new ATOM 0 HB2 ASP A 11 7.746 5.137 -8.065 1.00 33.54 H new ATOM 0 HB3 ASP A 11 8.190 4.823 -9.731 1.00 33.54 H new ATOM 173 N PRO A 12 5.436 2.734 -10.390 1.00 3.21 N ATOM 174 CA PRO A 12 5.254 1.268 -10.421 1.00 24.34 C ATOM 175 C PRO A 12 6.576 0.496 -10.268 1.00 23.40 C ATOM 176 O PRO A 12 6.597 -0.630 -9.768 1.00 24.44 O ATOM 177 CB PRO A 12 4.624 1.010 -11.804 1.00 14.14 C ATOM 178 CG PRO A 12 4.950 2.224 -12.610 1.00 32.43 C ATOM 179 CD PRO A 12 4.965 3.370 -11.634 1.00 2.34 C ATOM 0 HA PRO A 12 4.640 0.922 -9.590 1.00 24.34 H new ATOM 0 HB2 PRO A 12 5.034 0.110 -12.263 1.00 14.14 H new ATOM 0 HB3 PRO A 12 3.546 0.866 -11.726 1.00 14.14 H new ATOM 0 HG2 PRO A 12 5.916 2.118 -13.104 1.00 32.43 H new ATOM 0 HG3 PRO A 12 4.208 2.386 -13.392 1.00 32.43 H new ATOM 0 HD2 PRO A 12 5.633 4.168 -11.958 1.00 2.34 H new ATOM 0 HD3 PRO A 12 3.976 3.811 -11.513 1.00 2.34 H new ATOM 187 N GLU A 13 7.676 1.110 -10.701 1.00 33.12 N ATOM 188 CA GLU A 13 9.005 0.501 -10.578 1.00 3.15 C ATOM 189 C GLU A 13 9.398 0.328 -9.103 1.00 74.52 C ATOM 190 O GLU A 13 9.949 -0.700 -8.714 1.00 32.14 O ATOM 191 CB GLU A 13 10.048 1.362 -11.296 1.00 14.03 C ATOM 192 CG GLU A 13 9.718 1.631 -12.757 1.00 3.53 C ATOM 193 CD GLU A 13 10.770 2.481 -13.445 1.00 14.50 C ATOM 194 OE1 GLU A 13 10.689 3.726 -13.362 1.00 30.12 O ATOM 195 OE2 GLU A 13 11.688 1.906 -14.067 1.00 63.24 O ATOM 0 H GLU A 13 7.676 2.030 -11.141 1.00 33.12 H new ATOM 0 HA GLU A 13 8.970 -0.485 -11.042 1.00 3.15 H new ATOM 0 HB2 GLU A 13 10.143 2.314 -10.773 1.00 14.03 H new ATOM 0 HB3 GLU A 13 11.018 0.867 -11.237 1.00 14.03 H new ATOM 0 HG2 GLU A 13 9.621 0.682 -13.285 1.00 3.53 H new ATOM 0 HG3 GLU A 13 8.752 2.132 -12.821 1.00 3.53 H new ATOM 202 N ILE A 14 9.078 1.331 -8.286 1.00 10.51 N ATOM 203 CA ILE A 14 9.382 1.288 -6.854 1.00 4.23 C ATOM 204 C ILE A 14 8.528 0.215 -6.176 1.00 71.01 C ATOM 205 O ILE A 14 9.016 -0.567 -5.360 1.00 64.33 O ATOM 206 CB ILE A 14 9.132 2.661 -6.175 1.00 4.32 C ATOM 207 CG1 ILE A 14 10.065 3.729 -6.770 1.00 43.31 C ATOM 208 CG2 ILE A 14 9.313 2.563 -4.659 1.00 32.22 C ATOM 209 CD1 ILE A 14 9.910 5.099 -6.142 1.00 1.31 C ATOM 0 H ILE A 14 8.608 2.184 -8.590 1.00 10.51 H new ATOM 0 HA ILE A 14 10.439 1.046 -6.743 1.00 4.23 H new ATOM 0 HB ILE A 14 8.101 2.957 -6.369 1.00 4.32 H new ATOM 0 HG12 ILE A 14 11.098 3.401 -6.652 1.00 43.31 H new ATOM 0 HG13 ILE A 14 9.875 3.807 -7.840 1.00 43.31 H new ATOM 0 HG21 ILE A 14 9.132 3.538 -4.207 1.00 32.22 H new ATOM 0 HG22 ILE A 14 8.606 1.839 -4.254 1.00 32.22 H new ATOM 0 HG23 ILE A 14 10.330 2.242 -4.434 1.00 32.22 H new ATOM 0 HD11 ILE A 14 10.601 5.796 -6.615 1.00 1.31 H new ATOM 0 HD12 ILE A 14 8.888 5.450 -6.282 1.00 1.31 H new ATOM 0 HD13 ILE A 14 10.129 5.038 -5.076 1.00 1.31 H new ATOM 221 N LEU A 15 7.250 0.192 -6.540 1.00 44.11 N ATOM 222 CA LEU A 15 6.327 -0.862 -6.113 1.00 43.42 C ATOM 223 C LEU A 15 6.940 -2.259 -6.356 1.00 4.34 C ATOM 224 O LEU A 15 6.951 -3.107 -5.462 1.00 73.10 O ATOM 225 CB LEU A 15 4.983 -0.686 -6.864 1.00 70.21 C ATOM 226 CG LEU A 15 4.327 -1.964 -7.415 1.00 13.33 C ATOM 227 CD1 LEU A 15 3.825 -2.865 -6.287 1.00 24.34 C ATOM 228 CD2 LEU A 15 3.187 -1.617 -8.373 1.00 13.05 C ATOM 0 H LEU A 15 6.823 0.900 -7.137 1.00 44.11 H new ATOM 0 HA LEU A 15 6.144 -0.780 -5.042 1.00 43.42 H new ATOM 0 HB2 LEU A 15 4.276 -0.205 -6.188 1.00 70.21 H new ATOM 0 HB3 LEU A 15 5.145 -0.001 -7.696 1.00 70.21 H new ATOM 0 HG LEU A 15 5.089 -2.514 -7.967 1.00 13.33 H new ATOM 0 HD11 LEU A 15 3.367 -3.759 -6.711 1.00 24.34 H new ATOM 0 HD12 LEU A 15 4.662 -3.153 -5.651 1.00 24.34 H new ATOM 0 HD13 LEU A 15 3.087 -2.327 -5.693 1.00 24.34 H new ATOM 0 HD21 LEU A 15 2.737 -2.535 -8.751 1.00 13.05 H new ATOM 0 HD22 LEU A 15 2.433 -1.034 -7.845 1.00 13.05 H new ATOM 0 HD23 LEU A 15 3.577 -1.034 -9.207 1.00 13.05 H new ATOM 240 N LYS A 16 7.463 -2.481 -7.561 1.00 65.30 N ATOM 241 CA LYS A 16 8.097 -3.759 -7.909 1.00 71.12 C ATOM 242 C LYS A 16 9.318 -4.042 -7.014 1.00 74.34 C ATOM 243 O LYS A 16 9.483 -5.151 -6.495 1.00 35.21 O ATOM 244 CB LYS A 16 8.526 -3.745 -9.382 1.00 72.14 C ATOM 245 CG LYS A 16 9.025 -5.095 -9.888 1.00 73.40 C ATOM 246 CD LYS A 16 9.653 -4.990 -11.275 1.00 70.44 C ATOM 247 CE LYS A 16 8.687 -4.407 -12.300 1.00 65.34 C ATOM 248 NZ LYS A 16 9.293 -4.338 -13.653 1.00 34.51 N ATOM 0 H LYS A 16 7.462 -1.794 -8.315 1.00 65.30 H new ATOM 0 HA LYS A 16 7.367 -4.552 -7.747 1.00 71.12 H new ATOM 0 HB2 LYS A 16 7.682 -3.427 -9.994 1.00 72.14 H new ATOM 0 HB3 LYS A 16 9.314 -3.003 -9.515 1.00 72.14 H new ATOM 0 HG2 LYS A 16 9.758 -5.496 -9.188 1.00 73.40 H new ATOM 0 HG3 LYS A 16 8.194 -5.800 -9.919 1.00 73.40 H new ATOM 0 HD2 LYS A 16 10.545 -4.366 -11.222 1.00 70.44 H new ATOM 0 HD3 LYS A 16 9.975 -5.979 -11.602 1.00 70.44 H new ATOM 0 HE2 LYS A 16 7.785 -5.017 -12.337 1.00 65.34 H new ATOM 0 HE3 LYS A 16 8.384 -3.408 -11.986 1.00 65.34 H new ATOM 0 HZ1 LYS A 16 8.605 -3.936 -14.321 1.00 34.51 H new ATOM 0 HZ2 LYS A 16 10.140 -3.735 -13.624 1.00 34.51 H new ATOM 0 HZ3 LYS A 16 9.559 -5.294 -13.963 1.00 34.51 H new ATOM 262 N GLU A 17 10.163 -3.025 -6.843 1.00 34.44 N ATOM 263 CA GLU A 17 11.358 -3.127 -5.993 1.00 43.42 C ATOM 264 C GLU A 17 10.995 -3.478 -4.538 1.00 31.44 C ATOM 265 O GLU A 17 11.777 -4.107 -3.824 1.00 73.12 O ATOM 266 CB GLU A 17 12.148 -1.812 -6.046 1.00 11.40 C ATOM 267 CG GLU A 17 12.719 -1.488 -7.428 1.00 32.11 C ATOM 268 CD GLU A 17 13.917 -2.353 -7.799 1.00 61.03 C ATOM 269 OE1 GLU A 17 13.723 -3.477 -8.310 1.00 30.11 O ATOM 270 OE2 GLU A 17 15.063 -1.904 -7.580 1.00 35.21 O ATOM 0 H GLU A 17 10.044 -2.113 -7.284 1.00 34.44 H new ATOM 0 HA GLU A 17 11.977 -3.937 -6.378 1.00 43.42 H new ATOM 0 HB2 GLU A 17 11.498 -0.996 -5.732 1.00 11.40 H new ATOM 0 HB3 GLU A 17 12.967 -1.862 -5.328 1.00 11.40 H new ATOM 0 HG2 GLU A 17 11.938 -1.620 -8.177 1.00 32.11 H new ATOM 0 HG3 GLU A 17 13.014 -0.439 -7.456 1.00 32.11 H new ATOM 277 N ILE A 18 9.806 -3.064 -4.106 1.00 32.23 N ATOM 278 CA ILE A 18 9.290 -3.441 -2.786 1.00 2.03 C ATOM 279 C ILE A 18 8.860 -4.916 -2.768 1.00 20.33 C ATOM 280 O ILE A 18 9.298 -5.693 -1.917 1.00 61.53 O ATOM 281 CB ILE A 18 8.079 -2.557 -2.385 1.00 71.45 C ATOM 282 CG1 ILE A 18 8.480 -1.071 -2.361 1.00 63.21 C ATOM 283 CG2 ILE A 18 7.521 -2.987 -1.027 1.00 1.23 C ATOM 284 CD1 ILE A 18 7.315 -0.129 -2.133 1.00 10.02 C ATOM 0 H ILE A 18 9.180 -2.468 -4.648 1.00 32.23 H new ATOM 0 HA ILE A 18 10.097 -3.289 -2.069 1.00 2.03 H new ATOM 0 HB ILE A 18 7.296 -2.690 -3.132 1.00 71.45 H new ATOM 0 HG12 ILE A 18 9.220 -0.916 -1.576 1.00 63.21 H new ATOM 0 HG13 ILE A 18 8.961 -0.818 -3.306 1.00 63.21 H new ATOM 0 HG21 ILE A 18 6.673 -2.354 -0.765 1.00 1.23 H new ATOM 0 HG22 ILE A 18 7.196 -4.026 -1.080 1.00 1.23 H new ATOM 0 HG23 ILE A 18 8.296 -2.887 -0.267 1.00 1.23 H new ATOM 0 HD11 ILE A 18 7.675 0.900 -2.129 1.00 10.02 H new ATOM 0 HD12 ILE A 18 6.584 -0.255 -2.932 1.00 10.02 H new ATOM 0 HD13 ILE A 18 6.847 -0.354 -1.174 1.00 10.02 H new ATOM 296 N VAL A 19 8.008 -5.291 -3.723 1.00 63.11 N ATOM 297 CA VAL A 19 7.480 -6.660 -3.815 1.00 64.15 C ATOM 298 C VAL A 19 8.595 -7.721 -3.833 1.00 55.22 C ATOM 299 O VAL A 19 8.527 -8.718 -3.110 1.00 3.31 O ATOM 300 CB VAL A 19 6.596 -6.830 -5.075 1.00 51.51 C ATOM 301 CG1 VAL A 19 6.139 -8.279 -5.234 1.00 23.55 C ATOM 302 CG2 VAL A 19 5.395 -5.889 -5.027 1.00 63.30 C ATOM 0 H VAL A 19 7.665 -4.664 -4.450 1.00 63.11 H new ATOM 0 HA VAL A 19 6.878 -6.815 -2.920 1.00 64.15 H new ATOM 0 HB VAL A 19 7.200 -6.569 -5.944 1.00 51.51 H new ATOM 0 HG11 VAL A 19 5.520 -8.369 -6.127 1.00 23.55 H new ATOM 0 HG12 VAL A 19 7.010 -8.927 -5.329 1.00 23.55 H new ATOM 0 HG13 VAL A 19 5.560 -8.576 -4.359 1.00 23.55 H new ATOM 0 HG21 VAL A 19 4.789 -6.027 -5.922 1.00 63.30 H new ATOM 0 HG22 VAL A 19 4.794 -6.110 -4.145 1.00 63.30 H new ATOM 0 HG23 VAL A 19 5.743 -4.857 -4.979 1.00 63.30 H new ATOM 312 N ARG A 20 9.624 -7.499 -4.654 1.00 23.12 N ATOM 313 CA ARG A 20 10.743 -8.449 -4.772 1.00 70.21 C ATOM 314 C ARG A 20 11.422 -8.694 -3.411 1.00 4.24 C ATOM 315 O ARG A 20 11.916 -9.791 -3.144 1.00 72.22 O ATOM 316 CB ARG A 20 11.771 -7.940 -5.796 1.00 24.23 C ATOM 317 CG ARG A 20 12.435 -6.629 -5.399 1.00 13.45 C ATOM 318 CD ARG A 20 13.368 -6.103 -6.482 1.00 32.22 C ATOM 319 NE ARG A 20 14.461 -7.027 -6.773 1.00 32.11 N ATOM 320 CZ ARG A 20 15.451 -6.754 -7.577 1.00 74.23 C ATOM 321 NH1 ARG A 20 15.513 -5.612 -8.186 1.00 3.03 N ATOM 322 NH2 ARG A 20 16.381 -7.631 -7.774 1.00 53.00 N ATOM 0 H ARG A 20 9.710 -6.674 -5.247 1.00 23.12 H new ATOM 0 HA ARG A 20 10.337 -9.399 -5.118 1.00 70.21 H new ATOM 0 HB2 ARG A 20 12.541 -8.700 -5.933 1.00 24.23 H new ATOM 0 HB3 ARG A 20 11.277 -7.810 -6.759 1.00 24.23 H new ATOM 0 HG2 ARG A 20 11.667 -5.884 -5.191 1.00 13.45 H new ATOM 0 HG3 ARG A 20 12.998 -6.774 -4.477 1.00 13.45 H new ATOM 0 HD2 ARG A 20 12.797 -5.922 -7.393 1.00 32.22 H new ATOM 0 HD3 ARG A 20 13.780 -5.144 -6.168 1.00 32.22 H new ATOM 0 HE ARG A 20 14.449 -7.941 -6.320 1.00 32.11 H new ATOM 0 HH11 ARG A 20 14.783 -4.915 -8.039 1.00 3.03 H new ATOM 0 HH12 ARG A 20 16.292 -5.410 -8.812 1.00 3.03 H new ATOM 0 HH21 ARG A 20 16.339 -8.534 -7.301 1.00 53.00 H new ATOM 0 HH22 ARG A 20 17.156 -7.420 -8.402 1.00 53.00 H new ATOM 336 N GLU A 21 11.442 -7.669 -2.556 1.00 30.25 N ATOM 337 CA GLU A 21 11.982 -7.800 -1.196 1.00 31.41 C ATOM 338 C GLU A 21 10.990 -8.506 -0.262 1.00 42.12 C ATOM 339 O GLU A 21 11.383 -9.352 0.540 1.00 4.14 O ATOM 340 CB GLU A 21 12.365 -6.421 -0.625 1.00 44.12 C ATOM 341 CG GLU A 21 13.755 -5.947 -1.036 1.00 20.20 C ATOM 342 CD GLU A 21 14.858 -6.864 -0.521 1.00 54.03 C ATOM 343 OE1 GLU A 21 15.192 -6.789 0.683 1.00 21.53 O ATOM 344 OE2 GLU A 21 15.382 -7.678 -1.315 1.00 22.10 O ATOM 0 H GLU A 21 11.091 -6.738 -2.779 1.00 30.25 H new ATOM 0 HA GLU A 21 12.880 -8.415 -1.259 1.00 31.41 H new ATOM 0 HB2 GLU A 21 11.630 -5.686 -0.952 1.00 44.12 H new ATOM 0 HB3 GLU A 21 12.313 -6.462 0.463 1.00 44.12 H new ATOM 0 HG2 GLU A 21 13.810 -5.892 -2.123 1.00 20.20 H new ATOM 0 HG3 GLU A 21 13.919 -4.938 -0.657 1.00 20.20 H new ATOM 351 N ILE A 22 9.706 -8.164 -0.371 1.00 22.33 N ATOM 352 CA ILE A 22 8.658 -8.831 0.416 1.00 63.33 C ATOM 353 C ILE A 22 8.734 -10.357 0.244 1.00 22.52 C ATOM 354 O ILE A 22 8.677 -11.113 1.219 1.00 2.54 O ATOM 355 CB ILE A 22 7.245 -8.345 0.005 1.00 41.10 C ATOM 356 CG1 ILE A 22 7.129 -6.821 0.175 1.00 10.01 C ATOM 357 CG2 ILE A 22 6.167 -9.064 0.820 1.00 75.23 C ATOM 358 CD1 ILE A 22 5.811 -6.253 -0.308 1.00 43.43 C ATOM 0 H ILE A 22 9.363 -7.432 -0.993 1.00 22.33 H new ATOM 0 HA ILE A 22 8.829 -8.573 1.461 1.00 63.33 H new ATOM 0 HB ILE A 22 7.092 -8.586 -1.047 1.00 41.10 H new ATOM 0 HG12 ILE A 22 7.258 -6.571 1.228 1.00 10.01 H new ATOM 0 HG13 ILE A 22 7.943 -6.341 -0.369 1.00 10.01 H new ATOM 0 HG21 ILE A 22 5.183 -8.708 0.516 1.00 75.23 H new ATOM 0 HG22 ILE A 22 6.234 -10.138 0.645 1.00 75.23 H new ATOM 0 HG23 ILE A 22 6.315 -8.859 1.880 1.00 75.23 H new ATOM 0 HD11 ILE A 22 5.802 -5.174 -0.156 1.00 43.43 H new ATOM 0 HD12 ILE A 22 5.688 -6.471 -1.369 1.00 43.43 H new ATOM 0 HD13 ILE A 22 4.993 -6.705 0.253 1.00 43.43 H new ATOM 370 N LYS A 23 8.885 -10.794 -1.005 1.00 71.10 N ATOM 371 CA LYS A 23 9.028 -12.217 -1.321 1.00 64.40 C ATOM 372 C LYS A 23 10.288 -12.817 -0.675 1.00 32.43 C ATOM 373 O LYS A 23 10.313 -13.996 -0.330 1.00 21.35 O ATOM 374 CB LYS A 23 9.069 -12.418 -2.841 1.00 72.11 C ATOM 375 CG LYS A 23 7.829 -11.894 -3.566 1.00 71.53 C ATOM 376 CD LYS A 23 6.536 -12.587 -3.117 1.00 30.11 C ATOM 377 CE LYS A 23 6.432 -14.036 -3.602 1.00 2.44 C ATOM 378 NZ LYS A 23 7.418 -14.938 -2.944 1.00 70.45 N ATOM 0 H LYS A 23 8.912 -10.181 -1.820 1.00 71.10 H new ATOM 0 HA LYS A 23 8.163 -12.738 -0.910 1.00 64.40 H new ATOM 0 HB2 LYS A 23 9.951 -11.917 -3.241 1.00 72.11 H new ATOM 0 HB3 LYS A 23 9.181 -13.481 -3.055 1.00 72.11 H new ATOM 0 HG2 LYS A 23 7.739 -10.822 -3.393 1.00 71.53 H new ATOM 0 HG3 LYS A 23 7.956 -12.034 -4.640 1.00 71.53 H new ATOM 0 HD2 LYS A 23 6.480 -12.569 -2.029 1.00 30.11 H new ATOM 0 HD3 LYS A 23 5.680 -12.023 -3.489 1.00 30.11 H new ATOM 0 HE2 LYS A 23 5.425 -14.406 -3.412 1.00 2.44 H new ATOM 0 HE3 LYS A 23 6.584 -14.065 -4.681 1.00 2.44 H new ATOM 0 HZ1 LYS A 23 6.971 -15.856 -2.747 1.00 70.45 H new ATOM 0 HZ2 LYS A 23 8.234 -15.078 -3.573 1.00 70.45 H new ATOM 0 HZ3 LYS A 23 7.738 -14.511 -2.051 1.00 70.45 H new ATOM 392 N ARG A 24 11.330 -11.999 -0.511 1.00 34.41 N ATOM 393 CA ARG A 24 12.560 -12.437 0.168 1.00 63.41 C ATOM 394 C ARG A 24 12.324 -12.634 1.671 1.00 44.11 C ATOM 395 O ARG A 24 12.848 -13.568 2.281 1.00 50.24 O ATOM 396 CB ARG A 24 13.692 -11.417 -0.029 1.00 20.03 C ATOM 397 CG ARG A 24 14.129 -11.228 -1.474 1.00 61.32 C ATOM 398 CD ARG A 24 14.533 -12.547 -2.125 1.00 13.45 C ATOM 399 NE ARG A 24 15.530 -13.278 -1.340 1.00 15.35 N ATOM 400 CZ ARG A 24 15.838 -14.536 -1.531 1.00 70.54 C ATOM 401 NH1 ARG A 24 15.263 -15.227 -2.463 1.00 65.31 N ATOM 402 NH2 ARG A 24 16.723 -15.110 -0.783 1.00 0.24 N ATOM 0 H ARG A 24 11.351 -11.033 -0.836 1.00 34.41 H new ATOM 0 HA ARG A 24 12.849 -13.389 -0.278 1.00 63.41 H new ATOM 0 HB2 ARG A 24 13.369 -10.455 0.368 1.00 20.03 H new ATOM 0 HB3 ARG A 24 14.554 -11.732 0.559 1.00 20.03 H new ATOM 0 HG2 ARG A 24 13.316 -10.777 -2.043 1.00 61.32 H new ATOM 0 HG3 ARG A 24 14.968 -10.533 -1.511 1.00 61.32 H new ATOM 0 HD2 ARG A 24 13.648 -13.171 -2.254 1.00 13.45 H new ATOM 0 HD3 ARG A 24 14.932 -12.350 -3.120 1.00 13.45 H new ATOM 0 HE ARG A 24 16.015 -12.775 -0.597 1.00 15.35 H new ATOM 0 HH11 ARG A 24 14.560 -14.792 -3.060 1.00 65.31 H new ATOM 0 HH12 ARG A 24 15.513 -16.206 -2.600 1.00 65.31 H new ATOM 0 HH21 ARG A 24 17.184 -14.582 -0.041 1.00 0.24 H new ATOM 0 HH22 ARG A 24 16.961 -16.090 -0.935 1.00 0.24 H new ATOM 416 N GLN A 25 11.539 -11.739 2.263 1.00 41.45 N ATOM 417 CA GLN A 25 11.258 -11.782 3.702 1.00 63.15 C ATOM 418 C GLN A 25 10.263 -12.905 4.047 1.00 74.31 C ATOM 419 O GLN A 25 10.210 -13.379 5.186 1.00 34.15 O ATOM 420 CB GLN A 25 10.713 -10.423 4.166 1.00 72.22 C ATOM 421 CG GLN A 25 11.520 -9.229 3.656 1.00 5.53 C ATOM 422 CD GLN A 25 12.993 -9.285 4.033 1.00 44.45 C ATOM 423 OE1 GLN A 25 13.365 -9.781 5.091 1.00 51.15 O ATOM 424 NE2 GLN A 25 13.848 -8.789 3.158 1.00 55.53 N ATOM 0 H GLN A 25 11.083 -10.971 1.770 1.00 41.45 H new ATOM 0 HA GLN A 25 12.190 -11.995 4.226 1.00 63.15 H new ATOM 0 HB2 GLN A 25 9.681 -10.322 3.831 1.00 72.22 H new ATOM 0 HB3 GLN A 25 10.698 -10.401 5.256 1.00 72.22 H new ATOM 0 HG2 GLN A 25 11.433 -9.179 2.571 1.00 5.53 H new ATOM 0 HG3 GLN A 25 11.086 -8.311 4.053 1.00 5.53 H new ATOM 0 HE21 GLN A 25 13.508 -8.383 2.286 1.00 55.53 H new ATOM 0 HE22 GLN A 25 14.849 -8.812 3.354 1.00 55.53 H new ATOM 433 N GLY A 26 9.474 -13.321 3.056 1.00 23.42 N ATOM 434 CA GLY A 26 8.535 -14.429 3.243 1.00 22.55 C ATOM 435 C GLY A 26 7.122 -13.983 3.608 1.00 54.42 C ATOM 436 O GLY A 26 6.246 -14.816 3.853 1.00 43.45 O ATOM 0 H GLY A 26 9.465 -12.911 2.122 1.00 23.42 H new ATOM 0 HA2 GLY A 26 8.495 -15.018 2.327 1.00 22.55 H new ATOM 0 HA3 GLY A 26 8.913 -15.085 4.027 1.00 22.55 H new ATOM 440 N VAL A 27 6.895 -12.675 3.632 1.00 40.22 N ATOM 441 CA VAL A 27 5.583 -12.122 3.988 1.00 13.55 C ATOM 442 C VAL A 27 4.647 -12.083 2.768 1.00 61.23 C ATOM 443 O VAL A 27 5.101 -11.959 1.627 1.00 14.52 O ATOM 444 CB VAL A 27 5.726 -10.694 4.584 1.00 61.33 C ATOM 445 CG1 VAL A 27 4.372 -10.146 5.042 1.00 71.44 C ATOM 446 CG2 VAL A 27 6.730 -10.690 5.738 1.00 34.41 C ATOM 0 H VAL A 27 7.600 -11.972 3.410 1.00 40.22 H new ATOM 0 HA VAL A 27 5.147 -12.778 4.742 1.00 13.55 H new ATOM 0 HB VAL A 27 6.102 -10.039 3.798 1.00 61.33 H new ATOM 0 HG11 VAL A 27 4.505 -9.146 5.454 1.00 71.44 H new ATOM 0 HG12 VAL A 27 3.691 -10.101 4.192 1.00 71.44 H new ATOM 0 HG13 VAL A 27 3.954 -10.801 5.807 1.00 71.44 H new ATOM 0 HG21 VAL A 27 6.816 -9.681 6.142 1.00 34.41 H new ATOM 0 HG22 VAL A 27 6.387 -11.366 6.521 1.00 34.41 H new ATOM 0 HG23 VAL A 27 7.703 -11.020 5.375 1.00 34.41 H new ATOM 456 N ARG A 28 3.347 -12.214 3.010 1.00 74.41 N ATOM 457 CA ARG A 28 2.351 -12.148 1.938 1.00 21.43 C ATOM 458 C ARG A 28 2.136 -10.695 1.475 1.00 13.34 C ATOM 459 O ARG A 28 2.159 -9.762 2.281 1.00 65.11 O ATOM 460 CB ARG A 28 1.031 -12.766 2.416 1.00 41.31 C ATOM 461 CG ARG A 28 0.018 -12.984 1.299 1.00 23.21 C ATOM 462 CD ARG A 28 -1.218 -13.730 1.785 1.00 12.22 C ATOM 463 NE ARG A 28 -2.102 -14.079 0.680 1.00 60.24 N ATOM 464 CZ ARG A 28 -3.138 -14.863 0.782 1.00 64.52 C ATOM 465 NH1 ARG A 28 -3.448 -15.416 1.913 1.00 1.23 N ATOM 466 NH2 ARG A 28 -3.866 -15.102 -0.256 1.00 43.20 N ATOM 0 H ARG A 28 2.955 -12.367 3.939 1.00 74.41 H new ATOM 0 HA ARG A 28 2.719 -12.717 1.084 1.00 21.43 H new ATOM 0 HB2 ARG A 28 1.240 -13.722 2.897 1.00 41.31 H new ATOM 0 HB3 ARG A 28 0.590 -12.118 3.174 1.00 41.31 H new ATOM 0 HG2 ARG A 28 -0.280 -12.020 0.887 1.00 23.21 H new ATOM 0 HG3 ARG A 28 0.486 -13.546 0.490 1.00 23.21 H new ATOM 0 HD2 ARG A 28 -0.914 -14.636 2.309 1.00 12.22 H new ATOM 0 HD3 ARG A 28 -1.758 -13.112 2.503 1.00 12.22 H new ATOM 0 HE ARG A 28 -1.895 -13.682 -0.237 1.00 60.24 H new ATOM 0 HH11 ARG A 28 -2.878 -15.240 2.740 1.00 1.23 H new ATOM 0 HH12 ARG A 28 -4.262 -16.027 1.976 1.00 1.23 H new ATOM 0 HH21 ARG A 28 -3.630 -14.678 -1.153 1.00 43.20 H new ATOM 0 HH22 ARG A 28 -4.678 -15.715 -0.180 1.00 43.20 H new ATOM 480 N VAL A 29 1.919 -10.508 0.175 1.00 4.31 N ATOM 481 CA VAL A 29 1.814 -9.164 -0.409 1.00 32.11 C ATOM 482 C VAL A 29 0.468 -8.939 -1.121 1.00 32.20 C ATOM 483 O VAL A 29 0.091 -9.689 -2.023 1.00 44.04 O ATOM 484 CB VAL A 29 2.979 -8.907 -1.399 1.00 4.50 C ATOM 485 CG1 VAL A 29 3.089 -10.031 -2.425 1.00 72.23 C ATOM 486 CG2 VAL A 29 2.827 -7.545 -2.085 1.00 32.12 C ATOM 0 H VAL A 29 1.812 -11.267 -0.498 1.00 4.31 H new ATOM 0 HA VAL A 29 1.874 -8.456 0.417 1.00 32.11 H new ATOM 0 HB VAL A 29 3.906 -8.891 -0.826 1.00 4.50 H new ATOM 0 HG11 VAL A 29 3.915 -9.823 -3.106 1.00 72.23 H new ATOM 0 HG12 VAL A 29 3.271 -10.975 -1.912 1.00 72.23 H new ATOM 0 HG13 VAL A 29 2.160 -10.099 -2.991 1.00 72.23 H new ATOM 0 HG21 VAL A 29 3.657 -7.390 -2.774 1.00 32.12 H new ATOM 0 HG22 VAL A 29 1.887 -7.518 -2.637 1.00 32.12 H new ATOM 0 HG23 VAL A 29 2.828 -6.756 -1.332 1.00 32.12 H new ATOM 496 N VAL A 30 -0.247 -7.895 -0.704 1.00 44.22 N ATOM 497 CA VAL A 30 -1.528 -7.525 -1.318 1.00 73.14 C ATOM 498 C VAL A 30 -1.400 -6.206 -2.100 1.00 0.30 C ATOM 499 O VAL A 30 -1.317 -5.124 -1.517 1.00 11.43 O ATOM 500 CB VAL A 30 -2.649 -7.389 -0.254 1.00 13.30 C ATOM 501 CG1 VAL A 30 -3.972 -6.966 -0.899 1.00 64.15 C ATOM 502 CG2 VAL A 30 -2.816 -8.699 0.513 1.00 21.22 C ATOM 0 H VAL A 30 0.039 -7.285 0.062 1.00 44.22 H new ATOM 0 HA VAL A 30 -1.798 -8.326 -2.007 1.00 73.14 H new ATOM 0 HB VAL A 30 -2.357 -6.610 0.450 1.00 13.30 H new ATOM 0 HG11 VAL A 30 -4.740 -6.878 -0.130 1.00 64.15 H new ATOM 0 HG12 VAL A 30 -3.844 -6.004 -1.395 1.00 64.15 H new ATOM 0 HG13 VAL A 30 -4.275 -7.714 -1.631 1.00 64.15 H new ATOM 0 HG21 VAL A 30 -3.606 -8.588 1.256 1.00 21.22 H new ATOM 0 HG22 VAL A 30 -3.081 -9.496 -0.182 1.00 21.22 H new ATOM 0 HG23 VAL A 30 -1.881 -8.950 1.013 1.00 21.22 H new ATOM 512 N LEU A 31 -1.376 -6.306 -3.423 1.00 74.43 N ATOM 513 CA LEU A 31 -1.230 -5.130 -4.285 1.00 4.05 C ATOM 514 C LEU A 31 -2.591 -4.607 -4.767 1.00 63.23 C ATOM 515 O LEU A 31 -3.327 -5.308 -5.456 1.00 20.21 O ATOM 516 CB LEU A 31 -0.343 -5.469 -5.494 1.00 24.21 C ATOM 517 CG LEU A 31 -0.207 -4.361 -6.558 1.00 43.34 C ATOM 518 CD1 LEU A 31 0.315 -3.066 -5.942 1.00 53.02 C ATOM 519 CD2 LEU A 31 0.699 -4.821 -7.700 1.00 51.55 C ATOM 0 H LEU A 31 -1.456 -7.189 -3.927 1.00 74.43 H new ATOM 0 HA LEU A 31 -0.759 -4.344 -3.695 1.00 4.05 H new ATOM 0 HB2 LEU A 31 0.653 -5.722 -5.131 1.00 24.21 H new ATOM 0 HB3 LEU A 31 -0.743 -6.362 -5.975 1.00 24.21 H new ATOM 0 HG LEU A 31 -1.199 -4.161 -6.964 1.00 43.34 H new ATOM 0 HD11 LEU A 31 0.400 -2.303 -6.716 1.00 53.02 H new ATOM 0 HD12 LEU A 31 -0.376 -2.725 -5.171 1.00 53.02 H new ATOM 0 HD13 LEU A 31 1.294 -3.243 -5.498 1.00 53.02 H new ATOM 0 HD21 LEU A 31 0.783 -4.026 -8.441 1.00 51.55 H new ATOM 0 HD22 LEU A 31 1.688 -5.057 -7.307 1.00 51.55 H new ATOM 0 HD23 LEU A 31 0.273 -5.709 -8.167 1.00 51.55 H new ATOM 531 N LEU A 32 -2.914 -3.374 -4.399 1.00 73.11 N ATOM 532 CA LEU A 32 -4.127 -2.710 -4.880 1.00 33.15 C ATOM 533 C LEU A 32 -3.796 -1.885 -6.130 1.00 34.33 C ATOM 534 O LEU A 32 -3.352 -0.737 -6.041 1.00 5.41 O ATOM 535 CB LEU A 32 -4.725 -1.821 -3.777 1.00 41.23 C ATOM 536 CG LEU A 32 -5.104 -2.556 -2.476 1.00 12.22 C ATOM 537 CD1 LEU A 32 -5.642 -1.579 -1.435 1.00 10.00 C ATOM 538 CD2 LEU A 32 -6.124 -3.660 -2.754 1.00 64.02 C ATOM 0 H LEU A 32 -2.351 -2.807 -3.765 1.00 73.11 H new ATOM 0 HA LEU A 32 -4.871 -3.462 -5.142 1.00 33.15 H new ATOM 0 HB2 LEU A 32 -4.008 -1.036 -3.536 1.00 41.23 H new ATOM 0 HB3 LEU A 32 -5.615 -1.330 -4.171 1.00 41.23 H new ATOM 0 HG LEU A 32 -4.201 -3.017 -2.075 1.00 12.22 H new ATOM 0 HD11 LEU A 32 -5.902 -2.122 -0.526 1.00 10.00 H new ATOM 0 HD12 LEU A 32 -4.880 -0.834 -1.207 1.00 10.00 H new ATOM 0 HD13 LEU A 32 -6.529 -1.082 -1.827 1.00 10.00 H new ATOM 0 HD21 LEU A 32 -6.377 -4.165 -1.822 1.00 64.02 H new ATOM 0 HD22 LEU A 32 -7.025 -3.223 -3.186 1.00 64.02 H new ATOM 0 HD23 LEU A 32 -5.699 -4.380 -3.453 1.00 64.02 H new ATOM 550 N TYR A 33 -3.995 -2.490 -7.295 1.00 31.32 N ATOM 551 CA TYR A 33 -3.532 -1.909 -8.556 1.00 24.13 C ATOM 552 C TYR A 33 -4.591 -0.993 -9.190 1.00 2.31 C ATOM 553 O TYR A 33 -5.663 -1.449 -9.596 1.00 42.21 O ATOM 554 CB TYR A 33 -3.140 -3.028 -9.533 1.00 2.41 C ATOM 555 CG TYR A 33 -2.201 -2.565 -10.626 1.00 0.54 C ATOM 556 CD1 TYR A 33 -0.835 -2.475 -10.388 1.00 10.31 C ATOM 557 CD2 TYR A 33 -2.673 -2.206 -11.885 1.00 31.40 C ATOM 558 CE1 TYR A 33 0.032 -2.037 -11.367 1.00 2.13 C ATOM 559 CE2 TYR A 33 -1.810 -1.771 -12.871 1.00 15.14 C ATOM 560 CZ TYR A 33 -0.459 -1.686 -12.605 1.00 31.32 C ATOM 561 OH TYR A 33 0.405 -1.244 -13.579 1.00 34.33 O ATOM 0 H TYR A 33 -4.475 -3.385 -7.396 1.00 31.32 H new ATOM 0 HA TYR A 33 -2.659 -1.293 -8.339 1.00 24.13 H new ATOM 0 HB2 TYR A 33 -2.668 -3.838 -8.977 1.00 2.41 H new ATOM 0 HB3 TYR A 33 -4.042 -3.437 -9.988 1.00 2.41 H new ATOM 0 HD1 TYR A 33 -0.446 -2.753 -9.420 1.00 10.31 H new ATOM 0 HD2 TYR A 33 -3.731 -2.269 -12.094 1.00 31.40 H new ATOM 0 HE1 TYR A 33 1.091 -1.970 -11.164 1.00 2.13 H new ATOM 0 HE2 TYR A 33 -2.190 -1.499 -13.845 1.00 15.14 H new ATOM 0 HH TYR A 33 -0.099 -1.038 -14.394 1.00 34.33 H new ATOM 571 N SER A 34 -4.283 0.301 -9.269 1.00 33.42 N ATOM 572 CA SER A 34 -5.176 1.282 -9.904 1.00 64.15 C ATOM 573 C SER A 34 -4.607 1.756 -11.248 1.00 22.32 C ATOM 574 O SER A 34 -3.579 2.438 -11.296 1.00 32.32 O ATOM 575 CB SER A 34 -5.406 2.489 -8.979 1.00 15.22 C ATOM 576 OG SER A 34 -4.184 3.120 -8.626 1.00 1.14 O ATOM 0 H SER A 34 -3.419 0.700 -8.901 1.00 33.42 H new ATOM 0 HA SER A 34 -6.132 0.790 -10.085 1.00 64.15 H new ATOM 0 HB2 SER A 34 -6.057 3.209 -9.475 1.00 15.22 H new ATOM 0 HB3 SER A 34 -5.921 2.162 -8.076 1.00 15.22 H new ATOM 0 HG SER A 34 -3.529 2.440 -8.364 1.00 1.14 H new ATOM 582 N ASP A 35 -5.271 1.380 -12.339 1.00 42.32 N ATOM 583 CA ASP A 35 -4.842 1.773 -13.684 1.00 42.43 C ATOM 584 C ASP A 35 -6.036 2.265 -14.523 1.00 75.05 C ATOM 585 O ASP A 35 -7.179 1.857 -14.295 1.00 22.12 O ATOM 586 CB ASP A 35 -4.147 0.596 -14.381 1.00 33.53 C ATOM 587 CG ASP A 35 -3.541 0.988 -15.718 1.00 71.22 C ATOM 588 OD1 ASP A 35 -2.485 1.652 -15.723 1.00 4.55 O ATOM 589 OD2 ASP A 35 -4.129 0.657 -16.765 1.00 52.31 O ATOM 0 H ASP A 35 -6.111 0.802 -12.320 1.00 42.32 H new ATOM 0 HA ASP A 35 -4.134 2.597 -13.590 1.00 42.43 H new ATOM 0 HB2 ASP A 35 -3.364 0.204 -13.732 1.00 33.53 H new ATOM 0 HB3 ASP A 35 -4.867 -0.208 -14.534 1.00 33.53 H new ATOM 594 N GLN A 36 -5.759 3.134 -15.491 1.00 52.31 N ATOM 595 CA GLN A 36 -6.802 3.701 -16.356 1.00 61.24 C ATOM 596 C GLN A 36 -7.357 2.665 -17.350 1.00 21.33 C ATOM 597 O GLN A 36 -8.563 2.618 -17.605 1.00 43.20 O ATOM 598 CB GLN A 36 -6.245 4.905 -17.130 1.00 21.22 C ATOM 599 CG GLN A 36 -5.793 6.067 -16.246 1.00 4.51 C ATOM 600 CD GLN A 36 -6.942 6.734 -15.503 1.00 33.22 C ATOM 601 OE1 GLN A 36 -7.571 7.655 -16.012 1.00 50.12 O ATOM 602 NE2 GLN A 36 -7.209 6.293 -14.290 1.00 62.34 N ATOM 0 H GLN A 36 -4.817 3.465 -15.701 1.00 52.31 H new ATOM 0 HA GLN A 36 -7.621 4.018 -15.711 1.00 61.24 H new ATOM 0 HB2 GLN A 36 -5.401 4.574 -17.735 1.00 21.22 H new ATOM 0 HB3 GLN A 36 -7.009 5.264 -17.819 1.00 21.22 H new ATOM 0 HG2 GLN A 36 -5.063 5.703 -15.523 1.00 4.51 H new ATOM 0 HG3 GLN A 36 -5.287 6.810 -16.863 1.00 4.51 H new ATOM 0 HE21 GLN A 36 -6.666 5.525 -13.896 1.00 62.34 H new ATOM 0 HE22 GLN A 36 -7.958 6.720 -13.746 1.00 62.34 H new ATOM 611 N ASP A 37 -6.476 1.830 -17.896 1.00 32.15 N ATOM 612 CA ASP A 37 -6.851 0.880 -18.952 1.00 20.41 C ATOM 613 C ASP A 37 -7.274 -0.484 -18.369 1.00 62.45 C ATOM 614 O ASP A 37 -7.167 -0.717 -17.166 1.00 72.14 O ATOM 615 CB ASP A 37 -5.672 0.708 -19.921 1.00 12.43 C ATOM 616 CG ASP A 37 -6.048 -0.077 -21.164 1.00 4.11 C ATOM 617 OD1 ASP A 37 -6.786 0.466 -22.008 1.00 32.42 O ATOM 618 OD2 ASP A 37 -5.635 -1.246 -21.293 1.00 14.33 O ATOM 0 H ASP A 37 -5.493 1.789 -17.627 1.00 32.15 H new ATOM 0 HA ASP A 37 -7.711 1.282 -19.487 1.00 20.41 H new ATOM 0 HB2 ASP A 37 -5.301 1.690 -20.214 1.00 12.43 H new ATOM 0 HB3 ASP A 37 -4.856 0.200 -19.408 1.00 12.43 H new ATOM 623 N GLU A 38 -7.773 -1.372 -19.233 1.00 42.20 N ATOM 624 CA GLU A 38 -8.138 -2.738 -18.835 1.00 41.54 C ATOM 625 C GLU A 38 -7.042 -3.752 -19.210 1.00 52.02 C ATOM 626 O GLU A 38 -6.586 -4.535 -18.373 1.00 60.12 O ATOM 627 CB GLU A 38 -9.453 -3.157 -19.506 1.00 62.14 C ATOM 628 CG GLU A 38 -10.667 -2.338 -19.087 1.00 35.30 C ATOM 629 CD GLU A 38 -11.946 -2.836 -19.744 1.00 20.22 C ATOM 630 OE1 GLU A 38 -12.601 -3.737 -19.177 1.00 33.20 O ATOM 631 OE2 GLU A 38 -12.289 -2.344 -20.840 1.00 22.31 O ATOM 0 H GLU A 38 -7.935 -1.169 -20.219 1.00 42.20 H new ATOM 0 HA GLU A 38 -8.256 -2.736 -17.751 1.00 41.54 H new ATOM 0 HB2 GLU A 38 -9.335 -3.080 -20.587 1.00 62.14 H new ATOM 0 HB3 GLU A 38 -9.643 -4.206 -19.280 1.00 62.14 H new ATOM 0 HG2 GLU A 38 -10.776 -2.380 -18.003 1.00 35.30 H new ATOM 0 HG3 GLU A 38 -10.507 -1.293 -19.351 1.00 35.30 H new ATOM 638 N LYS A 39 -6.621 -3.731 -20.475 1.00 14.12 N ATOM 639 CA LYS A 39 -5.677 -4.725 -20.998 1.00 42.32 C ATOM 640 C LYS A 39 -4.275 -4.526 -20.398 1.00 4.14 C ATOM 641 O LYS A 39 -3.687 -5.463 -19.851 1.00 72.44 O ATOM 642 CB LYS A 39 -5.613 -4.640 -22.531 1.00 21.24 C ATOM 643 CG LYS A 39 -6.983 -4.631 -23.212 1.00 22.24 C ATOM 644 CD LYS A 39 -7.810 -5.893 -22.933 1.00 31.12 C ATOM 645 CE LYS A 39 -7.247 -7.139 -23.620 1.00 24.41 C ATOM 646 NZ LYS A 39 -6.101 -7.732 -22.880 1.00 24.32 N ATOM 0 H LYS A 39 -6.918 -3.036 -21.160 1.00 14.12 H new ATOM 0 HA LYS A 39 -6.033 -5.714 -20.710 1.00 42.32 H new ATOM 0 HB2 LYS A 39 -5.073 -3.736 -22.812 1.00 21.24 H new ATOM 0 HB3 LYS A 39 -5.037 -5.485 -22.908 1.00 21.24 H new ATOM 0 HG2 LYS A 39 -7.542 -3.758 -22.876 1.00 22.24 H new ATOM 0 HG3 LYS A 39 -6.845 -4.526 -24.288 1.00 22.24 H new ATOM 0 HD2 LYS A 39 -7.850 -6.064 -21.857 1.00 31.12 H new ATOM 0 HD3 LYS A 39 -8.834 -5.731 -23.268 1.00 31.12 H new ATOM 0 HE2 LYS A 39 -8.037 -7.884 -23.717 1.00 24.41 H new ATOM 0 HE3 LYS A 39 -6.928 -6.880 -24.629 1.00 24.41 H new ATOM 0 HZ1 LYS A 39 -5.209 -7.439 -23.328 1.00 24.32 H new ATOM 0 HZ2 LYS A 39 -6.117 -7.403 -21.894 1.00 24.32 H new ATOM 0 HZ3 LYS A 39 -6.174 -8.769 -22.900 1.00 24.32 H new ATOM 660 N ARG A 40 -3.750 -3.301 -20.493 1.00 2.34 N ATOM 661 CA ARG A 40 -2.442 -2.980 -19.904 1.00 2.03 C ATOM 662 C ARG A 40 -2.464 -3.203 -18.386 1.00 51.32 C ATOM 663 O ARG A 40 -1.488 -3.680 -17.807 1.00 23.24 O ATOM 664 CB ARG A 40 -2.028 -1.531 -20.210 1.00 41.23 C ATOM 665 CG ARG A 40 -1.928 -1.203 -21.696 1.00 71.12 C ATOM 666 CD ARG A 40 -1.049 -2.194 -22.462 1.00 20.53 C ATOM 667 NE ARG A 40 0.245 -2.436 -21.814 1.00 1.44 N ATOM 668 CZ ARG A 40 1.317 -1.712 -22.002 1.00 40.41 C ATOM 669 NH1 ARG A 40 1.288 -0.655 -22.751 1.00 64.12 N ATOM 670 NH2 ARG A 40 2.425 -2.054 -21.431 1.00 24.32 N ATOM 0 H ARG A 40 -4.204 -2.520 -20.967 1.00 2.34 H new ATOM 0 HA ARG A 40 -1.708 -3.649 -20.354 1.00 2.03 H new ATOM 0 HB2 ARG A 40 -2.749 -0.855 -19.749 1.00 41.23 H new ATOM 0 HB3 ARG A 40 -1.063 -1.335 -19.742 1.00 41.23 H new ATOM 0 HG2 ARG A 40 -2.927 -1.199 -22.131 1.00 71.12 H new ATOM 0 HG3 ARG A 40 -1.524 -0.198 -21.816 1.00 71.12 H new ATOM 0 HD2 ARG A 40 -1.581 -3.140 -22.562 1.00 20.53 H new ATOM 0 HD3 ARG A 40 -0.879 -1.816 -23.470 1.00 20.53 H new ATOM 0 HE ARG A 40 0.313 -3.225 -21.171 1.00 1.44 H new ATOM 0 HH11 ARG A 40 0.419 -0.376 -23.205 1.00 64.12 H new ATOM 0 HH12 ARG A 40 2.135 -0.102 -22.886 1.00 64.12 H new ATOM 0 HH21 ARG A 40 2.459 -2.884 -20.839 1.00 24.32 H new ATOM 0 HH22 ARG A 40 3.266 -1.494 -21.573 1.00 24.32 H new ATOM 684 N ARG A 41 -3.586 -2.853 -17.757 1.00 60.54 N ATOM 685 CA ARG A 41 -3.801 -3.103 -16.326 1.00 23.45 C ATOM 686 C ARG A 41 -3.556 -4.582 -15.984 1.00 62.24 C ATOM 687 O ARG A 41 -2.700 -4.909 -15.158 1.00 53.04 O ATOM 688 CB ARG A 41 -5.236 -2.723 -15.942 1.00 41.43 C ATOM 689 CG ARG A 41 -5.566 -2.919 -14.465 1.00 62.53 C ATOM 690 CD ARG A 41 -7.060 -2.763 -14.192 1.00 44.33 C ATOM 691 NE ARG A 41 -7.580 -1.463 -14.623 1.00 61.05 N ATOM 692 CZ ARG A 41 -8.833 -1.099 -14.514 1.00 30.04 C ATOM 693 NH1 ARG A 41 -9.718 -1.912 -14.043 1.00 40.21 N ATOM 694 NH2 ARG A 41 -9.205 0.077 -14.904 1.00 61.33 N ATOM 0 H ARG A 41 -4.369 -2.391 -18.219 1.00 60.54 H new ATOM 0 HA ARG A 41 -3.094 -2.493 -15.763 1.00 23.45 H new ATOM 0 HB2 ARG A 41 -5.405 -1.679 -16.204 1.00 41.43 H new ATOM 0 HB3 ARG A 41 -5.928 -3.317 -16.538 1.00 41.43 H new ATOM 0 HG2 ARG A 41 -5.240 -3.910 -14.148 1.00 62.53 H new ATOM 0 HG3 ARG A 41 -5.010 -2.195 -13.869 1.00 62.53 H new ATOM 0 HD2 ARG A 41 -7.604 -3.556 -14.706 1.00 44.33 H new ATOM 0 HD3 ARG A 41 -7.245 -2.889 -13.125 1.00 44.33 H new ATOM 0 HE ARG A 41 -6.924 -0.799 -15.034 1.00 61.05 H new ATOM 0 HH11 ARG A 41 -9.444 -2.850 -13.751 1.00 40.21 H new ATOM 0 HH12 ARG A 41 -10.691 -1.616 -13.963 1.00 40.21 H new ATOM 0 HH21 ARG A 41 -8.521 0.724 -15.298 1.00 61.33 H new ATOM 0 HH22 ARG A 41 -10.182 0.358 -14.818 1.00 61.33 H new ATOM 708 N ARG A 42 -4.314 -5.468 -16.636 1.00 4.13 N ATOM 709 CA ARG A 42 -4.173 -6.915 -16.441 1.00 42.51 C ATOM 710 C ARG A 42 -2.733 -7.375 -16.715 1.00 22.02 C ATOM 711 O ARG A 42 -2.142 -8.107 -15.925 1.00 0.50 O ATOM 712 CB ARG A 42 -5.151 -7.670 -17.359 1.00 32.03 C ATOM 713 CG ARG A 42 -5.051 -9.191 -17.256 1.00 41.45 C ATOM 714 CD ARG A 42 -5.331 -9.681 -15.838 1.00 63.52 C ATOM 715 NE ARG A 42 -5.146 -11.123 -15.705 1.00 33.35 N ATOM 716 CZ ARG A 42 -5.068 -11.750 -14.564 1.00 15.33 C ATOM 717 NH1 ARG A 42 -5.154 -11.097 -13.449 1.00 31.41 N ATOM 718 NH2 ARG A 42 -4.907 -13.032 -14.545 1.00 45.30 N ATOM 0 H ARG A 42 -5.036 -5.207 -17.308 1.00 4.13 H new ATOM 0 HA ARG A 42 -4.409 -7.140 -15.401 1.00 42.51 H new ATOM 0 HB2 ARG A 42 -6.169 -7.366 -17.117 1.00 32.03 H new ATOM 0 HB3 ARG A 42 -4.967 -7.373 -18.391 1.00 32.03 H new ATOM 0 HG2 ARG A 42 -5.759 -9.650 -17.946 1.00 41.45 H new ATOM 0 HG3 ARG A 42 -4.055 -9.512 -17.562 1.00 41.45 H new ATOM 0 HD2 ARG A 42 -4.670 -9.166 -15.141 1.00 63.52 H new ATOM 0 HD3 ARG A 42 -6.352 -9.421 -15.561 1.00 63.52 H new ATOM 0 HE ARG A 42 -5.073 -11.676 -16.559 1.00 33.35 H new ATOM 0 HH11 ARG A 42 -5.284 -10.085 -13.459 1.00 31.41 H new ATOM 0 HH12 ARG A 42 -5.092 -11.594 -12.561 1.00 31.41 H new ATOM 0 HH21 ARG A 42 -4.841 -13.551 -15.421 1.00 45.30 H new ATOM 0 HH22 ARG A 42 -4.846 -13.525 -13.654 1.00 45.30 H new ATOM 732 N GLU A 43 -2.185 -6.931 -17.841 1.00 24.42 N ATOM 733 CA GLU A 43 -0.812 -7.257 -18.236 1.00 13.12 C ATOM 734 C GLU A 43 0.201 -6.922 -17.124 1.00 64.23 C ATOM 735 O GLU A 43 0.980 -7.777 -16.699 1.00 33.44 O ATOM 736 CB GLU A 43 -0.454 -6.477 -19.505 1.00 41.34 C ATOM 737 CG GLU A 43 0.962 -6.720 -20.009 1.00 44.01 C ATOM 738 CD GLU A 43 1.394 -5.683 -21.029 1.00 53.45 C ATOM 739 OE1 GLU A 43 1.154 -5.883 -22.235 1.00 73.54 O ATOM 740 OE2 GLU A 43 1.973 -4.654 -20.620 1.00 12.25 O ATOM 0 H GLU A 43 -2.676 -6.335 -18.508 1.00 24.42 H new ATOM 0 HA GLU A 43 -0.760 -8.330 -18.420 1.00 13.12 H new ATOM 0 HB2 GLU A 43 -1.159 -6.744 -20.293 1.00 41.34 H new ATOM 0 HB3 GLU A 43 -0.581 -5.412 -19.311 1.00 41.34 H new ATOM 0 HG2 GLU A 43 1.653 -6.708 -19.166 1.00 44.01 H new ATOM 0 HG3 GLU A 43 1.022 -7.713 -20.455 1.00 44.01 H new ATOM 747 N ARG A 44 0.175 -5.673 -16.658 1.00 72.33 N ATOM 748 CA ARG A 44 1.143 -5.190 -15.665 1.00 10.05 C ATOM 749 C ARG A 44 1.063 -5.968 -14.340 1.00 3.54 C ATOM 750 O ARG A 44 2.089 -6.377 -13.791 1.00 3.12 O ATOM 751 CB ARG A 44 0.930 -3.692 -15.394 1.00 71.01 C ATOM 752 CG ARG A 44 1.189 -2.773 -16.593 1.00 50.43 C ATOM 753 CD ARG A 44 2.631 -2.860 -17.102 1.00 32.41 C ATOM 754 NE ARG A 44 2.847 -4.002 -17.994 1.00 54.52 N ATOM 755 CZ ARG A 44 3.944 -4.709 -18.033 1.00 31.21 C ATOM 756 NH1 ARG A 44 4.899 -4.493 -17.193 1.00 75.11 N ATOM 757 NH2 ARG A 44 4.071 -5.645 -18.913 1.00 74.43 N ATOM 0 H ARG A 44 -0.507 -4.973 -16.952 1.00 72.33 H new ATOM 0 HA ARG A 44 2.135 -5.353 -16.087 1.00 10.05 H new ATOM 0 HB2 ARG A 44 -0.095 -3.542 -15.055 1.00 71.01 H new ATOM 0 HB3 ARG A 44 1.584 -3.390 -14.576 1.00 71.01 H new ATOM 0 HG2 ARG A 44 0.506 -3.035 -17.401 1.00 50.43 H new ATOM 0 HG3 ARG A 44 0.969 -1.743 -16.311 1.00 50.43 H new ATOM 0 HD2 ARG A 44 2.882 -1.940 -17.629 1.00 32.41 H new ATOM 0 HD3 ARG A 44 3.308 -2.935 -16.251 1.00 32.41 H new ATOM 0 HE ARG A 44 2.090 -4.262 -18.626 1.00 54.52 H new ATOM 0 HH11 ARG A 44 4.802 -3.763 -16.488 1.00 75.11 H new ATOM 0 HH12 ARG A 44 5.751 -5.053 -17.234 1.00 75.11 H new ATOM 0 HH21 ARG A 44 3.316 -5.829 -19.574 1.00 74.43 H new ATOM 0 HH22 ARG A 44 4.926 -6.200 -18.947 1.00 74.43 H new ATOM 771 N LEU A 45 -0.152 -6.161 -13.823 1.00 33.11 N ATOM 772 CA LEU A 45 -0.339 -6.828 -12.527 1.00 63.50 C ATOM 773 C LEU A 45 -0.124 -8.349 -12.621 1.00 23.03 C ATOM 774 O LEU A 45 0.304 -8.984 -11.654 1.00 34.21 O ATOM 775 CB LEU A 45 -1.724 -6.487 -11.941 1.00 11.01 C ATOM 776 CG LEU A 45 -2.962 -6.899 -12.771 1.00 44.42 C ATOM 777 CD1 LEU A 45 -3.308 -8.377 -12.584 1.00 33.31 C ATOM 778 CD2 LEU A 45 -4.164 -6.022 -12.417 1.00 21.00 C ATOM 0 H LEU A 45 -1.018 -5.868 -14.276 1.00 33.11 H new ATOM 0 HA LEU A 45 0.424 -6.449 -11.847 1.00 63.50 H new ATOM 0 HB2 LEU A 45 -1.802 -6.958 -10.961 1.00 11.01 H new ATOM 0 HB3 LEU A 45 -1.767 -5.410 -11.781 1.00 11.01 H new ATOM 0 HG LEU A 45 -2.712 -6.750 -13.821 1.00 44.42 H new ATOM 0 HD11 LEU A 45 -4.183 -8.625 -13.184 1.00 33.31 H new ATOM 0 HD12 LEU A 45 -2.465 -8.991 -12.901 1.00 33.31 H new ATOM 0 HD13 LEU A 45 -3.522 -8.570 -11.533 1.00 33.31 H new ATOM 0 HD21 LEU A 45 -5.025 -6.328 -13.012 1.00 21.00 H new ATOM 0 HD22 LEU A 45 -4.396 -6.133 -11.358 1.00 21.00 H new ATOM 0 HD23 LEU A 45 -3.928 -4.979 -12.629 1.00 21.00 H new ATOM 790 N GLU A 46 -0.410 -8.928 -13.788 1.00 75.20 N ATOM 791 CA GLU A 46 -0.209 -10.364 -14.008 1.00 40.04 C ATOM 792 C GLU A 46 1.259 -10.754 -13.781 1.00 12.51 C ATOM 793 O GLU A 46 1.553 -11.813 -13.221 1.00 1.42 O ATOM 794 CB GLU A 46 -0.661 -10.756 -15.422 1.00 32.43 C ATOM 795 CG GLU A 46 -0.469 -12.233 -15.743 1.00 61.44 C ATOM 796 CD GLU A 46 -1.045 -12.628 -17.093 1.00 20.32 C ATOM 797 OE1 GLU A 46 -0.472 -12.236 -18.131 1.00 15.41 O ATOM 798 OE2 GLU A 46 -2.060 -13.352 -17.124 1.00 1.33 O ATOM 0 H GLU A 46 -0.781 -8.427 -14.595 1.00 75.20 H new ATOM 0 HA GLU A 46 -0.817 -10.909 -13.286 1.00 40.04 H new ATOM 0 HB2 GLU A 46 -1.715 -10.502 -15.540 1.00 32.43 H new ATOM 0 HB3 GLU A 46 -0.107 -10.161 -16.148 1.00 32.43 H new ATOM 0 HG2 GLU A 46 0.595 -12.467 -15.726 1.00 61.44 H new ATOM 0 HG3 GLU A 46 -0.940 -12.833 -14.964 1.00 61.44 H new ATOM 805 N GLU A 47 2.174 -9.878 -14.209 1.00 2.22 N ATOM 806 CA GLU A 47 3.610 -10.044 -13.944 1.00 51.13 C ATOM 807 C GLU A 47 3.877 -10.338 -12.459 1.00 43.21 C ATOM 808 O GLU A 47 4.742 -11.141 -12.116 1.00 40.13 O ATOM 809 CB GLU A 47 4.367 -8.775 -14.368 1.00 12.42 C ATOM 810 CG GLU A 47 4.471 -8.583 -15.880 1.00 34.25 C ATOM 811 CD GLU A 47 5.634 -9.350 -16.497 1.00 42.35 C ATOM 812 OE1 GLU A 47 5.472 -10.543 -16.820 1.00 22.12 O ATOM 813 OE2 GLU A 47 6.723 -8.752 -16.662 1.00 61.01 O ATOM 0 H GLU A 47 1.945 -9.041 -14.744 1.00 2.22 H new ATOM 0 HA GLU A 47 3.964 -10.895 -14.525 1.00 51.13 H new ATOM 0 HB2 GLU A 47 3.869 -7.907 -13.936 1.00 12.42 H new ATOM 0 HB3 GLU A 47 5.372 -8.807 -13.947 1.00 12.42 H new ATOM 0 HG2 GLU A 47 3.541 -8.906 -16.347 1.00 34.25 H new ATOM 0 HG3 GLU A 47 4.585 -7.521 -16.099 1.00 34.25 H new ATOM 820 N PHE A 48 3.120 -9.685 -11.583 1.00 34.11 N ATOM 821 CA PHE A 48 3.257 -9.887 -10.138 1.00 32.23 C ATOM 822 C PHE A 48 2.582 -11.191 -9.683 1.00 13.31 C ATOM 823 O PHE A 48 3.159 -11.966 -8.916 1.00 51.24 O ATOM 824 CB PHE A 48 2.671 -8.689 -9.380 1.00 14.12 C ATOM 825 CG PHE A 48 3.461 -7.417 -9.567 1.00 34.12 C ATOM 826 CD1 PHE A 48 4.618 -7.196 -8.832 1.00 3.10 C ATOM 827 CD2 PHE A 48 3.058 -6.451 -10.479 1.00 52.32 C ATOM 828 CE1 PHE A 48 5.355 -6.040 -9.004 1.00 21.53 C ATOM 829 CE2 PHE A 48 3.791 -5.292 -10.652 1.00 11.53 C ATOM 830 CZ PHE A 48 4.943 -5.086 -9.913 1.00 70.13 C ATOM 0 H PHE A 48 2.403 -9.009 -11.846 1.00 34.11 H new ATOM 0 HA PHE A 48 4.320 -9.969 -9.910 1.00 32.23 H new ATOM 0 HB2 PHE A 48 1.646 -8.524 -9.713 1.00 14.12 H new ATOM 0 HB3 PHE A 48 2.626 -8.927 -8.317 1.00 14.12 H new ATOM 0 HD1 PHE A 48 4.946 -7.936 -8.117 1.00 3.10 H new ATOM 0 HD2 PHE A 48 2.161 -6.607 -11.060 1.00 52.32 H new ATOM 0 HE1 PHE A 48 6.254 -5.883 -8.427 1.00 21.53 H new ATOM 0 HE2 PHE A 48 3.465 -4.548 -11.363 1.00 11.53 H new ATOM 0 HZ PHE A 48 5.518 -4.182 -10.047 1.00 70.13 H new ATOM 840 N GLU A 49 1.365 -11.440 -10.164 1.00 61.23 N ATOM 841 CA GLU A 49 0.613 -12.638 -9.768 1.00 52.42 C ATOM 842 C GLU A 49 1.383 -13.928 -10.098 1.00 2.41 C ATOM 843 O GLU A 49 1.503 -14.823 -9.258 1.00 75.04 O ATOM 844 CB GLU A 49 -0.759 -12.671 -10.447 1.00 2.11 C ATOM 845 CG GLU A 49 -1.613 -11.434 -10.191 1.00 65.15 C ATOM 846 CD GLU A 49 -3.079 -11.666 -10.516 1.00 63.21 C ATOM 847 OE1 GLU A 49 -3.395 -11.971 -11.683 1.00 11.23 O ATOM 848 OE2 GLU A 49 -3.919 -11.574 -9.597 1.00 52.21 O ATOM 0 H GLU A 49 0.878 -10.835 -10.825 1.00 61.23 H new ATOM 0 HA GLU A 49 0.477 -12.586 -8.688 1.00 52.42 H new ATOM 0 HB2 GLU A 49 -0.617 -12.785 -11.522 1.00 2.11 H new ATOM 0 HB3 GLU A 49 -1.302 -13.551 -10.102 1.00 2.11 H new ATOM 0 HG2 GLU A 49 -1.517 -11.140 -9.146 1.00 65.15 H new ATOM 0 HG3 GLU A 49 -1.237 -10.605 -10.791 1.00 65.15 H new ATOM 855 N LYS A 50 1.920 -14.007 -11.316 1.00 34.55 N ATOM 856 CA LYS A 50 2.679 -15.184 -11.762 1.00 52.44 C ATOM 857 C LYS A 50 3.978 -15.369 -10.956 1.00 70.20 C ATOM 858 O LYS A 50 4.608 -16.426 -11.014 1.00 14.32 O ATOM 859 CB LYS A 50 2.993 -15.071 -13.261 1.00 33.31 C ATOM 860 CG LYS A 50 3.913 -13.907 -13.618 1.00 63.35 C ATOM 861 CD LYS A 50 3.992 -13.679 -15.128 1.00 73.04 C ATOM 862 CE LYS A 50 4.493 -14.911 -15.871 1.00 14.11 C ATOM 863 NZ LYS A 50 4.585 -14.673 -17.334 1.00 63.21 N ATOM 0 H LYS A 50 1.845 -13.269 -12.016 1.00 34.55 H new ATOM 0 HA LYS A 50 2.059 -16.063 -11.588 1.00 52.44 H new ATOM 0 HB2 LYS A 50 3.454 -16.000 -13.596 1.00 33.31 H new ATOM 0 HB3 LYS A 50 2.058 -14.963 -13.810 1.00 33.31 H new ATOM 0 HG2 LYS A 50 3.554 -12.999 -13.133 1.00 63.35 H new ATOM 0 HG3 LYS A 50 4.912 -14.102 -13.228 1.00 63.35 H new ATOM 0 HD2 LYS A 50 3.006 -13.406 -15.504 1.00 73.04 H new ATOM 0 HD3 LYS A 50 4.655 -12.839 -15.333 1.00 73.04 H new ATOM 0 HE2 LYS A 50 5.473 -15.194 -15.486 1.00 14.11 H new ATOM 0 HE3 LYS A 50 3.822 -15.748 -15.680 1.00 14.11 H new ATOM 0 HZ1 LYS A 50 4.929 -15.534 -17.805 1.00 63.21 H new ATOM 0 HZ2 LYS A 50 3.645 -14.428 -17.706 1.00 63.21 H new ATOM 0 HZ3 LYS A 50 5.245 -13.890 -17.518 1.00 63.21 H new ATOM 877 N GLN A 51 4.385 -14.330 -10.224 1.00 51.01 N ATOM 878 CA GLN A 51 5.541 -14.421 -9.320 1.00 32.33 C ATOM 879 C GLN A 51 5.109 -14.804 -7.892 1.00 53.44 C ATOM 880 O GLN A 51 5.919 -15.279 -7.092 1.00 73.01 O ATOM 881 CB GLN A 51 6.319 -13.094 -9.301 1.00 11.22 C ATOM 882 CG GLN A 51 7.019 -12.761 -10.618 1.00 41.40 C ATOM 883 CD GLN A 51 7.801 -11.453 -10.562 1.00 45.44 C ATOM 884 OE1 GLN A 51 8.976 -11.427 -10.203 1.00 75.24 O ATOM 885 NE2 GLN A 51 7.163 -10.356 -10.925 1.00 71.23 N ATOM 0 H GLN A 51 3.934 -13.415 -10.237 1.00 51.01 H new ATOM 0 HA GLN A 51 6.194 -15.208 -9.698 1.00 32.33 H new ATOM 0 HB2 GLN A 51 5.631 -12.286 -9.053 1.00 11.22 H new ATOM 0 HB3 GLN A 51 7.064 -13.133 -8.506 1.00 11.22 H new ATOM 0 HG2 GLN A 51 7.698 -13.573 -10.878 1.00 41.40 H new ATOM 0 HG3 GLN A 51 6.276 -12.700 -11.413 1.00 41.40 H new ATOM 0 HE21 GLN A 51 6.188 -10.407 -11.219 1.00 71.23 H new ATOM 0 HE22 GLN A 51 7.645 -9.457 -10.912 1.00 71.23 H new ATOM 894 N GLY A 52 3.829 -14.605 -7.579 1.00 51.53 N ATOM 895 CA GLY A 52 3.305 -14.963 -6.259 1.00 3.21 C ATOM 896 C GLY A 52 2.799 -13.765 -5.457 1.00 2.24 C ATOM 897 O GLY A 52 3.055 -13.655 -4.256 1.00 33.41 O ATOM 0 H GLY A 52 3.140 -14.202 -8.214 1.00 51.53 H new ATOM 0 HA2 GLY A 52 2.491 -15.677 -6.382 1.00 3.21 H new ATOM 0 HA3 GLY A 52 4.087 -15.466 -5.691 1.00 3.21 H new ATOM 901 N VAL A 53 2.069 -12.869 -6.118 1.00 50.10 N ATOM 902 CA VAL A 53 1.542 -11.658 -5.473 1.00 54.11 C ATOM 903 C VAL A 53 0.006 -11.619 -5.510 1.00 61.42 C ATOM 904 O VAL A 53 -0.607 -11.888 -6.549 1.00 0.13 O ATOM 905 CB VAL A 53 2.099 -10.384 -6.159 1.00 2.42 C ATOM 906 CG1 VAL A 53 1.564 -9.112 -5.498 1.00 31.13 C ATOM 907 CG2 VAL A 53 3.628 -10.396 -6.154 1.00 10.15 C ATOM 0 H VAL A 53 1.826 -12.955 -7.105 1.00 50.10 H new ATOM 0 HA VAL A 53 1.866 -11.685 -4.432 1.00 54.11 H new ATOM 0 HB VAL A 53 1.756 -10.386 -7.194 1.00 2.42 H new ATOM 0 HG11 VAL A 53 1.975 -8.238 -6.004 1.00 31.13 H new ATOM 0 HG12 VAL A 53 0.476 -9.095 -5.569 1.00 31.13 H new ATOM 0 HG13 VAL A 53 1.859 -9.096 -4.449 1.00 31.13 H new ATOM 0 HG21 VAL A 53 4.001 -9.494 -6.640 1.00 10.15 H new ATOM 0 HG22 VAL A 53 3.988 -10.430 -5.126 1.00 10.15 H new ATOM 0 HG23 VAL A 53 3.987 -11.273 -6.693 1.00 10.15 H new ATOM 917 N ASP A 54 -0.609 -11.276 -4.378 1.00 3.50 N ATOM 918 CA ASP A 54 -2.070 -11.165 -4.296 1.00 41.12 C ATOM 919 C ASP A 54 -2.535 -9.769 -4.744 1.00 51.45 C ATOM 920 O ASP A 54 -2.568 -8.825 -3.953 1.00 11.14 O ATOM 921 CB ASP A 54 -2.539 -11.449 -2.865 1.00 64.12 C ATOM 922 CG ASP A 54 -2.111 -12.824 -2.377 1.00 1.24 C ATOM 923 OD1 ASP A 54 -0.983 -12.955 -1.860 1.00 74.34 O ATOM 924 OD2 ASP A 54 -2.905 -13.782 -2.503 1.00 62.21 O ATOM 0 H ASP A 54 -0.122 -11.070 -3.506 1.00 3.50 H new ATOM 0 HA ASP A 54 -2.512 -11.903 -4.966 1.00 41.12 H new ATOM 0 HB2 ASP A 54 -2.137 -10.688 -2.196 1.00 64.12 H new ATOM 0 HB3 ASP A 54 -3.625 -11.372 -2.820 1.00 64.12 H new ATOM 929 N VAL A 55 -2.879 -9.632 -6.023 1.00 64.02 N ATOM 930 CA VAL A 55 -3.254 -8.325 -6.580 1.00 44.34 C ATOM 931 C VAL A 55 -4.777 -8.145 -6.677 1.00 35.22 C ATOM 932 O VAL A 55 -5.481 -8.964 -7.266 1.00 20.31 O ATOM 933 CB VAL A 55 -2.637 -8.099 -7.983 1.00 20.34 C ATOM 934 CG1 VAL A 55 -2.974 -6.695 -8.491 1.00 52.42 C ATOM 935 CG2 VAL A 55 -1.123 -8.327 -7.960 1.00 44.12 C ATOM 0 H VAL A 55 -2.907 -10.401 -6.692 1.00 64.02 H new ATOM 0 HA VAL A 55 -2.856 -7.586 -5.885 1.00 44.34 H new ATOM 0 HB VAL A 55 -3.069 -8.826 -8.671 1.00 20.34 H new ATOM 0 HG11 VAL A 55 -2.534 -6.550 -9.478 1.00 52.42 H new ATOM 0 HG12 VAL A 55 -4.056 -6.582 -8.556 1.00 52.42 H new ATOM 0 HG13 VAL A 55 -2.572 -5.952 -7.802 1.00 52.42 H new ATOM 0 HG21 VAL A 55 -0.715 -8.162 -8.957 1.00 44.12 H new ATOM 0 HG22 VAL A 55 -0.661 -7.632 -7.259 1.00 44.12 H new ATOM 0 HG23 VAL A 55 -0.914 -9.350 -7.647 1.00 44.12 H new ATOM 945 N ARG A 56 -5.277 -7.071 -6.073 1.00 50.22 N ATOM 946 CA ARG A 56 -6.680 -6.665 -6.212 1.00 73.45 C ATOM 947 C ARG A 56 -6.778 -5.410 -7.094 1.00 63.24 C ATOM 948 O ARG A 56 -5.968 -4.490 -6.970 1.00 33.22 O ATOM 949 CB ARG A 56 -7.319 -6.393 -4.836 1.00 43.54 C ATOM 950 CG ARG A 56 -7.598 -7.644 -4.000 1.00 63.02 C ATOM 951 CD ARG A 56 -6.323 -8.391 -3.623 1.00 15.23 C ATOM 952 NE ARG A 56 -6.606 -9.605 -2.865 1.00 53.35 N ATOM 953 CZ ARG A 56 -6.281 -10.810 -3.250 1.00 64.34 C ATOM 954 NH1 ARG A 56 -5.684 -11.007 -4.385 1.00 74.31 N ATOM 955 NH2 ARG A 56 -6.566 -11.821 -2.500 1.00 13.30 N ATOM 0 H ARG A 56 -4.726 -6.456 -5.474 1.00 50.22 H new ATOM 0 HA ARG A 56 -7.225 -7.482 -6.684 1.00 73.45 H new ATOM 0 HB2 ARG A 56 -6.661 -5.734 -4.270 1.00 43.54 H new ATOM 0 HB3 ARG A 56 -8.256 -5.857 -4.986 1.00 43.54 H new ATOM 0 HG2 ARG A 56 -8.130 -7.359 -3.092 1.00 63.02 H new ATOM 0 HG3 ARG A 56 -8.255 -8.311 -4.558 1.00 63.02 H new ATOM 0 HD2 ARG A 56 -5.772 -8.648 -4.528 1.00 15.23 H new ATOM 0 HD3 ARG A 56 -5.680 -7.737 -3.034 1.00 15.23 H new ATOM 0 HE ARG A 56 -7.091 -9.506 -1.973 1.00 53.35 H new ATOM 0 HH11 ARG A 56 -5.463 -10.215 -4.989 1.00 74.31 H new ATOM 0 HH12 ARG A 56 -5.436 -11.953 -4.673 1.00 74.31 H new ATOM 0 HH21 ARG A 56 -7.043 -11.677 -1.610 1.00 13.30 H new ATOM 0 HH22 ARG A 56 -6.314 -12.764 -2.797 1.00 13.30 H new ATOM 969 N THR A 57 -7.762 -5.373 -7.981 1.00 61.35 N ATOM 970 CA THR A 57 -7.912 -4.254 -8.924 1.00 14.02 C ATOM 971 C THR A 57 -8.835 -3.164 -8.376 1.00 14.32 C ATOM 972 O THR A 57 -9.959 -3.443 -7.967 1.00 2.43 O ATOM 973 CB THR A 57 -8.476 -4.736 -10.280 1.00 24.40 C ATOM 974 OG1 THR A 57 -9.699 -5.461 -10.074 1.00 43.31 O ATOM 975 CG2 THR A 57 -7.476 -5.625 -11.006 1.00 34.13 C ATOM 0 H THR A 57 -8.472 -6.100 -8.074 1.00 61.35 H new ATOM 0 HA THR A 57 -6.914 -3.839 -9.065 1.00 14.02 H new ATOM 0 HB THR A 57 -8.669 -3.857 -10.895 1.00 24.40 H new ATOM 0 HG1 THR A 57 -10.217 -5.033 -9.361 1.00 43.31 H new ATOM 0 HG21 THR A 57 -7.900 -5.949 -11.956 1.00 34.13 H new ATOM 0 HG22 THR A 57 -6.559 -5.066 -11.190 1.00 34.13 H new ATOM 0 HG23 THR A 57 -7.252 -6.498 -10.392 1.00 34.13 H new ATOM 983 N VAL A 58 -8.361 -1.921 -8.379 1.00 41.43 N ATOM 984 CA VAL A 58 -9.181 -0.781 -7.952 1.00 2.45 C ATOM 985 C VAL A 58 -9.421 0.208 -9.097 1.00 24.12 C ATOM 986 O VAL A 58 -8.483 0.713 -9.720 1.00 3.33 O ATOM 987 CB VAL A 58 -8.574 -0.041 -6.732 1.00 21.22 C ATOM 988 CG1 VAL A 58 -8.989 -0.725 -5.435 1.00 23.23 C ATOM 989 CG2 VAL A 58 -7.053 0.041 -6.836 1.00 63.23 C ATOM 0 H VAL A 58 -7.416 -1.673 -8.671 1.00 41.43 H new ATOM 0 HA VAL A 58 -10.140 -1.200 -7.648 1.00 2.45 H new ATOM 0 HB VAL A 58 -8.962 0.978 -6.728 1.00 21.22 H new ATOM 0 HG11 VAL A 58 -8.555 -0.193 -4.588 1.00 23.23 H new ATOM 0 HG12 VAL A 58 -10.076 -0.716 -5.350 1.00 23.23 H new ATOM 0 HG13 VAL A 58 -8.634 -1.755 -5.437 1.00 23.23 H new ATOM 0 HG21 VAL A 58 -6.657 0.565 -5.966 1.00 63.23 H new ATOM 0 HG22 VAL A 58 -6.636 -0.965 -6.874 1.00 63.23 H new ATOM 0 HG23 VAL A 58 -6.779 0.582 -7.742 1.00 63.23 H new ATOM 999 N GLU A 59 -10.694 0.472 -9.366 1.00 5.12 N ATOM 1000 CA GLU A 59 -11.099 1.363 -10.457 1.00 13.43 C ATOM 1001 C GLU A 59 -11.352 2.804 -9.974 1.00 13.50 C ATOM 1002 O GLU A 59 -11.311 3.742 -10.773 1.00 20.25 O ATOM 1003 CB GLU A 59 -12.342 0.791 -11.154 1.00 61.12 C ATOM 1004 CG GLU A 59 -13.485 0.447 -10.203 1.00 63.12 C ATOM 1005 CD GLU A 59 -14.571 -0.387 -10.861 1.00 74.12 C ATOM 1006 OE1 GLU A 59 -14.418 -1.627 -10.927 1.00 22.41 O ATOM 1007 OE2 GLU A 59 -15.584 0.188 -11.311 1.00 65.24 O ATOM 0 H GLU A 59 -11.474 0.079 -8.840 1.00 5.12 H new ATOM 0 HA GLU A 59 -10.276 1.416 -11.170 1.00 13.43 H new ATOM 0 HB2 GLU A 59 -12.699 1.514 -11.888 1.00 61.12 H new ATOM 0 HB3 GLU A 59 -12.057 -0.107 -11.703 1.00 61.12 H new ATOM 0 HG2 GLU A 59 -13.087 -0.096 -9.346 1.00 63.12 H new ATOM 0 HG3 GLU A 59 -13.923 1.369 -9.821 1.00 63.12 H new ATOM 1014 N ASP A 60 -11.609 2.978 -8.675 1.00 2.15 N ATOM 1015 CA ASP A 60 -11.791 4.317 -8.092 1.00 21.23 C ATOM 1016 C ASP A 60 -11.672 4.299 -6.552 1.00 51.34 C ATOM 1017 O ASP A 60 -11.321 3.279 -5.957 1.00 72.13 O ATOM 1018 CB ASP A 60 -13.138 4.917 -8.522 1.00 70.44 C ATOM 1019 CG ASP A 60 -14.329 4.071 -8.110 1.00 10.02 C ATOM 1020 OD1 ASP A 60 -14.656 4.044 -6.905 1.00 41.33 O ATOM 1021 OD2 ASP A 60 -14.957 3.448 -8.988 1.00 75.03 O ATOM 0 H ASP A 60 -11.696 2.213 -8.006 1.00 2.15 H new ATOM 0 HA ASP A 60 -10.988 4.948 -8.473 1.00 21.23 H new ATOM 0 HB2 ASP A 60 -13.240 5.912 -8.088 1.00 70.44 H new ATOM 0 HB3 ASP A 60 -13.145 5.039 -9.605 1.00 70.44 H new ATOM 1026 N LYS A 61 -11.981 5.436 -5.921 1.00 51.43 N ATOM 1027 CA LYS A 61 -11.820 5.609 -4.468 1.00 44.43 C ATOM 1028 C LYS A 61 -12.800 4.732 -3.664 1.00 72.44 C ATOM 1029 O LYS A 61 -12.404 4.041 -2.722 1.00 60.22 O ATOM 1030 CB LYS A 61 -12.020 7.088 -4.113 1.00 21.44 C ATOM 1031 CG LYS A 61 -11.117 8.028 -4.909 1.00 21.55 C ATOM 1032 CD LYS A 61 -11.613 9.469 -4.859 1.00 24.31 C ATOM 1033 CE LYS A 61 -10.855 10.361 -5.837 1.00 25.24 C ATOM 1034 NZ LYS A 61 -9.466 10.655 -5.390 1.00 12.14 N ATOM 0 H LYS A 61 -12.348 6.260 -6.397 1.00 51.43 H new ATOM 0 HA LYS A 61 -10.813 5.290 -4.199 1.00 44.43 H new ATOM 0 HB2 LYS A 61 -13.061 7.359 -4.290 1.00 21.44 H new ATOM 0 HB3 LYS A 61 -11.830 7.228 -3.049 1.00 21.44 H new ATOM 0 HG2 LYS A 61 -10.103 7.979 -4.513 1.00 21.55 H new ATOM 0 HG3 LYS A 61 -11.071 7.696 -5.946 1.00 21.55 H new ATOM 0 HD2 LYS A 61 -12.677 9.496 -5.092 1.00 24.31 H new ATOM 0 HD3 LYS A 61 -11.498 9.858 -3.847 1.00 24.31 H new ATOM 0 HE2 LYS A 61 -10.823 9.877 -6.813 1.00 25.24 H new ATOM 0 HE3 LYS A 61 -11.398 11.298 -5.963 1.00 25.24 H new ATOM 0 HZ1 LYS A 61 -8.842 10.727 -6.219 1.00 12.14 H new ATOM 0 HZ2 LYS A 61 -9.452 11.554 -4.867 1.00 12.14 H new ATOM 0 HZ3 LYS A 61 -9.131 9.889 -4.771 1.00 12.14 H new ATOM 1048 N GLU A 62 -14.079 4.759 -4.033 1.00 32.31 N ATOM 1049 CA GLU A 62 -15.083 3.929 -3.359 1.00 45.42 C ATOM 1050 C GLU A 62 -14.811 2.437 -3.579 1.00 20.54 C ATOM 1051 O GLU A 62 -15.098 1.611 -2.716 1.00 52.32 O ATOM 1052 CB GLU A 62 -16.499 4.284 -3.830 1.00 44.14 C ATOM 1053 CG GLU A 62 -16.945 5.686 -3.429 1.00 40.22 C ATOM 1054 CD GLU A 62 -18.421 5.927 -3.695 1.00 40.43 C ATOM 1055 OE1 GLU A 62 -18.778 6.272 -4.841 1.00 23.30 O ATOM 1056 OE2 GLU A 62 -19.234 5.769 -2.758 1.00 55.43 O ATOM 0 H GLU A 62 -14.445 5.340 -4.787 1.00 32.31 H new ATOM 0 HA GLU A 62 -15.011 4.136 -2.291 1.00 45.42 H new ATOM 0 HB2 GLU A 62 -16.544 4.194 -4.915 1.00 44.14 H new ATOM 0 HB3 GLU A 62 -17.201 3.558 -3.421 1.00 44.14 H new ATOM 0 HG2 GLU A 62 -16.741 5.839 -2.369 1.00 40.22 H new ATOM 0 HG3 GLU A 62 -16.356 6.421 -3.977 1.00 40.22 H new ATOM 1063 N ASP A 63 -14.238 2.092 -4.727 1.00 0.34 N ATOM 1064 CA ASP A 63 -13.854 0.714 -4.997 1.00 52.42 C ATOM 1065 C ASP A 63 -12.608 0.355 -4.175 1.00 55.23 C ATOM 1066 O ASP A 63 -12.447 -0.777 -3.717 1.00 54.12 O ATOM 1067 CB ASP A 63 -13.602 0.532 -6.498 1.00 60.14 C ATOM 1068 CG ASP A 63 -13.332 -0.911 -6.875 1.00 71.41 C ATOM 1069 OD1 ASP A 63 -14.251 -1.748 -6.752 1.00 10.35 O ATOM 1070 OD2 ASP A 63 -12.210 -1.214 -7.306 1.00 21.13 O ATOM 0 H ASP A 63 -14.030 2.746 -5.482 1.00 0.34 H new ATOM 0 HA ASP A 63 -14.660 0.041 -4.704 1.00 52.42 H new ATOM 0 HB2 ASP A 63 -14.467 0.893 -7.054 1.00 60.14 H new ATOM 0 HB3 ASP A 63 -12.753 1.146 -6.797 1.00 60.14 H new ATOM 1075 N PHE A 64 -11.746 1.350 -3.968 1.00 5.42 N ATOM 1076 CA PHE A 64 -10.556 1.201 -3.127 1.00 23.21 C ATOM 1077 C PHE A 64 -10.920 0.701 -1.724 1.00 41.04 C ATOM 1078 O PHE A 64 -10.389 -0.311 -1.262 1.00 51.32 O ATOM 1079 CB PHE A 64 -9.804 2.540 -3.048 1.00 25.53 C ATOM 1080 CG PHE A 64 -8.558 2.507 -2.198 1.00 51.52 C ATOM 1081 CD1 PHE A 64 -7.434 1.808 -2.616 1.00 14.41 C ATOM 1082 CD2 PHE A 64 -8.509 3.176 -0.983 1.00 74.11 C ATOM 1083 CE1 PHE A 64 -6.292 1.779 -1.843 1.00 23.41 C ATOM 1084 CE2 PHE A 64 -7.368 3.148 -0.205 1.00 43.23 C ATOM 1085 CZ PHE A 64 -6.258 2.449 -0.635 1.00 60.00 C ATOM 0 H PHE A 64 -11.851 2.279 -4.376 1.00 5.42 H new ATOM 0 HA PHE A 64 -9.907 0.453 -3.581 1.00 23.21 H new ATOM 0 HB2 PHE A 64 -9.532 2.850 -4.057 1.00 25.53 H new ATOM 0 HB3 PHE A 64 -10.479 3.299 -2.652 1.00 25.53 H new ATOM 0 HD1 PHE A 64 -7.454 1.280 -3.558 1.00 14.41 H new ATOM 0 HD2 PHE A 64 -9.374 3.725 -0.642 1.00 74.11 H new ATOM 0 HE1 PHE A 64 -5.424 1.233 -2.182 1.00 23.41 H new ATOM 0 HE2 PHE A 64 -7.344 3.672 0.739 1.00 43.23 H new ATOM 0 HZ PHE A 64 -5.365 2.426 -0.028 1.00 60.00 H new ATOM 1095 N ARG A 65 -11.842 1.396 -1.058 1.00 10.32 N ATOM 1096 CA ARG A 65 -12.269 0.999 0.290 1.00 40.13 C ATOM 1097 C ARG A 65 -12.916 -0.401 0.304 1.00 55.31 C ATOM 1098 O ARG A 65 -12.725 -1.167 1.249 1.00 62.14 O ATOM 1099 CB ARG A 65 -13.226 2.042 0.892 1.00 74.44 C ATOM 1100 CG ARG A 65 -14.486 2.303 0.072 1.00 64.14 C ATOM 1101 CD ARG A 65 -15.454 3.226 0.805 1.00 31.22 C ATOM 1102 NE ARG A 65 -14.809 4.463 1.244 1.00 51.21 N ATOM 1103 CZ ARG A 65 -15.278 5.245 2.177 1.00 25.14 C ATOM 1104 NH1 ARG A 65 -16.421 5.007 2.735 1.00 2.31 N ATOM 1105 NH2 ARG A 65 -14.603 6.280 2.541 1.00 71.02 N ATOM 0 H ARG A 65 -12.305 2.229 -1.422 1.00 10.32 H new ATOM 0 HA ARG A 65 -11.372 0.950 0.908 1.00 40.13 H new ATOM 0 HB2 ARG A 65 -13.520 1.712 1.889 1.00 74.44 H new ATOM 0 HB3 ARG A 65 -12.687 2.982 1.013 1.00 74.44 H new ATOM 0 HG2 ARG A 65 -14.212 2.748 -0.884 1.00 64.14 H new ATOM 0 HG3 ARG A 65 -14.980 1.357 -0.147 1.00 64.14 H new ATOM 0 HD2 ARG A 65 -16.291 3.467 0.150 1.00 31.22 H new ATOM 0 HD3 ARG A 65 -15.866 2.706 1.670 1.00 31.22 H new ATOM 0 HE ARG A 65 -13.935 4.732 0.791 1.00 51.21 H new ATOM 0 HH11 ARG A 65 -16.970 4.197 2.447 1.00 2.31 H new ATOM 0 HH12 ARG A 65 -16.772 5.629 3.463 1.00 2.31 H new ATOM 0 HH21 ARG A 65 -13.706 6.485 2.100 1.00 71.02 H new ATOM 0 HH22 ARG A 65 -14.965 6.895 3.270 1.00 71.02 H new ATOM 1119 N GLU A 66 -13.658 -0.744 -0.751 1.00 13.14 N ATOM 1120 CA GLU A 66 -14.309 -2.061 -0.837 1.00 73.13 C ATOM 1121 C GLU A 66 -13.282 -3.206 -0.912 1.00 14.41 C ATOM 1122 O GLU A 66 -13.443 -4.232 -0.249 1.00 54.31 O ATOM 1123 CB GLU A 66 -15.266 -2.119 -2.037 1.00 43.33 C ATOM 1124 CG GLU A 66 -16.426 -1.127 -1.950 1.00 30.21 C ATOM 1125 CD GLU A 66 -17.225 -1.260 -0.658 1.00 33.23 C ATOM 1126 OE1 GLU A 66 -17.944 -2.269 -0.501 1.00 74.13 O ATOM 1127 OE2 GLU A 66 -17.124 -0.365 0.209 1.00 15.13 O ATOM 0 H GLU A 66 -13.825 -0.137 -1.553 1.00 13.14 H new ATOM 0 HA GLU A 66 -14.886 -2.196 0.078 1.00 73.13 H new ATOM 0 HB2 GLU A 66 -14.702 -1.925 -2.949 1.00 43.33 H new ATOM 0 HB3 GLU A 66 -15.669 -3.128 -2.120 1.00 43.33 H new ATOM 0 HG2 GLU A 66 -16.036 -0.112 -2.027 1.00 30.21 H new ATOM 0 HG3 GLU A 66 -17.091 -1.278 -2.800 1.00 30.21 H new ATOM 1134 N ASN A 67 -12.226 -3.029 -1.710 1.00 55.41 N ATOM 1135 CA ASN A 67 -11.137 -4.018 -1.771 1.00 62.31 C ATOM 1136 C ASN A 67 -10.452 -4.173 -0.399 1.00 61.43 C ATOM 1137 O ASN A 67 -10.020 -5.264 -0.026 1.00 61.43 O ATOM 1138 CB ASN A 67 -10.102 -3.633 -2.840 1.00 24.41 C ATOM 1139 CG ASN A 67 -10.593 -3.883 -4.261 1.00 11.42 C ATOM 1140 OD1 ASN A 67 -10.411 -4.963 -4.810 1.00 22.10 O ATOM 1141 ND2 ASN A 67 -11.210 -2.891 -4.868 1.00 60.35 N ATOM 0 H ASN A 67 -12.098 -2.220 -2.318 1.00 55.41 H new ATOM 0 HA ASN A 67 -11.578 -4.976 -2.046 1.00 62.31 H new ATOM 0 HB2 ASN A 67 -9.848 -2.579 -2.729 1.00 24.41 H new ATOM 0 HB3 ASN A 67 -9.187 -4.200 -2.673 1.00 24.41 H new ATOM 0 HD21 ASN A 67 -11.551 -3.010 -5.822 1.00 60.35 H new ATOM 0 HD22 ASN A 67 -11.347 -2.003 -4.385 1.00 60.35 H new ATOM 1148 N ILE A 68 -10.361 -3.070 0.346 1.00 25.22 N ATOM 1149 CA ILE A 68 -9.823 -3.095 1.713 1.00 13.11 C ATOM 1150 C ILE A 68 -10.721 -3.928 2.645 1.00 52.20 C ATOM 1151 O ILE A 68 -10.239 -4.622 3.541 1.00 74.30 O ATOM 1152 CB ILE A 68 -9.685 -1.661 2.291 1.00 44.22 C ATOM 1153 CG1 ILE A 68 -8.794 -0.800 1.384 1.00 60.44 C ATOM 1154 CG2 ILE A 68 -9.123 -1.699 3.715 1.00 63.31 C ATOM 1155 CD1 ILE A 68 -8.737 0.654 1.793 1.00 51.11 C ATOM 0 H ILE A 68 -10.653 -2.146 0.028 1.00 25.22 H new ATOM 0 HA ILE A 68 -8.836 -3.553 1.659 1.00 13.11 H new ATOM 0 HB ILE A 68 -10.678 -1.212 2.329 1.00 44.22 H new ATOM 0 HG12 ILE A 68 -7.784 -1.209 1.387 1.00 60.44 H new ATOM 0 HG13 ILE A 68 -9.161 -0.866 0.360 1.00 60.44 H new ATOM 0 HG21 ILE A 68 -9.035 -0.683 4.099 1.00 63.31 H new ATOM 0 HG22 ILE A 68 -9.793 -2.272 4.356 1.00 63.31 H new ATOM 0 HG23 ILE A 68 -8.140 -2.169 3.706 1.00 63.31 H new ATOM 0 HD11 ILE A 68 -8.089 1.200 1.107 1.00 51.11 H new ATOM 0 HD12 ILE A 68 -9.740 1.080 1.762 1.00 51.11 H new ATOM 0 HD13 ILE A 68 -8.341 0.732 2.805 1.00 51.11 H new ATOM 1167 N ARG A 69 -12.032 -3.859 2.420 1.00 2.41 N ATOM 1168 CA ARG A 69 -12.998 -4.601 3.239 1.00 32.51 C ATOM 1169 C ARG A 69 -12.840 -6.120 3.068 1.00 24.21 C ATOM 1170 O ARG A 69 -13.229 -6.893 3.946 1.00 62.20 O ATOM 1171 CB ARG A 69 -14.427 -4.143 2.921 1.00 43.32 C ATOM 1172 CG ARG A 69 -14.642 -2.673 3.260 1.00 23.04 C ATOM 1173 CD ARG A 69 -16.065 -2.196 3.008 1.00 52.15 C ATOM 1174 NE ARG A 69 -16.205 -0.788 3.368 1.00 2.24 N ATOM 1175 CZ ARG A 69 -17.322 -0.201 3.681 1.00 71.23 C ATOM 1176 NH1 ARG A 69 -18.454 -0.825 3.600 1.00 64.34 N ATOM 1177 NH2 ARG A 69 -17.305 1.035 4.056 1.00 11.44 N ATOM 0 H ARG A 69 -12.453 -3.298 1.679 1.00 2.41 H new ATOM 0 HA ARG A 69 -12.794 -4.381 4.287 1.00 32.51 H new ATOM 0 HB2 ARG A 69 -14.633 -4.305 1.863 1.00 43.32 H new ATOM 0 HB3 ARG A 69 -15.136 -4.752 3.481 1.00 43.32 H new ATOM 0 HG2 ARG A 69 -14.392 -2.509 4.308 1.00 23.04 H new ATOM 0 HG3 ARG A 69 -13.954 -2.067 2.670 1.00 23.04 H new ATOM 0 HD2 ARG A 69 -16.321 -2.336 1.958 1.00 52.15 H new ATOM 0 HD3 ARG A 69 -16.764 -2.797 3.589 1.00 52.15 H new ATOM 0 HE ARG A 69 -15.358 -0.219 3.374 1.00 2.24 H new ATOM 0 HH11 ARG A 69 -18.480 -1.795 3.286 1.00 64.34 H new ATOM 0 HH12 ARG A 69 -19.319 -0.346 3.850 1.00 64.34 H new ATOM 0 HH21 ARG A 69 -16.421 1.541 4.104 1.00 11.44 H new ATOM 0 HH22 ARG A 69 -18.176 1.505 4.304 1.00 11.44 H new ATOM 1191 N GLU A 70 -12.259 -6.546 1.945 1.00 51.42 N ATOM 1192 CA GLU A 70 -11.854 -7.947 1.788 1.00 14.15 C ATOM 1193 C GLU A 70 -10.740 -8.289 2.782 1.00 22.10 C ATOM 1194 O GLU A 70 -10.778 -9.323 3.441 1.00 4.02 O ATOM 1195 CB GLU A 70 -11.358 -8.243 0.367 1.00 11.31 C ATOM 1196 CG GLU A 70 -12.416 -8.125 -0.721 1.00 2.50 C ATOM 1197 CD GLU A 70 -11.936 -8.726 -2.034 1.00 14.41 C ATOM 1198 OE1 GLU A 70 -11.022 -8.149 -2.656 1.00 40.44 O ATOM 1199 OE2 GLU A 70 -12.436 -9.807 -2.419 1.00 11.14 O ATOM 0 H GLU A 70 -12.060 -5.952 1.140 1.00 51.42 H new ATOM 0 HA GLU A 70 -12.735 -8.560 1.982 1.00 14.15 H new ATOM 0 HB2 GLU A 70 -10.541 -7.560 0.134 1.00 11.31 H new ATOM 0 HB3 GLU A 70 -10.946 -9.252 0.345 1.00 11.31 H new ATOM 0 HG2 GLU A 70 -13.327 -8.630 -0.400 1.00 2.50 H new ATOM 0 HG3 GLU A 70 -12.669 -7.076 -0.871 1.00 2.50 H new ATOM 1206 N ILE A 71 -9.752 -7.396 2.885 1.00 44.23 N ATOM 1207 CA ILE A 71 -8.604 -7.586 3.785 1.00 11.22 C ATOM 1208 C ILE A 71 -9.055 -7.882 5.224 1.00 63.11 C ATOM 1209 O ILE A 71 -8.566 -8.820 5.854 1.00 21.14 O ATOM 1210 CB ILE A 71 -7.683 -6.335 3.780 1.00 21.02 C ATOM 1211 CG1 ILE A 71 -7.136 -6.077 2.362 1.00 53.33 C ATOM 1212 CG2 ILE A 71 -6.538 -6.483 4.786 1.00 3.34 C ATOM 1213 CD1 ILE A 71 -6.270 -4.836 2.255 1.00 4.14 C ATOM 0 H ILE A 71 -9.722 -6.526 2.353 1.00 44.23 H new ATOM 0 HA ILE A 71 -8.047 -8.446 3.413 1.00 11.22 H new ATOM 0 HB ILE A 71 -8.280 -5.475 4.084 1.00 21.02 H new ATOM 0 HG12 ILE A 71 -6.555 -6.943 2.044 1.00 53.33 H new ATOM 0 HG13 ILE A 71 -7.974 -5.984 1.671 1.00 53.33 H new ATOM 0 HG21 ILE A 71 -5.912 -5.591 4.758 1.00 3.34 H new ATOM 0 HG22 ILE A 71 -6.948 -6.607 5.788 1.00 3.34 H new ATOM 0 HG23 ILE A 71 -5.938 -7.356 4.529 1.00 3.34 H new ATOM 0 HD11 ILE A 71 -5.923 -4.722 1.228 1.00 4.14 H new ATOM 0 HD12 ILE A 71 -6.853 -3.960 2.541 1.00 4.14 H new ATOM 0 HD13 ILE A 71 -5.411 -4.933 2.919 1.00 4.14 H new ATOM 1225 N TRP A 72 -10.003 -7.091 5.728 1.00 4.13 N ATOM 1226 CA TRP A 72 -10.525 -7.272 7.091 1.00 44.11 C ATOM 1227 C TRP A 72 -11.178 -8.657 7.273 1.00 45.22 C ATOM 1228 O TRP A 72 -11.155 -9.232 8.363 1.00 2.11 O ATOM 1229 CB TRP A 72 -11.550 -6.174 7.426 1.00 73.32 C ATOM 1230 CG TRP A 72 -11.058 -4.769 7.185 1.00 22.55 C ATOM 1231 CD1 TRP A 72 -11.715 -3.775 6.515 1.00 23.21 C ATOM 1232 CD2 TRP A 72 -9.806 -4.203 7.604 1.00 4.41 C ATOM 1233 NE1 TRP A 72 -10.958 -2.631 6.499 1.00 71.45 N ATOM 1234 CE2 TRP A 72 -9.780 -2.869 7.154 1.00 32.41 C ATOM 1235 CE3 TRP A 72 -8.703 -4.693 8.314 1.00 71.13 C ATOM 1236 CZ2 TRP A 72 -8.701 -2.021 7.392 1.00 44.13 C ATOM 1237 CZ3 TRP A 72 -7.634 -3.849 8.549 1.00 13.52 C ATOM 1238 CH2 TRP A 72 -7.639 -2.527 8.088 1.00 62.54 C ATOM 0 H TRP A 72 -10.428 -6.318 5.216 1.00 4.13 H new ATOM 0 HA TRP A 72 -9.678 -7.201 7.773 1.00 44.11 H new ATOM 0 HB2 TRP A 72 -12.448 -6.339 6.831 1.00 73.32 H new ATOM 0 HB3 TRP A 72 -11.839 -6.270 8.473 1.00 73.32 H new ATOM 0 HD1 TRP A 72 -12.691 -3.876 6.063 1.00 23.21 H new ATOM 0 HE1 TRP A 72 -11.229 -1.747 6.069 1.00 71.45 H new ATOM 0 HE3 TRP A 72 -8.688 -5.712 8.672 1.00 71.13 H new ATOM 0 HZ2 TRP A 72 -8.703 -1.000 7.039 1.00 44.13 H new ATOM 0 HZ3 TRP A 72 -6.779 -4.216 9.098 1.00 13.52 H new ATOM 0 HH2 TRP A 72 -6.787 -1.894 8.286 1.00 62.54 H new ATOM 1249 N GLU A 73 -11.764 -9.186 6.199 1.00 3.44 N ATOM 1250 CA GLU A 73 -12.468 -10.477 6.245 1.00 2.43 C ATOM 1251 C GLU A 73 -11.528 -11.661 5.946 1.00 70.43 C ATOM 1252 O GLU A 73 -11.707 -12.758 6.477 1.00 52.14 O ATOM 1253 CB GLU A 73 -13.637 -10.471 5.240 1.00 41.20 C ATOM 1254 CG GLU A 73 -14.434 -11.775 5.198 1.00 21.24 C ATOM 1255 CD GLU A 73 -15.574 -11.745 4.188 1.00 4.53 C ATOM 1256 OE1 GLU A 73 -15.316 -11.950 2.983 1.00 71.51 O ATOM 1257 OE2 GLU A 73 -16.737 -11.519 4.597 1.00 30.35 O ATOM 0 H GLU A 73 -11.767 -8.742 5.281 1.00 3.44 H new ATOM 0 HA GLU A 73 -12.849 -10.608 7.258 1.00 2.43 H new ATOM 0 HB2 GLU A 73 -14.313 -9.653 5.491 1.00 41.20 H new ATOM 0 HB3 GLU A 73 -13.244 -10.266 4.244 1.00 41.20 H new ATOM 0 HG2 GLU A 73 -13.762 -12.597 4.954 1.00 21.24 H new ATOM 0 HG3 GLU A 73 -14.840 -11.978 6.189 1.00 21.24 H new ATOM 1264 N ARG A 74 -10.525 -11.435 5.099 1.00 10.55 N ATOM 1265 CA ARG A 74 -9.644 -12.516 4.628 1.00 54.11 C ATOM 1266 C ARG A 74 -8.383 -12.668 5.494 1.00 61.31 C ATOM 1267 O ARG A 74 -7.861 -13.774 5.656 1.00 15.00 O ATOM 1268 CB ARG A 74 -9.239 -12.262 3.168 1.00 71.31 C ATOM 1269 CG ARG A 74 -10.425 -12.169 2.207 1.00 71.34 C ATOM 1270 CD ARG A 74 -9.980 -12.046 0.751 1.00 51.54 C ATOM 1271 NE ARG A 74 -11.100 -11.752 -0.147 1.00 14.24 N ATOM 1272 CZ ARG A 74 -11.988 -12.630 -0.542 1.00 15.24 C ATOM 1273 NH1 ARG A 74 -11.901 -13.873 -0.185 1.00 54.21 N ATOM 1274 NH2 ARG A 74 -12.952 -12.260 -1.323 1.00 31.43 N ATOM 0 H ARG A 74 -10.298 -10.515 4.722 1.00 10.55 H new ATOM 0 HA ARG A 74 -10.208 -13.446 4.706 1.00 54.11 H new ATOM 0 HB2 ARG A 74 -8.667 -11.336 3.115 1.00 71.31 H new ATOM 0 HB3 ARG A 74 -8.578 -13.064 2.839 1.00 71.31 H new ATOM 0 HG2 ARG A 74 -11.052 -13.053 2.320 1.00 71.34 H new ATOM 0 HG3 ARG A 74 -11.038 -11.308 2.472 1.00 71.34 H new ATOM 0 HD2 ARG A 74 -9.232 -11.257 0.667 1.00 51.54 H new ATOM 0 HD3 ARG A 74 -9.501 -12.974 0.440 1.00 51.54 H new ATOM 0 HE ARG A 74 -11.195 -10.796 -0.489 1.00 14.24 H new ATOM 0 HH11 ARG A 74 -11.133 -14.180 0.412 1.00 54.21 H new ATOM 0 HH12 ARG A 74 -12.601 -14.545 -0.501 1.00 54.21 H new ATOM 0 HH21 ARG A 74 -13.017 -11.289 -1.628 1.00 31.43 H new ATOM 0 HH22 ARG A 74 -13.646 -12.940 -1.634 1.00 31.43 H new ATOM 1288 N TYR A 75 -7.886 -11.561 6.041 1.00 73.11 N ATOM 1289 CA TYR A 75 -6.648 -11.578 6.831 1.00 31.30 C ATOM 1290 C TYR A 75 -6.898 -11.088 8.270 1.00 11.30 C ATOM 1291 O TYR A 75 -6.693 -9.915 8.583 1.00 21.35 O ATOM 1292 CB TYR A 75 -5.577 -10.713 6.148 1.00 42.10 C ATOM 1293 CG TYR A 75 -5.445 -10.980 4.656 1.00 53.24 C ATOM 1294 CD1 TYR A 75 -4.997 -12.209 4.182 1.00 43.11 C ATOM 1295 CD2 TYR A 75 -5.781 -10.004 3.723 1.00 54.12 C ATOM 1296 CE1 TYR A 75 -4.889 -12.456 2.827 1.00 11.12 C ATOM 1297 CE2 TYR A 75 -5.674 -10.244 2.366 1.00 52.20 C ATOM 1298 CZ TYR A 75 -5.228 -11.471 1.923 1.00 23.03 C ATOM 1299 OH TYR A 75 -5.124 -11.715 0.573 1.00 75.21 O ATOM 0 H TYR A 75 -8.317 -10.641 5.954 1.00 73.11 H new ATOM 0 HA TYR A 75 -6.293 -12.607 6.887 1.00 31.30 H new ATOM 0 HB2 TYR A 75 -5.818 -9.661 6.301 1.00 42.10 H new ATOM 0 HB3 TYR A 75 -4.615 -10.893 6.628 1.00 42.10 H new ATOM 0 HD1 TYR A 75 -4.729 -12.983 4.886 1.00 43.11 H new ATOM 0 HD2 TYR A 75 -6.132 -9.042 4.065 1.00 54.12 H new ATOM 0 HE1 TYR A 75 -4.541 -13.416 2.477 1.00 11.12 H new ATOM 0 HE2 TYR A 75 -5.938 -9.474 1.656 1.00 52.20 H new ATOM 0 HH TYR A 75 -5.402 -10.919 0.074 1.00 75.21 H new ATOM 1309 N PRO A 76 -7.326 -11.996 9.173 1.00 14.42 N ATOM 1310 CA PRO A 76 -7.720 -11.632 10.551 1.00 13.53 C ATOM 1311 C PRO A 76 -6.553 -11.119 11.415 1.00 50.54 C ATOM 1312 O PRO A 76 -6.769 -10.398 12.391 1.00 23.30 O ATOM 1313 CB PRO A 76 -8.277 -12.947 11.117 1.00 2.34 C ATOM 1314 CG PRO A 76 -7.614 -14.016 10.314 1.00 33.11 C ATOM 1315 CD PRO A 76 -7.461 -13.447 8.928 1.00 45.13 C ATOM 0 HA PRO A 76 -8.431 -10.806 10.554 1.00 13.53 H new ATOM 0 HB2 PRO A 76 -8.049 -13.050 12.178 1.00 2.34 H new ATOM 0 HB3 PRO A 76 -9.362 -12.993 11.018 1.00 2.34 H new ATOM 0 HG2 PRO A 76 -6.645 -14.281 10.738 1.00 33.11 H new ATOM 0 HG3 PRO A 76 -8.215 -14.925 10.300 1.00 33.11 H new ATOM 0 HD2 PRO A 76 -6.586 -13.853 8.420 1.00 45.13 H new ATOM 0 HD3 PRO A 76 -8.325 -13.671 8.303 1.00 45.13 H new ATOM 1323 N GLN A 77 -5.325 -11.507 11.069 1.00 21.53 N ATOM 1324 CA GLN A 77 -4.134 -11.075 11.820 1.00 32.20 C ATOM 1325 C GLN A 77 -3.294 -10.058 11.024 1.00 73.30 C ATOM 1326 O GLN A 77 -2.211 -9.666 11.461 1.00 52.30 O ATOM 1327 CB GLN A 77 -3.285 -12.296 12.195 1.00 3.12 C ATOM 1328 CG GLN A 77 -4.029 -13.332 13.032 1.00 31.55 C ATOM 1329 CD GLN A 77 -4.378 -12.832 14.424 1.00 44.42 C ATOM 1330 OE1 GLN A 77 -3.617 -13.018 15.371 1.00 2.35 O ATOM 1331 NE2 GLN A 77 -5.523 -12.196 14.563 1.00 12.04 N ATOM 0 H GLN A 77 -5.124 -12.118 10.277 1.00 21.53 H new ATOM 0 HA GLN A 77 -4.471 -10.576 12.729 1.00 32.20 H new ATOM 0 HB2 GLN A 77 -2.926 -12.771 11.282 1.00 3.12 H new ATOM 0 HB3 GLN A 77 -2.407 -11.960 12.747 1.00 3.12 H new ATOM 0 HG2 GLN A 77 -4.945 -13.619 12.515 1.00 31.55 H new ATOM 0 HG3 GLN A 77 -3.417 -14.230 13.117 1.00 31.55 H new ATOM 0 HE21 GLN A 77 -6.131 -12.059 13.756 1.00 12.04 H new ATOM 0 HE22 GLN A 77 -5.801 -11.841 15.478 1.00 12.04 H new ATOM 1340 N LEU A 78 -3.806 -9.643 9.859 1.00 34.34 N ATOM 1341 CA LEU A 78 -3.172 -8.596 9.031 1.00 65.33 C ATOM 1342 C LEU A 78 -1.706 -8.913 8.659 1.00 24.55 C ATOM 1343 O LEU A 78 -0.878 -8.009 8.545 1.00 70.04 O ATOM 1344 CB LEU A 78 -3.250 -7.242 9.759 1.00 71.24 C ATOM 1345 CG LEU A 78 -4.673 -6.759 10.092 1.00 24.55 C ATOM 1346 CD1 LEU A 78 -4.640 -5.426 10.837 1.00 71.13 C ATOM 1347 CD2 LEU A 78 -5.513 -6.650 8.820 1.00 33.20 C ATOM 0 H LEU A 78 -4.667 -10.018 9.461 1.00 34.34 H new ATOM 0 HA LEU A 78 -3.727 -8.556 8.094 1.00 65.33 H new ATOM 0 HB2 LEU A 78 -2.681 -7.313 10.686 1.00 71.24 H new ATOM 0 HB3 LEU A 78 -2.762 -6.487 9.142 1.00 71.24 H new ATOM 0 HG LEU A 78 -5.137 -7.496 10.748 1.00 24.55 H new ATOM 0 HD11 LEU A 78 -5.659 -5.108 11.060 1.00 71.13 H new ATOM 0 HD12 LEU A 78 -4.085 -5.543 11.768 1.00 71.13 H new ATOM 0 HD13 LEU A 78 -4.153 -4.674 10.216 1.00 71.13 H new ATOM 0 HD21 LEU A 78 -6.516 -6.307 9.075 1.00 33.20 H new ATOM 0 HD22 LEU A 78 -5.049 -5.938 8.137 1.00 33.20 H new ATOM 0 HD23 LEU A 78 -5.574 -7.627 8.340 1.00 33.20 H new ATOM 1359 N ASP A 79 -1.401 -10.188 8.415 1.00 74.51 N ATOM 1360 CA ASP A 79 -0.033 -10.610 8.058 1.00 72.44 C ATOM 1361 C ASP A 79 0.289 -10.310 6.577 1.00 42.32 C ATOM 1362 O ASP A 79 0.933 -11.116 5.898 1.00 74.45 O ATOM 1363 CB ASP A 79 0.133 -12.117 8.302 1.00 23.35 C ATOM 1364 CG ASP A 79 -0.544 -12.588 9.569 1.00 44.52 C ATOM 1365 OD1 ASP A 79 -1.743 -12.945 9.502 1.00 64.35 O ATOM 1366 OD2 ASP A 79 0.113 -12.629 10.627 1.00 10.40 O ATOM 0 H ASP A 79 -2.077 -10.951 8.456 1.00 74.51 H new ATOM 0 HA ASP A 79 0.655 -10.045 8.687 1.00 72.44 H new ATOM 0 HB2 ASP A 79 -0.276 -12.664 7.453 1.00 23.35 H new ATOM 0 HB3 ASP A 79 1.195 -12.356 8.353 1.00 23.35 H new ATOM 1371 N VAL A 80 -0.143 -9.154 6.075 1.00 23.01 N ATOM 1372 CA VAL A 80 0.022 -8.825 4.652 1.00 71.12 C ATOM 1373 C VAL A 80 0.554 -7.400 4.435 1.00 41.44 C ATOM 1374 O VAL A 80 0.154 -6.458 5.119 1.00 65.02 O ATOM 1375 CB VAL A 80 -1.311 -8.988 3.870 1.00 2.51 C ATOM 1376 CG1 VAL A 80 -1.758 -10.449 3.851 1.00 52.51 C ATOM 1377 CG2 VAL A 80 -2.401 -8.093 4.461 1.00 14.42 C ATOM 0 H VAL A 80 -0.607 -8.431 6.625 1.00 23.01 H new ATOM 0 HA VAL A 80 0.758 -9.532 4.270 1.00 71.12 H new ATOM 0 HB VAL A 80 -1.138 -8.676 2.840 1.00 2.51 H new ATOM 0 HG11 VAL A 80 -2.693 -10.536 3.298 1.00 52.51 H new ATOM 0 HG12 VAL A 80 -0.993 -11.057 3.369 1.00 52.51 H new ATOM 0 HG13 VAL A 80 -1.907 -10.797 4.873 1.00 52.51 H new ATOM 0 HG21 VAL A 80 -3.325 -8.224 3.897 1.00 14.42 H new ATOM 0 HG22 VAL A 80 -2.570 -8.365 5.503 1.00 14.42 H new ATOM 0 HG23 VAL A 80 -2.086 -7.051 4.405 1.00 14.42 H new ATOM 1387 N VAL A 81 1.464 -7.255 3.474 1.00 32.22 N ATOM 1388 CA VAL A 81 1.957 -5.938 3.063 1.00 50.41 C ATOM 1389 C VAL A 81 1.080 -5.366 1.939 1.00 64.13 C ATOM 1390 O VAL A 81 1.105 -5.860 0.809 1.00 75.30 O ATOM 1391 CB VAL A 81 3.428 -6.006 2.579 1.00 31.04 C ATOM 1392 CG1 VAL A 81 3.941 -4.617 2.193 1.00 20.53 C ATOM 1393 CG2 VAL A 81 4.323 -6.639 3.643 1.00 32.33 C ATOM 0 H VAL A 81 1.877 -8.035 2.963 1.00 32.22 H new ATOM 0 HA VAL A 81 1.909 -5.286 3.935 1.00 50.41 H new ATOM 0 HB VAL A 81 3.461 -6.637 1.691 1.00 31.04 H new ATOM 0 HG11 VAL A 81 4.975 -4.692 1.857 1.00 20.53 H new ATOM 0 HG12 VAL A 81 3.326 -4.213 1.389 1.00 20.53 H new ATOM 0 HG13 VAL A 81 3.887 -3.956 3.058 1.00 20.53 H new ATOM 0 HG21 VAL A 81 5.350 -6.675 3.280 1.00 32.33 H new ATOM 0 HG22 VAL A 81 4.282 -6.043 4.555 1.00 32.33 H new ATOM 0 HG23 VAL A 81 3.977 -7.651 3.855 1.00 32.33 H new ATOM 1403 N VAL A 82 0.295 -4.342 2.256 1.00 31.34 N ATOM 1404 CA VAL A 82 -0.609 -3.731 1.275 1.00 54.53 C ATOM 1405 C VAL A 82 0.085 -2.589 0.515 1.00 23.22 C ATOM 1406 O VAL A 82 0.607 -1.660 1.122 1.00 23.23 O ATOM 1407 CB VAL A 82 -1.890 -3.189 1.963 1.00 74.51 C ATOM 1408 CG1 VAL A 82 -2.869 -2.617 0.938 1.00 31.44 C ATOM 1409 CG2 VAL A 82 -2.555 -4.282 2.800 1.00 42.23 C ATOM 0 H VAL A 82 0.263 -3.915 3.182 1.00 31.34 H new ATOM 0 HA VAL A 82 -0.888 -4.509 0.564 1.00 54.53 H new ATOM 0 HB VAL A 82 -1.596 -2.378 2.629 1.00 74.51 H new ATOM 0 HG11 VAL A 82 -3.756 -2.245 1.450 1.00 31.44 H new ATOM 0 HG12 VAL A 82 -2.393 -1.799 0.397 1.00 31.44 H new ATOM 0 HG13 VAL A 82 -3.157 -3.398 0.234 1.00 31.44 H new ATOM 0 HG21 VAL A 82 -3.451 -3.882 3.274 1.00 42.23 H new ATOM 0 HG22 VAL A 82 -2.827 -5.118 2.156 1.00 42.23 H new ATOM 0 HG23 VAL A 82 -1.861 -4.626 3.567 1.00 42.23 H new ATOM 1419 N ILE A 83 0.098 -2.666 -0.815 1.00 13.11 N ATOM 1420 CA ILE A 83 0.716 -1.622 -1.645 1.00 21.24 C ATOM 1421 C ILE A 83 -0.310 -0.995 -2.603 1.00 33.21 C ATOM 1422 O ILE A 83 -1.109 -1.697 -3.213 1.00 45.44 O ATOM 1423 CB ILE A 83 1.905 -2.181 -2.470 1.00 64.21 C ATOM 1424 CG1 ILE A 83 2.924 -2.870 -1.546 1.00 44.01 C ATOM 1425 CG2 ILE A 83 2.578 -1.061 -3.263 1.00 50.23 C ATOM 1426 CD1 ILE A 83 4.076 -3.521 -2.284 1.00 12.03 C ATOM 0 H ILE A 83 -0.310 -3.437 -1.344 1.00 13.11 H new ATOM 0 HA ILE A 83 1.087 -0.857 -0.963 1.00 21.24 H new ATOM 0 HB ILE A 83 1.520 -2.920 -3.173 1.00 64.21 H new ATOM 0 HG12 ILE A 83 3.322 -2.134 -0.847 1.00 44.01 H new ATOM 0 HG13 ILE A 83 2.410 -3.627 -0.954 1.00 44.01 H new ATOM 0 HG21 ILE A 83 3.410 -1.470 -3.836 1.00 50.23 H new ATOM 0 HG22 ILE A 83 1.855 -0.612 -3.944 1.00 50.23 H new ATOM 0 HG23 ILE A 83 2.950 -0.301 -2.576 1.00 50.23 H new ATOM 0 HD11 ILE A 83 4.752 -3.986 -1.566 1.00 12.03 H new ATOM 0 HD12 ILE A 83 3.690 -4.281 -2.963 1.00 12.03 H new ATOM 0 HD13 ILE A 83 4.616 -2.765 -2.854 1.00 12.03 H new ATOM 1438 N VAL A 84 -0.274 0.328 -2.733 1.00 14.33 N ATOM 1439 CA VAL A 84 -1.204 1.061 -3.601 1.00 61.01 C ATOM 1440 C VAL A 84 -0.440 1.893 -4.645 1.00 31.13 C ATOM 1441 O VAL A 84 0.530 2.581 -4.319 1.00 61.33 O ATOM 1442 CB VAL A 84 -2.122 1.996 -2.772 1.00 74.01 C ATOM 1443 CG1 VAL A 84 -3.154 2.689 -3.663 1.00 74.34 C ATOM 1444 CG2 VAL A 84 -2.806 1.221 -1.645 1.00 42.22 C ATOM 0 H VAL A 84 0.395 0.924 -2.245 1.00 14.33 H new ATOM 0 HA VAL A 84 -1.821 0.322 -4.113 1.00 61.01 H new ATOM 0 HB VAL A 84 -1.498 2.769 -2.324 1.00 74.01 H new ATOM 0 HG11 VAL A 84 -3.783 3.338 -3.054 1.00 74.34 H new ATOM 0 HG12 VAL A 84 -2.641 3.285 -4.418 1.00 74.34 H new ATOM 0 HG13 VAL A 84 -3.774 1.938 -4.153 1.00 74.34 H new ATOM 0 HG21 VAL A 84 -3.445 1.895 -1.076 1.00 42.22 H new ATOM 0 HG22 VAL A 84 -3.411 0.420 -2.069 1.00 42.22 H new ATOM 0 HG23 VAL A 84 -2.050 0.795 -0.986 1.00 42.22 H new ATOM 1454 N THR A 85 -0.895 1.842 -5.895 1.00 71.41 N ATOM 1455 CA THR A 85 -0.199 2.494 -7.020 1.00 30.25 C ATOM 1456 C THR A 85 -0.514 4.003 -7.143 1.00 23.45 C ATOM 1457 O THR A 85 -0.697 4.522 -8.249 1.00 3.43 O ATOM 1458 CB THR A 85 -0.560 1.795 -8.353 1.00 25.42 C ATOM 1459 OG1 THR A 85 -1.981 1.836 -8.564 1.00 33.43 O ATOM 1460 CG2 THR A 85 -0.091 0.343 -8.353 1.00 41.34 C ATOM 0 H THR A 85 -1.749 1.353 -6.163 1.00 71.41 H new ATOM 0 HA THR A 85 0.867 2.398 -6.811 1.00 30.25 H new ATOM 0 HB THR A 85 -0.054 2.327 -9.159 1.00 25.42 H new ATOM 0 HG1 THR A 85 -2.167 1.935 -9.521 1.00 33.43 H new ATOM 0 HG21 THR A 85 -0.357 -0.125 -9.301 1.00 41.34 H new ATOM 0 HG22 THR A 85 0.991 0.310 -8.223 1.00 41.34 H new ATOM 0 HG23 THR A 85 -0.571 -0.194 -7.535 1.00 41.34 H new ATOM 1468 N THR A 86 -0.542 4.710 -6.011 1.00 51.21 N ATOM 1469 CA THR A 86 -0.777 6.168 -6.000 1.00 65.34 C ATOM 1470 C THR A 86 -0.598 6.760 -4.595 1.00 63.15 C ATOM 1471 O THR A 86 -0.844 6.085 -3.600 1.00 11.31 O ATOM 1472 CB THR A 86 -2.197 6.536 -6.509 1.00 11.42 C ATOM 1473 OG1 THR A 86 -2.394 7.956 -6.433 1.00 0.33 O ATOM 1474 CG2 THR A 86 -3.283 5.829 -5.703 1.00 20.02 C ATOM 0 H THR A 86 -0.405 4.302 -5.086 1.00 51.21 H new ATOM 0 HA THR A 86 -0.034 6.592 -6.675 1.00 65.34 H new ATOM 0 HB THR A 86 -2.272 6.207 -7.545 1.00 11.42 H new ATOM 0 HG1 THR A 86 -3.291 8.180 -6.757 1.00 0.33 H new ATOM 0 HG21 THR A 86 -4.263 6.111 -6.088 1.00 20.02 H new ATOM 0 HG22 THR A 86 -3.156 4.750 -5.789 1.00 20.02 H new ATOM 0 HG23 THR A 86 -3.207 6.121 -4.656 1.00 20.02 H new ATOM 1482 N ASP A 87 -0.162 8.021 -4.524 1.00 51.33 N ATOM 1483 CA ASP A 87 -0.026 8.731 -3.241 1.00 63.34 C ATOM 1484 C ASP A 87 -1.070 9.861 -3.119 1.00 22.54 C ATOM 1485 O ASP A 87 -0.881 10.820 -2.364 1.00 33.04 O ATOM 1486 CB ASP A 87 1.403 9.288 -3.087 1.00 24.53 C ATOM 1487 CG ASP A 87 1.778 10.280 -4.179 1.00 61.50 C ATOM 1488 OD1 ASP A 87 2.149 9.841 -5.285 1.00 22.23 O ATOM 1489 OD2 ASP A 87 1.716 11.504 -3.936 1.00 30.31 O ATOM 0 H ASP A 87 0.104 8.575 -5.338 1.00 51.33 H new ATOM 0 HA ASP A 87 -0.210 8.020 -2.436 1.00 63.34 H new ATOM 0 HB2 ASP A 87 1.494 9.774 -2.116 1.00 24.53 H new ATOM 0 HB3 ASP A 87 2.112 8.460 -3.097 1.00 24.53 H new ATOM 1494 N ASP A 88 -2.181 9.723 -3.853 1.00 44.44 N ATOM 1495 CA ASP A 88 -3.260 10.721 -3.846 1.00 1.33 C ATOM 1496 C ASP A 88 -3.841 10.941 -2.438 1.00 1.50 C ATOM 1497 O ASP A 88 -3.974 10.004 -1.643 1.00 24.41 O ATOM 1498 CB ASP A 88 -4.376 10.304 -4.812 1.00 42.35 C ATOM 1499 CG ASP A 88 -5.521 11.306 -4.849 1.00 62.33 C ATOM 1500 OD1 ASP A 88 -5.430 12.296 -5.607 1.00 22.22 O ATOM 1501 OD2 ASP A 88 -6.511 11.113 -4.110 1.00 42.33 O ATOM 0 H ASP A 88 -2.358 8.925 -4.463 1.00 44.44 H new ATOM 0 HA ASP A 88 -2.826 11.666 -4.174 1.00 1.33 H new ATOM 0 HB2 ASP A 88 -3.962 10.194 -5.814 1.00 42.35 H new ATOM 0 HB3 ASP A 88 -4.761 9.328 -4.517 1.00 42.35 H new ATOM 1506 N LYS A 89 -4.215 12.190 -2.163 1.00 60.31 N ATOM 1507 CA LYS A 89 -4.750 12.591 -0.858 1.00 70.33 C ATOM 1508 C LYS A 89 -5.940 11.722 -0.428 1.00 33.43 C ATOM 1509 O LYS A 89 -5.961 11.172 0.676 1.00 62.11 O ATOM 1510 CB LYS A 89 -5.204 14.057 -0.906 1.00 41.14 C ATOM 1511 CG LYS A 89 -4.131 15.035 -1.373 1.00 1.40 C ATOM 1512 CD LYS A 89 -4.676 16.462 -1.462 1.00 12.05 C ATOM 1513 CE LYS A 89 -5.855 16.561 -2.426 1.00 53.23 C ATOM 1514 NZ LYS A 89 -6.411 17.940 -2.490 1.00 42.03 N ATOM 0 H LYS A 89 -4.157 12.954 -2.837 1.00 60.31 H new ATOM 0 HA LYS A 89 -3.949 12.460 -0.131 1.00 70.33 H new ATOM 0 HB2 LYS A 89 -6.064 14.136 -1.570 1.00 41.14 H new ATOM 0 HB3 LYS A 89 -5.540 14.353 0.088 1.00 41.14 H new ATOM 0 HG2 LYS A 89 -3.288 15.009 -0.683 1.00 1.40 H new ATOM 0 HG3 LYS A 89 -3.755 14.726 -2.348 1.00 1.40 H new ATOM 0 HD2 LYS A 89 -4.988 16.794 -0.472 1.00 12.05 H new ATOM 0 HD3 LYS A 89 -3.882 17.134 -1.789 1.00 12.05 H new ATOM 0 HE2 LYS A 89 -5.536 16.253 -3.422 1.00 53.23 H new ATOM 0 HE3 LYS A 89 -6.637 15.869 -2.114 1.00 53.23 H new ATOM 0 HZ1 LYS A 89 -7.209 17.962 -3.156 1.00 42.03 H new ATOM 0 HZ2 LYS A 89 -6.740 18.226 -1.546 1.00 42.03 H new ATOM 0 HZ3 LYS A 89 -5.673 18.597 -2.813 1.00 42.03 H new ATOM 1528 N GLU A 90 -6.925 11.595 -1.314 1.00 20.31 N ATOM 1529 CA GLU A 90 -8.179 10.919 -0.979 1.00 11.24 C ATOM 1530 C GLU A 90 -7.979 9.411 -0.802 1.00 13.50 C ATOM 1531 O GLU A 90 -8.535 8.818 0.112 1.00 32.31 O ATOM 1532 CB GLU A 90 -9.246 11.199 -2.046 1.00 72.23 C ATOM 1533 CG GLU A 90 -9.631 12.674 -2.149 1.00 13.15 C ATOM 1534 CD GLU A 90 -10.768 12.928 -3.129 1.00 51.34 C ATOM 1535 OE1 GLU A 90 -10.494 13.086 -4.337 1.00 4.11 O ATOM 1536 OE2 GLU A 90 -11.940 12.966 -2.697 1.00 53.00 O ATOM 0 H GLU A 90 -6.881 11.951 -2.269 1.00 20.31 H new ATOM 0 HA GLU A 90 -8.523 11.320 -0.026 1.00 11.24 H new ATOM 0 HB2 GLU A 90 -8.879 10.859 -3.014 1.00 72.23 H new ATOM 0 HB3 GLU A 90 -10.137 10.614 -1.820 1.00 72.23 H new ATOM 0 HG2 GLU A 90 -9.921 13.037 -1.163 1.00 13.15 H new ATOM 0 HG3 GLU A 90 -8.759 13.250 -2.457 1.00 13.15 H new ATOM 1543 N TRP A 91 -7.171 8.801 -1.662 1.00 3.21 N ATOM 1544 CA TRP A 91 -6.897 7.361 -1.566 1.00 22.05 C ATOM 1545 C TRP A 91 -6.271 6.992 -0.211 1.00 25.25 C ATOM 1546 O TRP A 91 -6.648 5.996 0.408 1.00 1.34 O ATOM 1547 CB TRP A 91 -5.995 6.910 -2.721 1.00 21.30 C ATOM 1548 CG TRP A 91 -6.693 6.931 -4.053 1.00 23.15 C ATOM 1549 CD1 TRP A 91 -7.185 8.024 -4.709 1.00 21.32 C ATOM 1550 CD2 TRP A 91 -6.990 5.802 -4.884 1.00 72.21 C ATOM 1551 NE1 TRP A 91 -7.763 7.643 -5.895 1.00 0.23 N ATOM 1552 CE2 TRP A 91 -7.652 6.286 -6.027 1.00 74.53 C ATOM 1553 CE3 TRP A 91 -6.751 4.431 -4.775 1.00 63.11 C ATOM 1554 CZ2 TRP A 91 -8.083 5.447 -7.050 1.00 33.30 C ATOM 1555 CZ3 TRP A 91 -7.181 3.598 -5.792 1.00 22.22 C ATOM 1556 CH2 TRP A 91 -7.839 4.109 -6.918 1.00 10.25 C ATOM 0 H TRP A 91 -6.694 9.272 -2.431 1.00 3.21 H new ATOM 0 HA TRP A 91 -7.849 6.836 -1.640 1.00 22.05 H new ATOM 0 HB2 TRP A 91 -5.119 7.558 -2.765 1.00 21.30 H new ATOM 0 HB3 TRP A 91 -5.635 5.901 -2.521 1.00 21.30 H new ATOM 0 HD1 TRP A 91 -7.128 9.040 -4.347 1.00 21.32 H new ATOM 0 HE1 TRP A 91 -8.204 8.270 -6.568 1.00 0.23 H new ATOM 0 HE3 TRP A 91 -6.240 4.028 -3.913 1.00 63.11 H new ATOM 0 HZ2 TRP A 91 -8.592 5.839 -7.918 1.00 33.30 H new ATOM 0 HZ3 TRP A 91 -7.006 2.535 -5.717 1.00 22.22 H new ATOM 0 HH2 TRP A 91 -8.160 3.433 -7.697 1.00 10.25 H new ATOM 1567 N ILE A 92 -5.325 7.805 0.255 1.00 54.33 N ATOM 1568 CA ILE A 92 -4.750 7.623 1.593 1.00 33.42 C ATOM 1569 C ILE A 92 -5.826 7.831 2.676 1.00 30.22 C ATOM 1570 O ILE A 92 -5.902 7.087 3.654 1.00 14.32 O ATOM 1571 CB ILE A 92 -3.574 8.607 1.840 1.00 25.25 C ATOM 1572 CG1 ILE A 92 -2.479 8.410 0.776 1.00 43.31 C ATOM 1573 CG2 ILE A 92 -2.999 8.427 3.246 1.00 63.32 C ATOM 1574 CD1 ILE A 92 -1.307 9.361 0.916 1.00 33.14 C ATOM 0 H ILE A 92 -4.940 8.592 -0.267 1.00 54.33 H new ATOM 0 HA ILE A 92 -4.370 6.603 1.650 1.00 33.42 H new ATOM 0 HB ILE A 92 -3.956 9.625 1.760 1.00 25.25 H new ATOM 0 HG12 ILE A 92 -2.111 7.385 0.833 1.00 43.31 H new ATOM 0 HG13 ILE A 92 -2.920 8.536 -0.213 1.00 43.31 H new ATOM 0 HG21 ILE A 92 -2.177 9.127 3.395 1.00 63.32 H new ATOM 0 HG22 ILE A 92 -3.777 8.619 3.985 1.00 63.32 H new ATOM 0 HG23 ILE A 92 -2.633 7.407 3.361 1.00 63.32 H new ATOM 0 HD11 ILE A 92 -0.579 9.159 0.130 1.00 33.14 H new ATOM 0 HD12 ILE A 92 -1.660 10.389 0.828 1.00 33.14 H new ATOM 0 HD13 ILE A 92 -0.838 9.220 1.890 1.00 33.14 H new ATOM 1586 N LYS A 93 -6.667 8.842 2.467 1.00 53.50 N ATOM 1587 CA LYS A 93 -7.742 9.193 3.402 1.00 10.33 C ATOM 1588 C LYS A 93 -8.777 8.053 3.548 1.00 51.52 C ATOM 1589 O LYS A 93 -9.135 7.675 4.666 1.00 35.24 O ATOM 1590 CB LYS A 93 -8.392 10.510 2.919 1.00 23.12 C ATOM 1591 CG LYS A 93 -9.548 11.046 3.776 1.00 32.25 C ATOM 1592 CD LYS A 93 -10.891 10.412 3.415 1.00 52.40 C ATOM 1593 CE LYS A 93 -11.222 10.563 1.931 1.00 11.12 C ATOM 1594 NZ LYS A 93 -12.502 9.895 1.581 1.00 30.21 N ATOM 0 H LYS A 93 -6.625 9.444 1.644 1.00 53.50 H new ATOM 0 HA LYS A 93 -7.326 9.338 4.399 1.00 10.33 H new ATOM 0 HB2 LYS A 93 -7.618 11.276 2.868 1.00 23.12 H new ATOM 0 HB3 LYS A 93 -8.759 10.360 1.904 1.00 23.12 H new ATOM 0 HG2 LYS A 93 -9.333 10.858 4.828 1.00 32.25 H new ATOM 0 HG3 LYS A 93 -9.616 12.127 3.653 1.00 32.25 H new ATOM 0 HD2 LYS A 93 -10.873 9.354 3.675 1.00 52.40 H new ATOM 0 HD3 LYS A 93 -11.680 10.873 4.010 1.00 52.40 H new ATOM 0 HE2 LYS A 93 -11.283 11.621 1.678 1.00 11.12 H new ATOM 0 HE3 LYS A 93 -10.415 10.139 1.333 1.00 11.12 H new ATOM 0 HZ1 LYS A 93 -12.406 9.420 0.661 1.00 30.21 H new ATOM 0 HZ2 LYS A 93 -12.737 9.192 2.310 1.00 30.21 H new ATOM 0 HZ3 LYS A 93 -13.260 10.605 1.527 1.00 30.21 H new ATOM 1608 N ASP A 94 -9.240 7.502 2.422 1.00 73.41 N ATOM 1609 CA ASP A 94 -10.225 6.409 2.431 1.00 25.10 C ATOM 1610 C ASP A 94 -9.701 5.167 3.179 1.00 33.12 C ATOM 1611 O ASP A 94 -10.455 4.505 3.898 1.00 22.11 O ATOM 1612 CB ASP A 94 -10.633 6.037 0.995 1.00 42.54 C ATOM 1613 CG ASP A 94 -11.631 7.018 0.398 1.00 53.23 C ATOM 1614 OD1 ASP A 94 -12.850 6.808 0.574 1.00 55.45 O ATOM 1615 OD2 ASP A 94 -11.212 8.005 -0.239 1.00 11.21 O ATOM 0 H ASP A 94 -8.949 7.794 1.489 1.00 73.41 H new ATOM 0 HA ASP A 94 -11.103 6.768 2.967 1.00 25.10 H new ATOM 0 HB2 ASP A 94 -9.743 6.001 0.366 1.00 42.54 H new ATOM 0 HB3 ASP A 94 -11.066 5.037 0.992 1.00 42.54 H new ATOM 1620 N PHE A 95 -8.414 4.852 3.009 1.00 30.20 N ATOM 1621 CA PHE A 95 -7.797 3.736 3.737 1.00 64.32 C ATOM 1622 C PHE A 95 -7.891 3.962 5.255 1.00 32.43 C ATOM 1623 O PHE A 95 -8.224 3.049 6.017 1.00 25.11 O ATOM 1624 CB PHE A 95 -6.324 3.565 3.328 1.00 72.11 C ATOM 1625 CG PHE A 95 -5.665 2.336 3.919 1.00 32.23 C ATOM 1626 CD1 PHE A 95 -5.078 2.373 5.179 1.00 4.44 C ATOM 1627 CD2 PHE A 95 -5.645 1.139 3.216 1.00 62.33 C ATOM 1628 CE1 PHE A 95 -4.490 1.244 5.721 1.00 52.43 C ATOM 1629 CE2 PHE A 95 -5.055 0.010 3.754 1.00 30.43 C ATOM 1630 CZ PHE A 95 -4.479 0.061 5.006 1.00 2.45 C ATOM 0 H PHE A 95 -7.783 5.348 2.380 1.00 30.20 H new ATOM 0 HA PHE A 95 -8.341 2.827 3.479 1.00 64.32 H new ATOM 0 HB2 PHE A 95 -6.262 3.512 2.241 1.00 72.11 H new ATOM 0 HB3 PHE A 95 -5.766 4.449 3.636 1.00 72.11 H new ATOM 0 HD1 PHE A 95 -5.081 3.295 5.742 1.00 4.44 H new ATOM 0 HD2 PHE A 95 -6.096 1.089 2.236 1.00 62.33 H new ATOM 0 HE1 PHE A 95 -4.040 1.287 6.702 1.00 52.43 H new ATOM 0 HE2 PHE A 95 -5.045 -0.913 3.193 1.00 30.43 H new ATOM 0 HZ PHE A 95 -4.020 -0.821 5.427 1.00 2.45 H new ATOM 1640 N ILE A 96 -7.586 5.188 5.678 1.00 23.52 N ATOM 1641 CA ILE A 96 -7.659 5.573 7.090 1.00 32.04 C ATOM 1642 C ILE A 96 -9.076 5.383 7.654 1.00 45.04 C ATOM 1643 O ILE A 96 -9.247 4.837 8.748 1.00 51.40 O ATOM 1644 CB ILE A 96 -7.219 7.048 7.286 1.00 72.40 C ATOM 1645 CG1 ILE A 96 -5.770 7.244 6.811 1.00 71.41 C ATOM 1646 CG2 ILE A 96 -7.366 7.474 8.746 1.00 42.23 C ATOM 1647 CD1 ILE A 96 -5.295 8.680 6.893 1.00 3.05 C ATOM 0 H ILE A 96 -7.283 5.939 5.058 1.00 23.52 H new ATOM 0 HA ILE A 96 -6.977 4.920 7.635 1.00 32.04 H new ATOM 0 HB ILE A 96 -7.872 7.679 6.683 1.00 72.40 H new ATOM 0 HG12 ILE A 96 -5.111 6.617 7.412 1.00 71.41 H new ATOM 0 HG13 ILE A 96 -5.684 6.900 5.780 1.00 71.41 H new ATOM 0 HG21 ILE A 96 -7.051 8.512 8.856 1.00 42.23 H new ATOM 0 HG22 ILE A 96 -8.408 7.377 9.050 1.00 42.23 H new ATOM 0 HG23 ILE A 96 -6.744 6.837 9.375 1.00 42.23 H new ATOM 0 HD11 ILE A 96 -4.265 8.743 6.542 1.00 3.05 H new ATOM 0 HD12 ILE A 96 -5.930 9.309 6.269 1.00 3.05 H new ATOM 0 HD13 ILE A 96 -5.348 9.022 7.927 1.00 3.05 H new ATOM 1659 N GLU A 97 -10.086 5.829 6.900 1.00 25.22 N ATOM 1660 CA GLU A 97 -11.491 5.669 7.311 1.00 52.10 C ATOM 1661 C GLU A 97 -11.806 4.209 7.657 1.00 40.34 C ATOM 1662 O GLU A 97 -12.140 3.884 8.799 1.00 30.32 O ATOM 1663 CB GLU A 97 -12.441 6.107 6.187 1.00 32.31 C ATOM 1664 CG GLU A 97 -12.367 7.580 5.811 1.00 52.35 C ATOM 1665 CD GLU A 97 -13.381 7.937 4.731 1.00 73.12 C ATOM 1666 OE1 GLU A 97 -14.596 7.944 5.028 1.00 1.12 O ATOM 1667 OE2 GLU A 97 -12.976 8.176 3.576 1.00 12.55 O ATOM 0 H GLU A 97 -9.961 6.302 6.005 1.00 25.22 H new ATOM 0 HA GLU A 97 -11.637 6.295 8.191 1.00 52.10 H new ATOM 0 HB2 GLU A 97 -12.227 5.511 5.300 1.00 32.31 H new ATOM 0 HB3 GLU A 97 -13.463 5.876 6.487 1.00 32.31 H new ATOM 0 HG2 GLU A 97 -12.547 8.191 6.696 1.00 52.35 H new ATOM 0 HG3 GLU A 97 -11.363 7.816 5.460 1.00 52.35 H new ATOM 1674 N GLU A 98 -11.659 3.338 6.661 1.00 13.52 N ATOM 1675 CA GLU A 98 -11.985 1.918 6.804 1.00 61.00 C ATOM 1676 C GLU A 98 -11.308 1.298 8.032 1.00 1.31 C ATOM 1677 O GLU A 98 -11.957 0.645 8.853 1.00 31.12 O ATOM 1678 CB GLU A 98 -11.573 1.156 5.537 1.00 32.03 C ATOM 1679 CG GLU A 98 -12.348 1.572 4.287 1.00 72.04 C ATOM 1680 CD GLU A 98 -13.843 1.308 4.402 1.00 40.41 C ATOM 1681 OE1 GLU A 98 -14.221 0.221 4.878 1.00 14.33 O ATOM 1682 OE2 GLU A 98 -14.649 2.172 4.000 1.00 65.33 O ATOM 0 H GLU A 98 -11.313 3.593 5.736 1.00 13.52 H new ATOM 0 HA GLU A 98 -13.063 1.838 6.945 1.00 61.00 H new ATOM 0 HB2 GLU A 98 -10.508 1.311 5.361 1.00 32.03 H new ATOM 0 HB3 GLU A 98 -11.717 0.088 5.704 1.00 32.03 H new ATOM 0 HG2 GLU A 98 -12.185 2.634 4.101 1.00 72.04 H new ATOM 0 HG3 GLU A 98 -11.954 1.033 3.425 1.00 72.04 H new ATOM 1689 N ALA A 99 -10.007 1.522 8.160 1.00 74.10 N ATOM 1690 CA ALA A 99 -9.227 0.961 9.262 1.00 4.33 C ATOM 1691 C ALA A 99 -9.712 1.466 10.634 1.00 41.02 C ATOM 1692 O ALA A 99 -9.987 0.671 11.538 1.00 63.40 O ATOM 1693 CB ALA A 99 -7.752 1.277 9.060 1.00 23.44 C ATOM 0 H ALA A 99 -9.464 2.092 7.511 1.00 74.10 H new ATOM 0 HA ALA A 99 -9.369 -0.120 9.257 1.00 4.33 H new ATOM 0 HB1 ALA A 99 -7.174 0.857 9.883 1.00 23.44 H new ATOM 0 HB2 ALA A 99 -7.412 0.843 8.120 1.00 23.44 H new ATOM 0 HB3 ALA A 99 -7.612 2.358 9.032 1.00 23.44 H new ATOM 1699 N LYS A 100 -9.837 2.782 10.783 1.00 32.32 N ATOM 1700 CA LYS A 100 -10.248 3.375 12.063 1.00 65.12 C ATOM 1701 C LYS A 100 -11.689 2.986 12.445 1.00 60.13 C ATOM 1702 O LYS A 100 -12.049 3.009 13.621 1.00 0.14 O ATOM 1703 CB LYS A 100 -10.099 4.901 12.022 1.00 22.44 C ATOM 1704 CG LYS A 100 -8.647 5.365 11.910 1.00 2.24 C ATOM 1705 CD LYS A 100 -8.516 6.887 11.959 1.00 51.25 C ATOM 1706 CE LYS A 100 -9.008 7.471 13.280 1.00 24.51 C ATOM 1707 NZ LYS A 100 -8.271 6.927 14.452 1.00 65.30 N ATOM 0 H LYS A 100 -9.662 3.459 10.041 1.00 32.32 H new ATOM 0 HA LYS A 100 -9.587 2.974 12.832 1.00 65.12 H new ATOM 0 HB2 LYS A 100 -10.664 5.291 11.176 1.00 22.44 H new ATOM 0 HB3 LYS A 100 -10.540 5.326 12.923 1.00 22.44 H new ATOM 0 HG2 LYS A 100 -8.065 4.927 12.721 1.00 2.24 H new ATOM 0 HG3 LYS A 100 -8.222 4.996 10.977 1.00 2.24 H new ATOM 0 HD2 LYS A 100 -7.473 7.164 11.809 1.00 51.25 H new ATOM 0 HD3 LYS A 100 -9.084 7.324 11.138 1.00 51.25 H new ATOM 0 HE2 LYS A 100 -8.899 8.555 13.257 1.00 24.51 H new ATOM 0 HE3 LYS A 100 -10.071 7.260 13.393 1.00 24.51 H new ATOM 0 HZ1 LYS A 100 -8.676 7.316 15.328 1.00 65.30 H new ATOM 0 HZ2 LYS A 100 -8.353 5.890 14.463 1.00 65.30 H new ATOM 0 HZ3 LYS A 100 -7.268 7.194 14.386 1.00 65.30 H new ATOM 1721 N GLU A 101 -12.511 2.636 11.454 1.00 44.14 N ATOM 1722 CA GLU A 101 -13.870 2.141 11.723 1.00 5.50 C ATOM 1723 C GLU A 101 -13.840 0.760 12.396 1.00 24.54 C ATOM 1724 O GLU A 101 -14.685 0.449 13.237 1.00 32.12 O ATOM 1725 CB GLU A 101 -14.695 2.077 10.428 1.00 35.35 C ATOM 1726 CG GLU A 101 -15.003 3.445 9.832 1.00 5.45 C ATOM 1727 CD GLU A 101 -15.866 3.362 8.583 1.00 73.33 C ATOM 1728 OE1 GLU A 101 -17.089 3.149 8.716 1.00 42.53 O ATOM 1729 OE2 GLU A 101 -15.327 3.509 7.468 1.00 14.40 O ATOM 0 H GLU A 101 -12.266 2.684 10.465 1.00 44.14 H new ATOM 0 HA GLU A 101 -14.344 2.845 12.408 1.00 5.50 H new ATOM 0 HB2 GLU A 101 -14.154 1.483 9.692 1.00 35.35 H new ATOM 0 HB3 GLU A 101 -15.632 1.559 10.630 1.00 35.35 H new ATOM 0 HG2 GLU A 101 -15.510 4.056 10.579 1.00 5.45 H new ATOM 0 HG3 GLU A 101 -14.068 3.950 9.589 1.00 5.45 H new ATOM 1736 N ARG A 102 -12.859 -0.064 12.023 1.00 75.22 N ATOM 1737 CA ARG A 102 -12.682 -1.393 12.636 1.00 11.14 C ATOM 1738 C ARG A 102 -11.790 -1.309 13.886 1.00 4.04 C ATOM 1739 O ARG A 102 -11.518 -2.318 14.538 1.00 63.23 O ATOM 1740 CB ARG A 102 -12.081 -2.389 11.622 1.00 31.42 C ATOM 1741 CG ARG A 102 -13.059 -2.875 10.547 1.00 42.03 C ATOM 1742 CD ARG A 102 -13.612 -1.724 9.716 1.00 15.45 C ATOM 1743 NE ARG A 102 -14.413 -2.173 8.581 1.00 63.43 N ATOM 1744 CZ ARG A 102 -14.656 -1.433 7.534 1.00 31.43 C ATOM 1745 NH1 ARG A 102 -14.222 -0.217 7.478 1.00 32.11 N ATOM 1746 NH2 ARG A 102 -15.342 -1.900 6.543 1.00 15.21 N ATOM 0 H ARG A 102 -12.174 0.160 11.302 1.00 75.22 H new ATOM 0 HA ARG A 102 -13.666 -1.753 12.937 1.00 11.14 H new ATOM 0 HB2 ARG A 102 -11.228 -1.918 11.132 1.00 31.42 H new ATOM 0 HB3 ARG A 102 -11.700 -3.254 12.165 1.00 31.42 H new ATOM 0 HG2 ARG A 102 -12.554 -3.585 9.892 1.00 42.03 H new ATOM 0 HG3 ARG A 102 -13.883 -3.409 11.021 1.00 42.03 H new ATOM 0 HD2 ARG A 102 -14.222 -1.083 10.353 1.00 15.45 H new ATOM 0 HD3 ARG A 102 -12.784 -1.116 9.351 1.00 15.45 H new ATOM 0 HE ARG A 102 -14.803 -3.115 8.608 1.00 63.43 H new ATOM 0 HH11 ARG A 102 -13.686 0.170 8.255 1.00 32.11 H new ATOM 0 HH12 ARG A 102 -14.415 0.356 6.657 1.00 32.11 H new ATOM 0 HH21 ARG A 102 -15.699 -2.855 6.575 1.00 15.21 H new ATOM 0 HH22 ARG A 102 -15.527 -1.313 5.729 1.00 15.21 H new ATOM 1760 N GLY A 103 -11.337 -0.098 14.207 1.00 53.42 N ATOM 1761 CA GLY A 103 -10.505 0.119 15.385 1.00 23.14 C ATOM 1762 C GLY A 103 -9.117 -0.510 15.280 1.00 62.35 C ATOM 1763 O GLY A 103 -8.625 -1.107 16.241 1.00 10.45 O ATOM 0 H GLY A 103 -11.533 0.745 13.668 1.00 53.42 H new ATOM 0 HA2 GLY A 103 -10.397 1.191 15.550 1.00 23.14 H new ATOM 0 HA3 GLY A 103 -11.014 -0.289 16.259 1.00 23.14 H new ATOM 1767 N VAL A 104 -8.480 -0.386 14.115 1.00 20.30 N ATOM 1768 CA VAL A 104 -7.125 -0.922 13.912 1.00 62.42 C ATOM 1769 C VAL A 104 -6.098 0.195 13.640 1.00 32.10 C ATOM 1770 O VAL A 104 -6.440 1.271 13.143 1.00 64.30 O ATOM 1771 CB VAL A 104 -7.087 -1.966 12.761 1.00 11.13 C ATOM 1772 CG1 VAL A 104 -7.884 -3.215 13.134 1.00 44.41 C ATOM 1773 CG2 VAL A 104 -7.612 -1.368 11.458 1.00 50.51 C ATOM 0 H VAL A 104 -8.875 0.079 13.297 1.00 20.30 H new ATOM 0 HA VAL A 104 -6.850 -1.420 14.842 1.00 62.42 H new ATOM 0 HB VAL A 104 -6.047 -2.253 12.608 1.00 11.13 H new ATOM 0 HG11 VAL A 104 -7.843 -3.931 12.313 1.00 44.41 H new ATOM 0 HG12 VAL A 104 -7.457 -3.665 14.030 1.00 44.41 H new ATOM 0 HG13 VAL A 104 -8.922 -2.941 13.325 1.00 44.41 H new ATOM 0 HG21 VAL A 104 -7.574 -2.121 10.671 1.00 50.51 H new ATOM 0 HG22 VAL A 104 -8.642 -1.041 11.597 1.00 50.51 H new ATOM 0 HG23 VAL A 104 -6.995 -0.515 11.175 1.00 50.51 H new ATOM 1783 N GLU A 105 -4.842 -0.075 13.983 1.00 75.15 N ATOM 1784 CA GLU A 105 -3.750 0.892 13.822 1.00 45.30 C ATOM 1785 C GLU A 105 -3.342 1.053 12.348 1.00 31.45 C ATOM 1786 O GLU A 105 -3.021 0.076 11.663 1.00 44.31 O ATOM 1787 CB GLU A 105 -2.540 0.443 14.652 1.00 41.01 C ATOM 1788 CG GLU A 105 -2.803 0.390 16.154 1.00 64.15 C ATOM 1789 CD GLU A 105 -1.733 -0.381 16.912 1.00 61.34 C ATOM 1790 OE1 GLU A 105 -0.546 0.007 16.848 1.00 72.14 O ATOM 1791 OE2 GLU A 105 -2.072 -1.389 17.571 1.00 50.04 O ATOM 0 H GLU A 105 -4.548 -0.967 14.380 1.00 75.15 H new ATOM 0 HA GLU A 105 -4.104 1.861 14.174 1.00 45.30 H new ATOM 0 HB2 GLU A 105 -2.226 -0.544 14.313 1.00 41.01 H new ATOM 0 HB3 GLU A 105 -1.710 1.123 14.463 1.00 41.01 H new ATOM 0 HG2 GLU A 105 -2.858 1.406 16.545 1.00 64.15 H new ATOM 0 HG3 GLU A 105 -3.773 -0.073 16.332 1.00 64.15 H new ATOM 1798 N VAL A 106 -3.336 2.295 11.876 1.00 24.31 N ATOM 1799 CA VAL A 106 -3.003 2.604 10.484 1.00 12.11 C ATOM 1800 C VAL A 106 -1.561 3.113 10.364 1.00 12.42 C ATOM 1801 O VAL A 106 -1.211 4.147 10.930 1.00 54.22 O ATOM 1802 CB VAL A 106 -3.952 3.688 9.914 1.00 53.45 C ATOM 1803 CG1 VAL A 106 -3.757 3.853 8.407 1.00 24.32 C ATOM 1804 CG2 VAL A 106 -5.406 3.373 10.251 1.00 12.34 C ATOM 0 H VAL A 106 -3.560 3.114 12.441 1.00 24.31 H new ATOM 0 HA VAL A 106 -3.116 1.680 9.916 1.00 12.11 H new ATOM 0 HB VAL A 106 -3.699 4.637 10.386 1.00 53.45 H new ATOM 0 HG11 VAL A 106 -4.436 4.620 8.034 1.00 24.32 H new ATOM 0 HG12 VAL A 106 -2.728 4.149 8.204 1.00 24.32 H new ATOM 0 HG13 VAL A 106 -3.968 2.908 7.907 1.00 24.32 H new ATOM 0 HG21 VAL A 106 -6.051 4.149 9.840 1.00 12.34 H new ATOM 0 HG22 VAL A 106 -5.678 2.409 9.821 1.00 12.34 H new ATOM 0 HG23 VAL A 106 -5.529 3.335 11.333 1.00 12.34 H new ATOM 1814 N PHE A 107 -0.726 2.388 9.628 1.00 4.00 N ATOM 1815 CA PHE A 107 0.660 2.809 9.407 1.00 1.42 C ATOM 1816 C PHE A 107 0.931 3.003 7.904 1.00 10.31 C ATOM 1817 O PHE A 107 1.094 2.036 7.154 1.00 33.53 O ATOM 1818 CB PHE A 107 1.616 1.776 10.023 1.00 5.05 C ATOM 1819 CG PHE A 107 3.078 2.147 9.962 1.00 44.41 C ATOM 1820 CD1 PHE A 107 3.496 3.455 10.172 1.00 21.45 C ATOM 1821 CD2 PHE A 107 4.037 1.180 9.695 1.00 22.12 C ATOM 1822 CE1 PHE A 107 4.837 3.786 10.115 1.00 50.43 C ATOM 1823 CE2 PHE A 107 5.377 1.507 9.635 1.00 30.23 C ATOM 1824 CZ PHE A 107 5.778 2.811 9.845 1.00 51.22 C ATOM 0 H PHE A 107 -0.979 1.510 9.175 1.00 4.00 H new ATOM 0 HA PHE A 107 0.830 3.768 9.896 1.00 1.42 H new ATOM 0 HB2 PHE A 107 1.338 1.622 11.066 1.00 5.05 H new ATOM 0 HB3 PHE A 107 1.476 0.823 9.512 1.00 5.05 H new ATOM 0 HD1 PHE A 107 2.765 4.222 10.382 1.00 21.45 H new ATOM 0 HD2 PHE A 107 3.731 0.157 9.532 1.00 22.12 H new ATOM 0 HE1 PHE A 107 5.149 4.806 10.281 1.00 50.43 H new ATOM 0 HE2 PHE A 107 6.111 0.743 9.424 1.00 30.23 H new ATOM 0 HZ PHE A 107 6.826 3.069 9.798 1.00 51.22 H new ATOM 1834 N VAL A 108 0.959 4.265 7.476 1.00 10.44 N ATOM 1835 CA VAL A 108 1.098 4.616 6.057 1.00 65.41 C ATOM 1836 C VAL A 108 2.532 5.047 5.701 1.00 53.45 C ATOM 1837 O VAL A 108 3.046 6.029 6.236 1.00 21.20 O ATOM 1838 CB VAL A 108 0.125 5.765 5.677 1.00 13.31 C ATOM 1839 CG1 VAL A 108 0.270 6.144 4.203 1.00 15.11 C ATOM 1840 CG2 VAL A 108 -1.318 5.381 6.000 1.00 5.44 C ATOM 0 H VAL A 108 0.887 5.071 8.097 1.00 10.44 H new ATOM 0 HA VAL A 108 0.855 3.716 5.492 1.00 65.41 H new ATOM 0 HB VAL A 108 0.387 6.639 6.274 1.00 13.31 H new ATOM 0 HG11 VAL A 108 -0.423 6.951 3.965 1.00 15.11 H new ATOM 0 HG12 VAL A 108 1.291 6.474 4.011 1.00 15.11 H new ATOM 0 HG13 VAL A 108 0.046 5.278 3.581 1.00 15.11 H new ATOM 0 HG21 VAL A 108 -1.983 6.200 5.726 1.00 5.44 H new ATOM 0 HG22 VAL A 108 -1.591 4.488 5.438 1.00 5.44 H new ATOM 0 HG23 VAL A 108 -1.411 5.180 7.067 1.00 5.44 H new ATOM 1850 N VAL A 109 3.167 4.310 4.792 1.00 64.44 N ATOM 1851 CA VAL A 109 4.503 4.658 4.288 1.00 24.32 C ATOM 1852 C VAL A 109 4.448 4.918 2.775 1.00 32.43 C ATOM 1853 O VAL A 109 4.155 4.014 2.000 1.00 70.35 O ATOM 1854 CB VAL A 109 5.523 3.521 4.563 1.00 34.14 C ATOM 1855 CG1 VAL A 109 6.932 3.937 4.137 1.00 50.41 C ATOM 1856 CG2 VAL A 109 5.493 3.101 6.032 1.00 3.30 C ATOM 0 H VAL A 109 2.778 3.460 4.384 1.00 64.44 H new ATOM 0 HA VAL A 109 4.827 5.558 4.811 1.00 24.32 H new ATOM 0 HB VAL A 109 5.234 2.657 3.964 1.00 34.14 H new ATOM 0 HG11 VAL A 109 7.629 3.123 4.340 1.00 50.41 H new ATOM 0 HG12 VAL A 109 6.938 4.162 3.071 1.00 50.41 H new ATOM 0 HG13 VAL A 109 7.235 4.822 4.697 1.00 50.41 H new ATOM 0 HG21 VAL A 109 6.217 2.303 6.197 1.00 3.30 H new ATOM 0 HG22 VAL A 109 5.745 3.956 6.660 1.00 3.30 H new ATOM 0 HG23 VAL A 109 4.495 2.744 6.288 1.00 3.30 H new ATOM 1866 N TYR A 110 4.720 6.148 2.342 1.00 65.02 N ATOM 1867 CA TYR A 110 4.621 6.472 0.912 1.00 34.30 C ATOM 1868 C TYR A 110 5.807 7.307 0.402 1.00 34.25 C ATOM 1869 O TYR A 110 6.397 8.102 1.139 1.00 3.24 O ATOM 1870 CB TYR A 110 3.283 7.163 0.602 1.00 52.23 C ATOM 1871 CG TYR A 110 3.097 8.544 1.199 1.00 72.21 C ATOM 1872 CD1 TYR A 110 3.524 9.674 0.515 1.00 13.44 C ATOM 1873 CD2 TYR A 110 2.465 8.724 2.427 1.00 14.14 C ATOM 1874 CE1 TYR A 110 3.337 10.932 1.035 1.00 63.34 C ATOM 1875 CE2 TYR A 110 2.269 9.988 2.949 1.00 53.01 C ATOM 1876 CZ TYR A 110 2.709 11.088 2.246 1.00 23.03 C ATOM 1877 OH TYR A 110 2.517 12.355 2.751 1.00 22.23 O ATOM 0 H TYR A 110 5.004 6.923 2.941 1.00 65.02 H new ATOM 0 HA TYR A 110 4.660 5.525 0.373 1.00 34.30 H new ATOM 0 HB2 TYR A 110 3.178 7.239 -0.480 1.00 52.23 H new ATOM 0 HB3 TYR A 110 2.475 6.523 0.957 1.00 52.23 H new ATOM 0 HD1 TYR A 110 4.012 9.562 -0.442 1.00 13.44 H new ATOM 0 HD2 TYR A 110 2.123 7.862 2.980 1.00 14.14 H new ATOM 0 HE1 TYR A 110 3.684 11.798 0.491 1.00 63.34 H new ATOM 0 HE2 TYR A 110 1.775 10.113 3.901 1.00 53.01 H new ATOM 0 HH TYR A 110 2.058 12.297 3.615 1.00 22.23 H new ATOM 1887 N ASN A 111 6.139 7.113 -0.878 1.00 65.02 N ATOM 1888 CA ASN A 111 7.289 7.777 -1.509 1.00 51.44 C ATOM 1889 C ASN A 111 6.851 8.782 -2.585 1.00 60.23 C ATOM 1890 O ASN A 111 6.064 8.460 -3.477 1.00 1.03 O ATOM 1891 CB ASN A 111 8.223 6.725 -2.133 1.00 42.35 C ATOM 1892 CG ASN A 111 9.463 7.322 -2.785 1.00 34.02 C ATOM 1893 OD1 ASN A 111 9.449 8.421 -3.318 1.00 62.13 O ATOM 1894 ND2 ASN A 111 10.557 6.597 -2.750 1.00 5.42 N ATOM 0 H ASN A 111 5.623 6.495 -1.505 1.00 65.02 H new ATOM 0 HA ASN A 111 7.818 8.329 -0.732 1.00 51.44 H new ATOM 0 HB2 ASN A 111 8.532 6.021 -1.360 1.00 42.35 H new ATOM 0 HB3 ASN A 111 7.669 6.156 -2.879 1.00 42.35 H new ATOM 0 HD21 ASN A 111 11.416 6.949 -3.173 1.00 5.42 H new ATOM 0 HD22 ASN A 111 10.548 5.682 -2.300 1.00 5.42 H new ATOM 1901 N ASN A 112 7.375 9.997 -2.479 1.00 64.33 N ATOM 1902 CA ASN A 112 7.196 11.026 -3.503 1.00 54.31 C ATOM 1903 C ASN A 112 8.208 12.164 -3.278 1.00 32.41 C ATOM 1904 O ASN A 112 8.408 12.608 -2.145 1.00 15.01 O ATOM 1905 CB ASN A 112 5.749 11.550 -3.501 1.00 11.55 C ATOM 1906 CG ASN A 112 5.445 12.487 -4.664 1.00 52.40 C ATOM 1907 OD1 ASN A 112 6.294 13.248 -5.107 1.00 3.40 O ATOM 1908 ND2 ASN A 112 4.230 12.430 -5.173 1.00 60.00 N ATOM 0 H ASN A 112 7.936 10.299 -1.683 1.00 64.33 H new ATOM 0 HA ASN A 112 7.382 10.590 -4.485 1.00 54.31 H new ATOM 0 HB2 ASN A 112 5.063 10.703 -3.537 1.00 11.55 H new ATOM 0 HB3 ASN A 112 5.561 12.073 -2.563 1.00 11.55 H new ATOM 0 HD21 ASN A 112 3.977 13.031 -5.958 1.00 60.00 H new ATOM 0 HD22 ASN A 112 3.543 11.785 -4.782 1.00 60.00 H new ATOM 1915 N LYS A 113 8.837 12.628 -4.357 1.00 42.44 N ATOM 1916 CA LYS A 113 9.897 13.645 -4.275 1.00 21.34 C ATOM 1917 C LYS A 113 9.381 14.963 -3.664 1.00 1.33 C ATOM 1918 O LYS A 113 10.076 15.602 -2.871 1.00 64.12 O ATOM 1919 CB LYS A 113 10.478 13.885 -5.684 1.00 41.31 C ATOM 1920 CG LYS A 113 11.790 14.680 -5.738 1.00 44.10 C ATOM 1921 CD LYS A 113 11.597 16.185 -5.538 1.00 43.21 C ATOM 1922 CE LYS A 113 10.595 16.772 -6.528 1.00 42.22 C ATOM 1923 NZ LYS A 113 10.939 16.438 -7.936 1.00 42.12 N ATOM 0 H LYS A 113 8.633 12.316 -5.306 1.00 42.44 H new ATOM 0 HA LYS A 113 10.681 13.276 -3.613 1.00 21.34 H new ATOM 0 HB2 LYS A 113 10.641 12.918 -6.159 1.00 41.31 H new ATOM 0 HB3 LYS A 113 9.732 14.411 -6.280 1.00 41.31 H new ATOM 0 HG2 LYS A 113 12.467 14.303 -4.971 1.00 44.10 H new ATOM 0 HG3 LYS A 113 12.271 14.508 -6.701 1.00 44.10 H new ATOM 0 HD2 LYS A 113 11.254 16.374 -4.521 1.00 43.21 H new ATOM 0 HD3 LYS A 113 12.556 16.691 -5.650 1.00 43.21 H new ATOM 0 HE2 LYS A 113 9.598 16.396 -6.300 1.00 42.22 H new ATOM 0 HE3 LYS A 113 10.562 17.855 -6.410 1.00 42.22 H new ATOM 0 HZ1 LYS A 113 10.327 16.978 -8.580 1.00 42.12 H new ATOM 0 HZ2 LYS A 113 11.934 16.682 -8.118 1.00 42.12 H new ATOM 0 HZ3 LYS A 113 10.798 15.420 -8.096 1.00 42.12 H new ATOM 1937 N ASP A 114 8.170 15.359 -4.044 1.00 11.02 N ATOM 1938 CA ASP A 114 7.574 16.621 -3.585 1.00 11.05 C ATOM 1939 C ASP A 114 7.466 16.688 -2.045 1.00 10.44 C ATOM 1940 O ASP A 114 6.461 16.283 -1.456 1.00 3.11 O ATOM 1941 CB ASP A 114 6.194 16.797 -4.228 1.00 12.42 C ATOM 1942 CG ASP A 114 6.266 16.915 -5.743 1.00 43.14 C ATOM 1943 OD1 ASP A 114 6.923 16.065 -6.389 1.00 53.33 O ATOM 1944 OD2 ASP A 114 5.646 17.844 -6.300 1.00 12.21 O ATOM 0 H ASP A 114 7.573 14.823 -4.674 1.00 11.02 H new ATOM 0 HA ASP A 114 8.230 17.435 -3.893 1.00 11.05 H new ATOM 0 HB2 ASP A 114 5.563 15.949 -3.963 1.00 12.42 H new ATOM 0 HB3 ASP A 114 5.718 17.689 -3.820 1.00 12.42 H new ATOM 1949 N ASP A 115 8.518 17.203 -1.407 1.00 33.51 N ATOM 1950 CA ASP A 115 8.604 17.262 0.057 1.00 4.34 C ATOM 1951 C ASP A 115 7.454 18.076 0.683 1.00 34.31 C ATOM 1952 O ASP A 115 6.900 17.691 1.711 1.00 23.54 O ATOM 1953 CB ASP A 115 9.956 17.857 0.468 1.00 55.22 C ATOM 1954 CG ASP A 115 10.125 19.288 -0.011 1.00 54.30 C ATOM 1955 OD1 ASP A 115 10.377 19.495 -1.219 1.00 3.42 O ATOM 1956 OD2 ASP A 115 9.991 20.215 0.811 1.00 2.43 O ATOM 0 H ASP A 115 9.332 17.590 -1.885 1.00 33.51 H new ATOM 0 HA ASP A 115 8.514 16.243 0.433 1.00 4.34 H new ATOM 0 HB2 ASP A 115 10.049 17.826 1.554 1.00 55.22 H new ATOM 0 HB3 ASP A 115 10.759 17.243 0.062 1.00 55.22 H new ATOM 1961 N ASP A 116 7.109 19.200 0.062 1.00 22.35 N ATOM 1962 CA ASP A 116 6.028 20.062 0.551 1.00 61.50 C ATOM 1963 C ASP A 116 4.675 19.325 0.564 1.00 64.31 C ATOM 1964 O ASP A 116 3.969 19.322 1.575 1.00 22.31 O ATOM 1965 CB ASP A 116 5.950 21.324 -0.314 1.00 45.43 C ATOM 1966 CG ASP A 116 5.819 21.002 -1.790 1.00 4.34 C ATOM 1967 OD1 ASP A 116 6.835 20.625 -2.413 1.00 12.01 O ATOM 1968 OD2 ASP A 116 4.700 21.106 -2.333 1.00 50.23 O ATOM 0 H ASP A 116 7.563 19.540 -0.786 1.00 22.35 H new ATOM 0 HA ASP A 116 6.250 20.342 1.581 1.00 61.50 H new ATOM 0 HB2 ASP A 116 5.098 21.926 0.001 1.00 45.43 H new ATOM 0 HB3 ASP A 116 6.843 21.928 -0.154 1.00 45.43 H new ATOM 1973 N ARG A 117 4.341 18.680 -0.557 1.00 24.42 N ATOM 1974 CA ARG A 117 3.100 17.898 -0.683 1.00 73.24 C ATOM 1975 C ARG A 117 3.015 16.799 0.392 1.00 12.12 C ATOM 1976 O ARG A 117 1.931 16.349 0.762 1.00 11.40 O ATOM 1977 CB ARG A 117 3.024 17.265 -2.080 1.00 21.15 C ATOM 1978 CG ARG A 117 3.095 18.271 -3.235 1.00 11.13 C ATOM 1979 CD ARG A 117 1.716 18.696 -3.739 1.00 43.42 C ATOM 1980 NE ARG A 117 0.945 19.455 -2.755 1.00 30.33 N ATOM 1981 CZ ARG A 117 -0.262 19.905 -2.973 1.00 4.25 C ATOM 1982 NH1 ARG A 117 -0.846 19.692 -4.112 1.00 50.43 N ATOM 1983 NH2 ARG A 117 -0.887 20.561 -2.055 1.00 5.04 N ATOM 0 H ARG A 117 4.916 18.682 -1.399 1.00 24.42 H new ATOM 0 HA ARG A 117 2.259 18.576 -0.539 1.00 73.24 H new ATOM 0 HB2 ARG A 117 3.840 16.550 -2.186 1.00 21.15 H new ATOM 0 HB3 ARG A 117 2.094 16.702 -2.161 1.00 21.15 H new ATOM 0 HG2 ARG A 117 3.645 19.154 -2.908 1.00 11.13 H new ATOM 0 HG3 ARG A 117 3.658 17.832 -4.059 1.00 11.13 H new ATOM 0 HD2 ARG A 117 1.837 19.300 -4.639 1.00 43.42 H new ATOM 0 HD3 ARG A 117 1.152 17.808 -4.024 1.00 43.42 H new ATOM 0 HE ARG A 117 1.373 19.643 -1.849 1.00 30.33 H new ATOM 0 HH11 ARG A 117 -0.363 19.171 -4.843 1.00 50.43 H new ATOM 0 HH12 ARG A 117 -1.788 20.046 -4.276 1.00 50.43 H new ATOM 0 HH21 ARG A 117 -0.439 20.730 -1.154 1.00 5.04 H new ATOM 0 HH22 ARG A 117 -1.829 20.910 -2.230 1.00 5.04 H new ATOM 1997 N ARG A 118 4.176 16.364 0.875 1.00 72.44 N ATOM 1998 CA ARG A 118 4.260 15.365 1.950 1.00 52.15 C ATOM 1999 C ARG A 118 4.090 16.020 3.328 1.00 4.23 C ATOM 2000 O ARG A 118 3.266 15.588 4.133 1.00 43.41 O ATOM 2001 CB ARG A 118 5.610 14.628 1.872 1.00 10.32 C ATOM 2002 CG ARG A 118 5.674 13.495 0.839 1.00 61.43 C ATOM 2003 CD ARG A 118 4.966 13.824 -0.479 1.00 3.24 C ATOM 2004 NE ARG A 118 3.516 13.583 -0.405 1.00 11.01 N ATOM 2005 CZ ARG A 118 2.769 13.255 -1.431 1.00 1.15 C ATOM 2006 NH1 ARG A 118 3.243 13.289 -2.632 1.00 3.04 N ATOM 2007 NH2 ARG A 118 1.532 12.917 -1.255 1.00 51.32 N ATOM 0 H ARG A 118 5.083 16.688 0.538 1.00 72.44 H new ATOM 0 HA ARG A 118 3.450 14.648 1.818 1.00 52.15 H new ATOM 0 HB2 ARG A 118 6.390 15.354 1.641 1.00 10.32 H new ATOM 0 HB3 ARG A 118 5.839 14.216 2.855 1.00 10.32 H new ATOM 0 HG2 ARG A 118 6.719 13.262 0.632 1.00 61.43 H new ATOM 0 HG3 ARG A 118 5.227 12.598 1.268 1.00 61.43 H new ATOM 0 HD2 ARG A 118 5.147 14.868 -0.736 1.00 3.24 H new ATOM 0 HD3 ARG A 118 5.393 13.220 -1.280 1.00 3.24 H new ATOM 0 HE ARG A 118 3.063 13.677 0.504 1.00 11.01 H new ATOM 0 HH11 ARG A 118 4.210 13.574 -2.791 1.00 3.04 H new ATOM 0 HH12 ARG A 118 2.651 13.031 -3.421 1.00 3.04 H new ATOM 0 HH21 ARG A 118 1.135 12.905 -0.315 1.00 51.32 H new ATOM 0 HH22 ARG A 118 0.954 12.662 -2.056 1.00 51.32 H new ATOM 2021 N LYS A 119 4.872 17.068 3.580 1.00 64.21 N ATOM 2022 CA LYS A 119 4.826 17.810 4.847 1.00 12.43 C ATOM 2023 C LYS A 119 3.390 18.228 5.209 1.00 75.43 C ATOM 2024 O LYS A 119 2.933 18.012 6.335 1.00 13.02 O ATOM 2025 CB LYS A 119 5.754 19.037 4.749 1.00 43.44 C ATOM 2026 CG LYS A 119 5.714 19.984 5.955 1.00 10.34 C ATOM 2027 CD LYS A 119 4.771 21.168 5.727 1.00 14.11 C ATOM 2028 CE LYS A 119 4.761 22.121 6.916 1.00 44.42 C ATOM 2029 NZ LYS A 119 3.938 23.331 6.659 1.00 62.53 N ATOM 0 H LYS A 119 5.556 17.430 2.915 1.00 64.21 H new ATOM 0 HA LYS A 119 5.174 17.158 5.648 1.00 12.43 H new ATOM 0 HB2 LYS A 119 6.778 18.688 4.615 1.00 43.44 H new ATOM 0 HB3 LYS A 119 5.490 19.602 3.855 1.00 43.44 H new ATOM 0 HG2 LYS A 119 5.394 19.432 6.839 1.00 10.34 H new ATOM 0 HG3 LYS A 119 6.719 20.355 6.157 1.00 10.34 H new ATOM 0 HD2 LYS A 119 5.076 21.708 4.831 1.00 14.11 H new ATOM 0 HD3 LYS A 119 3.761 20.799 5.548 1.00 14.11 H new ATOM 0 HE2 LYS A 119 4.375 21.601 7.793 1.00 44.42 H new ATOM 0 HE3 LYS A 119 5.783 22.421 7.147 1.00 44.42 H new ATOM 0 HZ1 LYS A 119 3.960 23.950 7.494 1.00 62.53 H new ATOM 0 HZ2 LYS A 119 4.320 23.843 5.838 1.00 62.53 H new ATOM 0 HZ3 LYS A 119 2.956 23.048 6.464 1.00 62.53 H new ATOM 2043 N GLU A 120 2.682 18.814 4.248 1.00 43.15 N ATOM 2044 CA GLU A 120 1.287 19.219 4.455 1.00 63.11 C ATOM 2045 C GLU A 120 0.377 18.003 4.712 1.00 40.31 C ATOM 2046 O GLU A 120 -0.522 18.051 5.559 1.00 35.12 O ATOM 2047 CB GLU A 120 0.776 20.008 3.240 1.00 14.20 C ATOM 2048 CG GLU A 120 0.784 19.209 1.942 1.00 44.41 C ATOM 2049 CD GLU A 120 0.248 19.992 0.757 1.00 64.13 C ATOM 2050 OE1 GLU A 120 -0.985 20.062 0.596 1.00 52.33 O ATOM 2051 OE2 GLU A 120 1.056 20.535 -0.025 1.00 3.42 O ATOM 0 H GLU A 120 3.047 19.021 3.318 1.00 43.15 H new ATOM 0 HA GLU A 120 1.255 19.856 5.339 1.00 63.11 H new ATOM 0 HB2 GLU A 120 -0.240 20.348 3.440 1.00 14.20 H new ATOM 0 HB3 GLU A 120 1.391 20.899 3.112 1.00 14.20 H new ATOM 0 HG2 GLU A 120 1.803 18.888 1.726 1.00 44.41 H new ATOM 0 HG3 GLU A 120 0.187 18.307 2.074 1.00 44.41 H new ATOM 2058 N ALA A 121 0.630 16.914 3.986 1.00 74.10 N ATOM 2059 CA ALA A 121 -0.189 15.700 4.079 1.00 74.10 C ATOM 2060 C ALA A 121 -0.014 14.981 5.426 1.00 55.12 C ATOM 2061 O ALA A 121 -0.960 14.395 5.950 1.00 73.42 O ATOM 2062 CB ALA A 121 0.143 14.756 2.927 1.00 61.44 C ATOM 0 H ALA A 121 1.401 16.846 3.322 1.00 74.10 H new ATOM 0 HA ALA A 121 -1.233 16.004 4.011 1.00 74.10 H new ATOM 0 HB1 ALA A 121 -0.470 13.858 3.004 1.00 61.44 H new ATOM 0 HB2 ALA A 121 -0.061 15.253 1.979 1.00 61.44 H new ATOM 0 HB3 ALA A 121 1.197 14.481 2.974 1.00 61.44 H new ATOM 2068 N GLN A 122 1.191 15.031 5.988 1.00 3.43 N ATOM 2069 CA GLN A 122 1.470 14.377 7.275 1.00 41.32 C ATOM 2070 C GLN A 122 0.572 14.929 8.394 1.00 63.21 C ATOM 2071 O GLN A 122 -0.105 14.171 9.086 1.00 72.42 O ATOM 2072 CB GLN A 122 2.948 14.538 7.649 1.00 12.15 C ATOM 2073 CG GLN A 122 3.898 13.868 6.661 1.00 62.11 C ATOM 2074 CD GLN A 122 5.362 13.995 7.051 1.00 1.24 C ATOM 2075 OE1 GLN A 122 6.240 14.050 6.197 1.00 5.22 O ATOM 2076 NE2 GLN A 122 5.639 14.027 8.338 1.00 62.43 N ATOM 0 H GLN A 122 1.991 15.514 5.579 1.00 3.43 H new ATOM 0 HA GLN A 122 1.248 13.316 7.162 1.00 41.32 H new ATOM 0 HB2 GLN A 122 3.187 15.600 7.709 1.00 12.15 H new ATOM 0 HB3 GLN A 122 3.112 14.118 8.641 1.00 12.15 H new ATOM 0 HG2 GLN A 122 3.641 12.812 6.581 1.00 62.11 H new ATOM 0 HG3 GLN A 122 3.753 14.307 5.674 1.00 62.11 H new ATOM 0 HE21 GLN A 122 4.885 13.979 9.023 1.00 62.43 H new ATOM 0 HE22 GLN A 122 6.608 14.099 8.650 1.00 62.43 H new ATOM 2085 N GLN A 123 0.561 16.252 8.556 1.00 20.12 N ATOM 2086 CA GLN A 123 -0.308 16.904 9.546 1.00 14.23 C ATOM 2087 C GLN A 123 -1.797 16.647 9.236 1.00 2.44 C ATOM 2088 O GLN A 123 -2.637 16.594 10.137 1.00 25.41 O ATOM 2089 CB GLN A 123 -0.028 18.417 9.575 1.00 62.25 C ATOM 2090 CG GLN A 123 -0.901 19.191 10.561 1.00 24.43 C ATOM 2091 CD GLN A 123 -0.628 20.689 10.569 1.00 61.33 C ATOM 2092 OE1 GLN A 123 -0.232 21.240 9.438 1.00 24.33 O flip ATOM 2093 NE2 GLN A 123 -0.790 21.354 11.588 1.00 12.30 N flip ATOM 0 H GLN A 123 1.141 16.895 8.018 1.00 20.12 H new ATOM 0 HA GLN A 123 -0.088 16.477 10.525 1.00 14.23 H new ATOM 0 HB2 GLN A 123 1.020 18.578 9.829 1.00 62.25 H new ATOM 0 HB3 GLN A 123 -0.179 18.823 8.575 1.00 62.25 H new ATOM 0 HG2 GLN A 123 -1.950 19.022 10.315 1.00 24.43 H new ATOM 0 HG3 GLN A 123 -0.741 18.795 11.564 1.00 24.43 H new ATOM 0 HE21 GLN A 123 -1.097 20.901 12.449 1.00 12.30 H new ATOM 0 HE22 GLN A 123 -0.618 22.359 11.574 1.00 12.30 H new ATOM 2102 N GLU A 124 -2.105 16.474 7.954 1.00 64.41 N ATOM 2103 CA GLU A 124 -3.481 16.235 7.500 1.00 11.01 C ATOM 2104 C GLU A 124 -3.996 14.843 7.916 1.00 12.14 C ATOM 2105 O GLU A 124 -5.060 14.714 8.526 1.00 73.50 O ATOM 2106 CB GLU A 124 -3.542 16.369 5.969 1.00 73.43 C ATOM 2107 CG GLU A 124 -4.936 16.199 5.369 1.00 32.22 C ATOM 2108 CD GLU A 124 -5.852 17.379 5.647 1.00 34.53 C ATOM 2109 OE1 GLU A 124 -5.812 18.360 4.871 1.00 2.04 O ATOM 2110 OE2 GLU A 124 -6.619 17.336 6.631 1.00 41.55 O ATOM 0 H GLU A 124 -1.417 16.494 7.201 1.00 64.41 H new ATOM 0 HA GLU A 124 -4.122 16.978 7.974 1.00 11.01 H new ATOM 0 HB2 GLU A 124 -3.157 17.349 5.688 1.00 73.43 H new ATOM 0 HB3 GLU A 124 -2.878 15.627 5.526 1.00 73.43 H new ATOM 0 HG2 GLU A 124 -4.847 16.062 4.291 1.00 32.22 H new ATOM 0 HG3 GLU A 124 -5.389 15.292 5.770 1.00 32.22 H new ATOM 2117 N PHE A 125 -3.228 13.804 7.588 1.00 23.05 N ATOM 2118 CA PHE A 125 -3.689 12.416 7.744 1.00 61.33 C ATOM 2119 C PHE A 125 -3.255 11.764 9.069 1.00 14.03 C ATOM 2120 O PHE A 125 -3.958 10.895 9.592 1.00 45.25 O ATOM 2121 CB PHE A 125 -3.188 11.574 6.563 1.00 75.11 C ATOM 2122 CG PHE A 125 -3.655 12.083 5.223 1.00 24.22 C ATOM 2123 CD1 PHE A 125 -5.006 12.097 4.905 1.00 14.13 C ATOM 2124 CD2 PHE A 125 -2.746 12.548 4.283 1.00 43.45 C ATOM 2125 CE1 PHE A 125 -5.438 12.567 3.681 1.00 24.12 C ATOM 2126 CE2 PHE A 125 -3.176 13.017 3.056 1.00 21.42 C ATOM 2127 CZ PHE A 125 -4.523 13.027 2.757 1.00 12.53 C ATOM 0 H PHE A 125 -2.284 13.893 7.212 1.00 23.05 H new ATOM 0 HA PHE A 125 -4.778 12.450 7.762 1.00 61.33 H new ATOM 0 HB2 PHE A 125 -2.098 11.555 6.576 1.00 75.11 H new ATOM 0 HB3 PHE A 125 -3.526 10.546 6.690 1.00 75.11 H new ATOM 0 HD1 PHE A 125 -5.727 11.736 5.623 1.00 14.13 H new ATOM 0 HD2 PHE A 125 -1.691 12.543 4.513 1.00 43.45 H new ATOM 0 HE1 PHE A 125 -6.492 12.575 3.447 1.00 24.12 H new ATOM 0 HE2 PHE A 125 -2.459 13.375 2.332 1.00 21.42 H new ATOM 0 HZ PHE A 125 -4.861 13.395 1.799 1.00 12.53 H new ATOM 2137 N ARG A 126 -2.109 12.162 9.621 1.00 53.42 N ATOM 2138 CA ARG A 126 -1.601 11.514 10.839 1.00 52.33 C ATOM 2139 C ARG A 126 -2.422 11.917 12.078 1.00 12.31 C ATOM 2140 O ARG A 126 -2.161 12.940 12.712 1.00 60.31 O ATOM 2141 CB ARG A 126 -0.111 11.825 11.063 1.00 5.32 C ATOM 2142 CG ARG A 126 0.524 10.974 12.163 1.00 71.10 C ATOM 2143 CD ARG A 126 2.022 11.219 12.303 1.00 24.14 C ATOM 2144 NE ARG A 126 2.638 10.295 13.258 1.00 31.32 N ATOM 2145 CZ ARG A 126 3.756 10.530 13.892 1.00 22.44 C ATOM 2146 NH1 ARG A 126 4.403 11.636 13.701 1.00 34.32 N ATOM 2147 NH2 ARG A 126 4.230 9.652 14.717 1.00 72.44 N ATOM 0 H ARG A 126 -1.523 12.913 9.257 1.00 53.42 H new ATOM 0 HA ARG A 126 -1.708 10.439 10.694 1.00 52.33 H new ATOM 0 HB2 ARG A 126 0.431 11.665 10.131 1.00 5.32 H new ATOM 0 HB3 ARG A 126 -0.001 12.879 11.319 1.00 5.32 H new ATOM 0 HG2 ARG A 126 0.034 11.190 13.112 1.00 71.10 H new ATOM 0 HG3 ARG A 126 0.351 9.920 11.947 1.00 71.10 H new ATOM 0 HD2 ARG A 126 2.501 11.108 11.330 1.00 24.14 H new ATOM 0 HD3 ARG A 126 2.194 12.245 12.628 1.00 24.14 H new ATOM 0 HE ARG A 126 2.163 9.411 13.440 1.00 31.32 H new ATOM 0 HH11 ARG A 126 4.040 12.333 13.051 1.00 34.32 H new ATOM 0 HH12 ARG A 126 5.275 11.810 14.201 1.00 34.32 H new ATOM 0 HH21 ARG A 126 3.731 8.776 14.872 1.00 72.44 H new ATOM 0 HH22 ARG A 126 5.103 9.836 15.212 1.00 72.44 H new ATOM 2161 N SER A 127 -3.434 11.111 12.394 1.00 75.13 N ATOM 2162 CA SER A 127 -4.286 11.330 13.575 1.00 60.31 C ATOM 2163 C SER A 127 -4.078 10.214 14.614 1.00 4.21 C ATOM 2164 O SER A 127 -3.097 9.469 14.550 1.00 43.13 O ATOM 2165 CB SER A 127 -5.765 11.391 13.150 1.00 63.43 C ATOM 2166 OG SER A 127 -6.616 11.684 14.251 1.00 74.54 O ATOM 0 H SER A 127 -3.691 10.290 11.846 1.00 75.13 H new ATOM 0 HA SER A 127 -4.006 12.279 14.033 1.00 60.31 H new ATOM 0 HB2 SER A 127 -5.891 12.152 12.380 1.00 63.43 H new ATOM 0 HB3 SER A 127 -6.056 10.438 12.708 1.00 63.43 H new ATOM 0 HG SER A 127 -7.547 11.717 13.946 1.00 74.54 H new ATOM 2172 N ASP A 128 -4.991 10.107 15.579 1.00 40.43 N ATOM 2173 CA ASP A 128 -4.933 9.051 16.592 1.00 45.55 C ATOM 2174 C ASP A 128 -4.912 7.653 15.946 1.00 51.42 C ATOM 2175 O ASP A 128 -5.707 7.357 15.049 1.00 20.55 O ATOM 2176 CB ASP A 128 -6.131 9.180 17.536 1.00 14.14 C ATOM 2177 CG ASP A 128 -7.450 8.936 16.827 1.00 40.13 C ATOM 2178 OD1 ASP A 128 -7.853 9.779 16.000 1.00 12.43 O ATOM 2179 OD2 ASP A 128 -8.083 7.890 17.076 1.00 64.21 O ATOM 0 H ASP A 128 -5.783 10.741 15.681 1.00 40.43 H new ATOM 0 HA ASP A 128 -4.008 9.168 17.157 1.00 45.55 H new ATOM 0 HB2 ASP A 128 -6.024 8.469 18.355 1.00 14.14 H new ATOM 0 HB3 ASP A 128 -6.137 10.176 17.978 1.00 14.14 H new ATOM 2184 N GLY A 129 -3.991 6.806 16.391 1.00 50.03 N ATOM 2185 CA GLY A 129 -3.886 5.457 15.846 1.00 51.42 C ATOM 2186 C GLY A 129 -3.436 5.429 14.390 1.00 11.04 C ATOM 2187 O GLY A 129 -3.631 4.432 13.694 1.00 54.32 O ATOM 0 H GLY A 129 -3.312 7.026 17.120 1.00 50.03 H new ATOM 0 HA2 GLY A 129 -3.181 4.883 16.448 1.00 51.42 H new ATOM 0 HA3 GLY A 129 -4.854 4.962 15.930 1.00 51.42 H new ATOM 2191 N VAL A 130 -2.856 6.534 13.918 1.00 25.43 N ATOM 2192 CA VAL A 130 -2.341 6.622 12.546 1.00 0.42 C ATOM 2193 C VAL A 130 -0.916 7.202 12.525 1.00 31.42 C ATOM 2194 O VAL A 130 -0.665 8.283 13.059 1.00 33.40 O ATOM 2195 CB VAL A 130 -3.251 7.501 11.641 1.00 64.44 C ATOM 2196 CG1 VAL A 130 -2.736 7.522 10.199 1.00 50.41 C ATOM 2197 CG2 VAL A 130 -4.706 7.027 11.692 1.00 53.00 C ATOM 0 H VAL A 130 -2.730 7.385 14.466 1.00 25.43 H new ATOM 0 HA VAL A 130 -2.330 5.605 12.155 1.00 0.42 H new ATOM 0 HB VAL A 130 -3.217 8.520 12.027 1.00 64.44 H new ATOM 0 HG11 VAL A 130 -3.390 8.144 9.588 1.00 50.41 H new ATOM 0 HG12 VAL A 130 -1.726 7.930 10.179 1.00 50.41 H new ATOM 0 HG13 VAL A 130 -2.725 6.507 9.802 1.00 50.41 H new ATOM 0 HG21 VAL A 130 -5.318 7.660 11.050 1.00 53.00 H new ATOM 0 HG22 VAL A 130 -4.765 5.995 11.346 1.00 53.00 H new ATOM 0 HG23 VAL A 130 -5.073 7.088 12.717 1.00 53.00 H new ATOM 2207 N ASP A 131 0.013 6.478 11.911 1.00 72.11 N ATOM 2208 CA ASP A 131 1.403 6.928 11.779 1.00 53.32 C ATOM 2209 C ASP A 131 1.813 7.033 10.300 1.00 40.42 C ATOM 2210 O ASP A 131 1.513 6.149 9.499 1.00 13.44 O ATOM 2211 CB ASP A 131 2.337 5.977 12.539 1.00 23.21 C ATOM 2212 CG ASP A 131 2.251 6.183 14.044 1.00 42.22 C ATOM 2213 OD1 ASP A 131 2.729 7.235 14.531 1.00 74.13 O ATOM 2214 OD2 ASP A 131 1.693 5.315 14.747 1.00 63.23 O ATOM 0 H ASP A 131 -0.170 5.567 11.491 1.00 72.11 H new ATOM 0 HA ASP A 131 1.487 7.923 12.215 1.00 53.32 H new ATOM 0 HB2 ASP A 131 2.080 4.946 12.298 1.00 23.21 H new ATOM 0 HB3 ASP A 131 3.364 6.135 12.209 1.00 23.21 H new ATOM 2219 N VAL A 132 2.495 8.124 9.945 1.00 15.42 N ATOM 2220 CA VAL A 132 2.871 8.381 8.548 1.00 51.10 C ATOM 2221 C VAL A 132 4.394 8.500 8.366 1.00 53.33 C ATOM 2222 O VAL A 132 5.046 9.340 8.993 1.00 21.52 O ATOM 2223 CB VAL A 132 2.203 9.678 8.017 1.00 21.30 C ATOM 2224 CG1 VAL A 132 2.592 9.939 6.561 1.00 12.51 C ATOM 2225 CG2 VAL A 132 0.682 9.609 8.166 1.00 53.31 C ATOM 0 H VAL A 132 2.799 8.843 10.601 1.00 15.42 H new ATOM 0 HA VAL A 132 2.517 7.522 7.977 1.00 51.10 H new ATOM 0 HB VAL A 132 2.566 10.511 8.619 1.00 21.30 H new ATOM 0 HG11 VAL A 132 2.110 10.853 6.214 1.00 12.51 H new ATOM 0 HG12 VAL A 132 3.674 10.048 6.487 1.00 12.51 H new ATOM 0 HG13 VAL A 132 2.269 9.102 5.942 1.00 12.51 H new ATOM 0 HG21 VAL A 132 0.237 10.529 7.787 1.00 53.31 H new ATOM 0 HG22 VAL A 132 0.299 8.760 7.599 1.00 53.31 H new ATOM 0 HG23 VAL A 132 0.425 9.488 9.218 1.00 53.31 H new ATOM 2235 N ARG A 133 4.946 7.649 7.505 1.00 75.23 N ATOM 2236 CA ARG A 133 6.356 7.723 7.105 1.00 43.10 C ATOM 2237 C ARG A 133 6.477 8.160 5.638 1.00 30.31 C ATOM 2238 O ARG A 133 5.976 7.486 4.734 1.00 72.40 O ATOM 2239 CB ARG A 133 7.042 6.360 7.298 1.00 55.40 C ATOM 2240 CG ARG A 133 7.368 6.020 8.750 1.00 73.22 C ATOM 2241 CD ARG A 133 8.517 6.870 9.286 1.00 1.42 C ATOM 2242 NE ARG A 133 8.945 6.445 10.618 1.00 14.44 N ATOM 2243 CZ ARG A 133 10.063 6.818 11.180 1.00 72.42 C ATOM 2244 NH1 ARG A 133 10.846 7.670 10.597 1.00 54.41 N ATOM 2245 NH2 ARG A 133 10.383 6.348 12.338 1.00 12.13 N ATOM 0 H ARG A 133 4.432 6.887 7.063 1.00 75.23 H new ATOM 0 HA ARG A 133 6.850 8.462 7.736 1.00 43.10 H new ATOM 0 HB2 ARG A 133 6.397 5.581 6.891 1.00 55.40 H new ATOM 0 HB3 ARG A 133 7.965 6.346 6.718 1.00 55.40 H new ATOM 0 HG2 ARG A 133 6.483 6.174 9.367 1.00 73.22 H new ATOM 0 HG3 ARG A 133 7.630 4.965 8.826 1.00 73.22 H new ATOM 0 HD2 ARG A 133 9.361 6.811 8.599 1.00 1.42 H new ATOM 0 HD3 ARG A 133 8.208 7.915 9.322 1.00 1.42 H new ATOM 0 HE ARG A 133 8.332 5.819 11.140 1.00 14.44 H new ATOM 0 HH11 ARG A 133 10.592 8.058 9.688 1.00 54.41 H new ATOM 0 HH12 ARG A 133 11.717 7.953 11.047 1.00 54.41 H new ATOM 0 HH21 ARG A 133 9.764 5.689 12.810 1.00 12.13 H new ATOM 0 HH22 ARG A 133 11.255 6.636 12.782 1.00 12.13 H new ATOM 2259 N THR A 134 7.130 9.292 5.404 1.00 74.41 N ATOM 2260 CA THR A 134 7.344 9.796 4.042 1.00 75.22 C ATOM 2261 C THR A 134 8.812 9.656 3.631 1.00 70.53 C ATOM 2262 O THR A 134 9.720 9.831 4.448 1.00 44.52 O ATOM 2263 CB THR A 134 6.929 11.282 3.908 1.00 45.12 C ATOM 2264 OG1 THR A 134 7.762 12.106 4.738 1.00 74.13 O ATOM 2265 CG2 THR A 134 5.470 11.477 4.301 1.00 41.12 C ATOM 0 H THR A 134 7.523 9.883 6.137 1.00 74.41 H new ATOM 0 HA THR A 134 6.718 9.193 3.384 1.00 75.22 H new ATOM 0 HB THR A 134 7.053 11.573 2.865 1.00 45.12 H new ATOM 0 HG1 THR A 134 7.206 12.756 5.217 1.00 74.13 H new ATOM 0 HG21 THR A 134 5.203 12.529 4.198 1.00 41.12 H new ATOM 0 HG22 THR A 134 4.835 10.876 3.650 1.00 41.12 H new ATOM 0 HG23 THR A 134 5.327 11.166 5.336 1.00 41.12 H new ATOM 2273 N VAL A 135 9.047 9.311 2.365 1.00 15.11 N ATOM 2274 CA VAL A 135 10.409 9.176 1.837 1.00 12.31 C ATOM 2275 C VAL A 135 10.522 9.749 0.414 1.00 74.43 C ATOM 2276 O VAL A 135 9.568 9.703 -0.366 1.00 24.45 O ATOM 2277 CB VAL A 135 10.879 7.695 1.835 1.00 51.24 C ATOM 2278 CG1 VAL A 135 10.962 7.138 3.256 1.00 45.51 C ATOM 2279 CG2 VAL A 135 9.962 6.834 0.971 1.00 3.12 C ATOM 0 H VAL A 135 8.313 9.119 1.684 1.00 15.11 H new ATOM 0 HA VAL A 135 11.057 9.749 2.501 1.00 12.31 H new ATOM 0 HB VAL A 135 11.880 7.666 1.405 1.00 51.24 H new ATOM 0 HG11 VAL A 135 11.294 6.100 3.221 1.00 45.51 H new ATOM 0 HG12 VAL A 135 11.672 7.727 3.837 1.00 45.51 H new ATOM 0 HG13 VAL A 135 9.979 7.189 3.725 1.00 45.51 H new ATOM 0 HG21 VAL A 135 10.312 5.802 0.986 1.00 3.12 H new ATOM 0 HG22 VAL A 135 8.946 6.878 1.363 1.00 3.12 H new ATOM 0 HG23 VAL A 135 9.972 7.206 -0.053 1.00 3.12 H new ATOM 2289 N SER A 136 11.691 10.301 0.093 1.00 22.12 N ATOM 2290 CA SER A 136 11.961 10.850 -1.247 1.00 64.23 C ATOM 2291 C SER A 136 12.752 9.849 -2.103 1.00 10.31 C ATOM 2292 O SER A 136 12.730 9.909 -3.335 1.00 75.31 O ATOM 2293 CB SER A 136 12.742 12.171 -1.133 1.00 31.43 C ATOM 2294 OG SER A 136 13.071 12.702 -2.411 1.00 4.44 O ATOM 0 H SER A 136 12.474 10.383 0.742 1.00 22.12 H new ATOM 0 HA SER A 136 11.004 11.039 -1.733 1.00 64.23 H new ATOM 0 HB2 SER A 136 12.148 12.898 -0.579 1.00 31.43 H new ATOM 0 HB3 SER A 136 13.656 12.005 -0.562 1.00 31.43 H new ATOM 0 HG SER A 136 13.565 13.541 -2.299 1.00 4.44 H new ATOM 2300 N ASP A 137 13.454 8.928 -1.442 1.00 74.41 N ATOM 2301 CA ASP A 137 14.253 7.906 -2.131 1.00 11.24 C ATOM 2302 C ASP A 137 13.613 6.512 -2.028 1.00 24.34 C ATOM 2303 O ASP A 137 12.946 6.185 -1.044 1.00 4.10 O ATOM 2304 CB ASP A 137 15.669 7.859 -1.555 1.00 72.11 C ATOM 2305 CG ASP A 137 16.424 9.155 -1.773 1.00 52.20 C ATOM 2306 OD1 ASP A 137 16.836 9.420 -2.923 1.00 54.41 O ATOM 2307 OD2 ASP A 137 16.632 9.903 -0.797 1.00 43.44 O ATOM 0 H ASP A 137 13.487 8.866 -0.424 1.00 74.41 H new ATOM 0 HA ASP A 137 14.293 8.185 -3.184 1.00 11.24 H new ATOM 0 HB2 ASP A 137 15.617 7.647 -0.487 1.00 72.11 H new ATOM 0 HB3 ASP A 137 16.219 7.039 -2.016 1.00 72.11 H new ATOM 2312 N LYS A 138 13.840 5.692 -3.051 1.00 51.14 N ATOM 2313 CA LYS A 138 13.295 4.331 -3.108 1.00 21.44 C ATOM 2314 C LYS A 138 13.817 3.454 -1.956 1.00 24.21 C ATOM 2315 O LYS A 138 13.040 2.808 -1.251 1.00 1.11 O ATOM 2316 CB LYS A 138 13.662 3.685 -4.454 1.00 20.31 C ATOM 2317 CG LYS A 138 13.195 2.238 -4.596 1.00 24.34 C ATOM 2318 CD LYS A 138 13.655 1.610 -5.910 1.00 3.24 C ATOM 2319 CE LYS A 138 15.176 1.522 -6.003 1.00 22.24 C ATOM 2320 NZ LYS A 138 15.621 0.808 -7.228 1.00 50.04 N ATOM 0 H LYS A 138 14.404 5.947 -3.862 1.00 51.14 H new ATOM 0 HA LYS A 138 12.212 4.402 -3.007 1.00 21.44 H new ATOM 0 HB2 LYS A 138 13.228 4.277 -5.260 1.00 20.31 H new ATOM 0 HB3 LYS A 138 14.744 3.721 -4.580 1.00 20.31 H new ATOM 0 HG2 LYS A 138 13.578 1.651 -3.761 1.00 24.34 H new ATOM 0 HG3 LYS A 138 12.107 2.202 -4.539 1.00 24.34 H new ATOM 0 HD2 LYS A 138 13.228 0.611 -6.003 1.00 3.24 H new ATOM 0 HD3 LYS A 138 13.275 2.198 -6.745 1.00 3.24 H new ATOM 0 HE2 LYS A 138 15.598 2.527 -5.996 1.00 22.24 H new ATOM 0 HE3 LYS A 138 15.563 1.008 -5.123 1.00 22.24 H new ATOM 0 HZ1 LYS A 138 16.658 0.845 -7.294 1.00 50.04 H new ATOM 0 HZ2 LYS A 138 15.312 -0.184 -7.183 1.00 50.04 H new ATOM 0 HZ3 LYS A 138 15.204 1.263 -8.065 1.00 50.04 H new ATOM 2334 N GLU A 139 15.134 3.446 -1.774 1.00 41.03 N ATOM 2335 CA GLU A 139 15.783 2.581 -0.780 1.00 15.22 C ATOM 2336 C GLU A 139 15.335 2.920 0.653 1.00 23.31 C ATOM 2337 O GLU A 139 15.277 2.044 1.519 1.00 73.03 O ATOM 2338 CB GLU A 139 17.308 2.692 -0.916 1.00 4.00 C ATOM 2339 CG GLU A 139 18.081 1.599 -0.184 1.00 23.34 C ATOM 2340 CD GLU A 139 19.543 1.544 -0.598 1.00 33.50 C ATOM 2341 OE1 GLU A 139 19.834 1.035 -1.704 1.00 1.31 O ATOM 2342 OE2 GLU A 139 20.408 2.013 0.170 1.00 44.15 O ATOM 0 H GLU A 139 15.781 4.031 -2.303 1.00 41.03 H new ATOM 0 HA GLU A 139 15.479 1.552 -0.973 1.00 15.22 H new ATOM 0 HB2 GLU A 139 17.571 2.662 -1.973 1.00 4.00 H new ATOM 0 HB3 GLU A 139 17.626 3.663 -0.536 1.00 4.00 H new ATOM 0 HG2 GLU A 139 18.017 1.771 0.891 1.00 23.34 H new ATOM 0 HG3 GLU A 139 17.614 0.634 -0.381 1.00 23.34 H new ATOM 2349 N GLU A 140 15.012 4.191 0.893 1.00 2.43 N ATOM 2350 CA GLU A 140 14.456 4.626 2.183 1.00 51.42 C ATOM 2351 C GLU A 140 13.118 3.926 2.477 1.00 2.21 C ATOM 2352 O GLU A 140 12.812 3.599 3.628 1.00 41.52 O ATOM 2353 CB GLU A 140 14.253 6.150 2.186 1.00 12.41 C ATOM 2354 CG GLU A 140 15.547 6.958 2.180 1.00 53.21 C ATOM 2355 CD GLU A 140 16.326 6.834 3.481 1.00 2.22 C ATOM 2356 OE1 GLU A 140 15.888 7.412 4.500 1.00 1.32 O ATOM 2357 OE2 GLU A 140 17.382 6.167 3.491 1.00 21.23 O ATOM 0 H GLU A 140 15.125 4.942 0.212 1.00 2.43 H new ATOM 0 HA GLU A 140 15.167 4.352 2.963 1.00 51.42 H new ATOM 0 HB2 GLU A 140 13.662 6.427 1.313 1.00 12.41 H new ATOM 0 HB3 GLU A 140 13.671 6.425 3.066 1.00 12.41 H new ATOM 0 HG2 GLU A 140 16.174 6.625 1.353 1.00 53.21 H new ATOM 0 HG3 GLU A 140 15.314 8.007 2.000 1.00 53.21 H new ATOM 2364 N LEU A 141 12.329 3.701 1.425 1.00 44.54 N ATOM 2365 CA LEU A 141 11.036 3.018 1.551 1.00 24.22 C ATOM 2366 C LEU A 141 11.256 1.526 1.854 1.00 42.14 C ATOM 2367 O LEU A 141 10.661 0.973 2.782 1.00 32.10 O ATOM 2368 CB LEU A 141 10.224 3.191 0.249 1.00 34.13 C ATOM 2369 CG LEU A 141 8.688 3.084 0.372 1.00 65.11 C ATOM 2370 CD1 LEU A 141 8.027 3.327 -0.982 1.00 30.45 C ATOM 2371 CD2 LEU A 141 8.255 1.731 0.935 1.00 32.52 C ATOM 0 H LEU A 141 12.562 3.982 0.473 1.00 44.54 H new ATOM 0 HA LEU A 141 10.475 3.460 2.375 1.00 24.22 H new ATOM 0 HB2 LEU A 141 10.465 4.166 -0.175 1.00 34.13 H new ATOM 0 HB3 LEU A 141 10.562 2.440 -0.465 1.00 34.13 H new ATOM 0 HG LEU A 141 8.363 3.853 1.073 1.00 65.11 H new ATOM 0 HD11 LEU A 141 6.945 3.248 -0.878 1.00 30.45 H new ATOM 0 HD12 LEU A 141 8.285 4.324 -1.339 1.00 30.45 H new ATOM 0 HD13 LEU A 141 8.378 2.583 -1.697 1.00 30.45 H new ATOM 0 HD21 LEU A 141 7.168 1.697 1.005 1.00 32.52 H new ATOM 0 HD22 LEU A 141 8.601 0.935 0.276 1.00 32.52 H new ATOM 0 HD23 LEU A 141 8.687 1.594 1.926 1.00 32.52 H new ATOM 2383 N ILE A 142 12.124 0.889 1.061 1.00 54.44 N ATOM 2384 CA ILE A 142 12.455 -0.532 1.246 1.00 34.20 C ATOM 2385 C ILE A 142 12.826 -0.822 2.708 1.00 13.01 C ATOM 2386 O ILE A 142 12.378 -1.808 3.292 1.00 1.41 O ATOM 2387 CB ILE A 142 13.635 -0.960 0.331 1.00 52.33 C ATOM 2388 CG1 ILE A 142 13.352 -0.590 -1.139 1.00 42.53 C ATOM 2389 CG2 ILE A 142 13.911 -2.460 0.469 1.00 74.33 C ATOM 2390 CD1 ILE A 142 12.120 -1.255 -1.718 1.00 14.11 C ATOM 0 H ILE A 142 12.612 1.334 0.283 1.00 54.44 H new ATOM 0 HA ILE A 142 11.568 -1.105 0.975 1.00 34.20 H new ATOM 0 HB ILE A 142 14.525 -0.419 0.651 1.00 52.33 H new ATOM 0 HG12 ILE A 142 13.238 0.491 -1.215 1.00 42.53 H new ATOM 0 HG13 ILE A 142 14.217 -0.862 -1.744 1.00 42.53 H new ATOM 0 HG21 ILE A 142 14.741 -2.738 -0.180 1.00 74.33 H new ATOM 0 HG22 ILE A 142 14.167 -2.689 1.503 1.00 74.33 H new ATOM 0 HG23 ILE A 142 13.022 -3.021 0.182 1.00 74.33 H new ATOM 0 HD11 ILE A 142 11.991 -0.943 -2.754 1.00 14.11 H new ATOM 0 HD12 ILE A 142 12.238 -2.338 -1.677 1.00 14.11 H new ATOM 0 HD13 ILE A 142 11.243 -0.963 -1.140 1.00 14.11 H new ATOM 2402 N GLU A 143 13.640 0.062 3.283 1.00 5.03 N ATOM 2403 CA GLU A 143 14.040 -0.012 4.684 1.00 20.42 C ATOM 2404 C GLU A 143 12.830 -0.238 5.611 1.00 2.14 C ATOM 2405 O GLU A 143 12.788 -1.209 6.372 1.00 14.23 O ATOM 2406 CB GLU A 143 14.756 1.299 5.042 1.00 0.11 C ATOM 2407 CG GLU A 143 15.774 1.180 6.161 1.00 43.54 C ATOM 2408 CD GLU A 143 15.160 0.847 7.513 1.00 64.31 C ATOM 2409 OE1 GLU A 143 14.141 1.471 7.880 1.00 43.34 O ATOM 2410 OE2 GLU A 143 15.700 -0.040 8.217 1.00 51.24 O ATOM 0 H GLU A 143 14.043 0.855 2.784 1.00 5.03 H new ATOM 0 HA GLU A 143 14.706 -0.863 4.825 1.00 20.42 H new ATOM 0 HB2 GLU A 143 15.258 1.678 4.152 1.00 0.11 H new ATOM 0 HB3 GLU A 143 14.008 2.040 5.326 1.00 0.11 H new ATOM 0 HG2 GLU A 143 16.498 0.408 5.901 1.00 43.54 H new ATOM 0 HG3 GLU A 143 16.323 2.118 6.242 1.00 43.54 H new ATOM 2417 N GLN A 144 11.845 0.658 5.527 1.00 44.04 N ATOM 2418 CA GLN A 144 10.630 0.566 6.350 1.00 20.10 C ATOM 2419 C GLN A 144 9.902 -0.774 6.142 1.00 43.11 C ATOM 2420 O GLN A 144 9.381 -1.364 7.091 1.00 64.14 O ATOM 2421 CB GLN A 144 9.682 1.731 6.027 1.00 4.24 C ATOM 2422 CG GLN A 144 10.239 3.111 6.375 1.00 11.35 C ATOM 2423 CD GLN A 144 10.492 3.294 7.867 1.00 22.24 C ATOM 2424 OE1 GLN A 144 9.606 3.693 8.612 1.00 32.24 O ATOM 2425 NE2 GLN A 144 11.704 3.025 8.311 1.00 32.31 N ATOM 0 H GLN A 144 11.862 1.459 4.896 1.00 44.04 H new ATOM 0 HA GLN A 144 10.935 0.623 7.395 1.00 20.10 H new ATOM 0 HB2 GLN A 144 9.444 1.706 4.964 1.00 4.24 H new ATOM 0 HB3 GLN A 144 8.747 1.583 6.567 1.00 4.24 H new ATOM 0 HG2 GLN A 144 11.171 3.267 5.832 1.00 11.35 H new ATOM 0 HG3 GLN A 144 9.540 3.875 6.035 1.00 11.35 H new ATOM 0 HE21 GLN A 144 12.422 2.694 7.666 1.00 32.31 H new ATOM 0 HE22 GLN A 144 11.924 3.148 9.299 1.00 32.31 H new ATOM 2434 N VAL A 145 9.872 -1.247 4.895 1.00 64.21 N ATOM 2435 CA VAL A 145 9.262 -2.544 4.570 1.00 12.21 C ATOM 2436 C VAL A 145 9.989 -3.694 5.287 1.00 13.12 C ATOM 2437 O VAL A 145 9.363 -4.620 5.809 1.00 25.13 O ATOM 2438 CB VAL A 145 9.272 -2.805 3.040 1.00 32.35 C ATOM 2439 CG1 VAL A 145 8.665 -4.170 2.706 1.00 50.50 C ATOM 2440 CG2 VAL A 145 8.541 -1.690 2.297 1.00 0.31 C ATOM 0 H VAL A 145 10.262 -0.754 4.092 1.00 64.21 H new ATOM 0 HA VAL A 145 8.229 -2.505 4.915 1.00 12.21 H new ATOM 0 HB VAL A 145 10.311 -2.813 2.709 1.00 32.35 H new ATOM 0 HG11 VAL A 145 8.686 -4.323 1.627 1.00 50.50 H new ATOM 0 HG12 VAL A 145 9.242 -4.954 3.196 1.00 50.50 H new ATOM 0 HG13 VAL A 145 7.634 -4.205 3.057 1.00 50.50 H new ATOM 0 HG21 VAL A 145 8.560 -1.893 1.226 1.00 0.31 H new ATOM 0 HG22 VAL A 145 7.507 -1.642 2.639 1.00 0.31 H new ATOM 0 HG23 VAL A 145 9.033 -0.738 2.495 1.00 0.31 H new ATOM 2450 N ARG A 146 11.317 -3.619 5.315 1.00 13.32 N ATOM 2451 CA ARG A 146 12.135 -4.625 5.994 1.00 22.40 C ATOM 2452 C ARG A 146 11.905 -4.580 7.514 1.00 34.31 C ATOM 2453 O ARG A 146 11.756 -5.617 8.166 1.00 31.12 O ATOM 2454 CB ARG A 146 13.618 -4.403 5.673 1.00 12.42 C ATOM 2455 CG ARG A 146 13.923 -4.322 4.186 1.00 11.11 C ATOM 2456 CD ARG A 146 15.414 -4.134 3.931 1.00 44.05 C ATOM 2457 NE ARG A 146 15.927 -5.147 3.019 1.00 22.21 N ATOM 2458 CZ ARG A 146 17.184 -5.465 2.897 1.00 52.10 C ATOM 2459 NH1 ARG A 146 18.092 -4.862 3.593 1.00 74.31 N ATOM 2460 NH2 ARG A 146 17.526 -6.384 2.060 1.00 61.32 N ATOM 0 H ARG A 146 11.852 -2.871 4.875 1.00 13.32 H new ATOM 0 HA ARG A 146 11.839 -5.610 5.634 1.00 22.40 H new ATOM 0 HB2 ARG A 146 13.949 -3.482 6.152 1.00 12.42 H new ATOM 0 HB3 ARG A 146 14.199 -5.216 6.109 1.00 12.42 H new ATOM 0 HG2 ARG A 146 13.580 -5.232 3.693 1.00 11.11 H new ATOM 0 HG3 ARG A 146 13.370 -3.493 3.745 1.00 11.11 H new ATOM 0 HD2 ARG A 146 15.592 -3.143 3.514 1.00 44.05 H new ATOM 0 HD3 ARG A 146 15.956 -4.184 4.875 1.00 44.05 H new ATOM 0 HE ARG A 146 15.254 -5.643 2.434 1.00 22.21 H new ATOM 0 HH11 ARG A 146 17.828 -4.126 4.248 1.00 74.31 H new ATOM 0 HH12 ARG A 146 19.073 -5.122 3.487 1.00 74.31 H new ATOM 0 HH21 ARG A 146 16.815 -6.855 1.501 1.00 61.32 H new ATOM 0 HH22 ARG A 146 18.508 -6.640 1.957 1.00 61.32 H new ATOM 2474 N ARG A 147 11.881 -3.367 8.071 1.00 70.52 N ATOM 2475 CA ARG A 147 11.560 -3.164 9.491 1.00 10.53 C ATOM 2476 C ARG A 147 10.193 -3.762 9.865 1.00 13.24 C ATOM 2477 O ARG A 147 10.036 -4.340 10.941 1.00 22.31 O ATOM 2478 CB ARG A 147 11.593 -1.670 9.848 1.00 22.33 C ATOM 2479 CG ARG A 147 12.982 -1.149 10.206 1.00 53.01 C ATOM 2480 CD ARG A 147 12.931 0.294 10.691 1.00 13.30 C ATOM 2481 NE ARG A 147 14.139 0.684 11.429 1.00 42.03 N ATOM 2482 CZ ARG A 147 14.782 1.806 11.244 1.00 12.14 C ATOM 2483 NH1 ARG A 147 14.517 2.554 10.225 1.00 54.33 N ATOM 2484 NH2 ARG A 147 15.736 2.151 12.043 1.00 35.03 N ATOM 0 H ARG A 147 12.080 -2.506 7.561 1.00 70.52 H new ATOM 0 HA ARG A 147 12.323 -3.688 10.068 1.00 10.53 H new ATOM 0 HB2 ARG A 147 11.207 -1.097 9.005 1.00 22.33 H new ATOM 0 HB3 ARG A 147 10.922 -1.493 10.688 1.00 22.33 H new ATOM 0 HG2 ARG A 147 13.419 -1.779 10.981 1.00 53.01 H new ATOM 0 HG3 ARG A 147 13.633 -1.218 9.334 1.00 53.01 H new ATOM 0 HD2 ARG A 147 12.803 0.957 9.835 1.00 13.30 H new ATOM 0 HD3 ARG A 147 12.059 0.428 11.331 1.00 13.30 H new ATOM 0 HE ARG A 147 14.499 0.038 12.131 1.00 42.03 H new ATOM 0 HH11 ARG A 147 13.801 2.270 9.557 1.00 54.33 H new ATOM 0 HH12 ARG A 147 15.024 3.428 10.089 1.00 54.33 H new ATOM 0 HH21 ARG A 147 15.991 1.546 12.824 1.00 35.03 H new ATOM 0 HH22 ARG A 147 16.234 3.028 11.893 1.00 35.03 H new ATOM 2498 N PHE A 148 9.204 -3.616 8.980 1.00 12.11 N ATOM 2499 CA PHE A 148 7.871 -4.192 9.206 1.00 21.11 C ATOM 2500 C PHE A 148 7.951 -5.693 9.531 1.00 43.21 C ATOM 2501 O PHE A 148 7.344 -6.167 10.495 1.00 1.34 O ATOM 2502 CB PHE A 148 6.971 -3.969 7.983 1.00 45.23 C ATOM 2503 CG PHE A 148 5.661 -4.717 8.058 1.00 30.42 C ATOM 2504 CD1 PHE A 148 4.711 -4.388 9.014 1.00 53.22 C ATOM 2505 CD2 PHE A 148 5.386 -5.754 7.175 1.00 45.12 C ATOM 2506 CE1 PHE A 148 3.515 -5.078 9.088 1.00 74.20 C ATOM 2507 CE2 PHE A 148 4.192 -6.445 7.245 1.00 22.33 C ATOM 2508 CZ PHE A 148 3.256 -6.108 8.202 1.00 62.12 C ATOM 0 H PHE A 148 9.298 -3.106 8.102 1.00 12.11 H new ATOM 0 HA PHE A 148 7.438 -3.682 10.066 1.00 21.11 H new ATOM 0 HB2 PHE A 148 6.767 -2.903 7.881 1.00 45.23 H new ATOM 0 HB3 PHE A 148 7.507 -4.278 7.086 1.00 45.23 H new ATOM 0 HD1 PHE A 148 4.908 -3.584 9.708 1.00 53.22 H new ATOM 0 HD2 PHE A 148 6.115 -6.023 6.425 1.00 45.12 H new ATOM 0 HE1 PHE A 148 2.784 -4.813 9.837 1.00 74.20 H new ATOM 0 HE2 PHE A 148 3.991 -7.248 6.552 1.00 22.33 H new ATOM 0 HZ PHE A 148 2.322 -6.648 8.259 1.00 62.12 H new ATOM 2518 N VAL A 149 8.705 -6.428 8.725 1.00 1.23 N ATOM 2519 CA VAL A 149 8.901 -7.866 8.937 1.00 71.53 C ATOM 2520 C VAL A 149 9.484 -8.153 10.332 1.00 55.43 C ATOM 2521 O VAL A 149 9.126 -9.136 10.985 1.00 13.10 O ATOM 2522 CB VAL A 149 9.840 -8.456 7.854 1.00 22.24 C ATOM 2523 CG1 VAL A 149 9.982 -9.970 8.007 1.00 30.01 C ATOM 2524 CG2 VAL A 149 9.337 -8.086 6.458 1.00 0.12 C ATOM 0 H VAL A 149 9.196 -6.055 7.912 1.00 1.23 H new ATOM 0 HA VAL A 149 7.923 -8.341 8.864 1.00 71.53 H new ATOM 0 HB VAL A 149 10.831 -8.023 7.988 1.00 22.24 H new ATOM 0 HG11 VAL A 149 10.647 -10.353 7.233 1.00 30.01 H new ATOM 0 HG12 VAL A 149 10.398 -10.199 8.988 1.00 30.01 H new ATOM 0 HG13 VAL A 149 9.003 -10.439 7.909 1.00 30.01 H new ATOM 0 HG21 VAL A 149 10.006 -8.507 5.707 1.00 0.12 H new ATOM 0 HG22 VAL A 149 8.333 -8.486 6.315 1.00 0.12 H new ATOM 0 HG23 VAL A 149 9.313 -7.001 6.356 1.00 0.12 H new ATOM 2534 N ARG A 150 10.371 -7.276 10.791 1.00 51.25 N ATOM 2535 CA ARG A 150 11.000 -7.425 12.106 1.00 40.22 C ATOM 2536 C ARG A 150 10.067 -7.013 13.259 1.00 41.14 C ATOM 2537 O ARG A 150 10.107 -7.616 14.335 1.00 52.21 O ATOM 2538 CB ARG A 150 12.309 -6.628 12.160 1.00 62.33 C ATOM 2539 CG ARG A 150 13.465 -7.325 11.449 1.00 32.53 C ATOM 2540 CD ARG A 150 14.728 -6.472 11.443 1.00 15.12 C ATOM 2541 NE ARG A 150 14.729 -5.494 10.358 1.00 34.30 N ATOM 2542 CZ ARG A 150 15.065 -4.240 10.485 1.00 41.15 C ATOM 2543 NH1 ARG A 150 15.307 -3.727 11.649 1.00 43.23 N ATOM 2544 NH2 ARG A 150 15.142 -3.492 9.437 1.00 44.02 N ATOM 0 H ARG A 150 10.674 -6.451 10.273 1.00 51.25 H new ATOM 0 HA ARG A 150 11.217 -8.485 12.241 1.00 40.22 H new ATOM 0 HB2 ARG A 150 12.150 -5.649 11.708 1.00 62.33 H new ATOM 0 HB3 ARG A 150 12.581 -6.458 13.202 1.00 62.33 H new ATOM 0 HG2 ARG A 150 13.672 -8.276 11.940 1.00 32.53 H new ATOM 0 HG3 ARG A 150 13.176 -7.552 10.423 1.00 32.53 H new ATOM 0 HD2 ARG A 150 14.818 -5.953 12.397 1.00 15.12 H new ATOM 0 HD3 ARG A 150 15.600 -7.118 11.348 1.00 15.12 H new ATOM 0 HE ARG A 150 14.446 -5.816 9.432 1.00 34.30 H new ATOM 0 HH11 ARG A 150 15.236 -4.306 12.486 1.00 43.23 H new ATOM 0 HH12 ARG A 150 15.568 -2.744 11.729 1.00 43.23 H new ATOM 0 HH21 ARG A 150 14.941 -3.882 8.516 1.00 44.02 H new ATOM 0 HH22 ARG A 150 15.404 -2.511 9.529 1.00 44.02 H new ATOM 2558 N LYS A 151 9.224 -6.003 13.042 1.00 60.10 N ATOM 2559 CA LYS A 151 8.313 -5.534 14.097 1.00 42.13 C ATOM 2560 C LYS A 151 7.187 -6.555 14.350 1.00 43.20 C ATOM 2561 O LYS A 151 6.802 -6.791 15.496 1.00 41.42 O ATOM 2562 CB LYS A 151 7.739 -4.144 13.754 1.00 2.12 C ATOM 2563 CG LYS A 151 6.628 -4.145 12.704 1.00 73.31 C ATOM 2564 CD LYS A 151 6.253 -2.733 12.254 1.00 71.13 C ATOM 2565 CE LYS A 151 5.838 -1.836 13.417 1.00 52.12 C ATOM 2566 NZ LYS A 151 4.659 -2.367 14.154 1.00 32.01 N ATOM 0 H LYS A 151 9.150 -5.497 12.159 1.00 60.10 H new ATOM 0 HA LYS A 151 8.887 -5.439 15.018 1.00 42.13 H new ATOM 0 HB2 LYS A 151 7.354 -3.691 14.668 1.00 2.12 H new ATOM 0 HB3 LYS A 151 8.552 -3.509 13.401 1.00 2.12 H new ATOM 0 HG2 LYS A 151 6.949 -4.726 11.839 1.00 73.31 H new ATOM 0 HG3 LYS A 151 5.747 -4.640 13.112 1.00 73.31 H new ATOM 0 HD2 LYS A 151 7.101 -2.283 11.738 1.00 71.13 H new ATOM 0 HD3 LYS A 151 5.436 -2.790 11.535 1.00 71.13 H new ATOM 0 HE2 LYS A 151 6.676 -1.730 14.106 1.00 52.12 H new ATOM 0 HE3 LYS A 151 5.608 -0.840 13.039 1.00 52.12 H new ATOM 0 HZ1 LYS A 151 4.397 -1.705 14.912 1.00 32.01 H new ATOM 0 HZ2 LYS A 151 3.860 -2.476 13.498 1.00 32.01 H new ATOM 0 HZ3 LYS A 151 4.896 -3.291 14.568 1.00 32.01 H new ATOM 2580 N VAL A 152 6.679 -7.180 13.284 1.00 2.44 N ATOM 2581 CA VAL A 152 5.669 -8.241 13.425 1.00 33.34 C ATOM 2582 C VAL A 152 6.297 -9.537 13.964 1.00 70.22 C ATOM 2583 O VAL A 152 5.638 -10.335 14.632 1.00 40.31 O ATOM 2584 CB VAL A 152 4.937 -8.531 12.088 1.00 11.03 C ATOM 2585 CG1 VAL A 152 4.192 -7.289 11.605 1.00 41.00 C ATOM 2586 CG2 VAL A 152 5.910 -9.035 11.022 1.00 24.23 C ATOM 0 H VAL A 152 6.945 -6.975 12.321 1.00 2.44 H new ATOM 0 HA VAL A 152 4.933 -7.876 14.142 1.00 33.34 H new ATOM 0 HB VAL A 152 4.207 -9.320 12.267 1.00 11.03 H new ATOM 0 HG11 VAL A 152 3.685 -7.511 10.666 1.00 41.00 H new ATOM 0 HG12 VAL A 152 3.457 -6.992 12.353 1.00 41.00 H new ATOM 0 HG13 VAL A 152 4.902 -6.476 11.450 1.00 41.00 H new ATOM 0 HG21 VAL A 152 5.367 -9.229 10.097 1.00 24.23 H new ATOM 0 HG22 VAL A 152 6.675 -8.280 10.842 1.00 24.23 H new ATOM 0 HG23 VAL A 152 6.382 -9.955 11.366 1.00 24.23 H new ATOM 2596 N GLY A 153 7.582 -9.732 13.679 1.00 1.14 N ATOM 2597 CA GLY A 153 8.317 -10.857 14.244 1.00 2.03 C ATOM 2598 C GLY A 153 8.772 -10.597 15.680 1.00 32.44 C ATOM 2599 O GLY A 153 9.405 -11.452 16.304 1.00 24.15 O ATOM 0 H GLY A 153 8.131 -9.130 13.065 1.00 1.14 H new ATOM 0 HA2 GLY A 153 7.687 -11.746 14.221 1.00 2.03 H new ATOM 0 HA3 GLY A 153 9.188 -11.067 13.623 1.00 2.03 H new ATOM 2603 N SER A 154 8.446 -9.412 16.201 1.00 22.14 N ATOM 2604 CA SER A 154 8.811 -9.022 17.570 1.00 51.24 C ATOM 2605 C SER A 154 7.605 -8.427 18.315 1.00 72.14 C ATOM 2606 O SER A 154 7.750 -7.493 19.107 1.00 24.20 O ATOM 2607 CB SER A 154 9.962 -8.001 17.540 1.00 13.14 C ATOM 2608 OG SER A 154 11.120 -8.544 16.919 1.00 32.11 O ATOM 0 H SER A 154 7.925 -8.698 15.692 1.00 22.14 H new ATOM 0 HA SER A 154 9.136 -9.917 18.102 1.00 51.24 H new ATOM 0 HB2 SER A 154 9.644 -7.108 17.003 1.00 13.14 H new ATOM 0 HB3 SER A 154 10.203 -7.692 18.557 1.00 13.14 H new ATOM 0 HG SER A 154 11.071 -8.398 15.951 1.00 32.11 H new ATOM 2614 N LEU A 155 6.416 -8.973 18.063 1.00 50.44 N ATOM 2615 CA LEU A 155 5.194 -8.508 18.733 1.00 34.04 C ATOM 2616 C LEU A 155 5.173 -8.935 20.211 1.00 5.24 C ATOM 2617 O LEU A 155 4.906 -10.095 20.529 1.00 42.24 O ATOM 2618 CB LEU A 155 3.945 -9.048 18.016 1.00 35.33 C ATOM 2619 CG LEU A 155 3.736 -8.539 16.579 1.00 21.03 C ATOM 2620 CD1 LEU A 155 2.504 -9.187 15.945 1.00 62.13 C ATOM 2621 CD2 LEU A 155 3.620 -7.015 16.557 1.00 42.41 C ATOM 0 H LEU A 155 6.269 -9.736 17.402 1.00 50.44 H new ATOM 0 HA LEU A 155 5.187 -7.419 18.689 1.00 34.04 H new ATOM 0 HB2 LEU A 155 4.002 -10.136 17.993 1.00 35.33 H new ATOM 0 HB3 LEU A 155 3.067 -8.788 18.607 1.00 35.33 H new ATOM 0 HG LEU A 155 4.607 -8.823 15.989 1.00 21.03 H new ATOM 0 HD11 LEU A 155 2.377 -8.811 14.930 1.00 62.13 H new ATOM 0 HD12 LEU A 155 2.635 -10.269 15.918 1.00 62.13 H new ATOM 0 HD13 LEU A 155 1.620 -8.943 16.535 1.00 62.13 H new ATOM 0 HD21 LEU A 155 3.473 -6.676 15.532 1.00 42.41 H new ATOM 0 HD22 LEU A 155 2.771 -6.706 17.167 1.00 42.41 H new ATOM 0 HD23 LEU A 155 4.533 -6.575 16.957 1.00 42.41 H new ATOM 2633 N GLU A 156 5.468 -7.992 21.104 1.00 32.32 N ATOM 2634 CA GLU A 156 5.483 -8.267 22.544 1.00 31.20 C ATOM 2635 C GLU A 156 4.093 -8.654 23.070 1.00 74.33 C ATOM 2636 O GLU A 156 3.164 -7.844 23.070 1.00 74.25 O ATOM 2637 CB GLU A 156 6.001 -7.049 23.325 1.00 3.43 C ATOM 2638 CG GLU A 156 7.456 -6.693 23.040 1.00 30.21 C ATOM 2639 CD GLU A 156 7.940 -5.535 23.898 1.00 62.52 C ATOM 2640 OE1 GLU A 156 8.441 -5.785 25.017 1.00 5.21 O ATOM 2641 OE2 GLU A 156 7.796 -4.371 23.473 1.00 52.11 O ATOM 0 H GLU A 156 5.700 -7.030 20.858 1.00 32.32 H new ATOM 0 HA GLU A 156 6.154 -9.112 22.697 1.00 31.20 H new ATOM 0 HB2 GLU A 156 5.376 -6.188 23.089 1.00 3.43 H new ATOM 0 HB3 GLU A 156 5.889 -7.242 24.392 1.00 3.43 H new ATOM 0 HG2 GLU A 156 8.084 -7.565 23.221 1.00 30.21 H new ATOM 0 HG3 GLU A 156 7.566 -6.434 21.987 1.00 30.21 H new ATOM 2648 N HIS A 157 3.959 -9.900 23.511 1.00 75.11 N ATOM 2649 CA HIS A 157 2.732 -10.361 24.166 1.00 51.34 C ATOM 2650 C HIS A 157 2.569 -9.653 25.530 1.00 45.14 C ATOM 2651 O HIS A 157 3.533 -9.092 26.056 1.00 12.24 O ATOM 2652 CB HIS A 157 2.790 -11.893 24.326 1.00 22.33 C ATOM 2653 CG HIS A 157 1.493 -12.535 24.727 1.00 54.31 C ATOM 2654 ND1 HIS A 157 0.458 -12.762 23.842 1.00 61.23 N ATOM 2655 CD2 HIS A 157 1.067 -13.015 25.921 1.00 72.23 C ATOM 2656 CE1 HIS A 157 -0.539 -13.349 24.473 1.00 4.43 C ATOM 2657 NE2 HIS A 157 -0.194 -13.514 25.731 1.00 70.45 N ATOM 0 H HIS A 157 4.684 -10.613 23.428 1.00 75.11 H new ATOM 0 HA HIS A 157 1.863 -10.111 23.557 1.00 51.34 H new ATOM 0 HB2 HIS A 157 3.119 -12.330 23.383 1.00 22.33 H new ATOM 0 HB3 HIS A 157 3.546 -12.138 25.072 1.00 22.33 H new ATOM 0 HD2 HIS A 157 1.619 -13.006 26.849 1.00 72.23 H new ATOM 0 HE1 HIS A 157 -1.480 -13.644 24.032 1.00 4.43 H new ATOM 0 HE2 HIS A 157 -0.774 -13.945 26.451 1.00 70.45 H new ATOM 2666 N HIS A 158 1.353 -9.670 26.088 1.00 10.20 N ATOM 2667 CA HIS A 158 1.030 -8.959 27.345 1.00 33.10 C ATOM 2668 C HIS A 158 0.830 -7.445 27.117 1.00 13.00 C ATOM 2669 O HIS A 158 -0.226 -6.896 27.450 1.00 44.03 O ATOM 2670 CB HIS A 158 2.092 -9.189 28.443 1.00 71.21 C ATOM 2671 CG HIS A 158 2.042 -10.545 29.089 1.00 63.22 C ATOM 2672 ND1 HIS A 158 2.744 -11.638 28.621 1.00 23.43 N ATOM 2673 CD2 HIS A 158 1.383 -10.976 30.194 1.00 1.32 C ATOM 2674 CE1 HIS A 158 2.518 -12.673 29.406 1.00 50.44 C ATOM 2675 NE2 HIS A 158 1.700 -12.300 30.368 1.00 71.13 N ATOM 0 H HIS A 158 0.562 -10.174 25.687 1.00 10.20 H new ATOM 0 HA HIS A 158 0.089 -9.385 27.692 1.00 33.10 H new ATOM 0 HB2 HIS A 158 3.081 -9.044 28.009 1.00 71.21 H new ATOM 0 HB3 HIS A 158 1.968 -8.429 29.214 1.00 71.21 H new ATOM 0 HD2 HIS A 158 0.730 -10.386 30.821 1.00 1.32 H new ATOM 0 HE1 HIS A 158 2.934 -13.662 29.281 1.00 50.44 H new ATOM 0 HE2 HIS A 158 1.358 -12.898 31.120 1.00 71.13 H new ATOM 2684 N HIS A 159 1.837 -6.767 26.551 1.00 10.30 N ATOM 2685 CA HIS A 159 1.761 -5.311 26.339 1.00 72.43 C ATOM 2686 C HIS A 159 2.095 -4.905 24.890 1.00 51.25 C ATOM 2687 O HIS A 159 3.219 -5.088 24.417 1.00 24.11 O ATOM 2688 CB HIS A 159 2.686 -4.571 27.328 1.00 1.03 C ATOM 2689 CG HIS A 159 4.152 -4.873 27.170 1.00 62.42 C ATOM 2690 ND1 HIS A 159 4.773 -5.932 27.793 1.00 4.42 N ATOM 2691 CD2 HIS A 159 5.122 -4.242 26.460 1.00 51.30 C ATOM 2692 CE1 HIS A 159 6.052 -5.943 27.474 1.00 12.01 C ATOM 2693 NE2 HIS A 159 6.289 -4.932 26.666 1.00 34.12 N ATOM 0 H HIS A 159 2.706 -7.196 26.234 1.00 10.30 H new ATOM 0 HA HIS A 159 0.727 -5.019 26.524 1.00 72.43 H new ATOM 0 HB2 HIS A 159 2.536 -3.498 27.210 1.00 1.03 H new ATOM 0 HB3 HIS A 159 2.385 -4.825 28.344 1.00 1.03 H new ATOM 0 HD2 HIS A 159 4.998 -3.361 25.847 1.00 51.30 H new ATOM 0 HE1 HIS A 159 6.782 -6.661 27.818 1.00 12.01 H new ATOM 0 HE2 HIS A 159 7.195 -4.699 26.259 1.00 34.12 H new ATOM 2702 N HIS A 160 1.105 -4.355 24.190 1.00 32.51 N ATOM 2703 CA HIS A 160 1.313 -3.794 22.849 1.00 45.43 C ATOM 2704 C HIS A 160 2.166 -2.514 22.907 1.00 75.43 C ATOM 2705 O HIS A 160 2.968 -2.245 22.011 1.00 11.50 O ATOM 2706 CB HIS A 160 -0.045 -3.505 22.183 1.00 35.40 C ATOM 2707 CG HIS A 160 0.020 -2.501 21.067 1.00 13.32 C ATOM 2708 ND1 HIS A 160 -0.201 -1.158 21.269 1.00 40.52 N ATOM 2709 CD2 HIS A 160 0.284 -2.639 19.745 1.00 71.32 C ATOM 2710 CE1 HIS A 160 -0.078 -0.514 20.127 1.00 63.12 C ATOM 2711 NE2 HIS A 160 0.217 -1.386 19.185 1.00 62.05 N ATOM 0 H HIS A 160 0.145 -4.284 24.528 1.00 32.51 H new ATOM 0 HA HIS A 160 1.854 -4.528 22.252 1.00 45.43 H new ATOM 0 HB2 HIS A 160 -0.453 -4.438 21.794 1.00 35.40 H new ATOM 0 HB3 HIS A 160 -0.740 -3.145 22.941 1.00 35.40 H new ATOM 0 HD2 HIS A 160 0.506 -3.561 19.228 1.00 71.32 H new ATOM 0 HE1 HIS A 160 -0.199 0.550 19.986 1.00 63.12 H new ATOM 0 HE2 HIS A 160 0.371 -1.167 18.201 1.00 62.05 H new ATOM 2720 N HIS A 161 1.971 -1.719 23.956 1.00 41.20 N ATOM 2721 CA HIS A 161 2.757 -0.499 24.164 1.00 30.31 C ATOM 2722 C HIS A 161 2.701 -0.038 25.624 1.00 51.30 C ATOM 2723 O HIS A 161 1.682 -0.198 26.298 1.00 10.12 O ATOM 2724 CB HIS A 161 2.261 0.630 23.246 1.00 5.31 C ATOM 2725 CG HIS A 161 2.969 1.936 23.465 1.00 35.34 C ATOM 2726 ND1 HIS A 161 4.247 2.180 23.022 1.00 12.11 N ATOM 2727 CD2 HIS A 161 2.579 3.066 24.108 1.00 70.43 C ATOM 2728 CE1 HIS A 161 4.613 3.397 23.379 1.00 52.55 C ATOM 2729 NE2 HIS A 161 3.620 3.955 24.038 1.00 24.45 N ATOM 0 H HIS A 161 1.274 -1.896 24.679 1.00 41.20 H new ATOM 0 HA HIS A 161 3.792 -0.734 23.917 1.00 30.31 H new ATOM 0 HB2 HIS A 161 2.390 0.326 22.207 1.00 5.31 H new ATOM 0 HB3 HIS A 161 1.192 0.774 23.406 1.00 5.31 H new ATOM 0 HD2 HIS A 161 1.625 3.234 24.586 1.00 70.43 H new ATOM 0 HE1 HIS A 161 5.567 3.857 23.166 1.00 52.55 H new ATOM 0 HE2 HIS A 161 3.624 4.896 24.432 1.00 24.45 H new ATOM 2738 N HIS A 162 3.804 0.530 26.105 1.00 63.13 N ATOM 2739 CA HIS A 162 3.853 1.128 27.443 1.00 74.25 C ATOM 2740 C HIS A 162 4.704 2.416 27.441 1.00 74.22 C ATOM 2741 O HIS A 162 4.130 3.513 27.255 1.00 36.72 O ATOM 2742 CB HIS A 162 4.402 0.112 28.458 1.00 33.13 C ATOM 2743 CG HIS A 162 4.341 0.593 29.879 1.00 64.40 C ATOM 2744 ND1 HIS A 162 3.172 0.642 30.606 1.00 5.31 N ATOM 2745 CD2 HIS A 162 5.311 1.056 30.704 1.00 11.15 C ATOM 2746 CE1 HIS A 162 3.421 1.113 31.811 1.00 62.40 C ATOM 2747 NE2 HIS A 162 4.708 1.372 31.896 1.00 21.23 N ATOM 2748 OXT HIS A 162 5.939 2.328 27.613 1.00 36.72 O ATOM 0 H HIS A 162 4.681 0.590 25.588 1.00 63.13 H new ATOM 0 HA HIS A 162 2.839 1.400 27.737 1.00 74.25 H new ATOM 0 HB2 HIS A 162 3.837 -0.816 28.372 1.00 33.13 H new ATOM 0 HB3 HIS A 162 5.437 -0.120 28.205 1.00 33.13 H new ATOM 0 HD2 HIS A 162 6.360 1.157 30.468 1.00 11.15 H new ATOM 0 HE1 HIS A 162 2.693 1.261 32.595 1.00 62.40 H new ATOM 0 HE2 HIS A 162 5.182 1.748 32.717 1.00 21.23 H new TER 2757 HIS A 162