USER MOD reduce.3.24.130724 H: found=0, std=0, add=1110, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1105 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 125 ASN : amide:sc= -3.57! K(o=-4.3!,f=-2.4) USER MOD Set 1.2: A 130 LYS NZ :NH3+ -118:sc= -0.681 (180deg=-2.09!) USER MOD Set 2.1: A 123 THR OG1 : rot 110:sc= 0.0342 USER MOD Set 2.2: A 151 SER OG : rot -172:sc= 1.8 USER MOD Set 3.1: A 77 SER OG : rot 28:sc= -1.87! USER MOD Set 3.2: A 110 GLN : amide:sc= -4.43! C(o=-6.3!,f=-8.5!) USER MOD Set 4.1: A 52 ASN : amide:sc= 0.119 K(o=0.18,f=-9.6!) USER MOD Set 4.2: A 55 SER OG : rot 80:sc= 0.0558 USER MOD Set 5.1: A 23 THR OG1 : rot -157:sc= 1.04 USER MOD Set 5.2: A 59 HIS : no HD1:sc= -0.482 K(o=0.56,f=-13!) USER MOD Set 6.1: A 19 SER OG : rot 45:sc= -0.262 USER MOD Set 6.2: A 47 THR OG1 : rot 73:sc= -1.52! USER MOD Set 6.3: A 48 HIS : no HD1:sc= -1.5 K(o=-0.57,f=-4.2!) USER MOD Set 6.4: A 50 THR OG1 : rot -65:sc= 1.84 USER MOD Set 6.5: A 61 LYS NZ :NH3+ -165:sc= 2.2 (180deg=0.939) USER MOD Set 6.6: A 75 THR OG1 : rot -169:sc= -1.33! USER MOD Set 7.1: A 13 HIS : no HD1:sc= -8.53! C(o=-11!,f=-13!) USER MOD Set 7.2: A 103 THR OG1 : rot 128:sc= 1.21 USER MOD Set 7.3: A 105 GLN : amide:sc= -3.45! C(o=-11!,f=-14!) USER MOD Single : A 1 SER N :NH3+ 167:sc= 1.26 (180deg=1.12) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ 178:sc= -5.11! (180deg=-5.15!) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= -1.66! C(o=-1.7!,f=-2.8!) USER MOD Single : A 17 LYS NZ :NH3+ -155:sc= 1.06 (180deg=0.479) USER MOD Single : A 32 SER OG : rot -155:sc= -0.454 USER MOD Single : A 35 GLN : amide:sc= -2.5! K(o=-2.5!,f=-0.13) USER MOD Single : A 39 GLN : amide:sc= -0.0442 K(o=-0.044,f=-0.73) USER MOD Single : A 41 LYS NZ :NH3+ -112:sc= 1.38 (180deg=0.285) USER MOD Single : A 51 TYR OH : rot 59:sc= -2.18! USER MOD Single : A 56 LYS NZ :NH3+ -134:sc= 1.26 (180deg=1.04) USER MOD Single : A 57 MET CE :methyl -173:sc= -1.5 (180deg=-1.58) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 TYR OH : rot 30:sc= 0 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 177:sc= 1.25 (180deg=1.21) USER MOD Single : A 79 SER OG : rot -70:sc= -1.92! USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 HIS : no HD1:sc=-0.000811 X(o=-0.00081,f=0) USER MOD Single : A 90 SER OG : rot -148:sc= 1.13 USER MOD Single : A 91 TYR OH : rot 150:sc= -0.272 USER MOD Single : A 98 MET CE :methyl 137:sc= -0.223 (180deg=-0.867) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 MET CE :methyl 155:sc= -0.445 (180deg=-2.36) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot -110:sc= 0.134 USER MOD Single : A 118 SER OG : rot -48:sc= 0.155 USER MOD Single : A 124 TYR OH : rot -178:sc= -0.0308 USER MOD Single : A 127 HIS : no HE2:sc= 1.19 K(o=1.2,f=-4!) USER MOD Single : A 129 GLN : amide:sc= -0.264 K(o=-0.26,f=-1.4!) USER MOD Single : A 132 THR OG1 : rot -50:sc= -2.02! USER MOD Single : A 134 LYS NZ :NH3+ -150:sc= -0.794 (180deg=-1.12) USER MOD Single : A 139 SER OG : rot -3:sc= 0.284 USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 THR OG1 : rot 9:sc= 0.0792 USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 GLN : amide:sc= -2.6 K(o=-2.6,f=-0.35) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 24.190 4.033 9.221 1.00 3.53 N ATOM 2 CA SER A 1 24.795 3.436 10.434 1.00 2.82 C ATOM 3 C SER A 1 24.075 2.148 10.819 1.00 1.84 C ATOM 4 O SER A 1 24.650 1.062 10.737 1.00 1.68 O ATOM 5 CB SER A 1 24.762 4.436 11.594 1.00 3.37 C ATOM 6 OG SER A 1 25.450 3.932 12.727 1.00 4.10 O ATOM 0 H1 SER A 1 24.539 5.005 9.101 1.00 3.53 H new ATOM 0 H2 SER A 1 24.451 3.467 8.388 1.00 3.53 H new ATOM 0 H3 SER A 1 23.155 4.047 9.320 1.00 3.53 H new ATOM 0 HA SER A 1 25.834 3.193 10.214 1.00 2.82 H new ATOM 0 HB2 SER A 1 25.214 5.376 11.279 1.00 3.37 H new ATOM 0 HB3 SER A 1 23.728 4.653 11.861 1.00 3.37 H new ATOM 0 HG SER A 1 25.414 4.591 13.451 1.00 4.10 H new ATOM 14 N SER A 2 22.825 2.267 11.248 1.00 1.72 N ATOM 15 CA SER A 2 22.019 1.104 11.577 1.00 1.06 C ATOM 16 C SER A 2 21.441 0.509 10.298 1.00 0.92 C ATOM 17 O SER A 2 20.304 0.797 9.918 1.00 1.65 O ATOM 18 CB SER A 2 20.904 1.505 12.544 1.00 1.60 C ATOM 19 OG SER A 2 21.431 2.203 13.662 1.00 2.37 O ATOM 0 H SER A 2 22.349 3.160 11.376 1.00 1.72 H new ATOM 0 HA SER A 2 22.639 0.350 12.062 1.00 1.06 H new ATOM 0 HB2 SER A 2 20.177 2.132 12.028 1.00 1.60 H new ATOM 0 HB3 SER A 2 20.373 0.615 12.883 1.00 1.60 H new ATOM 0 HG SER A 2 20.701 2.451 14.266 1.00 2.37 H new ATOM 25 N GLU A 3 22.243 -0.308 9.627 1.00 0.72 N ATOM 26 CA GLU A 3 21.898 -0.814 8.308 1.00 0.65 C ATOM 27 C GLU A 3 21.963 -2.336 8.256 1.00 0.56 C ATOM 28 O GLU A 3 22.991 -2.913 7.891 1.00 0.70 O ATOM 29 CB GLU A 3 22.846 -0.215 7.268 1.00 1.06 C ATOM 30 CG GLU A 3 22.762 1.299 7.179 1.00 1.63 C ATOM 31 CD GLU A 3 23.963 1.911 6.494 1.00 1.81 C ATOM 32 OE1 GLU A 3 23.975 1.956 5.245 1.00 2.08 O ATOM 33 OE2 GLU A 3 24.898 2.349 7.193 1.00 2.19 O ATOM 0 H GLU A 3 23.143 -0.635 9.979 1.00 0.72 H new ATOM 0 HA GLU A 3 20.872 -0.519 8.088 1.00 0.65 H new ATOM 0 HB2 GLU A 3 23.869 -0.501 7.512 1.00 1.06 H new ATOM 0 HB3 GLU A 3 22.619 -0.642 6.291 1.00 1.06 H new ATOM 0 HG2 GLU A 3 21.859 1.577 6.636 1.00 1.63 H new ATOM 0 HG3 GLU A 3 22.671 1.713 8.183 1.00 1.63 H new ATOM 40 N PRO A 4 20.869 -3.009 8.636 1.00 0.41 N ATOM 41 CA PRO A 4 20.752 -4.449 8.522 1.00 0.39 C ATOM 42 C PRO A 4 20.200 -4.857 7.161 1.00 0.39 C ATOM 43 O PRO A 4 19.775 -4.008 6.369 1.00 0.50 O ATOM 44 CB PRO A 4 19.760 -4.823 9.632 1.00 0.39 C ATOM 45 CG PRO A 4 19.170 -3.533 10.132 1.00 0.44 C ATOM 46 CD PRO A 4 19.663 -2.431 9.231 1.00 0.41 C ATOM 0 HA PRO A 4 21.715 -4.950 8.617 1.00 0.39 H new ATOM 0 HB2 PRO A 4 18.981 -5.483 9.250 1.00 0.39 H new ATOM 0 HB3 PRO A 4 20.263 -5.357 10.438 1.00 0.39 H new ATOM 0 HG2 PRO A 4 18.081 -3.579 10.120 1.00 0.44 H new ATOM 0 HG3 PRO A 4 19.470 -3.348 11.163 1.00 0.44 H new ATOM 0 HD2 PRO A 4 18.925 -2.168 8.473 1.00 0.41 H new ATOM 0 HD3 PRO A 4 19.884 -1.521 9.789 1.00 0.41 H new ATOM 54 N ALA A 5 20.221 -6.151 6.891 1.00 0.37 N ATOM 55 CA ALA A 5 19.638 -6.693 5.675 1.00 0.45 C ATOM 56 C ALA A 5 18.124 -6.527 5.698 1.00 0.22 C ATOM 57 O ALA A 5 17.545 -6.315 6.761 1.00 0.43 O ATOM 58 CB ALA A 5 20.014 -8.155 5.518 1.00 0.76 C ATOM 0 H ALA A 5 20.639 -6.851 7.503 1.00 0.37 H new ATOM 0 HA ALA A 5 20.032 -6.143 4.820 1.00 0.45 H new ATOM 0 HB1 ALA A 5 19.571 -8.548 4.603 1.00 0.76 H new ATOM 0 HB2 ALA A 5 21.099 -8.248 5.465 1.00 0.76 H new ATOM 0 HB3 ALA A 5 19.643 -8.720 6.373 1.00 0.76 H new ATOM 64 N LYS A 6 17.503 -6.569 4.515 1.00 0.31 N ATOM 65 CA LYS A 6 16.044 -6.454 4.379 1.00 0.15 C ATOM 66 C LYS A 6 15.313 -7.282 5.441 1.00 0.14 C ATOM 67 O LYS A 6 15.192 -8.499 5.305 1.00 0.20 O ATOM 68 CB LYS A 6 15.579 -6.934 2.990 1.00 0.17 C ATOM 69 CG LYS A 6 16.531 -6.638 1.828 1.00 0.17 C ATOM 70 CD LYS A 6 16.898 -5.169 1.720 1.00 0.24 C ATOM 71 CE LYS A 6 15.683 -4.302 1.440 1.00 0.23 C ATOM 72 NZ LYS A 6 14.911 -4.804 0.277 1.00 0.66 N ATOM 0 H LYS A 6 17.993 -6.683 3.628 1.00 0.31 H new ATOM 0 HA LYS A 6 15.801 -5.399 4.510 1.00 0.15 H new ATOM 0 HB2 LYS A 6 15.415 -8.011 3.035 1.00 0.17 H new ATOM 0 HB3 LYS A 6 14.615 -6.474 2.771 1.00 0.17 H new ATOM 0 HG2 LYS A 6 17.441 -7.226 1.952 1.00 0.17 H new ATOM 0 HG3 LYS A 6 16.068 -6.960 0.895 1.00 0.17 H new ATOM 0 HD2 LYS A 6 17.371 -4.844 2.647 1.00 0.24 H new ATOM 0 HD3 LYS A 6 17.631 -5.035 0.924 1.00 0.24 H new ATOM 0 HE2 LYS A 6 15.041 -4.278 2.321 1.00 0.23 H new ATOM 0 HE3 LYS A 6 16.002 -3.277 1.251 1.00 0.23 H new ATOM 0 HZ1 LYS A 6 14.070 -4.208 0.135 1.00 0.66 H new ATOM 0 HZ2 LYS A 6 15.506 -4.771 -0.575 1.00 0.66 H new ATOM 0 HZ3 LYS A 6 14.614 -5.785 0.454 1.00 0.66 H new ATOM 86 N LEU A 7 14.829 -6.625 6.494 1.00 0.14 N ATOM 87 CA LEU A 7 14.088 -7.314 7.548 1.00 0.14 C ATOM 88 C LEU A 7 12.604 -7.328 7.215 1.00 0.13 C ATOM 89 O LEU A 7 12.011 -6.274 7.000 1.00 0.10 O ATOM 90 CB LEU A 7 14.310 -6.626 8.896 1.00 0.15 C ATOM 91 CG LEU A 7 15.760 -6.579 9.380 1.00 0.19 C ATOM 92 CD1 LEU A 7 15.882 -5.691 10.607 1.00 0.20 C ATOM 93 CD2 LEU A 7 16.264 -7.981 9.687 1.00 0.24 C ATOM 0 H LEU A 7 14.936 -5.621 6.639 1.00 0.14 H new ATOM 0 HA LEU A 7 14.452 -8.339 7.614 1.00 0.14 H new ATOM 0 HB2 LEU A 7 13.934 -5.605 8.829 1.00 0.15 H new ATOM 0 HB3 LEU A 7 13.710 -7.138 9.649 1.00 0.15 H new ATOM 0 HG LEU A 7 16.375 -6.157 8.585 1.00 0.19 H new ATOM 0 HD11 LEU A 7 16.920 -5.669 10.938 1.00 0.20 H new ATOM 0 HD12 LEU A 7 15.559 -4.680 10.358 1.00 0.20 H new ATOM 0 HD13 LEU A 7 15.255 -6.086 11.406 1.00 0.20 H new ATOM 0 HD21 LEU A 7 17.297 -7.929 10.030 1.00 0.24 H new ATOM 0 HD22 LEU A 7 15.645 -8.428 10.465 1.00 0.24 H new ATOM 0 HD23 LEU A 7 16.211 -8.592 8.786 1.00 0.24 H new ATOM 105 N ASP A 8 12.022 -8.525 7.175 1.00 0.21 N ATOM 106 CA ASP A 8 10.621 -8.711 6.781 1.00 0.24 C ATOM 107 C ASP A 8 9.687 -7.792 7.567 1.00 0.21 C ATOM 108 O ASP A 8 9.610 -7.864 8.795 1.00 0.29 O ATOM 109 CB ASP A 8 10.212 -10.174 6.973 1.00 0.37 C ATOM 110 CG ASP A 8 8.769 -10.436 6.590 1.00 0.52 C ATOM 111 OD1 ASP A 8 7.947 -10.707 7.495 1.00 0.64 O ATOM 112 OD2 ASP A 8 8.444 -10.347 5.387 1.00 0.65 O ATOM 0 H ASP A 8 12.503 -9.392 7.413 1.00 0.21 H new ATOM 0 HA ASP A 8 10.532 -8.447 5.727 1.00 0.24 H new ATOM 0 HB2 ASP A 8 10.863 -10.810 6.374 1.00 0.37 H new ATOM 0 HB3 ASP A 8 10.363 -10.455 8.015 1.00 0.37 H new ATOM 117 N LEU A 9 8.993 -6.925 6.840 1.00 0.18 N ATOM 118 CA LEU A 9 8.137 -5.911 7.437 1.00 0.16 C ATOM 119 C LEU A 9 6.705 -6.420 7.584 1.00 0.18 C ATOM 120 O LEU A 9 6.380 -7.522 7.136 1.00 0.26 O ATOM 121 CB LEU A 9 8.135 -4.662 6.555 1.00 0.13 C ATOM 122 CG LEU A 9 7.824 -3.347 7.272 1.00 0.14 C ATOM 123 CD1 LEU A 9 9.073 -2.802 7.934 1.00 0.13 C ATOM 124 CD2 LEU A 9 7.243 -2.335 6.307 1.00 0.20 C ATOM 0 H LEU A 9 9.009 -6.906 5.820 1.00 0.18 H new ATOM 0 HA LEU A 9 8.527 -5.674 8.427 1.00 0.16 H new ATOM 0 HB2 LEU A 9 9.112 -4.573 6.079 1.00 0.13 H new ATOM 0 HB3 LEU A 9 7.404 -4.803 5.759 1.00 0.13 H new ATOM 0 HG LEU A 9 7.080 -3.542 8.045 1.00 0.14 H new ATOM 0 HD11 LEU A 9 8.837 -1.866 8.441 1.00 0.13 H new ATOM 0 HD12 LEU A 9 9.444 -3.524 8.661 1.00 0.13 H new ATOM 0 HD13 LEU A 9 9.837 -2.623 7.178 1.00 0.13 H new ATOM 0 HD21 LEU A 9 7.029 -1.407 6.838 1.00 0.20 H new ATOM 0 HD22 LEU A 9 7.960 -2.140 5.509 1.00 0.20 H new ATOM 0 HD23 LEU A 9 6.321 -2.728 5.878 1.00 0.20 H new ATOM 136 N SER A 10 5.851 -5.618 8.203 1.00 0.18 N ATOM 137 CA SER A 10 4.442 -5.948 8.323 1.00 0.21 C ATOM 138 C SER A 10 3.756 -5.885 6.958 1.00 0.19 C ATOM 139 O SER A 10 3.052 -6.817 6.560 1.00 0.24 O ATOM 140 CB SER A 10 3.778 -4.989 9.305 1.00 0.25 C ATOM 141 OG SER A 10 4.497 -4.950 10.527 1.00 1.21 O ATOM 0 H SER A 10 6.113 -4.730 8.631 1.00 0.18 H new ATOM 0 HA SER A 10 4.344 -6.966 8.699 1.00 0.21 H new ATOM 0 HB2 SER A 10 3.732 -3.990 8.872 1.00 0.25 H new ATOM 0 HB3 SER A 10 2.751 -5.303 9.491 1.00 0.25 H new ATOM 0 HG SER A 10 4.058 -4.329 11.145 1.00 1.21 H new ATOM 147 N CYS A 11 3.969 -4.791 6.233 1.00 0.15 N ATOM 148 CA CYS A 11 3.444 -4.671 4.887 1.00 0.15 C ATOM 149 C CYS A 11 4.586 -4.724 3.888 1.00 0.14 C ATOM 150 O CYS A 11 5.450 -3.854 3.864 1.00 0.12 O ATOM 151 CB CYS A 11 2.646 -3.371 4.718 1.00 0.17 C ATOM 152 SG CYS A 11 3.597 -1.836 4.992 1.00 0.19 S ATOM 0 H CYS A 11 4.499 -3.982 6.557 1.00 0.15 H new ATOM 0 HA CYS A 11 2.765 -5.504 4.704 1.00 0.15 H new ATOM 0 HB2 CYS A 11 2.230 -3.347 3.711 1.00 0.17 H new ATOM 0 HB3 CYS A 11 1.804 -3.387 5.411 1.00 0.17 H new ATOM 157 N VAL A 12 4.624 -5.789 3.115 1.00 0.15 N ATOM 158 CA VAL A 12 5.564 -5.912 2.015 1.00 0.13 C ATOM 159 C VAL A 12 5.077 -6.967 1.039 1.00 0.16 C ATOM 160 O VAL A 12 4.712 -8.072 1.445 1.00 0.21 O ATOM 161 CB VAL A 12 7.007 -6.224 2.497 1.00 0.11 C ATOM 162 CG1 VAL A 12 6.999 -6.991 3.807 1.00 0.12 C ATOM 163 CG2 VAL A 12 7.785 -6.998 1.449 1.00 0.12 C ATOM 0 H VAL A 12 4.007 -6.593 3.229 1.00 0.15 H new ATOM 0 HA VAL A 12 5.610 -4.947 1.510 1.00 0.13 H new ATOM 0 HB VAL A 12 7.503 -5.267 2.659 1.00 0.11 H new ATOM 0 HG11 VAL A 12 8.024 -7.193 4.116 1.00 0.12 H new ATOM 0 HG12 VAL A 12 6.499 -6.398 4.573 1.00 0.12 H new ATOM 0 HG13 VAL A 12 6.468 -7.933 3.674 1.00 0.12 H new ATOM 0 HG21 VAL A 12 8.791 -7.200 1.818 1.00 0.12 H new ATOM 0 HG22 VAL A 12 7.278 -7.941 1.242 1.00 0.12 H new ATOM 0 HG23 VAL A 12 7.846 -6.410 0.533 1.00 0.12 H new ATOM 173 N HIS A 13 5.024 -6.602 -0.236 1.00 0.17 N ATOM 174 CA HIS A 13 4.662 -7.537 -1.297 1.00 0.24 C ATOM 175 C HIS A 13 5.428 -8.847 -1.159 1.00 0.37 C ATOM 176 O HIS A 13 4.835 -9.922 -1.117 1.00 0.98 O ATOM 177 CB HIS A 13 4.962 -6.920 -2.658 1.00 0.32 C ATOM 178 CG HIS A 13 3.813 -6.174 -3.241 1.00 0.47 C ATOM 179 ND1 HIS A 13 2.817 -6.771 -3.975 1.00 0.68 N ATOM 180 CD2 HIS A 13 3.504 -4.863 -3.193 1.00 0.83 C ATOM 181 CE1 HIS A 13 1.952 -5.856 -4.353 1.00 1.01 C ATOM 182 NE2 HIS A 13 2.344 -4.688 -3.886 1.00 1.09 N ATOM 0 H HIS A 13 5.229 -5.658 -0.563 1.00 0.17 H new ATOM 0 HA HIS A 13 3.596 -7.746 -1.212 1.00 0.24 H new ATOM 0 HB2 HIS A 13 5.812 -6.244 -2.562 1.00 0.32 H new ATOM 0 HB3 HIS A 13 5.259 -7.710 -3.348 1.00 0.32 H new ATOM 0 HD2 HIS A 13 4.073 -4.091 -2.696 1.00 0.83 H new ATOM 0 HE1 HIS A 13 1.068 -6.032 -4.947 1.00 1.01 H new ATOM 0 HE2 HIS A 13 1.860 -3.800 -4.021 1.00 1.09 H new ATOM 190 N SER A 14 6.757 -8.724 -1.094 1.00 0.37 N ATOM 191 CA SER A 14 7.667 -9.852 -0.878 1.00 0.35 C ATOM 192 C SER A 14 7.771 -10.750 -2.113 1.00 0.52 C ATOM 193 O SER A 14 8.865 -11.194 -2.463 1.00 1.14 O ATOM 194 CB SER A 14 7.264 -10.652 0.370 1.00 0.30 C ATOM 195 OG SER A 14 8.148 -11.735 0.599 1.00 1.16 O ATOM 0 H SER A 14 7.236 -7.829 -1.191 1.00 0.37 H new ATOM 0 HA SER A 14 8.661 -9.440 -0.705 1.00 0.35 H new ATOM 0 HB2 SER A 14 7.259 -9.994 1.239 1.00 0.30 H new ATOM 0 HB3 SER A 14 6.248 -11.029 0.250 1.00 0.30 H new ATOM 0 HG SER A 14 7.866 -12.224 1.400 1.00 1.16 H new ATOM 201 N ASP A 15 6.653 -10.981 -2.795 1.00 0.25 N ATOM 202 CA ASP A 15 6.636 -11.838 -3.980 1.00 0.31 C ATOM 203 C ASP A 15 7.080 -11.065 -5.227 1.00 0.28 C ATOM 204 O ASP A 15 6.531 -11.235 -6.315 1.00 0.55 O ATOM 205 CB ASP A 15 5.238 -12.429 -4.182 1.00 0.48 C ATOM 206 CG ASP A 15 5.238 -13.613 -5.131 1.00 1.66 C ATOM 207 OD1 ASP A 15 4.723 -13.473 -6.261 1.00 2.50 O ATOM 208 OD2 ASP A 15 5.768 -14.682 -4.764 1.00 2.26 O ATOM 0 H ASP A 15 5.745 -10.587 -2.548 1.00 0.25 H new ATOM 0 HA ASP A 15 7.343 -12.652 -3.824 1.00 0.31 H new ATOM 0 HB2 ASP A 15 4.836 -12.741 -3.218 1.00 0.48 H new ATOM 0 HB3 ASP A 15 4.573 -11.657 -4.570 1.00 0.48 H new ATOM 213 N ASN A 16 8.074 -10.202 -5.039 1.00 0.23 N ATOM 214 CA ASN A 16 8.719 -9.462 -6.127 1.00 0.21 C ATOM 215 C ASN A 16 7.747 -8.505 -6.823 1.00 0.19 C ATOM 216 O ASN A 16 7.185 -8.817 -7.875 1.00 0.22 O ATOM 217 CB ASN A 16 9.360 -10.421 -7.149 1.00 0.23 C ATOM 218 CG ASN A 16 10.294 -11.432 -6.511 1.00 1.06 C ATOM 219 OD1 ASN A 16 10.919 -11.162 -5.486 1.00 2.09 O ATOM 220 ND2 ASN A 16 10.410 -12.600 -7.122 1.00 0.95 N ATOM 0 H ASN A 16 8.461 -9.992 -4.119 1.00 0.23 H new ATOM 0 HA ASN A 16 9.509 -8.860 -5.677 1.00 0.21 H new ATOM 0 HB2 ASN A 16 8.572 -10.951 -7.685 1.00 0.23 H new ATOM 0 HB3 ASN A 16 9.913 -9.840 -7.887 1.00 0.23 H new ATOM 0 HD21 ASN A 16 11.034 -13.313 -6.745 1.00 0.95 H new ATOM 0 HD22 ASN A 16 9.875 -12.787 -7.970 1.00 0.95 H new ATOM 227 N LYS A 17 7.572 -7.323 -6.239 1.00 0.19 N ATOM 228 CA LYS A 17 6.715 -6.292 -6.817 1.00 0.19 C ATOM 229 C LYS A 17 7.263 -4.899 -6.572 1.00 0.21 C ATOM 230 O LYS A 17 7.837 -4.615 -5.522 1.00 0.28 O ATOM 231 CB LYS A 17 5.306 -6.345 -6.231 1.00 0.23 C ATOM 232 CG LYS A 17 4.429 -7.465 -6.746 1.00 0.25 C ATOM 233 CD LYS A 17 3.927 -7.180 -8.148 1.00 0.25 C ATOM 234 CE LYS A 17 2.738 -8.057 -8.471 1.00 0.43 C ATOM 235 NZ LYS A 17 2.429 -8.087 -9.923 1.00 0.93 N ATOM 0 H LYS A 17 8.015 -7.054 -5.361 1.00 0.19 H new ATOM 0 HA LYS A 17 6.686 -6.494 -7.888 1.00 0.19 H new ATOM 0 HB2 LYS A 17 5.385 -6.437 -5.148 1.00 0.23 H new ATOM 0 HB3 LYS A 17 4.810 -5.396 -6.435 1.00 0.23 H new ATOM 0 HG2 LYS A 17 4.991 -8.399 -6.743 1.00 0.25 H new ATOM 0 HG3 LYS A 17 3.580 -7.601 -6.076 1.00 0.25 H new ATOM 0 HD2 LYS A 17 3.647 -6.130 -8.234 1.00 0.25 H new ATOM 0 HD3 LYS A 17 4.724 -7.357 -8.870 1.00 0.25 H new ATOM 0 HE2 LYS A 17 2.934 -9.071 -8.124 1.00 0.43 H new ATOM 0 HE3 LYS A 17 1.866 -7.697 -7.925 1.00 0.43 H new ATOM 0 HZ1 LYS A 17 1.425 -8.319 -10.059 1.00 0.93 H new ATOM 0 HZ2 LYS A 17 2.628 -7.155 -10.340 1.00 0.93 H new ATOM 0 HZ3 LYS A 17 3.017 -8.807 -10.388 1.00 0.93 H new ATOM 249 N GLY A 18 7.045 -4.033 -7.540 1.00 0.19 N ATOM 250 CA GLY A 18 7.385 -2.639 -7.391 1.00 0.20 C ATOM 251 C GLY A 18 6.208 -1.769 -7.750 1.00 0.15 C ATOM 252 O GLY A 18 5.123 -2.291 -8.003 1.00 0.15 O ATOM 0 H GLY A 18 6.632 -4.274 -8.441 1.00 0.19 H new ATOM 0 HA2 GLY A 18 7.692 -2.441 -6.364 1.00 0.20 H new ATOM 0 HA3 GLY A 18 8.234 -2.395 -8.030 1.00 0.20 H new ATOM 256 N SER A 19 6.395 -0.460 -7.791 1.00 0.19 N ATOM 257 CA SER A 19 5.295 0.432 -8.080 1.00 0.18 C ATOM 258 C SER A 19 5.776 1.638 -8.858 1.00 0.22 C ATOM 259 O SER A 19 6.745 2.276 -8.476 1.00 0.36 O ATOM 260 CB SER A 19 4.651 0.861 -6.772 1.00 0.21 C ATOM 261 OG SER A 19 5.643 1.173 -5.809 1.00 1.22 O ATOM 0 H SER A 19 7.290 0.001 -7.629 1.00 0.19 H new ATOM 0 HA SER A 19 4.559 -0.087 -8.694 1.00 0.18 H new ATOM 0 HB2 SER A 19 4.014 1.729 -6.941 1.00 0.21 H new ATOM 0 HB3 SER A 19 4.010 0.063 -6.397 1.00 0.21 H new ATOM 0 HG SER A 19 6.341 1.722 -6.224 1.00 1.22 H new ATOM 267 N ARG A 20 5.101 1.944 -9.949 1.00 0.18 N ATOM 268 CA ARG A 20 5.517 3.041 -10.801 1.00 0.20 C ATOM 269 C ARG A 20 5.133 4.361 -10.166 1.00 0.17 C ATOM 270 O ARG A 20 3.960 4.607 -9.869 1.00 0.16 O ATOM 271 CB ARG A 20 4.899 2.907 -12.186 1.00 0.24 C ATOM 272 CG ARG A 20 4.973 1.495 -12.720 1.00 0.31 C ATOM 273 CD ARG A 20 4.913 1.464 -14.230 1.00 0.40 C ATOM 274 NE ARG A 20 4.950 0.097 -14.746 1.00 0.58 N ATOM 275 CZ ARG A 20 6.027 -0.469 -15.291 1.00 0.97 C ATOM 276 NH1 ARG A 20 7.168 0.207 -15.380 1.00 2.03 N ATOM 277 NH2 ARG A 20 5.964 -1.716 -15.741 1.00 0.92 N ATOM 0 H ARG A 20 4.266 1.451 -10.265 1.00 0.18 H new ATOM 0 HA ARG A 20 6.601 3.010 -10.912 1.00 0.20 H new ATOM 0 HB2 ARG A 20 3.856 3.223 -12.147 1.00 0.24 H new ATOM 0 HB3 ARG A 20 5.410 3.580 -12.875 1.00 0.24 H new ATOM 0 HG2 ARG A 20 5.898 1.027 -12.383 1.00 0.31 H new ATOM 0 HG3 ARG A 20 4.151 0.908 -12.311 1.00 0.31 H new ATOM 0 HD2 ARG A 20 4.001 1.956 -14.568 1.00 0.40 H new ATOM 0 HD3 ARG A 20 5.750 2.030 -14.639 1.00 0.40 H new ATOM 0 HE ARG A 20 4.097 -0.459 -14.685 1.00 0.58 H new ATOM 0 HH11 ARG A 20 7.223 1.164 -15.030 1.00 2.03 H new ATOM 0 HH12 ARG A 20 7.989 -0.231 -15.798 1.00 2.03 H new ATOM 0 HH21 ARG A 20 5.092 -2.240 -15.670 1.00 0.92 H new ATOM 0 HH22 ARG A 20 6.787 -2.150 -16.158 1.00 0.92 H new ATOM 291 N ALA A 21 6.137 5.194 -9.961 1.00 0.17 N ATOM 292 CA ALA A 21 5.984 6.465 -9.277 1.00 0.15 C ATOM 293 C ALA A 21 7.359 7.103 -9.136 1.00 0.17 C ATOM 294 O ALA A 21 8.369 6.394 -9.137 1.00 0.20 O ATOM 295 CB ALA A 21 5.330 6.262 -7.913 1.00 0.17 C ATOM 0 H ALA A 21 7.091 5.005 -10.268 1.00 0.17 H new ATOM 0 HA ALA A 21 5.335 7.125 -9.853 1.00 0.15 H new ATOM 0 HB1 ALA A 21 5.223 7.225 -7.414 1.00 0.17 H new ATOM 0 HB2 ALA A 21 4.347 5.810 -8.045 1.00 0.17 H new ATOM 0 HB3 ALA A 21 5.953 5.606 -7.305 1.00 0.17 H new ATOM 301 N PRO A 22 7.430 8.438 -9.029 1.00 0.17 N ATOM 302 CA PRO A 22 8.706 9.146 -8.967 1.00 0.18 C ATOM 303 C PRO A 22 9.453 8.855 -7.680 1.00 0.16 C ATOM 304 O PRO A 22 8.882 8.942 -6.590 1.00 0.16 O ATOM 305 CB PRO A 22 8.312 10.629 -9.022 1.00 0.21 C ATOM 306 CG PRO A 22 6.884 10.643 -9.454 1.00 0.22 C ATOM 307 CD PRO A 22 6.295 9.365 -8.941 1.00 0.21 C ATOM 0 HA PRO A 22 9.374 8.843 -9.774 1.00 0.18 H new ATOM 0 HB2 PRO A 22 8.433 11.104 -8.048 1.00 0.21 H new ATOM 0 HB3 PRO A 22 8.940 11.177 -9.724 1.00 0.21 H new ATOM 0 HG2 PRO A 22 6.360 11.507 -9.047 1.00 0.22 H new ATOM 0 HG3 PRO A 22 6.803 10.704 -10.539 1.00 0.22 H new ATOM 0 HD2 PRO A 22 5.932 9.467 -7.918 1.00 0.21 H new ATOM 0 HD3 PRO A 22 5.452 9.034 -9.547 1.00 0.21 H new ATOM 315 N THR A 23 10.719 8.492 -7.805 1.00 0.16 N ATOM 316 CA THR A 23 11.549 8.280 -6.640 1.00 0.15 C ATOM 317 C THR A 23 11.913 9.619 -6.024 1.00 0.14 C ATOM 318 O THR A 23 12.695 10.391 -6.584 1.00 0.18 O ATOM 319 CB THR A 23 12.824 7.491 -6.981 1.00 0.17 C ATOM 320 OG1 THR A 23 12.462 6.219 -7.534 1.00 0.18 O ATOM 321 CG2 THR A 23 13.690 7.284 -5.740 1.00 0.17 C ATOM 0 H THR A 23 11.188 8.340 -8.698 1.00 0.16 H new ATOM 0 HA THR A 23 10.979 7.687 -5.925 1.00 0.15 H new ATOM 0 HB THR A 23 13.401 8.062 -7.708 1.00 0.17 H new ATOM 0 HG1 THR A 23 13.200 5.586 -7.409 1.00 0.18 H new ATOM 0 HG21 THR A 23 14.585 6.723 -6.010 1.00 0.17 H new ATOM 0 HG22 THR A 23 13.978 8.253 -5.332 1.00 0.17 H new ATOM 0 HG23 THR A 23 13.126 6.728 -4.991 1.00 0.17 H new ATOM 329 N ILE A 24 11.294 9.899 -4.898 1.00 0.12 N ATOM 330 CA ILE A 24 11.505 11.139 -4.183 1.00 0.12 C ATOM 331 C ILE A 24 12.930 11.211 -3.661 1.00 0.14 C ATOM 332 O ILE A 24 13.359 10.355 -2.887 1.00 0.15 O ATOM 333 CB ILE A 24 10.527 11.256 -3.009 1.00 0.11 C ATOM 334 CG1 ILE A 24 9.126 10.866 -3.454 1.00 0.11 C ATOM 335 CG2 ILE A 24 10.529 12.671 -2.464 1.00 0.13 C ATOM 336 CD1 ILE A 24 8.143 10.773 -2.314 1.00 0.13 C ATOM 0 H ILE A 24 10.627 9.270 -4.450 1.00 0.12 H new ATOM 0 HA ILE A 24 11.332 11.963 -4.875 1.00 0.12 H new ATOM 0 HB ILE A 24 10.846 10.577 -2.218 1.00 0.11 H new ATOM 0 HG12 ILE A 24 8.765 11.597 -4.177 1.00 0.11 H new ATOM 0 HG13 ILE A 24 9.169 9.905 -3.967 1.00 0.11 H new ATOM 0 HG21 ILE A 24 9.830 12.741 -1.630 1.00 0.13 H new ATOM 0 HG22 ILE A 24 11.531 12.927 -2.120 1.00 0.13 H new ATOM 0 HG23 ILE A 24 10.227 13.364 -3.249 1.00 0.13 H new ATOM 0 HD11 ILE A 24 7.164 10.491 -2.700 1.00 0.13 H new ATOM 0 HD12 ILE A 24 8.482 10.021 -1.601 1.00 0.13 H new ATOM 0 HD13 ILE A 24 8.072 11.740 -1.815 1.00 0.13 H new ATOM 348 N GLY A 25 13.657 12.227 -4.091 1.00 0.14 N ATOM 349 CA GLY A 25 15.052 12.343 -3.717 1.00 0.16 C ATOM 350 C GLY A 25 15.887 11.234 -4.328 1.00 0.16 C ATOM 351 O GLY A 25 15.718 10.903 -5.505 1.00 0.24 O ATOM 0 H GLY A 25 13.309 12.974 -4.692 1.00 0.14 H new ATOM 0 HA2 GLY A 25 15.437 13.310 -4.041 1.00 0.16 H new ATOM 0 HA3 GLY A 25 15.142 12.311 -2.631 1.00 0.16 H new ATOM 355 N GLU A 26 16.779 10.656 -3.541 1.00 0.17 N ATOM 356 CA GLU A 26 17.577 9.530 -3.994 1.00 0.16 C ATOM 357 C GLU A 26 17.355 8.316 -3.094 1.00 0.16 C ATOM 358 O GLU A 26 17.016 8.461 -1.918 1.00 0.21 O ATOM 359 CB GLU A 26 19.060 9.920 -4.086 1.00 0.26 C ATOM 360 CG GLU A 26 19.604 10.732 -2.913 1.00 1.20 C ATOM 361 CD GLU A 26 19.957 9.896 -1.699 1.00 1.83 C ATOM 362 OE1 GLU A 26 19.237 9.977 -0.681 1.00 2.41 O ATOM 363 OE2 GLU A 26 20.934 9.123 -1.768 1.00 2.09 O ATOM 0 H GLU A 26 16.969 10.949 -2.583 1.00 0.17 H new ATOM 0 HA GLU A 26 17.254 9.251 -4.997 1.00 0.16 H new ATOM 0 HB2 GLU A 26 19.651 9.009 -4.179 1.00 0.26 H new ATOM 0 HB3 GLU A 26 19.210 10.492 -5.001 1.00 0.26 H new ATOM 0 HG2 GLU A 26 20.492 11.274 -3.239 1.00 1.20 H new ATOM 0 HG3 GLU A 26 18.863 11.478 -2.625 1.00 1.20 H new ATOM 370 N PRO A 27 17.501 7.097 -3.644 1.00 0.13 N ATOM 371 CA PRO A 27 17.235 5.865 -2.911 1.00 0.13 C ATOM 372 C PRO A 27 18.301 5.544 -1.876 1.00 0.14 C ATOM 373 O PRO A 27 19.440 6.005 -1.964 1.00 0.20 O ATOM 374 CB PRO A 27 17.206 4.774 -3.986 1.00 0.14 C ATOM 375 CG PRO A 27 17.326 5.476 -5.298 1.00 0.14 C ATOM 376 CD PRO A 27 17.935 6.818 -5.017 1.00 0.14 C ATOM 0 HA PRO A 27 16.305 5.949 -2.348 1.00 0.13 H new ATOM 0 HB2 PRO A 27 18.025 4.068 -3.846 1.00 0.14 H new ATOM 0 HB3 PRO A 27 16.280 4.202 -3.934 1.00 0.14 H new ATOM 0 HG2 PRO A 27 17.949 4.905 -5.986 1.00 0.14 H new ATOM 0 HG3 PRO A 27 16.349 5.586 -5.769 1.00 0.14 H new ATOM 0 HD2 PRO A 27 19.022 6.793 -5.100 1.00 0.14 H new ATOM 0 HD3 PRO A 27 17.580 7.576 -5.715 1.00 0.14 H new ATOM 384 N VAL A 28 17.915 4.740 -0.902 1.00 0.13 N ATOM 385 CA VAL A 28 18.810 4.334 0.169 1.00 0.13 C ATOM 386 C VAL A 28 19.222 2.887 -0.023 1.00 0.13 C ATOM 387 O VAL A 28 18.421 1.985 0.198 1.00 0.10 O ATOM 388 CB VAL A 28 18.130 4.443 1.540 1.00 0.13 C ATOM 389 CG1 VAL A 28 19.154 4.749 2.616 1.00 0.16 C ATOM 390 CG2 VAL A 28 17.026 5.483 1.521 1.00 0.14 C ATOM 0 H VAL A 28 16.975 4.350 -0.830 1.00 0.13 H new ATOM 0 HA VAL A 28 19.675 4.997 0.136 1.00 0.13 H new ATOM 0 HB VAL A 28 17.670 3.482 1.771 1.00 0.13 H new ATOM 0 HG11 VAL A 28 18.655 4.823 3.582 1.00 0.16 H new ATOM 0 HG12 VAL A 28 19.895 3.951 2.650 1.00 0.16 H new ATOM 0 HG13 VAL A 28 19.649 5.694 2.390 1.00 0.16 H new ATOM 0 HG21 VAL A 28 16.562 5.539 2.506 1.00 0.14 H new ATOM 0 HG22 VAL A 28 17.446 6.455 1.262 1.00 0.14 H new ATOM 0 HG23 VAL A 28 16.276 5.204 0.781 1.00 0.14 H new ATOM 400 N PRO A 29 20.455 2.632 -0.443 1.00 0.17 N ATOM 401 CA PRO A 29 20.919 1.279 -0.685 1.00 0.17 C ATOM 402 C PRO A 29 21.406 0.589 0.574 1.00 0.17 C ATOM 403 O PRO A 29 21.870 1.241 1.518 1.00 0.20 O ATOM 404 CB PRO A 29 22.055 1.493 -1.654 1.00 0.20 C ATOM 405 CG PRO A 29 22.659 2.781 -1.210 1.00 0.23 C ATOM 406 CD PRO A 29 21.506 3.628 -0.718 1.00 0.21 C ATOM 0 HA PRO A 29 20.127 0.629 -1.057 1.00 0.17 H new ATOM 0 HB2 PRO A 29 22.776 0.677 -1.612 1.00 0.20 H new ATOM 0 HB3 PRO A 29 21.699 1.551 -2.682 1.00 0.20 H new ATOM 0 HG2 PRO A 29 23.390 2.618 -0.418 1.00 0.23 H new ATOM 0 HG3 PRO A 29 23.182 3.271 -2.031 1.00 0.23 H new ATOM 0 HD2 PRO A 29 21.772 4.191 0.177 1.00 0.21 H new ATOM 0 HD3 PRO A 29 21.189 4.352 -1.468 1.00 0.21 H new ATOM 414 N ASP A 30 21.285 -0.729 0.569 1.00 0.17 N ATOM 415 CA ASP A 30 21.741 -1.564 1.666 1.00 0.20 C ATOM 416 C ASP A 30 20.998 -1.207 2.952 1.00 0.18 C ATOM 417 O ASP A 30 21.600 -0.897 3.979 1.00 0.28 O ATOM 418 CB ASP A 30 23.254 -1.416 1.835 1.00 0.27 C ATOM 419 CG ASP A 30 23.859 -2.536 2.654 1.00 0.37 C ATOM 420 OD1 ASP A 30 24.064 -3.639 2.099 1.00 0.47 O ATOM 421 OD2 ASP A 30 24.144 -2.322 3.850 1.00 0.48 O ATOM 0 H ASP A 30 20.866 -1.251 -0.200 1.00 0.17 H new ATOM 0 HA ASP A 30 21.523 -2.608 1.439 1.00 0.20 H new ATOM 0 HB2 ASP A 30 23.725 -1.393 0.852 1.00 0.27 H new ATOM 0 HB3 ASP A 30 23.471 -0.462 2.315 1.00 0.27 H new ATOM 426 N VAL A 31 19.671 -1.252 2.879 1.00 0.12 N ATOM 427 CA VAL A 31 18.827 -0.893 4.010 1.00 0.12 C ATOM 428 C VAL A 31 17.756 -1.939 4.214 1.00 0.12 C ATOM 429 O VAL A 31 17.451 -2.718 3.316 1.00 0.13 O ATOM 430 CB VAL A 31 18.158 0.494 3.843 1.00 0.12 C ATOM 431 CG1 VAL A 31 19.213 1.554 3.609 1.00 0.14 C ATOM 432 CG2 VAL A 31 17.114 0.506 2.727 1.00 0.10 C ATOM 0 H VAL A 31 19.157 -1.535 2.045 1.00 0.12 H new ATOM 0 HA VAL A 31 19.480 -0.843 4.882 1.00 0.12 H new ATOM 0 HB VAL A 31 17.627 0.717 4.768 1.00 0.12 H new ATOM 0 HG11 VAL A 31 18.733 2.526 3.493 1.00 0.14 H new ATOM 0 HG12 VAL A 31 19.893 1.585 4.460 1.00 0.14 H new ATOM 0 HG13 VAL A 31 19.774 1.316 2.705 1.00 0.14 H new ATOM 0 HG21 VAL A 31 16.675 1.501 2.651 1.00 0.10 H new ATOM 0 HG22 VAL A 31 17.589 0.246 1.781 1.00 0.10 H new ATOM 0 HG23 VAL A 31 16.332 -0.220 2.952 1.00 0.10 H new ATOM 442 N SER A 32 17.192 -1.947 5.399 1.00 0.16 N ATOM 443 CA SER A 32 16.175 -2.905 5.750 1.00 0.16 C ATOM 444 C SER A 32 14.811 -2.399 5.303 1.00 0.16 C ATOM 445 O SER A 32 14.674 -1.222 4.961 1.00 0.18 O ATOM 446 CB SER A 32 16.209 -3.142 7.258 1.00 0.18 C ATOM 447 OG SER A 32 15.073 -3.857 7.705 1.00 0.19 O ATOM 0 H SER A 32 17.426 -1.291 6.144 1.00 0.16 H new ATOM 0 HA SER A 32 16.364 -3.852 5.244 1.00 0.16 H new ATOM 0 HB2 SER A 32 17.112 -3.695 7.518 1.00 0.18 H new ATOM 0 HB3 SER A 32 16.262 -2.184 7.775 1.00 0.18 H new ATOM 0 HG SER A 32 14.912 -3.657 8.651 1.00 0.19 H new ATOM 453 N LEU A 33 13.808 -3.265 5.301 1.00 0.14 N ATOM 454 CA LEU A 33 12.459 -2.840 4.970 1.00 0.14 C ATOM 455 C LEU A 33 12.019 -1.840 6.009 1.00 0.13 C ATOM 456 O LEU A 33 11.408 -0.824 5.705 1.00 0.13 O ATOM 457 CB LEU A 33 11.488 -4.025 4.950 1.00 0.14 C ATOM 458 CG LEU A 33 11.942 -5.240 4.141 1.00 0.14 C ATOM 459 CD1 LEU A 33 10.788 -6.211 3.946 1.00 0.16 C ATOM 460 CD2 LEU A 33 12.517 -4.808 2.810 1.00 0.14 C ATOM 0 H LEU A 33 13.902 -4.256 5.523 1.00 0.14 H new ATOM 0 HA LEU A 33 12.456 -2.396 3.974 1.00 0.14 H new ATOM 0 HB2 LEU A 33 11.309 -4.342 5.977 1.00 0.14 H new ATOM 0 HB3 LEU A 33 10.533 -3.682 4.551 1.00 0.14 H new ATOM 0 HG LEU A 33 12.727 -5.753 4.697 1.00 0.14 H new ATOM 0 HD11 LEU A 33 11.129 -7.070 3.368 1.00 0.16 H new ATOM 0 HD12 LEU A 33 10.428 -6.548 4.918 1.00 0.16 H new ATOM 0 HD13 LEU A 33 9.979 -5.712 3.412 1.00 0.16 H new ATOM 0 HD21 LEU A 33 12.835 -5.687 2.248 1.00 0.14 H new ATOM 0 HD22 LEU A 33 11.757 -4.270 2.243 1.00 0.14 H new ATOM 0 HD23 LEU A 33 13.374 -4.156 2.978 1.00 0.14 H new ATOM 472 N GLU A 34 12.413 -2.122 7.235 1.00 0.14 N ATOM 473 CA GLU A 34 12.057 -1.299 8.368 1.00 0.14 C ATOM 474 C GLU A 34 12.789 0.041 8.311 1.00 0.14 C ATOM 475 O GLU A 34 12.240 1.076 8.686 1.00 0.19 O ATOM 476 CB GLU A 34 12.377 -2.049 9.657 1.00 0.15 C ATOM 477 CG GLU A 34 12.138 -3.551 9.556 1.00 0.16 C ATOM 478 CD GLU A 34 11.975 -4.207 10.913 1.00 0.23 C ATOM 479 OE1 GLU A 34 10.836 -4.585 11.260 1.00 0.43 O ATOM 480 OE2 GLU A 34 12.976 -4.328 11.648 1.00 0.43 O ATOM 0 H GLU A 34 12.990 -2.930 7.471 1.00 0.14 H new ATOM 0 HA GLU A 34 10.988 -1.088 8.341 1.00 0.14 H new ATOM 0 HB2 GLU A 34 13.419 -1.871 9.924 1.00 0.15 H new ATOM 0 HB3 GLU A 34 11.768 -1.645 10.465 1.00 0.15 H new ATOM 0 HG2 GLU A 34 11.245 -3.734 8.958 1.00 0.16 H new ATOM 0 HG3 GLU A 34 12.973 -4.014 9.031 1.00 0.16 H new ATOM 487 N GLN A 35 14.024 0.021 7.812 1.00 0.13 N ATOM 488 CA GLN A 35 14.790 1.250 7.634 1.00 0.14 C ATOM 489 C GLN A 35 14.230 2.066 6.478 1.00 0.12 C ATOM 490 O GLN A 35 14.134 3.290 6.554 1.00 0.15 O ATOM 491 CB GLN A 35 16.275 0.959 7.383 1.00 0.17 C ATOM 492 CG GLN A 35 17.055 2.208 7.005 1.00 0.24 C ATOM 493 CD GLN A 35 18.542 2.096 7.255 1.00 0.69 C ATOM 494 OE1 GLN A 35 19.219 3.095 7.495 1.00 1.45 O ATOM 495 NE2 GLN A 35 19.063 0.884 7.215 1.00 0.67 N ATOM 0 H GLN A 35 14.512 -0.828 7.526 1.00 0.13 H new ATOM 0 HA GLN A 35 14.703 1.822 8.558 1.00 0.14 H new ATOM 0 HB2 GLN A 35 16.712 0.518 8.279 1.00 0.17 H new ATOM 0 HB3 GLN A 35 16.368 0.221 6.586 1.00 0.17 H new ATOM 0 HG2 GLN A 35 16.888 2.424 5.950 1.00 0.24 H new ATOM 0 HG3 GLN A 35 16.664 3.054 7.569 1.00 0.24 H new ATOM 0 HE21 GLN A 35 18.469 0.080 7.013 1.00 0.67 H new ATOM 0 HE22 GLN A 35 20.060 0.751 7.386 1.00 0.67 H new ATOM 504 N CYS A 36 13.865 1.387 5.408 1.00 0.10 N ATOM 505 CA CYS A 36 13.297 2.056 4.251 1.00 0.09 C ATOM 506 C CYS A 36 11.897 2.575 4.571 1.00 0.10 C ATOM 507 O CYS A 36 11.475 3.617 4.071 1.00 0.10 O ATOM 508 CB CYS A 36 13.259 1.124 3.050 1.00 0.08 C ATOM 509 SG CYS A 36 12.368 1.817 1.621 1.00 0.08 S ATOM 0 H CYS A 36 13.951 0.375 5.314 1.00 0.10 H new ATOM 0 HA CYS A 36 13.934 2.904 4.001 1.00 0.09 H new ATOM 0 HB2 CYS A 36 14.280 0.887 2.751 1.00 0.08 H new ATOM 0 HB3 CYS A 36 12.787 0.186 3.343 1.00 0.08 H new ATOM 514 N ALA A 37 11.185 1.847 5.420 1.00 0.11 N ATOM 515 CA ALA A 37 9.898 2.302 5.916 1.00 0.12 C ATOM 516 C ALA A 37 10.079 3.597 6.700 1.00 0.14 C ATOM 517 O ALA A 37 9.265 4.519 6.612 1.00 0.16 O ATOM 518 CB ALA A 37 9.252 1.224 6.780 1.00 0.14 C ATOM 0 H ALA A 37 11.479 0.938 5.779 1.00 0.11 H new ATOM 0 HA ALA A 37 9.235 2.497 5.073 1.00 0.12 H new ATOM 0 HB1 ALA A 37 8.288 1.579 7.145 1.00 0.14 H new ATOM 0 HB2 ALA A 37 9.105 0.322 6.187 1.00 0.14 H new ATOM 0 HB3 ALA A 37 9.900 1.000 7.627 1.00 0.14 H new ATOM 524 N ALA A 38 11.182 3.665 7.436 1.00 0.15 N ATOM 525 CA ALA A 38 11.541 4.859 8.182 1.00 0.16 C ATOM 526 C ALA A 38 11.965 5.971 7.228 1.00 0.15 C ATOM 527 O ALA A 38 11.815 7.154 7.524 1.00 0.19 O ATOM 528 CB ALA A 38 12.664 4.539 9.159 1.00 0.19 C ATOM 0 H ALA A 38 11.847 2.898 7.531 1.00 0.15 H new ATOM 0 HA ALA A 38 10.672 5.201 8.744 1.00 0.16 H new ATOM 0 HB1 ALA A 38 12.929 5.438 9.716 1.00 0.19 H new ATOM 0 HB2 ALA A 38 12.333 3.767 9.853 1.00 0.19 H new ATOM 0 HB3 ALA A 38 13.535 4.183 8.608 1.00 0.19 H new ATOM 534 N GLN A 39 12.489 5.570 6.077 1.00 0.11 N ATOM 535 CA GLN A 39 12.916 6.502 5.040 1.00 0.10 C ATOM 536 C GLN A 39 11.728 7.266 4.477 1.00 0.10 C ATOM 537 O GLN A 39 11.794 8.477 4.283 1.00 0.11 O ATOM 538 CB GLN A 39 13.634 5.734 3.924 1.00 0.09 C ATOM 539 CG GLN A 39 13.981 6.562 2.700 1.00 0.10 C ATOM 540 CD GLN A 39 14.765 7.816 3.030 1.00 0.13 C ATOM 541 OE1 GLN A 39 15.519 7.855 4.002 1.00 0.43 O ATOM 542 NE2 GLN A 39 14.590 8.849 2.219 1.00 0.47 N ATOM 0 H GLN A 39 12.630 4.589 5.835 1.00 0.11 H new ATOM 0 HA GLN A 39 13.603 7.225 5.479 1.00 0.10 H new ATOM 0 HB2 GLN A 39 14.552 5.308 4.329 1.00 0.09 H new ATOM 0 HB3 GLN A 39 13.005 4.900 3.614 1.00 0.09 H new ATOM 0 HG2 GLN A 39 14.560 5.951 2.008 1.00 0.10 H new ATOM 0 HG3 GLN A 39 13.061 6.841 2.186 1.00 0.10 H new ATOM 0 HE21 GLN A 39 13.955 8.772 1.425 1.00 0.47 H new ATOM 0 HE22 GLN A 39 15.091 9.721 2.389 1.00 0.47 H new ATOM 551 N CYS A 40 10.638 6.561 4.237 1.00 0.10 N ATOM 552 CA CYS A 40 9.435 7.179 3.698 1.00 0.11 C ATOM 553 C CYS A 40 8.790 8.081 4.742 1.00 0.14 C ATOM 554 O CYS A 40 7.999 8.966 4.420 1.00 0.17 O ATOM 555 CB CYS A 40 8.471 6.095 3.225 1.00 0.12 C ATOM 556 SG CYS A 40 6.886 6.699 2.558 1.00 0.16 S ATOM 0 H CYS A 40 10.558 5.558 4.406 1.00 0.10 H new ATOM 0 HA CYS A 40 9.698 7.801 2.843 1.00 0.11 H new ATOM 0 HB2 CYS A 40 8.967 5.501 2.457 1.00 0.12 H new ATOM 0 HB3 CYS A 40 8.264 5.427 4.061 1.00 0.12 H new ATOM 561 N LYS A 41 9.152 7.862 6.000 1.00 0.14 N ATOM 562 CA LYS A 41 8.709 8.732 7.075 1.00 0.18 C ATOM 563 C LYS A 41 9.698 9.880 7.274 1.00 0.19 C ATOM 564 O LYS A 41 9.399 10.862 7.951 1.00 0.27 O ATOM 565 CB LYS A 41 8.553 7.935 8.369 1.00 0.20 C ATOM 566 CG LYS A 41 7.544 6.806 8.264 1.00 0.22 C ATOM 567 CD LYS A 41 7.512 5.969 9.531 1.00 0.28 C ATOM 568 CE LYS A 41 6.643 4.734 9.359 1.00 0.32 C ATOM 569 NZ LYS A 41 5.209 5.076 9.148 1.00 1.15 N ATOM 0 H LYS A 41 9.750 7.091 6.297 1.00 0.14 H new ATOM 0 HA LYS A 41 7.741 9.153 6.805 1.00 0.18 H new ATOM 0 HB2 LYS A 41 9.521 7.522 8.651 1.00 0.20 H new ATOM 0 HB3 LYS A 41 8.249 8.611 9.169 1.00 0.20 H new ATOM 0 HG2 LYS A 41 6.553 7.219 8.074 1.00 0.22 H new ATOM 0 HG3 LYS A 41 7.793 6.171 7.414 1.00 0.22 H new ATOM 0 HD2 LYS A 41 8.526 5.668 9.796 1.00 0.28 H new ATOM 0 HD3 LYS A 41 7.132 6.571 10.357 1.00 0.28 H new ATOM 0 HE2 LYS A 41 7.004 4.154 8.510 1.00 0.32 H new ATOM 0 HE3 LYS A 41 6.737 4.101 10.241 1.00 0.32 H new ATOM 0 HZ1 LYS A 41 4.654 4.771 9.973 1.00 1.15 H new ATOM 0 HZ2 LYS A 41 5.112 6.104 9.026 1.00 1.15 H new ATOM 0 HZ3 LYS A 41 4.858 4.592 8.297 1.00 1.15 H new ATOM 583 N ALA A 42 10.880 9.750 6.683 1.00 0.16 N ATOM 584 CA ALA A 42 11.895 10.787 6.762 1.00 0.17 C ATOM 585 C ALA A 42 11.706 11.817 5.654 1.00 0.16 C ATOM 586 O ALA A 42 12.046 12.990 5.816 1.00 0.19 O ATOM 587 CB ALA A 42 13.279 10.168 6.678 1.00 0.17 C ATOM 0 H ALA A 42 11.157 8.931 6.142 1.00 0.16 H new ATOM 0 HA ALA A 42 11.793 11.297 7.720 1.00 0.17 H new ATOM 0 HB1 ALA A 42 14.033 10.953 6.738 1.00 0.17 H new ATOM 0 HB2 ALA A 42 13.416 9.469 7.503 1.00 0.17 H new ATOM 0 HB3 ALA A 42 13.383 9.637 5.732 1.00 0.17 H new ATOM 593 N VAL A 43 11.177 11.371 4.523 1.00 0.14 N ATOM 594 CA VAL A 43 10.915 12.258 3.400 1.00 0.15 C ATOM 595 C VAL A 43 9.437 12.636 3.339 1.00 0.18 C ATOM 596 O VAL A 43 8.564 11.771 3.270 1.00 0.21 O ATOM 597 CB VAL A 43 11.355 11.626 2.054 1.00 0.13 C ATOM 598 CG1 VAL A 43 10.813 10.216 1.902 1.00 0.13 C ATOM 599 CG2 VAL A 43 10.913 12.485 0.881 1.00 0.16 C ATOM 0 H VAL A 43 10.921 10.397 4.359 1.00 0.14 H new ATOM 0 HA VAL A 43 11.506 13.160 3.559 1.00 0.15 H new ATOM 0 HB VAL A 43 12.444 11.574 2.059 1.00 0.13 H new ATOM 0 HG11 VAL A 43 11.140 9.802 0.948 1.00 0.13 H new ATOM 0 HG12 VAL A 43 11.186 9.593 2.715 1.00 0.13 H new ATOM 0 HG13 VAL A 43 9.724 10.240 1.933 1.00 0.13 H new ATOM 0 HG21 VAL A 43 11.234 12.020 -0.051 1.00 0.16 H new ATOM 0 HG22 VAL A 43 9.827 12.577 0.886 1.00 0.16 H new ATOM 0 HG23 VAL A 43 11.361 13.475 0.966 1.00 0.16 H new ATOM 609 N ASP A 44 9.166 13.932 3.380 1.00 0.27 N ATOM 610 CA ASP A 44 7.803 14.434 3.285 1.00 0.34 C ATOM 611 C ASP A 44 7.309 14.342 1.859 1.00 0.32 C ATOM 612 O ASP A 44 7.947 14.846 0.933 1.00 0.39 O ATOM 613 CB ASP A 44 7.711 15.887 3.761 1.00 0.49 C ATOM 614 CG ASP A 44 7.829 16.026 5.263 1.00 0.57 C ATOM 615 OD1 ASP A 44 8.967 16.089 5.772 1.00 0.63 O ATOM 616 OD2 ASP A 44 6.785 16.067 5.946 1.00 0.70 O ATOM 0 H ASP A 44 9.875 14.658 3.479 1.00 0.27 H new ATOM 0 HA ASP A 44 7.178 13.817 3.930 1.00 0.34 H new ATOM 0 HB2 ASP A 44 8.499 16.470 3.285 1.00 0.49 H new ATOM 0 HB3 ASP A 44 6.761 16.310 3.436 1.00 0.49 H new ATOM 621 N GLY A 45 6.174 13.700 1.686 1.00 0.29 N ATOM 622 CA GLY A 45 5.602 13.577 0.371 1.00 0.27 C ATOM 623 C GLY A 45 5.684 12.170 -0.162 1.00 0.22 C ATOM 624 O GLY A 45 5.547 11.948 -1.363 1.00 0.21 O ATOM 0 H GLY A 45 5.637 13.261 2.433 1.00 0.29 H new ATOM 0 HA2 GLY A 45 4.559 13.891 0.401 1.00 0.27 H new ATOM 0 HA3 GLY A 45 6.119 14.252 -0.312 1.00 0.27 H new ATOM 628 N CYS A 46 5.882 11.217 0.731 1.00 0.19 N ATOM 629 CA CYS A 46 5.986 9.820 0.342 1.00 0.15 C ATOM 630 C CYS A 46 4.775 9.049 0.835 1.00 0.14 C ATOM 631 O CYS A 46 4.425 9.095 2.015 1.00 0.19 O ATOM 632 CB CYS A 46 7.268 9.196 0.902 1.00 0.14 C ATOM 633 SG CYS A 46 7.364 7.387 0.712 1.00 0.13 S ATOM 0 H CYS A 46 5.974 11.384 1.733 1.00 0.19 H new ATOM 0 HA CYS A 46 6.023 9.768 -0.746 1.00 0.15 H new ATOM 0 HB2 CYS A 46 8.126 9.648 0.404 1.00 0.14 H new ATOM 0 HB3 CYS A 46 7.347 9.443 1.961 1.00 0.14 H new ATOM 638 N THR A 47 4.120 8.362 -0.084 1.00 0.12 N ATOM 639 CA THR A 47 2.925 7.606 0.240 1.00 0.12 C ATOM 640 C THR A 47 3.243 6.124 0.333 1.00 0.12 C ATOM 641 O THR A 47 2.654 5.388 1.132 1.00 0.13 O ATOM 642 CB THR A 47 1.842 7.821 -0.826 1.00 0.13 C ATOM 643 OG1 THR A 47 2.339 7.394 -2.104 1.00 0.18 O ATOM 644 CG2 THR A 47 1.447 9.289 -0.897 1.00 0.12 C ATOM 0 H THR A 47 4.398 8.313 -1.064 1.00 0.12 H new ATOM 0 HA THR A 47 2.557 7.960 1.203 1.00 0.12 H new ATOM 0 HB THR A 47 0.963 7.236 -0.557 1.00 0.13 H new ATOM 0 HG1 THR A 47 2.379 6.415 -2.129 1.00 0.18 H new ATOM 0 HG21 THR A 47 0.678 9.423 -1.658 1.00 0.12 H new ATOM 0 HG22 THR A 47 1.059 9.609 0.070 1.00 0.12 H new ATOM 0 HG23 THR A 47 2.320 9.889 -1.154 1.00 0.12 H new ATOM 652 N HIS A 48 4.186 5.695 -0.488 1.00 0.13 N ATOM 653 CA HIS A 48 4.581 4.299 -0.525 1.00 0.14 C ATOM 654 C HIS A 48 6.026 4.203 -0.962 1.00 0.13 C ATOM 655 O HIS A 48 6.545 5.103 -1.620 1.00 0.20 O ATOM 656 CB HIS A 48 3.682 3.476 -1.468 1.00 0.15 C ATOM 657 CG HIS A 48 3.835 3.810 -2.919 1.00 0.14 C ATOM 658 ND1 HIS A 48 3.265 4.916 -3.508 1.00 0.17 N ATOM 659 CD2 HIS A 48 4.508 3.170 -3.901 1.00 0.16 C ATOM 660 CE1 HIS A 48 3.581 4.936 -4.789 1.00 0.17 C ATOM 661 NE2 HIS A 48 4.336 3.890 -5.054 1.00 0.17 N ATOM 0 H HIS A 48 4.693 6.295 -1.139 1.00 0.13 H new ATOM 0 HA HIS A 48 4.467 3.882 0.476 1.00 0.14 H new ATOM 0 HB2 HIS A 48 3.901 2.418 -1.327 1.00 0.15 H new ATOM 0 HB3 HIS A 48 2.641 3.627 -1.181 1.00 0.15 H new ATOM 0 HD2 HIS A 48 5.077 2.258 -3.796 1.00 0.16 H new ATOM 0 HE1 HIS A 48 3.272 5.686 -5.502 1.00 0.17 H new ATOM 0 HE2 HIS A 48 4.728 3.655 -5.966 1.00 0.17 H new ATOM 669 N PHE A 49 6.659 3.111 -0.615 1.00 0.13 N ATOM 670 CA PHE A 49 8.062 2.922 -0.920 1.00 0.13 C ATOM 671 C PHE A 49 8.265 1.637 -1.697 1.00 0.13 C ATOM 672 O PHE A 49 7.353 0.817 -1.821 1.00 0.18 O ATOM 673 CB PHE A 49 8.896 2.903 0.370 1.00 0.13 C ATOM 674 CG PHE A 49 8.194 2.234 1.520 1.00 0.14 C ATOM 675 CD1 PHE A 49 7.688 0.955 1.386 1.00 0.21 C ATOM 676 CD2 PHE A 49 8.068 2.870 2.740 1.00 0.18 C ATOM 677 CE1 PHE A 49 7.068 0.323 2.442 1.00 0.27 C ATOM 678 CE2 PHE A 49 7.446 2.244 3.797 1.00 0.22 C ATOM 679 CZ PHE A 49 6.858 1.033 3.631 1.00 0.25 C ATOM 0 H PHE A 49 6.225 2.333 -0.118 1.00 0.13 H new ATOM 0 HA PHE A 49 8.396 3.757 -1.535 1.00 0.13 H new ATOM 0 HB2 PHE A 49 9.838 2.388 0.179 1.00 0.13 H new ATOM 0 HB3 PHE A 49 9.144 3.927 0.650 1.00 0.13 H new ATOM 0 HD1 PHE A 49 7.780 0.443 0.439 1.00 0.21 H new ATOM 0 HD2 PHE A 49 8.461 3.868 2.866 1.00 0.18 H new ATOM 0 HE1 PHE A 49 6.749 -0.705 2.354 1.00 0.27 H new ATOM 0 HE2 PHE A 49 7.426 2.721 4.766 1.00 0.22 H new ATOM 0 HZ PHE A 49 6.233 0.620 4.409 1.00 0.25 H new ATOM 689 N THR A 50 9.449 1.484 -2.237 1.00 0.11 N ATOM 690 CA THR A 50 9.822 0.274 -2.925 1.00 0.11 C ATOM 691 C THR A 50 11.193 -0.186 -2.469 1.00 0.10 C ATOM 692 O THR A 50 12.209 0.438 -2.784 1.00 0.11 O ATOM 693 CB THR A 50 9.833 0.472 -4.452 1.00 0.14 C ATOM 694 OG1 THR A 50 8.549 0.933 -4.892 1.00 0.15 O ATOM 695 CG2 THR A 50 10.182 -0.828 -5.163 1.00 0.19 C ATOM 0 H THR A 50 10.180 2.195 -2.212 1.00 0.11 H new ATOM 0 HA THR A 50 9.078 -0.484 -2.681 1.00 0.11 H new ATOM 0 HB THR A 50 10.591 1.216 -4.697 1.00 0.14 H new ATOM 0 HG1 THR A 50 7.878 0.237 -4.729 1.00 0.15 H new ATOM 0 HG21 THR A 50 10.184 -0.664 -6.241 1.00 0.19 H new ATOM 0 HG22 THR A 50 11.169 -1.163 -4.845 1.00 0.19 H new ATOM 0 HG23 THR A 50 9.443 -1.589 -4.913 1.00 0.19 H new ATOM 703 N TYR A 51 11.220 -1.260 -1.709 1.00 0.11 N ATOM 704 CA TYR A 51 12.469 -1.873 -1.345 1.00 0.13 C ATOM 705 C TYR A 51 12.872 -2.794 -2.447 1.00 0.18 C ATOM 706 O TYR A 51 12.070 -3.577 -2.940 1.00 0.41 O ATOM 707 CB TYR A 51 12.373 -2.725 -0.080 1.00 0.20 C ATOM 708 CG TYR A 51 11.342 -2.322 0.944 1.00 0.11 C ATOM 709 CD1 TYR A 51 11.504 -1.189 1.703 1.00 0.23 C ATOM 710 CD2 TYR A 51 10.244 -3.133 1.202 1.00 0.09 C ATOM 711 CE1 TYR A 51 10.606 -0.867 2.699 1.00 0.33 C ATOM 712 CE2 TYR A 51 9.333 -2.812 2.181 1.00 0.18 C ATOM 713 CZ TYR A 51 9.525 -1.681 2.930 1.00 0.31 C ATOM 714 OH TYR A 51 8.654 -1.378 3.934 1.00 0.46 O ATOM 0 H TYR A 51 10.391 -1.722 -1.335 1.00 0.11 H new ATOM 0 HA TYR A 51 13.181 -1.067 -1.168 1.00 0.13 H new ATOM 0 HB2 TYR A 51 12.168 -3.753 -0.379 1.00 0.20 H new ATOM 0 HB3 TYR A 51 13.350 -2.722 0.404 1.00 0.20 H new ATOM 0 HD1 TYR A 51 12.347 -0.540 1.517 1.00 0.23 H new ATOM 0 HD2 TYR A 51 10.103 -4.033 0.622 1.00 0.09 H new ATOM 0 HE1 TYR A 51 10.753 0.022 3.295 1.00 0.33 H new ATOM 0 HE2 TYR A 51 8.476 -3.445 2.357 1.00 0.18 H new ATOM 0 HH TYR A 51 8.268 -0.491 3.776 1.00 0.46 H new ATOM 724 N ASN A 52 14.102 -2.709 -2.842 1.00 0.10 N ATOM 725 CA ASN A 52 14.630 -3.711 -3.701 1.00 0.12 C ATOM 726 C ASN A 52 15.339 -4.721 -2.829 1.00 0.13 C ATOM 727 O ASN A 52 16.271 -4.381 -2.125 1.00 0.17 O ATOM 728 CB ASN A 52 15.572 -3.105 -4.713 1.00 0.14 C ATOM 729 CG ASN A 52 15.736 -4.022 -5.909 1.00 0.15 C ATOM 730 OD1 ASN A 52 16.632 -4.853 -5.938 1.00 0.17 O ATOM 731 ND2 ASN A 52 14.842 -3.907 -6.882 1.00 0.16 N ATOM 0 H ASN A 52 14.750 -1.964 -2.586 1.00 0.10 H new ATOM 0 HA ASN A 52 13.833 -4.195 -4.265 1.00 0.12 H new ATOM 0 HB2 ASN A 52 15.190 -2.138 -5.040 1.00 0.14 H new ATOM 0 HB3 ASN A 52 16.543 -2.924 -4.251 1.00 0.14 H new ATOM 0 HD21 ASN A 52 14.887 -4.525 -7.692 1.00 0.16 H new ATOM 0 HD22 ASN A 52 14.109 -3.200 -6.820 1.00 0.16 H new ATOM 738 N ASP A 53 14.837 -5.930 -2.793 1.00 0.12 N ATOM 739 CA ASP A 53 15.397 -6.971 -1.959 1.00 0.14 C ATOM 740 C ASP A 53 16.655 -7.547 -2.597 1.00 0.17 C ATOM 741 O ASP A 53 17.473 -8.169 -1.926 1.00 0.23 O ATOM 742 CB ASP A 53 14.332 -8.044 -1.729 1.00 0.14 C ATOM 743 CG ASP A 53 14.738 -9.064 -0.697 1.00 0.25 C ATOM 744 OD1 ASP A 53 14.644 -8.747 0.505 1.00 0.36 O ATOM 745 OD2 ASP A 53 15.116 -10.186 -1.070 1.00 0.30 O ATOM 0 H ASP A 53 14.028 -6.223 -3.340 1.00 0.12 H new ATOM 0 HA ASP A 53 15.692 -6.559 -0.994 1.00 0.14 H new ATOM 0 HB2 ASP A 53 13.404 -7.566 -1.414 1.00 0.14 H new ATOM 0 HB3 ASP A 53 14.125 -8.551 -2.671 1.00 0.14 H new ATOM 750 N ASP A 54 16.816 -7.294 -3.890 1.00 0.18 N ATOM 751 CA ASP A 54 17.997 -7.739 -4.623 1.00 0.22 C ATOM 752 C ASP A 54 19.143 -6.736 -4.461 1.00 0.25 C ATOM 753 O ASP A 54 20.284 -7.115 -4.209 1.00 0.37 O ATOM 754 CB ASP A 54 17.657 -7.922 -6.108 1.00 0.23 C ATOM 755 CG ASP A 54 18.843 -8.394 -6.927 1.00 0.31 C ATOM 756 OD1 ASP A 54 19.422 -7.573 -7.671 1.00 0.46 O ATOM 757 OD2 ASP A 54 19.215 -9.581 -6.816 1.00 0.31 O ATOM 0 H ASP A 54 16.140 -6.780 -4.456 1.00 0.18 H new ATOM 0 HA ASP A 54 18.319 -8.696 -4.213 1.00 0.22 H new ATOM 0 HB2 ASP A 54 16.845 -8.642 -6.204 1.00 0.23 H new ATOM 0 HB3 ASP A 54 17.295 -6.977 -6.513 1.00 0.23 H new ATOM 762 N SER A 55 18.817 -5.453 -4.578 1.00 0.17 N ATOM 763 CA SER A 55 19.798 -4.382 -4.491 1.00 0.19 C ATOM 764 C SER A 55 19.772 -3.735 -3.114 1.00 0.19 C ATOM 765 O SER A 55 20.497 -2.778 -2.845 1.00 0.24 O ATOM 766 CB SER A 55 19.492 -3.343 -5.557 1.00 0.21 C ATOM 767 OG SER A 55 19.456 -3.928 -6.849 1.00 0.28 O ATOM 0 H SER A 55 17.863 -5.128 -4.736 1.00 0.17 H new ATOM 0 HA SER A 55 20.793 -4.797 -4.651 1.00 0.19 H new ATOM 0 HB2 SER A 55 18.534 -2.870 -5.343 1.00 0.21 H new ATOM 0 HB3 SER A 55 20.248 -2.558 -5.531 1.00 0.21 H new ATOM 0 HG SER A 55 18.594 -4.374 -6.982 1.00 0.28 H new ATOM 773 N LYS A 56 18.927 -4.290 -2.250 1.00 0.16 N ATOM 774 CA LYS A 56 18.686 -3.782 -0.905 1.00 0.16 C ATOM 775 C LYS A 56 18.495 -2.267 -0.863 1.00 0.14 C ATOM 776 O LYS A 56 18.762 -1.636 0.153 1.00 0.17 O ATOM 777 CB LYS A 56 19.826 -4.217 -0.004 1.00 0.21 C ATOM 778 CG LYS A 56 20.061 -5.713 -0.044 1.00 0.29 C ATOM 779 CD LYS A 56 21.421 -6.069 0.504 1.00 0.50 C ATOM 780 CE LYS A 56 21.496 -5.824 2.002 1.00 1.20 C ATOM 781 NZ LYS A 56 22.868 -6.016 2.546 1.00 1.31 N ATOM 0 H LYS A 56 18.380 -5.122 -2.471 1.00 0.16 H new ATOM 0 HA LYS A 56 17.747 -4.205 -0.548 1.00 0.16 H new ATOM 0 HB2 LYS A 56 20.738 -3.701 -0.304 1.00 0.21 H new ATOM 0 HB3 LYS A 56 19.611 -3.914 1.021 1.00 0.21 H new ATOM 0 HG2 LYS A 56 19.289 -6.220 0.535 1.00 0.29 H new ATOM 0 HG3 LYS A 56 19.975 -6.069 -1.071 1.00 0.29 H new ATOM 0 HD2 LYS A 56 21.637 -7.116 0.294 1.00 0.50 H new ATOM 0 HD3 LYS A 56 22.185 -5.478 -0.002 1.00 0.50 H new ATOM 0 HE2 LYS A 56 21.163 -4.809 2.217 1.00 1.20 H new ATOM 0 HE3 LYS A 56 20.809 -6.500 2.512 1.00 1.20 H new ATOM 0 HZ1 LYS A 56 22.820 -6.586 3.415 1.00 1.31 H new ATOM 0 HZ2 LYS A 56 23.455 -6.507 1.842 1.00 1.31 H new ATOM 0 HZ3 LYS A 56 23.289 -5.090 2.762 1.00 1.31 H new ATOM 795 N MET A 57 17.984 -1.695 -1.947 1.00 0.12 N ATOM 796 CA MET A 57 17.867 -0.250 -2.052 1.00 0.13 C ATOM 797 C MET A 57 16.442 0.197 -1.750 1.00 0.13 C ATOM 798 O MET A 57 15.488 -0.556 -1.948 1.00 0.22 O ATOM 799 CB MET A 57 18.298 0.214 -3.443 1.00 0.13 C ATOM 800 CG MET A 57 17.234 0.111 -4.514 1.00 0.14 C ATOM 801 SD MET A 57 17.738 0.910 -6.051 1.00 0.24 S ATOM 802 CE MET A 57 19.277 0.066 -6.408 1.00 1.62 C ATOM 0 H MET A 57 17.646 -2.209 -2.761 1.00 0.12 H new ATOM 0 HA MET A 57 18.527 0.208 -1.315 1.00 0.13 H new ATOM 0 HB2 MET A 57 18.626 1.252 -3.377 1.00 0.13 H new ATOM 0 HB3 MET A 57 19.162 -0.374 -3.753 1.00 0.13 H new ATOM 0 HG2 MET A 57 17.015 -0.939 -4.707 1.00 0.14 H new ATOM 0 HG3 MET A 57 16.312 0.568 -4.154 1.00 0.14 H new ATOM 0 HE1 MET A 57 19.763 0.541 -7.260 1.00 1.62 H new ATOM 0 HE2 MET A 57 19.933 0.122 -5.539 1.00 1.62 H new ATOM 0 HE3 MET A 57 19.073 -0.979 -6.642 1.00 1.62 H new ATOM 812 N CYS A 58 16.311 1.413 -1.252 1.00 0.08 N ATOM 813 CA CYS A 58 15.020 1.956 -0.871 1.00 0.07 C ATOM 814 C CYS A 58 14.582 3.067 -1.808 1.00 0.07 C ATOM 815 O CYS A 58 15.154 4.152 -1.804 1.00 0.09 O ATOM 816 CB CYS A 58 15.076 2.499 0.549 1.00 0.08 C ATOM 817 SG CYS A 58 13.555 3.350 1.061 1.00 0.08 S ATOM 0 H CYS A 58 17.093 2.050 -1.101 1.00 0.08 H new ATOM 0 HA CYS A 58 14.295 1.144 -0.932 1.00 0.07 H new ATOM 0 HB2 CYS A 58 15.271 1.676 1.237 1.00 0.08 H new ATOM 0 HB3 CYS A 58 15.915 3.190 0.632 1.00 0.08 H new ATOM 822 N HIS A 59 13.564 2.797 -2.599 1.00 0.08 N ATOM 823 CA HIS A 59 13.001 3.801 -3.487 1.00 0.08 C ATOM 824 C HIS A 59 11.723 4.384 -2.891 1.00 0.08 C ATOM 825 O HIS A 59 10.650 3.802 -3.030 1.00 0.09 O ATOM 826 CB HIS A 59 12.693 3.190 -4.858 1.00 0.10 C ATOM 827 CG HIS A 59 13.824 3.242 -5.837 1.00 0.12 C ATOM 828 ND1 HIS A 59 13.872 4.120 -6.898 1.00 0.16 N ATOM 829 CD2 HIS A 59 14.940 2.491 -5.932 1.00 0.14 C ATOM 830 CE1 HIS A 59 14.965 3.903 -7.602 1.00 0.18 C ATOM 831 NE2 HIS A 59 15.630 2.921 -7.036 1.00 0.17 N ATOM 0 H HIS A 59 13.106 1.887 -2.647 1.00 0.08 H new ATOM 0 HA HIS A 59 13.735 4.598 -3.607 1.00 0.08 H new ATOM 0 HB2 HIS A 59 12.399 2.150 -4.719 1.00 0.10 H new ATOM 0 HB3 HIS A 59 11.836 3.709 -5.287 1.00 0.10 H new ATOM 0 HD2 HIS A 59 15.236 1.697 -5.262 1.00 0.14 H new ATOM 0 HE1 HIS A 59 15.263 4.440 -8.491 1.00 0.18 H new ATOM 0 HE2 HIS A 59 16.517 2.540 -7.365 1.00 0.17 H new ATOM 839 N VAL A 60 11.842 5.520 -2.214 1.00 0.07 N ATOM 840 CA VAL A 60 10.670 6.237 -1.715 1.00 0.07 C ATOM 841 C VAL A 60 9.928 6.870 -2.879 1.00 0.08 C ATOM 842 O VAL A 60 10.534 7.529 -3.721 1.00 0.09 O ATOM 843 CB VAL A 60 11.033 7.330 -0.680 1.00 0.07 C ATOM 844 CG1 VAL A 60 11.045 6.750 0.728 1.00 0.08 C ATOM 845 CG2 VAL A 60 12.383 7.955 -1.004 1.00 0.09 C ATOM 0 H VAL A 60 12.734 5.965 -1.997 1.00 0.07 H new ATOM 0 HA VAL A 60 10.038 5.508 -1.208 1.00 0.07 H new ATOM 0 HB VAL A 60 10.272 8.109 -0.730 1.00 0.07 H new ATOM 0 HG11 VAL A 60 11.302 7.533 1.442 1.00 0.08 H new ATOM 0 HG12 VAL A 60 10.059 6.352 0.966 1.00 0.08 H new ATOM 0 HG13 VAL A 60 11.783 5.950 0.786 1.00 0.08 H new ATOM 0 HG21 VAL A 60 12.617 8.720 -0.264 1.00 0.09 H new ATOM 0 HG22 VAL A 60 13.154 7.185 -0.986 1.00 0.09 H new ATOM 0 HG23 VAL A 60 12.346 8.408 -1.995 1.00 0.09 H new ATOM 855 N LYS A 61 8.625 6.660 -2.941 1.00 0.09 N ATOM 856 CA LYS A 61 7.855 7.098 -4.091 1.00 0.11 C ATOM 857 C LYS A 61 6.653 7.937 -3.693 1.00 0.11 C ATOM 858 O LYS A 61 6.247 7.977 -2.527 1.00 0.11 O ATOM 859 CB LYS A 61 7.425 5.891 -4.918 1.00 0.14 C ATOM 860 CG LYS A 61 8.578 5.253 -5.675 1.00 0.13 C ATOM 861 CD LYS A 61 8.170 3.948 -6.328 1.00 0.22 C ATOM 862 CE LYS A 61 9.311 3.343 -7.135 1.00 0.20 C ATOM 863 NZ LYS A 61 9.122 1.896 -7.387 1.00 1.22 N ATOM 0 H LYS A 61 8.082 6.193 -2.215 1.00 0.09 H new ATOM 0 HA LYS A 61 8.497 7.738 -4.697 1.00 0.11 H new ATOM 0 HB2 LYS A 61 6.973 5.148 -4.260 1.00 0.14 H new ATOM 0 HB3 LYS A 61 6.657 6.198 -5.627 1.00 0.14 H new ATOM 0 HG2 LYS A 61 8.938 5.944 -6.437 1.00 0.13 H new ATOM 0 HG3 LYS A 61 9.407 5.073 -4.990 1.00 0.13 H new ATOM 0 HD2 LYS A 61 7.851 3.241 -5.562 1.00 0.22 H new ATOM 0 HD3 LYS A 61 7.313 4.119 -6.980 1.00 0.22 H new ATOM 0 HE2 LYS A 61 9.396 3.866 -8.087 1.00 0.20 H new ATOM 0 HE3 LYS A 61 10.250 3.496 -6.602 1.00 0.20 H new ATOM 0 HZ1 LYS A 61 10.019 1.479 -7.707 1.00 1.22 H new ATOM 0 HZ2 LYS A 61 8.816 1.428 -6.510 1.00 1.22 H new ATOM 0 HZ3 LYS A 61 8.397 1.763 -8.121 1.00 1.22 H new ATOM 877 N GLU A 62 6.074 8.583 -4.690 1.00 0.10 N ATOM 878 CA GLU A 62 4.998 9.532 -4.481 1.00 0.11 C ATOM 879 C GLU A 62 3.643 8.873 -4.678 1.00 0.12 C ATOM 880 O GLU A 62 3.570 7.724 -5.093 1.00 0.12 O ATOM 881 CB GLU A 62 5.129 10.738 -5.411 1.00 0.12 C ATOM 882 CG GLU A 62 6.505 11.382 -5.389 1.00 0.12 C ATOM 883 CD GLU A 62 6.504 12.783 -5.961 1.00 0.17 C ATOM 884 OE1 GLU A 62 6.870 12.951 -7.142 1.00 0.39 O ATOM 885 OE2 GLU A 62 6.135 13.726 -5.235 1.00 0.40 O ATOM 0 H GLU A 62 6.338 8.463 -5.668 1.00 0.10 H new ATOM 0 HA GLU A 62 5.073 9.881 -3.451 1.00 0.11 H new ATOM 0 HB2 GLU A 62 4.900 10.426 -6.430 1.00 0.12 H new ATOM 0 HB3 GLU A 62 4.385 11.483 -5.131 1.00 0.12 H new ATOM 0 HG2 GLU A 62 6.870 11.413 -4.363 1.00 0.12 H new ATOM 0 HG3 GLU A 62 7.200 10.763 -5.956 1.00 0.12 H new ATOM 892 N GLY A 63 2.597 9.615 -4.338 1.00 0.13 N ATOM 893 CA GLY A 63 1.233 9.100 -4.241 1.00 0.13 C ATOM 894 C GLY A 63 0.802 8.085 -5.292 1.00 0.14 C ATOM 895 O GLY A 63 1.272 8.086 -6.430 1.00 0.18 O ATOM 0 H GLY A 63 2.671 10.608 -4.118 1.00 0.13 H new ATOM 0 HA2 GLY A 63 1.112 8.643 -3.259 1.00 0.13 H new ATOM 0 HA3 GLY A 63 0.547 9.946 -4.285 1.00 0.13 H new ATOM 899 N LYS A 64 -0.159 7.258 -4.870 1.00 0.16 N ATOM 900 CA LYS A 64 -0.702 6.134 -5.640 1.00 0.16 C ATOM 901 C LYS A 64 0.360 5.119 -6.071 1.00 0.15 C ATOM 902 O LYS A 64 1.262 5.421 -6.851 1.00 0.17 O ATOM 903 CB LYS A 64 -1.505 6.591 -6.857 1.00 0.19 C ATOM 904 CG LYS A 64 -2.574 7.610 -6.542 1.00 0.30 C ATOM 905 CD LYS A 64 -2.013 9.011 -6.622 1.00 0.73 C ATOM 906 CE LYS A 64 -3.107 10.032 -6.542 1.00 0.54 C ATOM 907 NZ LYS A 64 -2.616 11.403 -6.845 1.00 1.10 N ATOM 0 H LYS A 64 -0.595 7.355 -3.953 1.00 0.16 H new ATOM 0 HA LYS A 64 -1.376 5.630 -4.948 1.00 0.16 H new ATOM 0 HB2 LYS A 64 -0.821 7.013 -7.593 1.00 0.19 H new ATOM 0 HB3 LYS A 64 -1.972 5.721 -7.319 1.00 0.19 H new ATOM 0 HG2 LYS A 64 -3.403 7.504 -7.242 1.00 0.30 H new ATOM 0 HG3 LYS A 64 -2.974 7.429 -5.544 1.00 0.30 H new ATOM 0 HD2 LYS A 64 -1.303 9.169 -5.810 1.00 0.73 H new ATOM 0 HD3 LYS A 64 -1.463 9.134 -7.555 1.00 0.73 H new ATOM 0 HE2 LYS A 64 -3.900 9.769 -7.242 1.00 0.54 H new ATOM 0 HE3 LYS A 64 -3.545 10.016 -5.544 1.00 0.54 H new ATOM 0 HZ1 LYS A 64 -3.405 12.077 -6.778 1.00 1.10 H new ATOM 0 HZ2 LYS A 64 -1.877 11.666 -6.162 1.00 1.10 H new ATOM 0 HZ3 LYS A 64 -2.222 11.426 -7.807 1.00 1.10 H new ATOM 921 N PRO A 65 0.252 3.886 -5.557 1.00 0.17 N ATOM 922 CA PRO A 65 1.086 2.771 -5.970 1.00 0.19 C ATOM 923 C PRO A 65 0.628 2.201 -7.294 1.00 0.22 C ATOM 924 O PRO A 65 -0.555 1.950 -7.508 1.00 0.52 O ATOM 925 CB PRO A 65 0.922 1.727 -4.863 1.00 0.32 C ATOM 926 CG PRO A 65 -0.023 2.317 -3.873 1.00 0.35 C ATOM 927 CD PRO A 65 -0.704 3.474 -4.542 1.00 0.19 C ATOM 0 HA PRO A 65 2.123 3.078 -6.109 1.00 0.19 H new ATOM 0 HB2 PRO A 65 0.532 0.792 -5.264 1.00 0.32 H new ATOM 0 HB3 PRO A 65 1.881 1.499 -4.398 1.00 0.32 H new ATOM 0 HG2 PRO A 65 -0.754 1.575 -3.550 1.00 0.35 H new ATOM 0 HG3 PRO A 65 0.511 2.648 -2.982 1.00 0.35 H new ATOM 0 HD2 PRO A 65 -1.656 3.180 -4.983 1.00 0.19 H new ATOM 0 HD3 PRO A 65 -0.914 4.279 -3.838 1.00 0.19 H new ATOM 935 N ASP A 66 1.582 2.001 -8.166 1.00 0.22 N ATOM 936 CA ASP A 66 1.320 1.498 -9.496 1.00 0.21 C ATOM 937 C ASP A 66 2.064 0.186 -9.671 1.00 0.20 C ATOM 938 O ASP A 66 3.129 0.133 -10.283 1.00 0.19 O ATOM 939 CB ASP A 66 1.785 2.527 -10.514 1.00 0.21 C ATOM 940 CG ASP A 66 1.188 2.312 -11.891 1.00 0.25 C ATOM 941 OD1 ASP A 66 0.110 2.867 -12.184 1.00 0.40 O ATOM 942 OD2 ASP A 66 1.800 1.568 -12.688 1.00 0.34 O ATOM 0 H ASP A 66 2.568 2.182 -7.976 1.00 0.22 H new ATOM 0 HA ASP A 66 0.254 1.323 -9.643 1.00 0.21 H new ATOM 0 HB2 ASP A 66 1.520 3.524 -10.161 1.00 0.21 H new ATOM 0 HB3 ASP A 66 2.872 2.493 -10.586 1.00 0.21 H new ATOM 947 N LEU A 67 1.510 -0.856 -9.084 1.00 0.21 N ATOM 948 CA LEU A 67 2.199 -2.120 -8.929 1.00 0.20 C ATOM 949 C LEU A 67 2.510 -2.811 -10.242 1.00 0.22 C ATOM 950 O LEU A 67 1.676 -2.901 -11.145 1.00 0.27 O ATOM 951 CB LEU A 67 1.379 -3.021 -8.025 1.00 0.23 C ATOM 952 CG LEU A 67 1.205 -2.451 -6.621 1.00 0.26 C ATOM 953 CD1 LEU A 67 0.248 -3.281 -5.799 1.00 0.31 C ATOM 954 CD2 LEU A 67 2.561 -2.373 -5.955 1.00 0.28 C ATOM 0 H LEU A 67 0.565 -0.849 -8.700 1.00 0.21 H new ATOM 0 HA LEU A 67 3.169 -1.909 -8.478 1.00 0.20 H new ATOM 0 HB2 LEU A 67 0.397 -3.180 -8.472 1.00 0.23 H new ATOM 0 HB3 LEU A 67 1.861 -3.997 -7.959 1.00 0.23 H new ATOM 0 HG LEU A 67 0.774 -1.453 -6.694 1.00 0.26 H new ATOM 0 HD11 LEU A 67 0.149 -2.845 -4.805 1.00 0.31 H new ATOM 0 HD12 LEU A 67 -0.727 -3.300 -6.286 1.00 0.31 H new ATOM 0 HD13 LEU A 67 0.630 -4.298 -5.712 1.00 0.31 H new ATOM 0 HD21 LEU A 67 2.450 -1.967 -4.950 1.00 0.28 H new ATOM 0 HD22 LEU A 67 2.996 -3.371 -5.897 1.00 0.28 H new ATOM 0 HD23 LEU A 67 3.216 -1.725 -6.538 1.00 0.28 H new ATOM 966 N TYR A 68 3.732 -3.303 -10.312 1.00 0.19 N ATOM 967 CA TYR A 68 4.217 -4.059 -11.451 1.00 0.21 C ATOM 968 C TYR A 68 5.144 -5.157 -10.953 1.00 0.22 C ATOM 969 O TYR A 68 5.592 -5.119 -9.803 1.00 0.21 O ATOM 970 CB TYR A 68 4.953 -3.147 -12.439 1.00 0.22 C ATOM 971 CG TYR A 68 6.195 -2.494 -11.875 1.00 0.21 C ATOM 972 CD1 TYR A 68 6.143 -1.214 -11.354 1.00 0.22 C ATOM 973 CD2 TYR A 68 7.414 -3.159 -11.860 1.00 0.25 C ATOM 974 CE1 TYR A 68 7.266 -0.611 -10.830 1.00 0.24 C ATOM 975 CE2 TYR A 68 8.545 -2.561 -11.338 1.00 0.28 C ATOM 976 CZ TYR A 68 8.464 -1.287 -10.824 1.00 0.27 C ATOM 977 OH TYR A 68 9.577 -0.690 -10.283 1.00 0.33 O ATOM 0 H TYR A 68 4.424 -3.188 -9.571 1.00 0.19 H new ATOM 0 HA TYR A 68 3.370 -4.501 -11.976 1.00 0.21 H new ATOM 0 HB2 TYR A 68 5.230 -3.730 -13.317 1.00 0.22 H new ATOM 0 HB3 TYR A 68 4.269 -2.369 -12.776 1.00 0.22 H new ATOM 0 HD1 TYR A 68 5.206 -0.677 -11.358 1.00 0.22 H new ATOM 0 HD2 TYR A 68 7.479 -4.159 -12.263 1.00 0.25 H new ATOM 0 HE1 TYR A 68 7.206 0.389 -10.426 1.00 0.24 H new ATOM 0 HE2 TYR A 68 9.487 -3.090 -11.333 1.00 0.28 H new ATOM 0 HH TYR A 68 9.305 -0.078 -9.568 1.00 0.33 H new ATOM 987 N ASP A 69 5.437 -6.125 -11.808 1.00 0.28 N ATOM 988 CA ASP A 69 6.289 -7.244 -11.420 1.00 0.31 C ATOM 989 C ASP A 69 7.751 -6.820 -11.385 1.00 0.25 C ATOM 990 O ASP A 69 8.357 -6.540 -12.420 1.00 0.31 O ATOM 991 CB ASP A 69 6.091 -8.435 -12.361 1.00 0.44 C ATOM 992 CG ASP A 69 4.704 -9.035 -12.247 1.00 1.40 C ATOM 993 OD1 ASP A 69 3.909 -8.895 -13.199 1.00 2.32 O ATOM 994 OD2 ASP A 69 4.403 -9.662 -11.211 1.00 1.40 O ATOM 0 H ASP A 69 5.101 -6.161 -12.770 1.00 0.28 H new ATOM 0 HA ASP A 69 6.000 -7.557 -10.417 1.00 0.31 H new ATOM 0 HB2 ASP A 69 6.263 -8.115 -13.389 1.00 0.44 H new ATOM 0 HB3 ASP A 69 6.835 -9.200 -12.137 1.00 0.44 H new ATOM 999 N LEU A 70 8.298 -6.770 -10.179 1.00 0.21 N ATOM 1000 CA LEU A 70 9.668 -6.328 -9.949 1.00 0.18 C ATOM 1001 C LEU A 70 10.449 -7.430 -9.248 1.00 0.17 C ATOM 1002 O LEU A 70 10.197 -7.711 -8.089 1.00 0.17 O ATOM 1003 CB LEU A 70 9.655 -5.051 -9.093 1.00 0.15 C ATOM 1004 CG LEU A 70 11.017 -4.557 -8.601 1.00 0.16 C ATOM 1005 CD1 LEU A 70 12.023 -4.493 -9.743 1.00 0.21 C ATOM 1006 CD2 LEU A 70 10.880 -3.189 -7.951 1.00 0.17 C ATOM 0 H LEU A 70 7.803 -7.036 -9.328 1.00 0.21 H new ATOM 0 HA LEU A 70 10.150 -6.110 -10.902 1.00 0.18 H new ATOM 0 HB2 LEU A 70 9.190 -4.254 -9.673 1.00 0.15 H new ATOM 0 HB3 LEU A 70 9.019 -5.226 -8.225 1.00 0.15 H new ATOM 0 HG LEU A 70 11.385 -5.268 -7.861 1.00 0.16 H new ATOM 0 HD11 LEU A 70 12.982 -4.139 -9.364 1.00 0.21 H new ATOM 0 HD12 LEU A 70 12.148 -5.486 -10.174 1.00 0.21 H new ATOM 0 HD13 LEU A 70 11.660 -3.808 -10.509 1.00 0.21 H new ATOM 0 HD21 LEU A 70 11.857 -2.851 -7.606 1.00 0.17 H new ATOM 0 HD22 LEU A 70 10.486 -2.479 -8.678 1.00 0.17 H new ATOM 0 HD23 LEU A 70 10.199 -3.256 -7.103 1.00 0.17 H new ATOM 1018 N THR A 71 11.382 -8.059 -9.951 1.00 0.26 N ATOM 1019 CA THR A 71 12.167 -9.147 -9.374 1.00 0.29 C ATOM 1020 C THR A 71 12.913 -8.690 -8.124 1.00 0.22 C ATOM 1021 O THR A 71 13.702 -7.745 -8.170 1.00 0.26 O ATOM 1022 CB THR A 71 13.187 -9.694 -10.376 1.00 0.42 C ATOM 1023 OG1 THR A 71 12.535 -9.996 -11.619 1.00 0.48 O ATOM 1024 CG2 THR A 71 13.855 -10.942 -9.823 1.00 0.49 C ATOM 0 H THR A 71 11.615 -7.837 -10.919 1.00 0.26 H new ATOM 0 HA THR A 71 11.460 -9.934 -9.110 1.00 0.29 H new ATOM 0 HB THR A 71 13.952 -8.937 -10.547 1.00 0.42 H new ATOM 0 HG1 THR A 71 13.192 -10.344 -12.257 1.00 0.48 H new ATOM 0 HG21 THR A 71 14.577 -11.319 -10.547 1.00 0.49 H new ATOM 0 HG22 THR A 71 14.367 -10.698 -8.892 1.00 0.49 H new ATOM 0 HG23 THR A 71 13.100 -11.705 -9.633 1.00 0.49 H new ATOM 1032 N GLY A 72 12.645 -9.359 -7.008 1.00 0.17 N ATOM 1033 CA GLY A 72 13.233 -8.971 -5.742 1.00 0.12 C ATOM 1034 C GLY A 72 12.618 -7.692 -5.227 1.00 0.13 C ATOM 1035 O GLY A 72 13.051 -7.134 -4.230 1.00 0.14 O ATOM 0 H GLY A 72 12.026 -10.169 -6.959 1.00 0.17 H new ATOM 0 HA2 GLY A 72 13.089 -9.767 -5.012 1.00 0.12 H new ATOM 0 HA3 GLY A 72 14.308 -8.839 -5.862 1.00 0.12 H new ATOM 1039 N GLY A 73 11.602 -7.228 -5.922 1.00 0.15 N ATOM 1040 CA GLY A 73 10.929 -6.021 -5.533 1.00 0.16 C ATOM 1041 C GLY A 73 10.053 -6.223 -4.326 1.00 0.14 C ATOM 1042 O GLY A 73 9.361 -7.232 -4.199 1.00 0.15 O ATOM 0 H GLY A 73 11.228 -7.674 -6.760 1.00 0.15 H new ATOM 0 HA2 GLY A 73 11.667 -5.248 -5.319 1.00 0.16 H new ATOM 0 HA3 GLY A 73 10.322 -5.661 -6.364 1.00 0.16 H new ATOM 1046 N LYS A 74 10.087 -5.268 -3.438 1.00 0.15 N ATOM 1047 CA LYS A 74 9.231 -5.285 -2.274 1.00 0.13 C ATOM 1048 C LYS A 74 8.625 -3.904 -2.070 1.00 0.12 C ATOM 1049 O LYS A 74 9.264 -3.003 -1.550 1.00 0.12 O ATOM 1050 CB LYS A 74 10.023 -5.738 -1.036 1.00 0.13 C ATOM 1051 CG LYS A 74 10.362 -7.224 -1.038 1.00 0.18 C ATOM 1052 CD LYS A 74 11.170 -7.646 0.183 1.00 0.22 C ATOM 1053 CE LYS A 74 11.358 -9.161 0.213 1.00 0.33 C ATOM 1054 NZ LYS A 74 12.216 -9.611 1.342 1.00 0.38 N ATOM 0 H LYS A 74 10.704 -4.458 -3.496 1.00 0.15 H new ATOM 0 HA LYS A 74 8.421 -5.998 -2.426 1.00 0.13 H new ATOM 0 HB2 LYS A 74 10.947 -5.163 -0.976 1.00 0.13 H new ATOM 0 HB3 LYS A 74 9.445 -5.507 -0.141 1.00 0.13 H new ATOM 0 HG2 LYS A 74 9.439 -7.803 -1.075 1.00 0.18 H new ATOM 0 HG3 LYS A 74 10.924 -7.463 -1.941 1.00 0.18 H new ATOM 0 HD2 LYS A 74 12.143 -7.155 0.168 1.00 0.22 H new ATOM 0 HD3 LYS A 74 10.662 -7.320 1.091 1.00 0.22 H new ATOM 0 HE2 LYS A 74 10.383 -9.643 0.289 1.00 0.33 H new ATOM 0 HE3 LYS A 74 11.802 -9.487 -0.728 1.00 0.33 H new ATOM 0 HZ1 LYS A 74 12.269 -10.650 1.345 1.00 0.38 H new ATOM 0 HZ2 LYS A 74 13.172 -9.216 1.231 1.00 0.38 H new ATOM 0 HZ3 LYS A 74 11.808 -9.283 2.240 1.00 0.38 H new ATOM 1068 N THR A 75 7.387 -3.745 -2.500 1.00 0.14 N ATOM 1069 CA THR A 75 6.689 -2.479 -2.361 1.00 0.15 C ATOM 1070 C THR A 75 5.587 -2.588 -1.313 1.00 0.16 C ATOM 1071 O THR A 75 5.044 -3.673 -1.085 1.00 0.22 O ATOM 1072 CB THR A 75 6.111 -2.007 -3.725 1.00 0.19 C ATOM 1073 OG1 THR A 75 7.158 -1.456 -4.523 1.00 0.26 O ATOM 1074 CG2 THR A 75 4.997 -0.975 -3.555 1.00 0.23 C ATOM 0 H THR A 75 6.842 -4.480 -2.950 1.00 0.14 H new ATOM 0 HA THR A 75 7.407 -1.731 -2.027 1.00 0.15 H new ATOM 0 HB THR A 75 5.679 -2.878 -4.218 1.00 0.19 H new ATOM 0 HG1 THR A 75 6.772 -1.004 -5.302 1.00 0.26 H new ATOM 0 HG21 THR A 75 4.625 -0.676 -4.535 1.00 0.23 H new ATOM 0 HG22 THR A 75 4.183 -1.410 -2.976 1.00 0.23 H new ATOM 0 HG23 THR A 75 5.387 -0.101 -3.033 1.00 0.23 H new ATOM 1082 N ALA A 76 5.318 -1.475 -0.644 1.00 0.14 N ATOM 1083 CA ALA A 76 4.220 -1.374 0.297 1.00 0.13 C ATOM 1084 C ALA A 76 3.993 0.089 0.657 1.00 0.13 C ATOM 1085 O ALA A 76 4.721 0.973 0.194 1.00 0.15 O ATOM 1086 CB ALA A 76 4.496 -2.210 1.538 1.00 0.14 C ATOM 0 H ALA A 76 5.859 -0.616 -0.742 1.00 0.14 H new ATOM 0 HA ALA A 76 3.314 -1.765 -0.165 1.00 0.13 H new ATOM 0 HB1 ALA A 76 3.659 -2.120 2.231 1.00 0.14 H new ATOM 0 HB2 ALA A 76 4.620 -3.255 1.253 1.00 0.14 H new ATOM 0 HB3 ALA A 76 5.407 -1.855 2.021 1.00 0.14 H new ATOM 1092 N SER A 77 2.982 0.338 1.465 1.00 0.14 N ATOM 1093 CA SER A 77 2.652 1.691 1.893 1.00 0.13 C ATOM 1094 C SER A 77 3.490 2.105 3.094 1.00 0.15 C ATOM 1095 O SER A 77 3.983 1.266 3.842 1.00 0.18 O ATOM 1096 CB SER A 77 1.173 1.772 2.258 1.00 0.15 C ATOM 1097 OG SER A 77 0.812 3.074 2.704 1.00 0.27 O ATOM 0 H SER A 77 2.368 -0.383 1.843 1.00 0.14 H new ATOM 0 HA SER A 77 2.868 2.369 1.067 1.00 0.13 H new ATOM 0 HB2 SER A 77 0.569 1.504 1.391 1.00 0.15 H new ATOM 0 HB3 SER A 77 0.950 1.045 3.039 1.00 0.15 H new ATOM 0 HG SER A 77 1.400 3.737 2.287 1.00 0.27 H new ATOM 1103 N ARG A 78 3.609 3.423 3.271 1.00 0.15 N ATOM 1104 CA ARG A 78 4.332 4.022 4.395 1.00 0.18 C ATOM 1105 C ARG A 78 3.791 3.537 5.737 1.00 0.18 C ATOM 1106 O ARG A 78 4.464 3.636 6.765 1.00 0.21 O ATOM 1107 CB ARG A 78 4.211 5.544 4.322 1.00 0.18 C ATOM 1108 CG ARG A 78 2.775 6.034 4.319 1.00 0.14 C ATOM 1109 CD ARG A 78 2.692 7.551 4.279 1.00 0.19 C ATOM 1110 NE ARG A 78 3.397 8.185 5.393 1.00 0.21 N ATOM 1111 CZ ARG A 78 3.637 9.495 5.476 1.00 0.40 C ATOM 1112 NH1 ARG A 78 3.295 10.304 4.481 1.00 0.60 N ATOM 1113 NH2 ARG A 78 4.225 9.991 6.554 1.00 0.43 N ATOM 0 H ARG A 78 3.204 4.109 2.634 1.00 0.15 H new ATOM 0 HA ARG A 78 5.377 3.719 4.323 1.00 0.18 H new ATOM 0 HB2 ARG A 78 4.736 5.984 5.170 1.00 0.18 H new ATOM 0 HB3 ARG A 78 4.710 5.898 3.420 1.00 0.18 H new ATOM 0 HG2 ARG A 78 2.252 5.619 3.457 1.00 0.14 H new ATOM 0 HG3 ARG A 78 2.264 5.666 5.209 1.00 0.14 H new ATOM 0 HD2 ARG A 78 3.111 7.909 3.339 1.00 0.19 H new ATOM 0 HD3 ARG A 78 1.645 7.854 4.297 1.00 0.19 H new ATOM 0 HE ARG A 78 3.725 7.589 6.153 1.00 0.21 H new ATOM 0 HH11 ARG A 78 2.846 9.925 3.647 1.00 0.60 H new ATOM 0 HH12 ARG A 78 3.481 11.304 4.550 1.00 0.60 H new ATOM 0 HH21 ARG A 78 4.494 9.372 7.319 1.00 0.43 H new ATOM 0 HH22 ARG A 78 4.409 10.992 6.619 1.00 0.43 H new ATOM 1127 N SER A 79 2.563 3.051 5.721 1.00 0.17 N ATOM 1128 CA SER A 79 1.936 2.509 6.906 1.00 0.20 C ATOM 1129 C SER A 79 1.397 1.114 6.641 1.00 0.20 C ATOM 1130 O SER A 79 0.650 0.899 5.688 1.00 0.31 O ATOM 1131 CB SER A 79 0.799 3.420 7.354 1.00 0.22 C ATOM 1132 OG SER A 79 1.294 4.671 7.769 1.00 1.00 O ATOM 0 H SER A 79 1.976 3.022 4.887 1.00 0.17 H new ATOM 0 HA SER A 79 2.687 2.448 7.694 1.00 0.20 H new ATOM 0 HB2 SER A 79 0.093 3.557 6.535 1.00 0.22 H new ATOM 0 HB3 SER A 79 0.252 2.951 8.172 1.00 0.22 H new ATOM 0 HG SER A 79 1.781 4.567 8.613 1.00 1.00 H new ATOM 1138 N CYS A 80 1.789 0.170 7.476 1.00 0.15 N ATOM 1139 CA CYS A 80 1.224 -1.166 7.431 1.00 0.16 C ATOM 1140 C CYS A 80 0.131 -1.269 8.485 1.00 0.18 C ATOM 1141 O CYS A 80 -0.555 -2.285 8.601 1.00 0.29 O ATOM 1142 CB CYS A 80 2.305 -2.213 7.693 1.00 0.19 C ATOM 1143 SG CYS A 80 3.928 -1.791 6.990 1.00 0.20 S ATOM 0 H CYS A 80 2.499 0.304 8.196 1.00 0.15 H new ATOM 0 HA CYS A 80 0.805 -1.351 6.442 1.00 0.16 H new ATOM 0 HB2 CYS A 80 2.411 -2.350 8.769 1.00 0.19 H new ATOM 0 HB3 CYS A 80 1.979 -3.168 7.281 1.00 0.19 H new ATOM 1148 N ASP A 81 -0.004 -0.189 9.253 1.00 0.20 N ATOM 1149 CA ASP A 81 -0.988 -0.101 10.322 1.00 0.23 C ATOM 1150 C ASP A 81 -2.397 -0.234 9.775 1.00 0.20 C ATOM 1151 O ASP A 81 -2.801 0.505 8.882 1.00 0.24 O ATOM 1152 CB ASP A 81 -0.861 1.230 11.063 1.00 0.31 C ATOM 1153 CG ASP A 81 0.430 1.353 11.842 1.00 0.99 C ATOM 1154 OD1 ASP A 81 1.453 1.746 11.245 1.00 1.78 O ATOM 1155 OD2 ASP A 81 0.432 1.052 13.054 1.00 1.03 O ATOM 0 H ASP A 81 0.568 0.649 9.149 1.00 0.20 H new ATOM 0 HA ASP A 81 -0.796 -0.921 11.014 1.00 0.23 H new ATOM 0 HB2 ASP A 81 -0.924 2.047 10.344 1.00 0.31 H new ATOM 0 HB3 ASP A 81 -1.703 1.341 11.746 1.00 0.31 H new ATOM 1160 N ARG A 82 -3.141 -1.170 10.327 1.00 0.19 N ATOM 1161 CA ARG A 82 -4.510 -1.403 9.903 1.00 0.18 C ATOM 1162 C ARG A 82 -5.474 -0.824 10.932 1.00 0.18 C ATOM 1163 O ARG A 82 -6.594 -1.302 11.101 1.00 0.29 O ATOM 1164 CB ARG A 82 -4.749 -2.903 9.726 1.00 0.25 C ATOM 1165 CG ARG A 82 -3.684 -3.586 8.879 1.00 0.37 C ATOM 1166 CD ARG A 82 -4.021 -5.047 8.632 1.00 0.53 C ATOM 1167 NE ARG A 82 -2.878 -5.791 8.101 1.00 1.31 N ATOM 1168 CZ ARG A 82 -2.974 -6.942 7.440 1.00 1.74 C ATOM 1169 NH1 ARG A 82 -4.164 -7.469 7.178 1.00 1.65 N ATOM 1170 NH2 ARG A 82 -1.874 -7.566 7.037 1.00 2.65 N ATOM 0 H ARG A 82 -2.820 -1.786 11.074 1.00 0.19 H new ATOM 0 HA ARG A 82 -4.683 -0.908 8.947 1.00 0.18 H new ATOM 0 HB2 ARG A 82 -4.782 -3.377 10.707 1.00 0.25 H new ATOM 0 HB3 ARG A 82 -5.724 -3.057 9.264 1.00 0.25 H new ATOM 0 HG2 ARG A 82 -3.588 -3.067 7.925 1.00 0.37 H new ATOM 0 HG3 ARG A 82 -2.718 -3.514 9.379 1.00 0.37 H new ATOM 0 HD2 ARG A 82 -4.351 -5.506 9.564 1.00 0.53 H new ATOM 0 HD3 ARG A 82 -4.854 -5.114 7.932 1.00 0.53 H new ATOM 0 HE ARG A 82 -1.947 -5.402 8.247 1.00 1.31 H new ATOM 0 HH11 ARG A 82 -5.012 -6.991 7.484 1.00 1.65 H new ATOM 0 HH12 ARG A 82 -4.230 -8.352 6.671 1.00 1.65 H new ATOM 0 HH21 ARG A 82 -0.958 -7.163 7.234 1.00 2.65 H new ATOM 0 HH22 ARG A 82 -1.945 -8.448 6.530 1.00 2.65 H new ATOM 1184 N SER A 83 -5.020 0.224 11.606 1.00 0.18 N ATOM 1185 CA SER A 83 -5.762 0.832 12.705 1.00 0.26 C ATOM 1186 C SER A 83 -7.056 1.493 12.236 1.00 0.23 C ATOM 1187 O SER A 83 -8.016 1.591 12.998 1.00 0.27 O ATOM 1188 CB SER A 83 -4.875 1.859 13.408 1.00 0.40 C ATOM 1189 OG SER A 83 -3.622 1.289 13.739 1.00 1.28 O ATOM 0 H SER A 83 -4.128 0.677 11.408 1.00 0.18 H new ATOM 0 HA SER A 83 -6.041 0.038 13.398 1.00 0.26 H new ATOM 0 HB2 SER A 83 -4.728 2.724 12.762 1.00 0.40 H new ATOM 0 HB3 SER A 83 -5.369 2.216 14.312 1.00 0.40 H new ATOM 0 HG SER A 83 -3.065 1.960 14.187 1.00 1.28 H new ATOM 1195 N CYS A 84 -7.098 1.936 10.989 1.00 0.20 N ATOM 1196 CA CYS A 84 -8.277 2.623 10.493 1.00 0.20 C ATOM 1197 C CYS A 84 -8.965 1.809 9.402 1.00 0.18 C ATOM 1198 O CYS A 84 -9.818 2.322 8.675 1.00 0.22 O ATOM 1199 CB CYS A 84 -7.935 4.045 10.003 1.00 0.25 C ATOM 1200 SG CYS A 84 -7.047 4.164 8.410 1.00 0.28 S ATOM 0 H CYS A 84 -6.342 1.834 10.312 1.00 0.20 H new ATOM 0 HA CYS A 84 -8.976 2.725 11.323 1.00 0.20 H new ATOM 0 HB2 CYS A 84 -8.863 4.610 9.920 1.00 0.25 H new ATOM 0 HB3 CYS A 84 -7.332 4.534 10.768 1.00 0.25 H new ATOM 1205 N PHE A 85 -8.612 0.528 9.303 1.00 0.16 N ATOM 1206 CA PHE A 85 -9.274 -0.361 8.362 1.00 0.16 C ATOM 1207 C PHE A 85 -10.483 -1.016 9.015 1.00 0.17 C ATOM 1208 O PHE A 85 -10.552 -1.162 10.236 1.00 0.21 O ATOM 1209 CB PHE A 85 -8.346 -1.471 7.855 1.00 0.15 C ATOM 1210 CG PHE A 85 -7.119 -1.020 7.102 1.00 0.15 C ATOM 1211 CD1 PHE A 85 -7.024 0.294 6.672 1.00 0.17 C ATOM 1212 CD2 PHE A 85 -6.072 -1.884 6.825 1.00 0.16 C ATOM 1213 CE1 PHE A 85 -5.917 0.737 5.978 1.00 0.18 C ATOM 1214 CE2 PHE A 85 -4.960 -1.441 6.128 1.00 0.18 C ATOM 1215 CZ PHE A 85 -4.834 -0.245 5.720 1.00 0.18 C ATOM 0 H PHE A 85 -7.878 0.090 9.859 1.00 0.16 H new ATOM 0 HA PHE A 85 -9.576 0.255 7.516 1.00 0.16 H new ATOM 0 HB2 PHE A 85 -8.024 -2.066 8.710 1.00 0.15 H new ATOM 0 HB3 PHE A 85 -8.923 -2.131 7.207 1.00 0.15 H new ATOM 0 HD1 PHE A 85 -7.829 0.982 6.883 1.00 0.17 H new ATOM 0 HD2 PHE A 85 -6.123 -2.911 7.155 1.00 0.16 H new ATOM 0 HE1 PHE A 85 -5.841 1.759 5.636 1.00 0.18 H new ATOM 0 HE2 PHE A 85 -4.166 -2.143 5.923 1.00 0.18 H new ATOM 0 HZ PHE A 85 -3.944 0.056 5.188 1.00 0.18 H new ATOM 1225 N GLU A 86 -11.416 -1.407 8.179 1.00 0.16 N ATOM 1226 CA GLU A 86 -12.599 -2.139 8.586 1.00 0.17 C ATOM 1227 C GLU A 86 -12.532 -3.530 7.970 1.00 0.16 C ATOM 1228 O GLU A 86 -12.559 -3.671 6.748 1.00 0.17 O ATOM 1229 CB GLU A 86 -13.860 -1.414 8.097 1.00 0.20 C ATOM 1230 CG GLU A 86 -13.990 0.018 8.594 1.00 0.34 C ATOM 1231 CD GLU A 86 -14.274 0.104 10.078 1.00 1.22 C ATOM 1232 OE1 GLU A 86 -13.383 0.554 10.830 1.00 2.18 O ATOM 1233 OE2 GLU A 86 -15.377 -0.300 10.504 1.00 1.18 O ATOM 0 H GLU A 86 -11.376 -1.223 7.177 1.00 0.16 H new ATOM 0 HA GLU A 86 -12.641 -2.208 9.673 1.00 0.17 H new ATOM 0 HB2 GLU A 86 -13.863 -1.410 7.007 1.00 0.20 H new ATOM 0 HB3 GLU A 86 -14.736 -1.978 8.416 1.00 0.20 H new ATOM 0 HG2 GLU A 86 -13.069 0.558 8.374 1.00 0.34 H new ATOM 0 HG3 GLU A 86 -14.791 0.516 8.047 1.00 0.34 H new ATOM 1240 N GLN A 87 -12.397 -4.549 8.793 1.00 0.17 N ATOM 1241 CA GLN A 87 -12.284 -5.902 8.293 1.00 0.18 C ATOM 1242 C GLN A 87 -13.643 -6.509 7.977 1.00 0.14 C ATOM 1243 O GLN A 87 -14.644 -6.202 8.626 1.00 0.16 O ATOM 1244 CB GLN A 87 -11.536 -6.763 9.293 1.00 0.27 C ATOM 1245 CG GLN A 87 -10.108 -6.301 9.503 1.00 0.36 C ATOM 1246 CD GLN A 87 -9.317 -7.206 10.423 1.00 0.55 C ATOM 1247 OE1 GLN A 87 -9.254 -6.985 11.635 1.00 0.70 O ATOM 1248 NE2 GLN A 87 -8.720 -8.239 9.858 1.00 0.87 N ATOM 0 H GLN A 87 -12.363 -4.466 9.809 1.00 0.17 H new ATOM 0 HA GLN A 87 -11.724 -5.865 7.359 1.00 0.18 H new ATOM 0 HB2 GLN A 87 -12.063 -6.748 10.247 1.00 0.27 H new ATOM 0 HB3 GLN A 87 -11.533 -7.797 8.947 1.00 0.27 H new ATOM 0 HG2 GLN A 87 -9.605 -6.246 8.537 1.00 0.36 H new ATOM 0 HG3 GLN A 87 -10.116 -5.292 9.916 1.00 0.36 H new ATOM 0 HE21 GLN A 87 -8.798 -8.385 8.851 1.00 0.87 H new ATOM 0 HE22 GLN A 87 -8.181 -8.891 10.428 1.00 0.87 H new ATOM 1257 N HIS A 88 -13.645 -7.369 6.963 1.00 0.14 N ATOM 1258 CA HIS A 88 -14.837 -8.086 6.515 1.00 0.16 C ATOM 1259 C HIS A 88 -15.946 -7.139 6.084 1.00 0.15 C ATOM 1260 O HIS A 88 -17.056 -7.197 6.598 1.00 0.18 O ATOM 1261 CB HIS A 88 -15.369 -9.032 7.593 1.00 0.20 C ATOM 1262 CG HIS A 88 -14.382 -10.066 8.045 1.00 0.25 C ATOM 1263 ND1 HIS A 88 -14.505 -10.765 9.226 1.00 0.42 N ATOM 1264 CD2 HIS A 88 -13.257 -10.530 7.453 1.00 0.37 C ATOM 1265 CE1 HIS A 88 -13.497 -11.611 9.339 1.00 0.43 C ATOM 1266 NE2 HIS A 88 -12.726 -11.489 8.276 1.00 0.37 N ATOM 0 H HIS A 88 -12.809 -7.591 6.422 1.00 0.14 H new ATOM 0 HA HIS A 88 -14.527 -8.674 5.651 1.00 0.16 H new ATOM 0 HB2 HIS A 88 -15.682 -8.443 8.455 1.00 0.20 H new ATOM 0 HB3 HIS A 88 -16.257 -9.536 7.212 1.00 0.20 H new ATOM 0 HD2 HIS A 88 -12.852 -10.205 6.506 1.00 0.37 H new ATOM 0 HE1 HIS A 88 -13.332 -12.289 10.163 1.00 0.43 H new ATOM 0 HE2 HIS A 88 -11.874 -12.021 8.096 1.00 0.37 H new ATOM 1274 N VAL A 89 -15.646 -6.275 5.137 1.00 0.14 N ATOM 1275 CA VAL A 89 -16.629 -5.339 4.618 1.00 0.14 C ATOM 1276 C VAL A 89 -16.199 -4.833 3.249 1.00 0.15 C ATOM 1277 O VAL A 89 -15.054 -4.421 3.062 1.00 0.17 O ATOM 1278 CB VAL A 89 -16.851 -4.171 5.605 1.00 0.16 C ATOM 1279 CG1 VAL A 89 -15.543 -3.770 6.241 1.00 0.15 C ATOM 1280 CG2 VAL A 89 -17.502 -2.970 4.941 1.00 0.20 C ATOM 0 H VAL A 89 -14.724 -6.199 4.707 1.00 0.14 H new ATOM 0 HA VAL A 89 -17.581 -5.858 4.506 1.00 0.14 H new ATOM 0 HB VAL A 89 -17.536 -4.525 6.375 1.00 0.16 H new ATOM 0 HG11 VAL A 89 -15.713 -2.946 6.934 1.00 0.15 H new ATOM 0 HG12 VAL A 89 -15.126 -4.619 6.782 1.00 0.15 H new ATOM 0 HG13 VAL A 89 -14.844 -3.454 5.467 1.00 0.15 H new ATOM 0 HG21 VAL A 89 -17.637 -2.176 5.676 1.00 0.20 H new ATOM 0 HG22 VAL A 89 -16.865 -2.611 4.133 1.00 0.20 H new ATOM 0 HG23 VAL A 89 -18.472 -3.259 4.537 1.00 0.20 H new ATOM 1290 N SER A 90 -17.111 -4.898 2.294 1.00 0.17 N ATOM 1291 CA SER A 90 -16.790 -4.559 0.918 1.00 0.20 C ATOM 1292 C SER A 90 -17.704 -3.467 0.385 1.00 0.22 C ATOM 1293 O SER A 90 -18.918 -3.503 0.589 1.00 0.21 O ATOM 1294 CB SER A 90 -16.911 -5.799 0.027 1.00 0.22 C ATOM 1295 OG SER A 90 -16.395 -5.552 -1.270 1.00 0.30 O ATOM 0 H SER A 90 -18.079 -5.182 2.446 1.00 0.17 H new ATOM 0 HA SER A 90 -15.765 -4.190 0.901 1.00 0.20 H new ATOM 0 HB2 SER A 90 -16.374 -6.631 0.482 1.00 0.22 H new ATOM 0 HB3 SER A 90 -17.957 -6.097 -0.046 1.00 0.22 H new ATOM 0 HG SER A 90 -16.890 -6.086 -1.926 1.00 0.30 H new ATOM 1301 N TYR A 91 -17.112 -2.479 -0.266 1.00 0.28 N ATOM 1302 CA TYR A 91 -17.876 -1.510 -1.024 1.00 0.28 C ATOM 1303 C TYR A 91 -17.599 -1.730 -2.510 1.00 0.32 C ATOM 1304 O TYR A 91 -16.460 -1.592 -2.962 1.00 0.38 O ATOM 1305 CB TYR A 91 -17.483 -0.088 -0.621 1.00 0.33 C ATOM 1306 CG TYR A 91 -17.638 0.221 0.860 1.00 0.33 C ATOM 1307 CD1 TYR A 91 -16.731 -0.264 1.785 1.00 0.32 C ATOM 1308 CD2 TYR A 91 -18.707 0.976 1.335 1.00 0.39 C ATOM 1309 CE1 TYR A 91 -16.879 -0.014 3.134 1.00 0.36 C ATOM 1310 CE2 TYR A 91 -18.857 1.234 2.683 1.00 0.43 C ATOM 1311 CZ TYR A 91 -17.904 0.835 3.561 1.00 0.39 C ATOM 1312 OH TYR A 91 -18.089 0.984 4.921 1.00 0.46 O ATOM 0 H TYR A 91 -16.103 -2.329 -0.283 1.00 0.28 H new ATOM 0 HA TYR A 91 -18.939 -1.638 -0.819 1.00 0.28 H new ATOM 0 HB2 TYR A 91 -16.445 0.082 -0.906 1.00 0.33 H new ATOM 0 HB3 TYR A 91 -18.089 0.617 -1.190 1.00 0.33 H new ATOM 0 HD1 TYR A 91 -15.890 -0.850 1.445 1.00 0.32 H new ATOM 0 HD2 TYR A 91 -19.432 1.367 0.636 1.00 0.39 H new ATOM 0 HE1 TYR A 91 -16.211 -0.469 3.851 1.00 0.36 H new ATOM 0 HE2 TYR A 91 -19.734 1.754 3.038 1.00 0.43 H new ATOM 0 HH TYR A 91 -18.443 1.879 5.107 1.00 0.46 H new ATOM 1322 N GLU A 92 -18.634 -2.038 -3.277 1.00 0.30 N ATOM 1323 CA GLU A 92 -18.452 -2.365 -4.688 1.00 0.36 C ATOM 1324 C GLU A 92 -19.464 -1.642 -5.560 1.00 0.32 C ATOM 1325 O GLU A 92 -19.111 -1.077 -6.589 1.00 0.32 O ATOM 1326 CB GLU A 92 -18.563 -3.873 -4.906 1.00 0.45 C ATOM 1327 CG GLU A 92 -17.417 -4.658 -4.294 1.00 0.51 C ATOM 1328 CD GLU A 92 -17.613 -6.152 -4.397 1.00 0.68 C ATOM 1329 OE1 GLU A 92 -17.878 -6.645 -5.515 1.00 0.91 O ATOM 1330 OE2 GLU A 92 -17.509 -6.847 -3.363 1.00 1.12 O ATOM 0 H GLU A 92 -19.601 -2.069 -2.953 1.00 0.30 H new ATOM 0 HA GLU A 92 -17.455 -2.033 -4.977 1.00 0.36 H new ATOM 0 HB2 GLU A 92 -19.503 -4.226 -4.481 1.00 0.45 H new ATOM 0 HB3 GLU A 92 -18.601 -4.076 -5.976 1.00 0.45 H new ATOM 0 HG2 GLU A 92 -16.487 -4.383 -4.791 1.00 0.51 H new ATOM 0 HG3 GLU A 92 -17.312 -4.381 -3.245 1.00 0.51 H new ATOM 1337 N GLY A 93 -20.720 -1.659 -5.140 1.00 0.31 N ATOM 1338 CA GLY A 93 -21.755 -0.951 -5.873 1.00 0.30 C ATOM 1339 C GLY A 93 -21.512 0.546 -5.898 1.00 0.28 C ATOM 1340 O GLY A 93 -22.082 1.264 -6.719 1.00 0.28 O ATOM 0 H GLY A 93 -21.043 -2.149 -4.306 1.00 0.31 H new ATOM 0 HA2 GLY A 93 -21.798 -1.328 -6.895 1.00 0.30 H new ATOM 0 HA3 GLY A 93 -22.724 -1.153 -5.418 1.00 0.30 H new ATOM 1344 N ALA A 94 -20.658 1.006 -4.988 1.00 0.28 N ATOM 1345 CA ALA A 94 -20.301 2.413 -4.885 1.00 0.28 C ATOM 1346 C ALA A 94 -19.614 2.893 -6.158 1.00 0.29 C ATOM 1347 O ALA A 94 -18.994 2.102 -6.865 1.00 0.33 O ATOM 1348 CB ALA A 94 -19.384 2.619 -3.685 1.00 0.28 C ATOM 0 H ALA A 94 -20.195 0.411 -4.301 1.00 0.28 H new ATOM 0 HA ALA A 94 -21.212 2.996 -4.751 1.00 0.28 H new ATOM 0 HB1 ALA A 94 -19.117 3.673 -3.608 1.00 0.28 H new ATOM 0 HB2 ALA A 94 -19.899 2.308 -2.776 1.00 0.28 H new ATOM 0 HB3 ALA A 94 -18.480 2.024 -3.812 1.00 0.28 H new ATOM 1354 N PRO A 95 -19.732 4.188 -6.484 1.00 0.33 N ATOM 1355 CA PRO A 95 -19.011 4.778 -7.610 1.00 0.37 C ATOM 1356 C PRO A 95 -17.506 4.712 -7.384 1.00 0.32 C ATOM 1357 O PRO A 95 -16.979 5.371 -6.484 1.00 0.31 O ATOM 1358 CB PRO A 95 -19.481 6.239 -7.631 1.00 0.47 C ATOM 1359 CG PRO A 95 -20.728 6.261 -6.817 1.00 0.52 C ATOM 1360 CD PRO A 95 -20.579 5.175 -5.794 1.00 0.43 C ATOM 0 HA PRO A 95 -19.206 4.256 -8.547 1.00 0.37 H new ATOM 0 HB2 PRO A 95 -18.725 6.902 -7.210 1.00 0.47 H new ATOM 0 HB3 PRO A 95 -19.670 6.577 -8.650 1.00 0.47 H new ATOM 0 HG2 PRO A 95 -20.863 7.231 -6.338 1.00 0.52 H new ATOM 0 HG3 PRO A 95 -21.604 6.089 -7.442 1.00 0.52 H new ATOM 0 HD2 PRO A 95 -20.110 5.542 -4.881 1.00 0.43 H new ATOM 0 HD3 PRO A 95 -21.543 4.752 -5.510 1.00 0.43 H new ATOM 1368 N ASP A 96 -16.819 3.898 -8.177 1.00 0.33 N ATOM 1369 CA ASP A 96 -15.389 3.733 -8.028 1.00 0.33 C ATOM 1370 C ASP A 96 -14.654 4.963 -8.482 1.00 0.35 C ATOM 1371 O ASP A 96 -15.033 5.630 -9.446 1.00 0.48 O ATOM 1372 CB ASP A 96 -14.871 2.498 -8.760 1.00 0.43 C ATOM 1373 CG ASP A 96 -15.909 1.834 -9.640 1.00 0.51 C ATOM 1374 OD1 ASP A 96 -16.562 0.880 -9.178 1.00 0.71 O ATOM 1375 OD2 ASP A 96 -16.080 2.275 -10.798 1.00 0.59 O ATOM 0 H ASP A 96 -17.234 3.345 -8.927 1.00 0.33 H new ATOM 0 HA ASP A 96 -15.197 3.585 -6.965 1.00 0.33 H new ATOM 0 HB2 ASP A 96 -14.015 2.782 -9.373 1.00 0.43 H new ATOM 0 HB3 ASP A 96 -14.513 1.775 -8.027 1.00 0.43 H new ATOM 1380 N VAL A 97 -13.607 5.263 -7.752 1.00 0.28 N ATOM 1381 CA VAL A 97 -12.863 6.482 -7.943 1.00 0.29 C ATOM 1382 C VAL A 97 -11.454 6.189 -8.430 1.00 0.29 C ATOM 1383 O VAL A 97 -10.729 7.089 -8.844 1.00 0.32 O ATOM 1384 CB VAL A 97 -12.813 7.277 -6.630 1.00 0.28 C ATOM 1385 CG1 VAL A 97 -14.216 7.641 -6.178 1.00 0.30 C ATOM 1386 CG2 VAL A 97 -12.118 6.475 -5.548 1.00 0.24 C ATOM 0 H VAL A 97 -13.247 4.666 -7.007 1.00 0.28 H new ATOM 0 HA VAL A 97 -13.369 7.076 -8.704 1.00 0.29 H new ATOM 0 HB VAL A 97 -12.248 8.192 -6.808 1.00 0.28 H new ATOM 0 HG11 VAL A 97 -14.163 8.204 -5.246 1.00 0.30 H new ATOM 0 HG12 VAL A 97 -14.698 8.249 -6.943 1.00 0.30 H new ATOM 0 HG13 VAL A 97 -14.795 6.731 -6.020 1.00 0.30 H new ATOM 0 HG21 VAL A 97 -12.092 7.055 -4.625 1.00 0.24 H new ATOM 0 HG22 VAL A 97 -12.662 5.546 -5.378 1.00 0.24 H new ATOM 0 HG23 VAL A 97 -11.099 6.247 -5.862 1.00 0.24 H new ATOM 1396 N MET A 98 -11.070 4.921 -8.378 1.00 0.27 N ATOM 1397 CA MET A 98 -9.755 4.505 -8.869 1.00 0.27 C ATOM 1398 C MET A 98 -9.869 3.160 -9.563 1.00 0.27 C ATOM 1399 O MET A 98 -10.920 2.516 -9.521 1.00 0.27 O ATOM 1400 CB MET A 98 -8.711 4.371 -7.747 1.00 0.26 C ATOM 1401 CG MET A 98 -8.684 5.494 -6.727 1.00 0.36 C ATOM 1402 SD MET A 98 -7.287 5.381 -5.590 1.00 1.01 S ATOM 1403 CE MET A 98 -5.906 5.580 -6.714 1.00 0.65 C ATOM 0 H MET A 98 -11.643 4.164 -8.004 1.00 0.27 H new ATOM 0 HA MET A 98 -9.422 5.284 -9.555 1.00 0.27 H new ATOM 0 HB2 MET A 98 -8.890 3.433 -7.221 1.00 0.26 H new ATOM 0 HB3 MET A 98 -7.724 4.297 -8.203 1.00 0.26 H new ATOM 0 HG2 MET A 98 -8.644 6.450 -7.249 1.00 0.36 H new ATOM 0 HG3 MET A 98 -9.612 5.481 -6.156 1.00 0.36 H new ATOM 0 HE1 MET A 98 -5.169 6.250 -6.270 1.00 0.65 H new ATOM 0 HE2 MET A 98 -5.447 4.609 -6.902 1.00 0.65 H new ATOM 0 HE3 MET A 98 -6.260 6.002 -7.654 1.00 0.65 H new ATOM 1413 N THR A 99 -8.786 2.749 -10.201 1.00 0.31 N ATOM 1414 CA THR A 99 -8.693 1.443 -10.811 1.00 0.32 C ATOM 1415 C THR A 99 -8.231 0.422 -9.776 1.00 0.28 C ATOM 1416 O THR A 99 -7.266 0.670 -9.049 1.00 0.30 O ATOM 1417 CB THR A 99 -7.697 1.481 -11.984 1.00 0.38 C ATOM 1418 OG1 THR A 99 -8.163 2.395 -12.988 1.00 0.45 O ATOM 1419 CG2 THR A 99 -7.507 0.100 -12.587 1.00 0.41 C ATOM 0 H THR A 99 -7.946 3.318 -10.308 1.00 0.31 H new ATOM 0 HA THR A 99 -9.675 1.155 -11.187 1.00 0.32 H new ATOM 0 HB THR A 99 -6.733 1.819 -11.603 1.00 0.38 H new ATOM 0 HG1 THR A 99 -7.525 2.417 -13.732 1.00 0.45 H new ATOM 0 HG21 THR A 99 -6.798 0.158 -13.413 1.00 0.41 H new ATOM 0 HG22 THR A 99 -7.123 -0.579 -11.826 1.00 0.41 H new ATOM 0 HG23 THR A 99 -8.464 -0.271 -12.955 1.00 0.41 H new ATOM 1427 N ALA A 100 -8.937 -0.704 -9.690 1.00 0.27 N ATOM 1428 CA ALA A 100 -8.582 -1.757 -8.750 1.00 0.24 C ATOM 1429 C ALA A 100 -7.155 -2.220 -8.957 1.00 0.24 C ATOM 1430 O ALA A 100 -6.672 -2.318 -10.089 1.00 0.34 O ATOM 1431 CB ALA A 100 -9.510 -2.948 -8.871 1.00 0.25 C ATOM 0 H ALA A 100 -9.757 -0.907 -10.261 1.00 0.27 H new ATOM 0 HA ALA A 100 -8.681 -1.330 -7.752 1.00 0.24 H new ATOM 0 HB1 ALA A 100 -9.214 -3.714 -8.154 1.00 0.25 H new ATOM 0 HB2 ALA A 100 -10.533 -2.634 -8.665 1.00 0.25 H new ATOM 0 HB3 ALA A 100 -9.451 -3.354 -9.881 1.00 0.25 H new ATOM 1437 N MET A 101 -6.498 -2.530 -7.862 1.00 0.17 N ATOM 1438 CA MET A 101 -5.111 -2.932 -7.903 1.00 0.17 C ATOM 1439 C MET A 101 -4.951 -4.304 -7.286 1.00 0.14 C ATOM 1440 O MET A 101 -5.761 -4.717 -6.482 1.00 0.15 O ATOM 1441 CB MET A 101 -4.264 -1.926 -7.140 1.00 0.21 C ATOM 1442 CG MET A 101 -2.773 -2.203 -7.200 1.00 0.26 C ATOM 1443 SD MET A 101 -2.055 -1.855 -8.821 1.00 1.07 S ATOM 1444 CE MET A 101 -2.461 -0.119 -9.015 1.00 0.90 C ATOM 0 H MET A 101 -6.905 -2.511 -6.927 1.00 0.17 H new ATOM 0 HA MET A 101 -4.782 -2.969 -8.942 1.00 0.17 H new ATOM 0 HB2 MET A 101 -4.454 -0.930 -7.539 1.00 0.21 H new ATOM 0 HB3 MET A 101 -4.580 -1.918 -6.097 1.00 0.21 H new ATOM 0 HG2 MET A 101 -2.266 -1.599 -6.447 1.00 0.26 H new ATOM 0 HG3 MET A 101 -2.593 -3.247 -6.945 1.00 0.26 H new ATOM 0 HE1 MET A 101 -1.749 0.347 -9.697 1.00 0.90 H new ATOM 0 HE2 MET A 101 -3.468 -0.024 -9.421 1.00 0.90 H new ATOM 0 HE3 MET A 101 -2.413 0.377 -8.045 1.00 0.90 H new ATOM 1454 N VAL A 102 -3.918 -5.003 -7.671 1.00 0.15 N ATOM 1455 CA VAL A 102 -3.630 -6.315 -7.106 1.00 0.14 C ATOM 1456 C VAL A 102 -2.383 -6.252 -6.223 1.00 0.14 C ATOM 1457 O VAL A 102 -1.286 -5.961 -6.704 1.00 0.18 O ATOM 1458 CB VAL A 102 -3.445 -7.378 -8.209 1.00 0.15 C ATOM 1459 CG1 VAL A 102 -2.984 -8.705 -7.619 1.00 0.16 C ATOM 1460 CG2 VAL A 102 -4.740 -7.566 -8.985 1.00 0.16 C ATOM 0 H VAL A 102 -3.251 -4.693 -8.378 1.00 0.15 H new ATOM 0 HA VAL A 102 -4.485 -6.608 -6.497 1.00 0.14 H new ATOM 0 HB VAL A 102 -2.673 -7.025 -8.893 1.00 0.15 H new ATOM 0 HG11 VAL A 102 -2.862 -9.436 -8.418 1.00 0.16 H new ATOM 0 HG12 VAL A 102 -2.032 -8.564 -7.107 1.00 0.16 H new ATOM 0 HG13 VAL A 102 -3.728 -9.065 -6.909 1.00 0.16 H new ATOM 0 HG21 VAL A 102 -4.594 -8.319 -9.760 1.00 0.16 H new ATOM 0 HG22 VAL A 102 -5.527 -7.892 -8.305 1.00 0.16 H new ATOM 0 HG23 VAL A 102 -5.028 -6.622 -9.447 1.00 0.16 H new ATOM 1470 N THR A 103 -2.560 -6.521 -4.936 1.00 0.15 N ATOM 1471 CA THR A 103 -1.476 -6.420 -3.965 1.00 0.14 C ATOM 1472 C THR A 103 -1.673 -7.411 -2.817 1.00 0.15 C ATOM 1473 O THR A 103 -2.786 -7.864 -2.566 1.00 0.18 O ATOM 1474 CB THR A 103 -1.376 -4.986 -3.403 1.00 0.15 C ATOM 1475 OG1 THR A 103 -0.391 -4.921 -2.363 1.00 0.18 O ATOM 1476 CG2 THR A 103 -2.718 -4.513 -2.875 1.00 0.19 C ATOM 0 H THR A 103 -3.452 -6.813 -4.537 1.00 0.15 H new ATOM 0 HA THR A 103 -0.548 -6.664 -4.482 1.00 0.14 H new ATOM 0 HB THR A 103 -1.075 -4.328 -4.218 1.00 0.15 H new ATOM 0 HG1 THR A 103 0.236 -4.191 -2.551 1.00 0.18 H new ATOM 0 HG21 THR A 103 -2.619 -3.500 -2.485 1.00 0.19 H new ATOM 0 HG22 THR A 103 -3.450 -4.521 -3.683 1.00 0.19 H new ATOM 0 HG23 THR A 103 -3.050 -5.178 -2.078 1.00 0.19 H new ATOM 1484 N SER A 104 -0.592 -7.748 -2.113 1.00 0.16 N ATOM 1485 CA SER A 104 -0.668 -8.722 -1.031 1.00 0.19 C ATOM 1486 C SER A 104 -0.941 -8.041 0.314 1.00 0.18 C ATOM 1487 O SER A 104 -0.939 -8.692 1.361 1.00 0.26 O ATOM 1488 CB SER A 104 0.632 -9.523 -0.962 1.00 0.25 C ATOM 1489 OG SER A 104 0.974 -10.048 -2.235 1.00 1.03 O ATOM 0 H SER A 104 0.339 -7.363 -2.273 1.00 0.16 H new ATOM 0 HA SER A 104 -1.499 -9.397 -1.238 1.00 0.19 H new ATOM 0 HB2 SER A 104 1.438 -8.885 -0.600 1.00 0.25 H new ATOM 0 HB3 SER A 104 0.524 -10.338 -0.246 1.00 0.25 H new ATOM 0 HG SER A 104 1.810 -10.555 -2.166 1.00 1.03 H new ATOM 1495 N GLN A 105 -1.175 -6.732 0.282 1.00 0.15 N ATOM 1496 CA GLN A 105 -1.454 -5.973 1.497 1.00 0.14 C ATOM 1497 C GLN A 105 -2.482 -4.878 1.254 1.00 0.13 C ATOM 1498 O GLN A 105 -2.471 -4.216 0.220 1.00 0.15 O ATOM 1499 CB GLN A 105 -0.177 -5.338 2.057 1.00 0.15 C ATOM 1500 CG GLN A 105 0.728 -4.710 1.005 1.00 0.15 C ATOM 1501 CD GLN A 105 1.651 -5.724 0.350 1.00 0.24 C ATOM 1502 OE1 GLN A 105 2.034 -5.576 -0.801 1.00 0.67 O ATOM 1503 NE2 GLN A 105 2.001 -6.777 1.074 1.00 0.21 N ATOM 0 H GLN A 105 -1.177 -6.175 -0.572 1.00 0.15 H new ATOM 0 HA GLN A 105 -1.857 -6.682 2.220 1.00 0.14 H new ATOM 0 HB2 GLN A 105 -0.454 -4.574 2.783 1.00 0.15 H new ATOM 0 HB3 GLN A 105 0.387 -6.100 2.596 1.00 0.15 H new ATOM 0 HG2 GLN A 105 0.114 -4.235 0.240 1.00 0.15 H new ATOM 0 HG3 GLN A 105 1.326 -3.925 1.467 1.00 0.15 H new ATOM 0 HE21 GLN A 105 1.665 -6.872 2.032 1.00 0.21 H new ATOM 0 HE22 GLN A 105 2.607 -7.493 0.673 1.00 0.21 H new ATOM 1512 N SER A 106 -3.353 -4.682 2.238 1.00 0.13 N ATOM 1513 CA SER A 106 -4.335 -3.607 2.204 1.00 0.13 C ATOM 1514 C SER A 106 -3.636 -2.261 2.335 1.00 0.14 C ATOM 1515 O SER A 106 -4.221 -1.213 2.049 1.00 0.15 O ATOM 1516 CB SER A 106 -5.349 -3.779 3.341 1.00 0.17 C ATOM 1517 OG SER A 106 -6.361 -2.785 3.287 1.00 1.31 O ATOM 0 H SER A 106 -3.398 -5.261 3.077 1.00 0.13 H new ATOM 0 HA SER A 106 -4.863 -3.645 1.251 1.00 0.13 H new ATOM 0 HB2 SER A 106 -5.804 -4.767 3.278 1.00 0.17 H new ATOM 0 HB3 SER A 106 -4.835 -3.725 4.301 1.00 0.17 H new ATOM 0 HG SER A 106 -6.250 -2.164 4.037 1.00 1.31 H new ATOM 1523 N ALA A 107 -2.383 -2.307 2.774 1.00 0.14 N ATOM 1524 CA ALA A 107 -1.572 -1.117 2.932 1.00 0.16 C ATOM 1525 C ALA A 107 -1.435 -0.367 1.614 1.00 0.14 C ATOM 1526 O ALA A 107 -1.529 0.859 1.573 1.00 0.15 O ATOM 1527 CB ALA A 107 -0.207 -1.507 3.454 1.00 0.20 C ATOM 0 H ALA A 107 -1.906 -3.172 3.029 1.00 0.14 H new ATOM 0 HA ALA A 107 -2.062 -0.453 3.644 1.00 0.16 H new ATOM 0 HB1 ALA A 107 0.406 -0.613 3.574 1.00 0.20 H new ATOM 0 HB2 ALA A 107 -0.315 -2.005 4.418 1.00 0.20 H new ATOM 0 HB3 ALA A 107 0.273 -2.184 2.747 1.00 0.20 H new ATOM 1533 N ASP A 108 -1.233 -1.110 0.536 1.00 0.14 N ATOM 1534 CA ASP A 108 -1.035 -0.523 -0.775 1.00 0.15 C ATOM 1535 C ASP A 108 -2.267 0.268 -1.197 1.00 0.13 C ATOM 1536 O ASP A 108 -2.161 1.394 -1.685 1.00 0.14 O ATOM 1537 CB ASP A 108 -0.751 -1.627 -1.783 1.00 0.17 C ATOM 1538 CG ASP A 108 0.669 -1.617 -2.310 1.00 0.51 C ATOM 1539 OD1 ASP A 108 1.286 -0.527 -2.308 1.00 0.83 O ATOM 1540 OD2 ASP A 108 1.168 -2.683 -2.726 1.00 0.98 O ATOM 0 H ASP A 108 -1.202 -2.129 0.548 1.00 0.14 H new ATOM 0 HA ASP A 108 -0.187 0.160 -0.736 1.00 0.15 H new ATOM 0 HB2 ASP A 108 -0.950 -2.592 -1.318 1.00 0.17 H new ATOM 0 HB3 ASP A 108 -1.441 -1.529 -2.621 1.00 0.17 H new ATOM 1545 N CYS A 109 -3.443 -0.316 -0.977 1.00 0.11 N ATOM 1546 CA CYS A 109 -4.700 0.348 -1.307 1.00 0.11 C ATOM 1547 C CYS A 109 -4.867 1.607 -0.463 1.00 0.10 C ATOM 1548 O CYS A 109 -5.476 2.586 -0.895 1.00 0.11 O ATOM 1549 CB CYS A 109 -5.884 -0.587 -1.062 1.00 0.13 C ATOM 1550 SG CYS A 109 -5.533 -2.351 -1.363 1.00 0.14 S ATOM 0 H CYS A 109 -3.551 -1.246 -0.572 1.00 0.11 H new ATOM 0 HA CYS A 109 -4.674 0.619 -2.363 1.00 0.11 H new ATOM 0 HB2 CYS A 109 -6.218 -0.467 -0.031 1.00 0.13 H new ATOM 0 HB3 CYS A 109 -6.711 -0.280 -1.702 1.00 0.13 H new ATOM 1555 N GLN A 110 -4.308 1.572 0.741 1.00 0.10 N ATOM 1556 CA GLN A 110 -4.344 2.710 1.642 1.00 0.10 C ATOM 1557 C GLN A 110 -3.573 3.878 1.043 1.00 0.10 C ATOM 1558 O GLN A 110 -4.098 4.979 0.926 1.00 0.13 O ATOM 1559 CB GLN A 110 -3.762 2.314 3.000 1.00 0.12 C ATOM 1560 CG GLN A 110 -3.337 3.483 3.871 1.00 0.13 C ATOM 1561 CD GLN A 110 -2.643 3.016 5.127 1.00 0.26 C ATOM 1562 OE1 GLN A 110 -3.254 2.873 6.182 1.00 1.33 O ATOM 1563 NE2 GLN A 110 -1.358 2.751 5.013 1.00 0.80 N ATOM 0 H GLN A 110 -3.821 0.758 1.115 1.00 0.10 H new ATOM 0 HA GLN A 110 -5.378 3.022 1.785 1.00 0.10 H new ATOM 0 HB2 GLN A 110 -4.503 1.726 3.541 1.00 0.12 H new ATOM 0 HB3 GLN A 110 -2.900 1.667 2.836 1.00 0.12 H new ATOM 0 HG2 GLN A 110 -2.670 4.134 3.307 1.00 0.13 H new ATOM 0 HG3 GLN A 110 -4.212 4.076 4.137 1.00 0.13 H new ATOM 0 HE21 GLN A 110 -0.887 2.883 4.118 1.00 0.80 H new ATOM 0 HE22 GLN A 110 -0.833 2.413 5.820 1.00 0.80 H new ATOM 1572 N ALA A 111 -2.338 3.618 0.635 1.00 0.10 N ATOM 1573 CA ALA A 111 -1.499 4.647 0.034 1.00 0.11 C ATOM 1574 C ALA A 111 -2.089 5.133 -1.278 1.00 0.11 C ATOM 1575 O ALA A 111 -1.899 6.281 -1.673 1.00 0.13 O ATOM 1576 CB ALA A 111 -0.096 4.116 -0.193 1.00 0.15 C ATOM 0 H ALA A 111 -1.894 2.703 0.709 1.00 0.10 H new ATOM 0 HA ALA A 111 -1.454 5.490 0.723 1.00 0.11 H new ATOM 0 HB1 ALA A 111 0.520 4.895 -0.642 1.00 0.15 H new ATOM 0 HB2 ALA A 111 0.338 3.815 0.761 1.00 0.15 H new ATOM 0 HB3 ALA A 111 -0.136 3.255 -0.861 1.00 0.15 H new ATOM 1582 N ALA A 112 -2.789 4.239 -1.951 1.00 0.10 N ATOM 1583 CA ALA A 112 -3.435 4.552 -3.206 1.00 0.13 C ATOM 1584 C ALA A 112 -4.564 5.549 -3.008 1.00 0.13 C ATOM 1585 O ALA A 112 -4.568 6.628 -3.601 1.00 0.19 O ATOM 1586 CB ALA A 112 -3.943 3.268 -3.828 1.00 0.17 C ATOM 0 H ALA A 112 -2.924 3.277 -1.641 1.00 0.10 H new ATOM 0 HA ALA A 112 -2.713 5.018 -3.877 1.00 0.13 H new ATOM 0 HB1 ALA A 112 -4.433 3.492 -4.776 1.00 0.17 H new ATOM 0 HB2 ALA A 112 -3.106 2.592 -4.003 1.00 0.17 H new ATOM 0 HB3 ALA A 112 -4.657 2.795 -3.154 1.00 0.17 H new ATOM 1592 N CYS A 113 -5.496 5.198 -2.142 1.00 0.12 N ATOM 1593 CA CYS A 113 -6.675 6.016 -1.928 1.00 0.14 C ATOM 1594 C CYS A 113 -6.344 7.274 -1.134 1.00 0.13 C ATOM 1595 O CYS A 113 -6.906 8.340 -1.385 1.00 0.15 O ATOM 1596 CB CYS A 113 -7.746 5.216 -1.208 1.00 0.17 C ATOM 1597 SG CYS A 113 -9.330 6.093 -1.053 1.00 0.25 S ATOM 0 H CYS A 113 -5.459 4.351 -1.575 1.00 0.12 H new ATOM 0 HA CYS A 113 -7.049 6.322 -2.905 1.00 0.14 H new ATOM 0 HB2 CYS A 113 -7.909 4.280 -1.743 1.00 0.17 H new ATOM 0 HB3 CYS A 113 -7.386 4.956 -0.213 1.00 0.17 H new ATOM 1602 N ALA A 114 -5.414 7.157 -0.189 1.00 0.14 N ATOM 1603 CA ALA A 114 -5.039 8.288 0.653 1.00 0.16 C ATOM 1604 C ALA A 114 -4.323 9.360 -0.155 1.00 0.17 C ATOM 1605 O ALA A 114 -4.165 10.493 0.297 1.00 0.25 O ATOM 1606 CB ALA A 114 -4.162 7.829 1.809 1.00 0.18 C ATOM 0 H ALA A 114 -4.909 6.294 0.012 1.00 0.14 H new ATOM 0 HA ALA A 114 -5.955 8.719 1.057 1.00 0.16 H new ATOM 0 HB1 ALA A 114 -3.893 8.687 2.425 1.00 0.18 H new ATOM 0 HB2 ALA A 114 -4.707 7.105 2.414 1.00 0.18 H new ATOM 0 HB3 ALA A 114 -3.256 7.366 1.417 1.00 0.18 H new ATOM 1612 N ALA A 115 -3.892 8.993 -1.351 1.00 0.16 N ATOM 1613 CA ALA A 115 -3.162 9.903 -2.207 1.00 0.19 C ATOM 1614 C ALA A 115 -4.076 10.584 -3.215 1.00 0.22 C ATOM 1615 O ALA A 115 -3.828 11.720 -3.619 1.00 0.31 O ATOM 1616 CB ALA A 115 -2.060 9.158 -2.929 1.00 0.18 C ATOM 0 H ALA A 115 -4.038 8.065 -1.749 1.00 0.16 H new ATOM 0 HA ALA A 115 -2.728 10.679 -1.576 1.00 0.19 H new ATOM 0 HB1 ALA A 115 -1.514 9.849 -3.572 1.00 0.18 H new ATOM 0 HB2 ALA A 115 -1.376 8.724 -2.200 1.00 0.18 H new ATOM 0 HB3 ALA A 115 -2.495 8.364 -3.536 1.00 0.18 H new ATOM 1622 N ASP A 116 -5.122 9.883 -3.637 1.00 0.22 N ATOM 1623 CA ASP A 116 -6.027 10.418 -4.640 1.00 0.26 C ATOM 1624 C ASP A 116 -7.005 11.394 -3.997 1.00 0.28 C ATOM 1625 O ASP A 116 -7.610 11.094 -2.966 1.00 0.31 O ATOM 1626 CB ASP A 116 -6.799 9.296 -5.328 1.00 0.30 C ATOM 1627 CG ASP A 116 -7.412 9.734 -6.647 1.00 0.40 C ATOM 1628 OD1 ASP A 116 -8.526 10.294 -6.631 1.00 0.44 O ATOM 1629 OD2 ASP A 116 -6.791 9.513 -7.709 1.00 0.51 O ATOM 0 H ASP A 116 -5.361 8.950 -3.302 1.00 0.22 H new ATOM 0 HA ASP A 116 -5.433 10.942 -5.389 1.00 0.26 H new ATOM 0 HB2 ASP A 116 -6.130 8.454 -5.504 1.00 0.30 H new ATOM 0 HB3 ASP A 116 -7.588 8.942 -4.664 1.00 0.30 H new ATOM 1634 N PRO A 117 -7.184 12.566 -4.609 1.00 0.30 N ATOM 1635 CA PRO A 117 -8.026 13.626 -4.058 1.00 0.34 C ATOM 1636 C PRO A 117 -9.509 13.338 -4.254 1.00 0.35 C ATOM 1637 O PRO A 117 -10.367 13.977 -3.647 1.00 0.40 O ATOM 1638 CB PRO A 117 -7.603 14.857 -4.858 1.00 0.38 C ATOM 1639 CG PRO A 117 -7.137 14.317 -6.169 1.00 0.36 C ATOM 1640 CD PRO A 117 -6.585 12.942 -5.897 1.00 0.31 C ATOM 0 HA PRO A 117 -7.900 13.740 -2.981 1.00 0.34 H new ATOM 0 HB2 PRO A 117 -8.435 15.549 -4.988 1.00 0.38 H new ATOM 0 HB3 PRO A 117 -6.809 15.405 -4.351 1.00 0.38 H new ATOM 0 HG2 PRO A 117 -7.959 14.270 -6.883 1.00 0.36 H new ATOM 0 HG3 PRO A 117 -6.374 14.962 -6.604 1.00 0.36 H new ATOM 0 HD2 PRO A 117 -6.858 12.239 -6.684 1.00 0.31 H new ATOM 0 HD3 PRO A 117 -5.496 12.953 -5.843 1.00 0.31 H new ATOM 1648 N SER A 118 -9.802 12.361 -5.096 1.00 0.36 N ATOM 1649 CA SER A 118 -11.171 12.014 -5.401 1.00 0.40 C ATOM 1650 C SER A 118 -11.533 10.684 -4.748 1.00 0.35 C ATOM 1651 O SER A 118 -12.629 10.162 -4.948 1.00 0.32 O ATOM 1652 CB SER A 118 -11.358 11.943 -6.919 1.00 0.46 C ATOM 1653 OG SER A 118 -12.730 11.928 -7.280 1.00 1.13 O ATOM 0 H SER A 118 -9.104 11.795 -5.579 1.00 0.36 H new ATOM 0 HA SER A 118 -11.836 12.781 -5.003 1.00 0.40 H new ATOM 0 HB2 SER A 118 -10.868 12.798 -7.386 1.00 0.46 H new ATOM 0 HB3 SER A 118 -10.871 11.047 -7.304 1.00 0.46 H new ATOM 0 HG SER A 118 -13.204 11.265 -6.736 1.00 1.13 H new ATOM 1659 N CYS A 119 -10.619 10.149 -3.949 1.00 0.35 N ATOM 1660 CA CYS A 119 -10.848 8.866 -3.312 1.00 0.31 C ATOM 1661 C CYS A 119 -11.197 9.049 -1.843 1.00 0.32 C ATOM 1662 O CYS A 119 -10.566 9.833 -1.131 1.00 0.37 O ATOM 1663 CB CYS A 119 -9.629 7.954 -3.453 1.00 0.31 C ATOM 1664 SG CYS A 119 -9.959 6.223 -2.977 1.00 0.31 S ATOM 0 H CYS A 119 -9.721 10.581 -3.730 1.00 0.35 H new ATOM 0 HA CYS A 119 -11.690 8.392 -3.816 1.00 0.31 H new ATOM 0 HB2 CYS A 119 -9.283 7.979 -4.486 1.00 0.31 H new ATOM 0 HB3 CYS A 119 -8.819 8.344 -2.837 1.00 0.31 H new ATOM 1669 N GLU A 120 -12.213 8.324 -1.402 1.00 0.28 N ATOM 1670 CA GLU A 120 -12.684 8.411 -0.028 1.00 0.29 C ATOM 1671 C GLU A 120 -12.342 7.133 0.717 1.00 0.27 C ATOM 1672 O GLU A 120 -11.731 7.165 1.786 1.00 0.32 O ATOM 1673 CB GLU A 120 -14.200 8.621 0.002 1.00 0.29 C ATOM 1674 CG GLU A 120 -14.696 9.705 -0.940 1.00 0.31 C ATOM 1675 CD GLU A 120 -14.206 11.088 -0.566 1.00 0.36 C ATOM 1676 OE1 GLU A 120 -14.737 11.674 0.395 1.00 0.53 O ATOM 1677 OE2 GLU A 120 -13.277 11.595 -1.227 1.00 0.70 O ATOM 0 H GLU A 120 -12.731 7.663 -1.981 1.00 0.28 H new ATOM 0 HA GLU A 120 -12.195 9.258 0.453 1.00 0.29 H new ATOM 0 HB2 GLU A 120 -14.691 7.682 -0.252 1.00 0.29 H new ATOM 0 HB3 GLU A 120 -14.501 8.873 1.019 1.00 0.29 H new ATOM 0 HG2 GLU A 120 -14.371 9.473 -1.954 1.00 0.31 H new ATOM 0 HG3 GLU A 120 -15.786 9.702 -0.946 1.00 0.31 H new ATOM 1684 N ILE A 121 -12.742 6.004 0.141 1.00 0.21 N ATOM 1685 CA ILE A 121 -12.544 4.713 0.781 1.00 0.19 C ATOM 1686 C ILE A 121 -11.883 3.721 -0.172 1.00 0.15 C ATOM 1687 O ILE A 121 -11.758 3.970 -1.374 1.00 0.15 O ATOM 1688 CB ILE A 121 -13.883 4.096 1.265 1.00 0.21 C ATOM 1689 CG1 ILE A 121 -14.681 3.524 0.087 1.00 0.21 C ATOM 1690 CG2 ILE A 121 -14.722 5.123 2.006 1.00 0.27 C ATOM 1691 CD1 ILE A 121 -14.634 2.014 -0.008 1.00 0.21 C ATOM 0 H ILE A 121 -13.205 5.959 -0.767 1.00 0.21 H new ATOM 0 HA ILE A 121 -11.898 4.896 1.640 1.00 0.19 H new ATOM 0 HB ILE A 121 -13.640 3.285 1.951 1.00 0.21 H new ATOM 0 HG12 ILE A 121 -15.720 3.841 0.176 1.00 0.21 H new ATOM 0 HG13 ILE A 121 -14.297 3.949 -0.840 1.00 0.21 H new ATOM 0 HG21 ILE A 121 -15.654 4.663 2.334 1.00 0.27 H new ATOM 0 HG22 ILE A 121 -14.171 5.485 2.874 1.00 0.27 H new ATOM 0 HG23 ILE A 121 -14.943 5.959 1.343 1.00 0.27 H new ATOM 0 HD11 ILE A 121 -15.221 1.685 -0.865 1.00 0.21 H new ATOM 0 HD12 ILE A 121 -13.601 1.689 -0.130 1.00 0.21 H new ATOM 0 HD13 ILE A 121 -15.046 1.579 0.903 1.00 0.21 H new ATOM 1703 N PHE A 122 -11.517 2.577 0.378 1.00 0.13 N ATOM 1704 CA PHE A 122 -10.960 1.476 -0.393 1.00 0.13 C ATOM 1705 C PHE A 122 -11.285 0.160 0.284 1.00 0.12 C ATOM 1706 O PHE A 122 -11.549 0.126 1.477 1.00 0.20 O ATOM 1707 CB PHE A 122 -9.444 1.605 -0.557 1.00 0.14 C ATOM 1708 CG PHE A 122 -8.696 1.771 0.737 1.00 0.15 C ATOM 1709 CD1 PHE A 122 -8.241 0.665 1.433 1.00 0.17 C ATOM 1710 CD2 PHE A 122 -8.446 3.032 1.252 1.00 0.15 C ATOM 1711 CE1 PHE A 122 -7.555 0.811 2.621 1.00 0.20 C ATOM 1712 CE2 PHE A 122 -7.760 3.186 2.441 1.00 0.18 C ATOM 1713 CZ PHE A 122 -7.314 2.074 3.125 1.00 0.20 C ATOM 0 H PHE A 122 -11.597 2.383 1.376 1.00 0.13 H new ATOM 0 HA PHE A 122 -11.409 1.507 -1.386 1.00 0.13 H new ATOM 0 HB2 PHE A 122 -9.069 0.719 -1.070 1.00 0.14 H new ATOM 0 HB3 PHE A 122 -9.231 2.459 -1.199 1.00 0.14 H new ATOM 0 HD1 PHE A 122 -8.425 -0.325 1.041 1.00 0.17 H new ATOM 0 HD2 PHE A 122 -8.791 3.905 0.718 1.00 0.15 H new ATOM 0 HE1 PHE A 122 -7.207 -0.060 3.156 1.00 0.20 H new ATOM 0 HE2 PHE A 122 -7.573 4.174 2.834 1.00 0.18 H new ATOM 0 HZ PHE A 122 -6.777 2.191 4.054 1.00 0.20 H new ATOM 1723 N THR A 123 -11.271 -0.907 -0.479 1.00 0.13 N ATOM 1724 CA THR A 123 -11.484 -2.243 0.059 1.00 0.13 C ATOM 1725 C THR A 123 -10.455 -3.203 -0.519 1.00 0.13 C ATOM 1726 O THR A 123 -10.339 -3.355 -1.733 1.00 0.22 O ATOM 1727 CB THR A 123 -12.898 -2.779 -0.254 1.00 0.15 C ATOM 1728 OG1 THR A 123 -13.901 -1.831 0.150 1.00 0.17 O ATOM 1729 CG2 THR A 123 -13.132 -4.107 0.458 1.00 0.16 C ATOM 0 H THR A 123 -11.113 -0.882 -1.486 1.00 0.13 H new ATOM 0 HA THR A 123 -11.378 -2.174 1.142 1.00 0.13 H new ATOM 0 HB THR A 123 -12.971 -2.932 -1.331 1.00 0.15 H new ATOM 0 HG1 THR A 123 -14.321 -1.440 -0.645 1.00 0.17 H new ATOM 0 HG21 THR A 123 -14.133 -4.472 0.228 1.00 0.16 H new ATOM 0 HG22 THR A 123 -12.394 -4.835 0.122 1.00 0.16 H new ATOM 0 HG23 THR A 123 -13.037 -3.964 1.534 1.00 0.16 H new ATOM 1737 N TYR A 124 -9.695 -3.826 0.352 1.00 0.12 N ATOM 1738 CA TYR A 124 -8.705 -4.789 -0.056 1.00 0.12 C ATOM 1739 C TYR A 124 -9.241 -6.207 0.047 1.00 0.10 C ATOM 1740 O TYR A 124 -9.545 -6.695 1.127 1.00 0.09 O ATOM 1741 CB TYR A 124 -7.440 -4.657 0.785 1.00 0.13 C ATOM 1742 CG TYR A 124 -6.473 -5.789 0.553 1.00 0.13 C ATOM 1743 CD1 TYR A 124 -6.146 -6.654 1.583 1.00 0.15 C ATOM 1744 CD2 TYR A 124 -5.870 -5.976 -0.684 1.00 0.17 C ATOM 1745 CE1 TYR A 124 -5.244 -7.672 1.395 1.00 0.17 C ATOM 1746 CE2 TYR A 124 -4.966 -7.003 -0.883 1.00 0.20 C ATOM 1747 CZ TYR A 124 -4.735 -7.899 0.089 1.00 0.20 C ATOM 1748 OH TYR A 124 -3.749 -8.865 -0.012 1.00 0.23 O ATOM 0 H TYR A 124 -9.747 -3.678 1.360 1.00 0.12 H new ATOM 0 HA TYR A 124 -8.462 -4.583 -1.098 1.00 0.12 H new ATOM 0 HB2 TYR A 124 -6.950 -3.711 0.553 1.00 0.13 H new ATOM 0 HB3 TYR A 124 -7.711 -4.625 1.840 1.00 0.13 H new ATOM 0 HD1 TYR A 124 -6.608 -6.526 2.551 1.00 0.15 H new ATOM 0 HD2 TYR A 124 -6.110 -5.311 -1.500 1.00 0.17 H new ATOM 0 HE1 TYR A 124 -4.928 -8.288 2.224 1.00 0.17 H new ATOM 0 HE2 TYR A 124 -4.444 -7.085 -1.825 1.00 0.20 H new ATOM 0 HH TYR A 124 -3.443 -8.925 -0.941 1.00 0.23 H new ATOM 1758 N ASN A 125 -9.359 -6.847 -1.092 1.00 0.13 N ATOM 1759 CA ASN A 125 -9.680 -8.249 -1.174 1.00 0.14 C ATOM 1760 C ASN A 125 -8.470 -9.064 -0.784 1.00 0.16 C ATOM 1761 O ASN A 125 -7.499 -9.135 -1.524 1.00 0.20 O ATOM 1762 CB ASN A 125 -10.091 -8.586 -2.604 1.00 0.20 C ATOM 1763 CG ASN A 125 -11.513 -8.195 -2.936 1.00 0.34 C ATOM 1764 OD1 ASN A 125 -12.158 -8.837 -3.758 1.00 0.66 O ATOM 1765 ND2 ASN A 125 -12.003 -7.133 -2.319 1.00 0.24 N ATOM 0 H ASN A 125 -9.233 -6.400 -2.000 1.00 0.13 H new ATOM 0 HA ASN A 125 -10.502 -8.481 -0.496 1.00 0.14 H new ATOM 0 HB2 ASN A 125 -9.415 -8.083 -3.295 1.00 0.20 H new ATOM 0 HB3 ASN A 125 -9.971 -9.658 -2.764 1.00 0.20 H new ATOM 0 HD21 ASN A 125 -12.952 -6.819 -2.520 1.00 0.24 H new ATOM 0 HD22 ASN A 125 -11.432 -6.628 -1.642 1.00 0.24 H new ATOM 1772 N GLU A 126 -8.541 -9.669 0.379 1.00 0.17 N ATOM 1773 CA GLU A 126 -7.459 -10.488 0.887 1.00 0.20 C ATOM 1774 C GLU A 126 -7.421 -11.807 0.128 1.00 0.23 C ATOM 1775 O GLU A 126 -6.426 -12.527 0.142 1.00 0.30 O ATOM 1776 CB GLU A 126 -7.662 -10.737 2.381 1.00 0.22 C ATOM 1777 CG GLU A 126 -8.240 -9.535 3.109 1.00 0.23 C ATOM 1778 CD GLU A 126 -8.175 -9.673 4.616 1.00 0.31 C ATOM 1779 OE1 GLU A 126 -9.202 -10.031 5.232 1.00 0.50 O ATOM 1780 OE2 GLU A 126 -7.094 -9.430 5.190 1.00 0.57 O ATOM 0 H GLU A 126 -9.348 -9.609 1.000 1.00 0.17 H new ATOM 0 HA GLU A 126 -6.509 -9.972 0.744 1.00 0.20 H new ATOM 0 HB2 GLU A 126 -8.327 -11.590 2.515 1.00 0.22 H new ATOM 0 HB3 GLU A 126 -6.706 -11.004 2.833 1.00 0.22 H new ATOM 0 HG2 GLU A 126 -7.698 -8.639 2.807 1.00 0.23 H new ATOM 0 HG3 GLU A 126 -9.278 -9.397 2.806 1.00 0.23 H new ATOM 1787 N HIS A 127 -8.521 -12.095 -0.555 1.00 0.21 N ATOM 1788 CA HIS A 127 -8.666 -13.326 -1.315 1.00 0.23 C ATOM 1789 C HIS A 127 -8.105 -13.164 -2.717 1.00 0.26 C ATOM 1790 O HIS A 127 -7.295 -13.965 -3.171 1.00 0.35 O ATOM 1791 CB HIS A 127 -10.146 -13.709 -1.384 1.00 0.25 C ATOM 1792 CG HIS A 127 -10.435 -14.904 -2.244 1.00 0.71 C ATOM 1793 ND1 HIS A 127 -10.908 -14.798 -3.532 1.00 1.26 N ATOM 1794 CD2 HIS A 127 -10.320 -16.229 -1.994 1.00 0.95 C ATOM 1795 CE1 HIS A 127 -11.070 -16.004 -4.039 1.00 1.74 C ATOM 1796 NE2 HIS A 127 -10.720 -16.894 -3.128 1.00 1.56 N ATOM 0 H HIS A 127 -9.335 -11.482 -0.597 1.00 0.21 H new ATOM 0 HA HIS A 127 -8.106 -14.116 -0.814 1.00 0.23 H new ATOM 0 HB2 HIS A 127 -10.505 -13.907 -0.374 1.00 0.25 H new ATOM 0 HB3 HIS A 127 -10.712 -12.858 -1.763 1.00 0.25 H new ATOM 0 HD1 HIS A 127 -11.103 -13.923 -4.018 1.00 1.26 H new ATOM 0 HD2 HIS A 127 -9.978 -16.680 -1.074 1.00 0.95 H new ATOM 0 HE1 HIS A 127 -11.429 -16.227 -5.033 1.00 1.74 H new ATOM 1804 N ASP A 128 -8.551 -12.123 -3.395 1.00 0.25 N ATOM 1805 CA ASP A 128 -8.139 -11.868 -4.766 1.00 0.29 C ATOM 1806 C ASP A 128 -6.878 -11.031 -4.785 1.00 0.27 C ATOM 1807 O ASP A 128 -6.324 -10.739 -5.845 1.00 0.32 O ATOM 1808 CB ASP A 128 -9.243 -11.132 -5.528 1.00 0.32 C ATOM 1809 CG ASP A 128 -10.540 -11.918 -5.595 1.00 0.72 C ATOM 1810 OD1 ASP A 128 -11.003 -12.210 -6.715 1.00 0.72 O ATOM 1811 OD2 ASP A 128 -11.103 -12.244 -4.529 1.00 1.33 O ATOM 0 H ASP A 128 -9.203 -11.435 -3.017 1.00 0.25 H new ATOM 0 HA ASP A 128 -7.947 -12.826 -5.249 1.00 0.29 H new ATOM 0 HB2 ASP A 128 -9.431 -10.172 -5.048 1.00 0.32 H new ATOM 0 HB3 ASP A 128 -8.900 -10.920 -6.541 1.00 0.32 H new ATOM 1816 N GLN A 129 -6.441 -10.659 -3.581 1.00 0.21 N ATOM 1817 CA GLN A 129 -5.338 -9.728 -3.393 1.00 0.21 C ATOM 1818 C GLN A 129 -5.572 -8.480 -4.223 1.00 0.18 C ATOM 1819 O GLN A 129 -4.751 -8.110 -5.047 1.00 0.18 O ATOM 1820 CB GLN A 129 -3.991 -10.372 -3.736 1.00 0.30 C ATOM 1821 CG GLN A 129 -3.584 -11.472 -2.767 1.00 0.53 C ATOM 1822 CD GLN A 129 -4.253 -12.797 -3.065 1.00 0.72 C ATOM 1823 OE1 GLN A 129 -4.529 -13.119 -4.220 1.00 1.75 O ATOM 1824 NE2 GLN A 129 -4.539 -13.566 -2.027 1.00 0.69 N ATOM 0 H GLN A 129 -6.846 -10.999 -2.709 1.00 0.21 H new ATOM 0 HA GLN A 129 -5.300 -9.450 -2.340 1.00 0.21 H new ATOM 0 HB2 GLN A 129 -4.040 -10.785 -4.743 1.00 0.30 H new ATOM 0 HB3 GLN A 129 -3.220 -9.602 -3.745 1.00 0.30 H new ATOM 0 HG2 GLN A 129 -2.502 -11.600 -2.805 1.00 0.53 H new ATOM 0 HG3 GLN A 129 -3.833 -11.165 -1.751 1.00 0.53 H new ATOM 0 HE21 GLN A 129 -4.293 -13.263 -1.085 1.00 0.69 H new ATOM 0 HE22 GLN A 129 -5.005 -14.462 -2.169 1.00 0.69 H new ATOM 1833 N LYS A 130 -6.701 -7.829 -3.998 1.00 0.17 N ATOM 1834 CA LYS A 130 -7.104 -6.729 -4.852 1.00 0.16 C ATOM 1835 C LYS A 130 -7.599 -5.536 -4.047 1.00 0.18 C ATOM 1836 O LYS A 130 -8.162 -5.687 -2.981 1.00 0.26 O ATOM 1837 CB LYS A 130 -8.212 -7.172 -5.799 1.00 0.18 C ATOM 1838 CG LYS A 130 -8.159 -6.492 -7.143 1.00 0.18 C ATOM 1839 CD LYS A 130 -9.232 -7.016 -8.067 1.00 0.22 C ATOM 1840 CE LYS A 130 -10.600 -6.953 -7.415 1.00 0.26 C ATOM 1841 NZ LYS A 130 -10.921 -8.176 -6.625 1.00 1.15 N ATOM 0 H LYS A 130 -7.348 -8.042 -3.239 1.00 0.17 H new ATOM 0 HA LYS A 130 -6.222 -6.427 -5.417 1.00 0.16 H new ATOM 0 HB2 LYS A 130 -8.147 -8.250 -5.943 1.00 0.18 H new ATOM 0 HB3 LYS A 130 -9.178 -6.970 -5.336 1.00 0.18 H new ATOM 0 HG2 LYS A 130 -8.281 -5.417 -7.014 1.00 0.18 H new ATOM 0 HG3 LYS A 130 -7.179 -6.650 -7.594 1.00 0.18 H new ATOM 0 HD2 LYS A 130 -9.239 -6.433 -8.988 1.00 0.22 H new ATOM 0 HD3 LYS A 130 -9.006 -8.046 -8.344 1.00 0.22 H new ATOM 0 HE2 LYS A 130 -10.646 -6.082 -6.762 1.00 0.26 H new ATOM 0 HE3 LYS A 130 -11.358 -6.814 -8.185 1.00 0.26 H new ATOM 0 HZ1 LYS A 130 -11.756 -8.643 -7.032 1.00 1.15 H new ATOM 0 HZ2 LYS A 130 -10.112 -8.829 -6.652 1.00 1.15 H new ATOM 0 HZ3 LYS A 130 -11.119 -7.910 -5.639 1.00 1.15 H new ATOM 1855 N CYS A 131 -7.398 -4.361 -4.592 1.00 0.16 N ATOM 1856 CA CYS A 131 -7.899 -3.135 -4.016 1.00 0.16 C ATOM 1857 C CYS A 131 -9.100 -2.664 -4.807 1.00 0.14 C ATOM 1858 O CYS A 131 -9.138 -2.829 -6.016 1.00 0.20 O ATOM 1859 CB CYS A 131 -6.840 -2.048 -4.095 1.00 0.20 C ATOM 1860 SG CYS A 131 -5.231 -2.478 -3.366 1.00 0.26 S ATOM 0 H CYS A 131 -6.876 -4.227 -5.458 1.00 0.16 H new ATOM 0 HA CYS A 131 -8.166 -3.325 -2.976 1.00 0.16 H new ATOM 0 HB2 CYS A 131 -6.688 -1.787 -5.142 1.00 0.20 H new ATOM 0 HB3 CYS A 131 -7.220 -1.156 -3.596 1.00 0.20 H new ATOM 1865 N THR A 132 -10.065 -2.091 -4.135 1.00 0.17 N ATOM 1866 CA THR A 132 -11.172 -1.435 -4.802 1.00 0.18 C ATOM 1867 C THR A 132 -11.369 -0.055 -4.196 1.00 0.19 C ATOM 1868 O THR A 132 -11.328 0.101 -2.981 1.00 0.25 O ATOM 1869 CB THR A 132 -12.478 -2.252 -4.705 1.00 0.20 C ATOM 1870 OG1 THR A 132 -12.769 -2.558 -3.339 1.00 0.22 O ATOM 1871 CG2 THR A 132 -12.379 -3.541 -5.508 1.00 0.25 C ATOM 0 H THR A 132 -10.111 -2.063 -3.116 1.00 0.17 H new ATOM 0 HA THR A 132 -10.928 -1.350 -5.861 1.00 0.18 H new ATOM 0 HB THR A 132 -13.284 -1.647 -5.120 1.00 0.20 H new ATOM 0 HG1 THR A 132 -11.975 -2.945 -2.914 1.00 0.22 H new ATOM 0 HG21 THR A 132 -13.313 -4.096 -5.421 1.00 0.25 H new ATOM 0 HG22 THR A 132 -12.194 -3.304 -6.556 1.00 0.25 H new ATOM 0 HG23 THR A 132 -11.559 -4.148 -5.123 1.00 0.25 H new ATOM 1879 N PHE A 133 -11.548 0.948 -5.036 1.00 0.17 N ATOM 1880 CA PHE A 133 -11.598 2.327 -4.563 1.00 0.18 C ATOM 1881 C PHE A 133 -12.939 2.957 -4.884 1.00 0.18 C ATOM 1882 O PHE A 133 -13.368 2.955 -6.033 1.00 0.20 O ATOM 1883 CB PHE A 133 -10.470 3.128 -5.204 1.00 0.19 C ATOM 1884 CG PHE A 133 -9.121 2.512 -4.983 1.00 0.18 C ATOM 1885 CD1 PHE A 133 -8.517 1.762 -5.975 1.00 0.18 C ATOM 1886 CD2 PHE A 133 -8.472 2.669 -3.779 1.00 0.19 C ATOM 1887 CE1 PHE A 133 -7.285 1.179 -5.768 1.00 0.18 C ATOM 1888 CE2 PHE A 133 -7.237 2.093 -3.562 1.00 0.19 C ATOM 1889 CZ PHE A 133 -6.644 1.344 -4.558 1.00 0.18 C ATOM 0 H PHE A 133 -11.661 0.839 -6.044 1.00 0.17 H new ATOM 0 HA PHE A 133 -11.473 2.332 -3.480 1.00 0.18 H new ATOM 0 HB2 PHE A 133 -10.654 3.213 -6.275 1.00 0.19 H new ATOM 0 HB3 PHE A 133 -10.473 4.140 -4.798 1.00 0.19 H new ATOM 0 HD1 PHE A 133 -9.016 1.631 -6.924 1.00 0.18 H new ATOM 0 HD2 PHE A 133 -8.935 3.250 -2.995 1.00 0.19 H new ATOM 0 HE1 PHE A 133 -6.823 0.595 -6.551 1.00 0.18 H new ATOM 0 HE2 PHE A 133 -6.736 2.228 -2.615 1.00 0.19 H new ATOM 0 HZ PHE A 133 -5.680 0.888 -4.390 1.00 0.18 H new ATOM 1899 N LYS A 134 -13.588 3.510 -3.870 1.00 0.18 N ATOM 1900 CA LYS A 134 -14.936 4.043 -4.019 1.00 0.20 C ATOM 1901 C LYS A 134 -15.043 5.434 -3.408 1.00 0.21 C ATOM 1902 O LYS A 134 -14.308 5.778 -2.478 1.00 0.20 O ATOM 1903 CB LYS A 134 -15.939 3.112 -3.351 1.00 0.21 C ATOM 1904 CG LYS A 134 -15.979 1.709 -3.950 1.00 0.26 C ATOM 1905 CD LYS A 134 -16.320 1.720 -5.424 1.00 0.55 C ATOM 1906 CE LYS A 134 -16.513 0.314 -5.965 1.00 0.56 C ATOM 1907 NZ LYS A 134 -15.334 -0.555 -5.719 1.00 0.72 N ATOM 0 H LYS A 134 -13.201 3.602 -2.931 1.00 0.18 H new ATOM 0 HA LYS A 134 -15.158 4.115 -5.084 1.00 0.20 H new ATOM 0 HB2 LYS A 134 -15.698 3.036 -2.291 1.00 0.21 H new ATOM 0 HB3 LYS A 134 -16.933 3.554 -3.422 1.00 0.21 H new ATOM 0 HG2 LYS A 134 -15.011 1.228 -3.807 1.00 0.26 H new ATOM 0 HG3 LYS A 134 -16.715 1.109 -3.414 1.00 0.26 H new ATOM 0 HD2 LYS A 134 -17.229 2.299 -5.583 1.00 0.55 H new ATOM 0 HD3 LYS A 134 -15.524 2.217 -5.978 1.00 0.55 H new ATOM 0 HE2 LYS A 134 -17.393 -0.133 -5.502 1.00 0.56 H new ATOM 0 HE3 LYS A 134 -16.707 0.364 -7.036 1.00 0.56 H new ATOM 0 HZ1 LYS A 134 -15.262 -1.264 -6.476 1.00 0.72 H new ATOM 0 HZ2 LYS A 134 -14.471 0.026 -5.705 1.00 0.72 H new ATOM 0 HZ3 LYS A 134 -15.442 -1.036 -4.803 1.00 0.72 H new ATOM 1921 N GLY A 135 -15.953 6.232 -3.947 1.00 0.25 N ATOM 1922 CA GLY A 135 -16.166 7.570 -3.439 1.00 0.29 C ATOM 1923 C GLY A 135 -17.442 7.687 -2.637 1.00 0.31 C ATOM 1924 O GLY A 135 -18.028 6.677 -2.244 1.00 0.35 O ATOM 0 H GLY A 135 -16.551 5.974 -4.732 1.00 0.25 H new ATOM 0 HA2 GLY A 135 -15.320 7.857 -2.814 1.00 0.29 H new ATOM 0 HA3 GLY A 135 -16.199 8.271 -4.273 1.00 0.29 H new ATOM 1928 N ARG A 136 -17.873 8.923 -2.403 1.00 0.33 N ATOM 1929 CA ARG A 136 -19.055 9.203 -1.600 1.00 0.40 C ATOM 1930 C ARG A 136 -20.294 8.477 -2.111 1.00 0.39 C ATOM 1931 O ARG A 136 -20.518 8.364 -3.320 1.00 0.43 O ATOM 1932 CB ARG A 136 -19.277 10.701 -1.552 1.00 0.51 C ATOM 1933 CG ARG A 136 -18.200 11.390 -0.746 1.00 0.55 C ATOM 1934 CD ARG A 136 -18.384 11.144 0.742 1.00 1.03 C ATOM 1935 NE ARG A 136 -17.159 11.370 1.507 1.00 1.91 N ATOM 1936 CZ ARG A 136 -17.058 11.167 2.819 1.00 2.55 C ATOM 1937 NH1 ARG A 136 -18.112 10.755 3.511 1.00 2.53 N ATOM 1938 NH2 ARG A 136 -15.902 11.370 3.436 1.00 3.44 N ATOM 0 H ARG A 136 -17.412 9.757 -2.765 1.00 0.33 H new ATOM 0 HA ARG A 136 -18.881 8.826 -0.592 1.00 0.40 H new ATOM 0 HB2 ARG A 136 -19.288 11.102 -2.566 1.00 0.51 H new ATOM 0 HB3 ARG A 136 -20.253 10.912 -1.115 1.00 0.51 H new ATOM 0 HG2 ARG A 136 -17.221 11.028 -1.059 1.00 0.55 H new ATOM 0 HG3 ARG A 136 -18.222 12.461 -0.945 1.00 0.55 H new ATOM 0 HD2 ARG A 136 -19.169 11.799 1.120 1.00 1.03 H new ATOM 0 HD3 ARG A 136 -18.721 10.119 0.898 1.00 1.03 H new ATOM 0 HE ARG A 136 -16.334 11.702 1.007 1.00 1.91 H new ATOM 0 HH11 ARG A 136 -19.001 10.593 3.038 1.00 2.53 H new ATOM 0 HH12 ARG A 136 -18.033 10.600 4.516 1.00 2.53 H new ATOM 0 HH21 ARG A 136 -15.089 11.682 2.905 1.00 3.44 H new ATOM 0 HH22 ARG A 136 -15.826 11.214 4.441 1.00 3.44 H new ATOM 1952 N GLY A 137 -21.091 7.987 -1.173 1.00 0.37 N ATOM 1953 CA GLY A 137 -22.225 7.153 -1.510 1.00 0.37 C ATOM 1954 C GLY A 137 -21.947 5.707 -1.169 1.00 0.33 C ATOM 1955 O GLY A 137 -22.817 4.845 -1.275 1.00 0.35 O ATOM 0 H GLY A 137 -20.970 8.155 -0.174 1.00 0.37 H new ATOM 0 HA2 GLY A 137 -23.108 7.496 -0.970 1.00 0.37 H new ATOM 0 HA3 GLY A 137 -22.446 7.245 -2.573 1.00 0.37 H new ATOM 1959 N PHE A 138 -20.718 5.461 -0.731 1.00 0.31 N ATOM 1960 CA PHE A 138 -20.245 4.123 -0.417 1.00 0.30 C ATOM 1961 C PHE A 138 -21.082 3.456 0.674 1.00 0.35 C ATOM 1962 O PHE A 138 -21.308 2.250 0.629 1.00 0.38 O ATOM 1963 CB PHE A 138 -18.763 4.179 -0.009 1.00 0.29 C ATOM 1964 CG PHE A 138 -18.455 5.144 1.110 1.00 0.33 C ATOM 1965 CD1 PHE A 138 -18.183 6.476 0.843 1.00 0.36 C ATOM 1966 CD2 PHE A 138 -18.446 4.716 2.428 1.00 0.38 C ATOM 1967 CE1 PHE A 138 -17.906 7.361 1.867 1.00 0.42 C ATOM 1968 CE2 PHE A 138 -18.169 5.596 3.457 1.00 0.43 C ATOM 1969 CZ PHE A 138 -17.875 6.923 3.167 1.00 0.44 C ATOM 0 H PHE A 138 -20.020 6.190 -0.584 1.00 0.31 H new ATOM 0 HA PHE A 138 -20.351 3.512 -1.313 1.00 0.30 H new ATOM 0 HB2 PHE A 138 -18.445 3.181 0.292 1.00 0.29 H new ATOM 0 HB3 PHE A 138 -18.170 4.453 -0.881 1.00 0.29 H new ATOM 0 HD1 PHE A 138 -18.188 6.827 -0.178 1.00 0.36 H new ATOM 0 HD2 PHE A 138 -18.658 3.681 2.654 1.00 0.38 H new ATOM 0 HE1 PHE A 138 -17.713 8.400 1.644 1.00 0.42 H new ATOM 0 HE2 PHE A 138 -18.181 5.254 4.481 1.00 0.43 H new ATOM 0 HZ PHE A 138 -17.623 7.608 3.963 1.00 0.44 H new ATOM 1979 N SER A 139 -21.567 4.242 1.627 1.00 0.41 N ATOM 1980 CA SER A 139 -22.294 3.701 2.773 1.00 0.50 C ATOM 1981 C SER A 139 -23.608 3.033 2.351 1.00 0.44 C ATOM 1982 O SER A 139 -24.136 2.178 3.061 1.00 0.49 O ATOM 1983 CB SER A 139 -22.568 4.810 3.782 1.00 0.60 C ATOM 1984 OG SER A 139 -21.370 5.491 4.122 1.00 1.47 O ATOM 0 H SER A 139 -21.471 5.257 1.631 1.00 0.41 H new ATOM 0 HA SER A 139 -21.670 2.935 3.233 1.00 0.50 H new ATOM 0 HB2 SER A 139 -23.287 5.516 3.367 1.00 0.60 H new ATOM 0 HB3 SER A 139 -23.018 4.387 4.680 1.00 0.60 H new ATOM 0 HG SER A 139 -20.612 5.067 3.667 1.00 1.47 H new ATOM 1990 N ALA A 140 -24.126 3.419 1.192 1.00 0.37 N ATOM 1991 CA ALA A 140 -25.341 2.819 0.663 1.00 0.38 C ATOM 1992 C ALA A 140 -25.023 1.487 0.006 1.00 0.39 C ATOM 1993 O ALA A 140 -25.860 0.586 -0.057 1.00 0.53 O ATOM 1994 CB ALA A 140 -25.984 3.749 -0.343 1.00 0.39 C ATOM 0 H ALA A 140 -23.722 4.146 0.601 1.00 0.37 H new ATOM 0 HA ALA A 140 -26.036 2.651 1.486 1.00 0.38 H new ATOM 0 HB1 ALA A 140 -26.893 3.291 -0.733 1.00 0.39 H new ATOM 0 HB2 ALA A 140 -26.233 4.693 0.142 1.00 0.39 H new ATOM 0 HB3 ALA A 140 -25.290 3.934 -1.163 1.00 0.39 H new ATOM 2000 N PHE A 141 -23.792 1.367 -0.453 1.00 0.31 N ATOM 2001 CA PHE A 141 -23.346 0.193 -1.174 1.00 0.30 C ATOM 2002 C PHE A 141 -22.365 -0.585 -0.319 1.00 0.30 C ATOM 2003 O PHE A 141 -21.436 -1.222 -0.817 1.00 0.31 O ATOM 2004 CB PHE A 141 -22.696 0.615 -2.487 1.00 0.28 C ATOM 2005 CG PHE A 141 -23.630 1.357 -3.403 1.00 0.28 C ATOM 2006 CD1 PHE A 141 -24.575 0.674 -4.149 1.00 0.30 C ATOM 2007 CD2 PHE A 141 -23.559 2.735 -3.517 1.00 0.29 C ATOM 2008 CE1 PHE A 141 -25.435 1.352 -4.992 1.00 0.33 C ATOM 2009 CE2 PHE A 141 -24.416 3.419 -4.358 1.00 0.31 C ATOM 2010 CZ PHE A 141 -25.355 2.729 -5.093 1.00 0.32 C ATOM 0 H PHE A 141 -23.074 2.082 -0.336 1.00 0.31 H new ATOM 0 HA PHE A 141 -24.199 -0.447 -1.398 1.00 0.30 H new ATOM 0 HB2 PHE A 141 -21.833 1.245 -2.271 1.00 0.28 H new ATOM 0 HB3 PHE A 141 -22.323 -0.271 -3.001 1.00 0.28 H new ATOM 0 HD1 PHE A 141 -24.641 -0.401 -4.071 1.00 0.30 H new ATOM 0 HD2 PHE A 141 -22.826 3.281 -2.942 1.00 0.29 H new ATOM 0 HE1 PHE A 141 -26.167 0.808 -5.570 1.00 0.33 H new ATOM 0 HE2 PHE A 141 -24.350 4.494 -4.439 1.00 0.31 H new ATOM 0 HZ PHE A 141 -26.028 3.263 -5.747 1.00 0.32 H new ATOM 2020 N LYS A 142 -22.577 -0.503 0.979 1.00 0.31 N ATOM 2021 CA LYS A 142 -21.715 -1.155 1.940 1.00 0.30 C ATOM 2022 C LYS A 142 -22.161 -2.589 2.200 1.00 0.28 C ATOM 2023 O LYS A 142 -23.347 -2.859 2.378 1.00 0.35 O ATOM 2024 CB LYS A 142 -21.715 -0.367 3.242 1.00 0.32 C ATOM 2025 CG LYS A 142 -20.901 -1.022 4.336 1.00 0.37 C ATOM 2026 CD LYS A 142 -20.850 -0.164 5.579 1.00 0.38 C ATOM 2027 CE LYS A 142 -19.923 -0.770 6.608 1.00 0.46 C ATOM 2028 NZ LYS A 142 -19.747 0.109 7.791 1.00 0.50 N ATOM 0 H LYS A 142 -23.350 0.016 1.395 1.00 0.31 H new ATOM 0 HA LYS A 142 -20.706 -1.186 1.529 1.00 0.30 H new ATOM 0 HB2 LYS A 142 -21.322 0.632 3.054 1.00 0.32 H new ATOM 0 HB3 LYS A 142 -22.742 -0.246 3.586 1.00 0.32 H new ATOM 0 HG2 LYS A 142 -21.333 -1.993 4.580 1.00 0.37 H new ATOM 0 HG3 LYS A 142 -19.888 -1.205 3.977 1.00 0.37 H new ATOM 0 HD2 LYS A 142 -20.510 0.839 5.321 1.00 0.38 H new ATOM 0 HD3 LYS A 142 -21.851 -0.063 5.999 1.00 0.38 H new ATOM 0 HE2 LYS A 142 -20.319 -1.733 6.929 1.00 0.46 H new ATOM 0 HE3 LYS A 142 -18.952 -0.961 6.152 1.00 0.46 H new ATOM 0 HZ1 LYS A 142 -19.104 -0.347 8.470 1.00 0.50 H new ATOM 0 HZ2 LYS A 142 -19.344 1.019 7.490 1.00 0.50 H new ATOM 0 HZ3 LYS A 142 -20.669 0.271 8.243 1.00 0.50 H new ATOM 2042 N GLU A 143 -21.202 -3.499 2.220 1.00 0.25 N ATOM 2043 CA GLU A 143 -21.475 -4.898 2.506 1.00 0.25 C ATOM 2044 C GLU A 143 -20.689 -5.330 3.737 1.00 0.23 C ATOM 2045 O GLU A 143 -19.467 -5.405 3.695 1.00 0.23 O ATOM 2046 CB GLU A 143 -21.088 -5.768 1.305 1.00 0.29 C ATOM 2047 CG GLU A 143 -21.897 -7.049 1.194 1.00 0.33 C ATOM 2048 CD GLU A 143 -21.578 -7.823 -0.065 1.00 0.43 C ATOM 2049 OE1 GLU A 143 -20.936 -8.889 0.033 1.00 0.73 O ATOM 2050 OE2 GLU A 143 -21.959 -7.365 -1.161 1.00 0.52 O ATOM 0 H GLU A 143 -20.220 -3.292 2.040 1.00 0.25 H new ATOM 0 HA GLU A 143 -22.541 -5.022 2.698 1.00 0.25 H new ATOM 0 HB2 GLU A 143 -21.215 -5.188 0.391 1.00 0.29 H new ATOM 0 HB3 GLU A 143 -20.030 -6.022 1.377 1.00 0.29 H new ATOM 0 HG2 GLU A 143 -21.700 -7.677 2.063 1.00 0.33 H new ATOM 0 HG3 GLU A 143 -22.960 -6.807 1.210 1.00 0.33 H new ATOM 2057 N ARG A 144 -21.384 -5.582 4.838 1.00 0.23 N ATOM 2058 CA ARG A 144 -20.729 -6.010 6.070 1.00 0.23 C ATOM 2059 C ARG A 144 -20.640 -7.524 6.132 1.00 0.23 C ATOM 2060 O ARG A 144 -21.531 -8.226 5.648 1.00 0.29 O ATOM 2061 CB ARG A 144 -21.477 -5.514 7.313 1.00 0.30 C ATOM 2062 CG ARG A 144 -21.567 -4.004 7.442 1.00 0.35 C ATOM 2063 CD ARG A 144 -22.672 -3.429 6.569 1.00 0.34 C ATOM 2064 NE ARG A 144 -23.940 -4.129 6.779 1.00 0.49 N ATOM 2065 CZ ARG A 144 -25.067 -3.867 6.119 1.00 0.57 C ATOM 2066 NH1 ARG A 144 -25.128 -2.865 5.250 1.00 0.71 N ATOM 2067 NH2 ARG A 144 -26.144 -4.603 6.345 1.00 0.77 N ATOM 0 H ARG A 144 -22.398 -5.498 4.905 1.00 0.23 H new ATOM 0 HA ARG A 144 -19.729 -5.576 6.062 1.00 0.23 H new ATOM 0 HB2 ARG A 144 -22.487 -5.924 7.300 1.00 0.30 H new ATOM 0 HB3 ARG A 144 -20.983 -5.911 8.200 1.00 0.30 H new ATOM 0 HG2 ARG A 144 -21.750 -3.738 8.483 1.00 0.35 H new ATOM 0 HG3 ARG A 144 -20.613 -3.557 7.162 1.00 0.35 H new ATOM 0 HD2 ARG A 144 -22.799 -2.370 6.791 1.00 0.34 H new ATOM 0 HD3 ARG A 144 -22.384 -3.502 5.520 1.00 0.34 H new ATOM 0 HE ARG A 144 -23.962 -4.870 7.480 1.00 0.49 H new ATOM 0 HH11 ARG A 144 -24.306 -2.285 5.081 1.00 0.71 H new ATOM 0 HH12 ARG A 144 -25.997 -2.675 4.751 1.00 0.71 H new ATOM 0 HH21 ARG A 144 -26.108 -5.366 7.021 1.00 0.77 H new ATOM 0 HH22 ARG A 144 -27.010 -4.407 5.843 1.00 0.77 H new ATOM 2081 N GLY A 145 -19.566 -8.020 6.721 1.00 0.21 N ATOM 2082 CA GLY A 145 -19.429 -9.447 6.931 1.00 0.25 C ATOM 2083 C GLY A 145 -18.945 -10.155 5.691 1.00 0.22 C ATOM 2084 O GLY A 145 -19.337 -11.287 5.414 1.00 0.25 O ATOM 0 H GLY A 145 -18.783 -7.460 7.059 1.00 0.21 H new ATOM 0 HA2 GLY A 145 -18.731 -9.628 7.748 1.00 0.25 H new ATOM 0 HA3 GLY A 145 -20.390 -9.863 7.235 1.00 0.25 H new ATOM 2088 N VAL A 146 -18.098 -9.477 4.939 1.00 0.19 N ATOM 2089 CA VAL A 146 -17.547 -10.028 3.715 1.00 0.18 C ATOM 2090 C VAL A 146 -16.179 -10.632 3.990 1.00 0.17 C ATOM 2091 O VAL A 146 -15.215 -9.913 4.245 1.00 0.17 O ATOM 2092 CB VAL A 146 -17.420 -8.939 2.629 1.00 0.16 C ATOM 2093 CG1 VAL A 146 -16.971 -9.528 1.303 1.00 0.17 C ATOM 2094 CG2 VAL A 146 -18.731 -8.198 2.461 1.00 0.20 C ATOM 0 H VAL A 146 -17.774 -8.535 5.157 1.00 0.19 H new ATOM 0 HA VAL A 146 -18.224 -10.802 3.354 1.00 0.18 H new ATOM 0 HB VAL A 146 -16.658 -8.232 2.957 1.00 0.16 H new ATOM 0 HG11 VAL A 146 -16.892 -8.734 0.560 1.00 0.17 H new ATOM 0 HG12 VAL A 146 -16.000 -10.007 1.428 1.00 0.17 H new ATOM 0 HG13 VAL A 146 -17.699 -10.267 0.968 1.00 0.17 H new ATOM 0 HG21 VAL A 146 -18.621 -7.434 1.691 1.00 0.20 H new ATOM 0 HG22 VAL A 146 -19.511 -8.900 2.167 1.00 0.20 H new ATOM 0 HG23 VAL A 146 -19.005 -7.725 3.404 1.00 0.20 H new ATOM 2104 N LEU A 147 -16.099 -11.950 3.978 1.00 0.21 N ATOM 2105 CA LEU A 147 -14.836 -12.623 4.215 1.00 0.22 C ATOM 2106 C LEU A 147 -13.890 -12.410 3.052 1.00 0.21 C ATOM 2107 O LEU A 147 -14.276 -12.531 1.889 1.00 0.23 O ATOM 2108 CB LEU A 147 -15.047 -14.113 4.438 1.00 0.29 C ATOM 2109 CG LEU A 147 -15.919 -14.464 5.641 1.00 0.35 C ATOM 2110 CD1 LEU A 147 -16.065 -15.970 5.780 1.00 0.41 C ATOM 2111 CD2 LEU A 147 -15.331 -13.864 6.905 1.00 0.37 C ATOM 0 H LEU A 147 -16.889 -12.572 3.808 1.00 0.21 H new ATOM 0 HA LEU A 147 -14.395 -12.193 5.115 1.00 0.22 H new ATOM 0 HB2 LEU A 147 -15.499 -14.539 3.543 1.00 0.29 H new ATOM 0 HB3 LEU A 147 -14.074 -14.589 4.561 1.00 0.29 H new ATOM 0 HG LEU A 147 -16.912 -14.043 5.484 1.00 0.35 H new ATOM 0 HD11 LEU A 147 -16.690 -16.197 6.644 1.00 0.41 H new ATOM 0 HD12 LEU A 147 -16.528 -16.375 4.880 1.00 0.41 H new ATOM 0 HD13 LEU A 147 -15.082 -16.420 5.916 1.00 0.41 H new ATOM 0 HD21 LEU A 147 -15.961 -14.121 7.757 1.00 0.37 H new ATOM 0 HD22 LEU A 147 -14.328 -14.260 7.063 1.00 0.37 H new ATOM 0 HD23 LEU A 147 -15.281 -12.780 6.804 1.00 0.37 H new ATOM 2123 N GLY A 148 -12.657 -12.078 3.372 1.00 0.22 N ATOM 2124 CA GLY A 148 -11.656 -11.923 2.353 1.00 0.24 C ATOM 2125 C GLY A 148 -11.534 -10.507 1.857 1.00 0.19 C ATOM 2126 O GLY A 148 -11.032 -10.283 0.760 1.00 0.19 O ATOM 0 H GLY A 148 -12.331 -11.913 4.324 1.00 0.22 H new ATOM 0 HA2 GLY A 148 -10.693 -12.249 2.746 1.00 0.24 H new ATOM 0 HA3 GLY A 148 -11.896 -12.576 1.514 1.00 0.24 H new ATOM 2130 N VAL A 149 -12.004 -9.546 2.643 1.00 0.17 N ATOM 2131 CA VAL A 149 -11.854 -8.143 2.283 1.00 0.13 C ATOM 2132 C VAL A 149 -11.605 -7.272 3.510 1.00 0.13 C ATOM 2133 O VAL A 149 -11.932 -7.640 4.641 1.00 0.17 O ATOM 2134 CB VAL A 149 -13.074 -7.587 1.519 1.00 0.13 C ATOM 2135 CG1 VAL A 149 -13.310 -8.335 0.218 1.00 0.15 C ATOM 2136 CG2 VAL A 149 -14.301 -7.637 2.388 1.00 0.15 C ATOM 0 H VAL A 149 -12.488 -9.711 3.526 1.00 0.17 H new ATOM 0 HA VAL A 149 -10.988 -8.105 1.623 1.00 0.13 H new ATOM 0 HB VAL A 149 -12.863 -6.548 1.265 1.00 0.13 H new ATOM 0 HG11 VAL A 149 -14.177 -7.915 -0.291 1.00 0.15 H new ATOM 0 HG12 VAL A 149 -12.432 -8.239 -0.421 1.00 0.15 H new ATOM 0 HG13 VAL A 149 -13.490 -9.389 0.432 1.00 0.15 H new ATOM 0 HG21 VAL A 149 -15.154 -7.242 1.836 1.00 0.15 H new ATOM 0 HG22 VAL A 149 -14.501 -8.669 2.675 1.00 0.15 H new ATOM 0 HG23 VAL A 149 -14.138 -7.036 3.283 1.00 0.15 H new ATOM 2146 N THR A 150 -11.015 -6.119 3.258 1.00 0.13 N ATOM 2147 CA THR A 150 -10.700 -5.145 4.282 1.00 0.15 C ATOM 2148 C THR A 150 -10.854 -3.736 3.722 1.00 0.14 C ATOM 2149 O THR A 150 -10.132 -3.345 2.814 1.00 0.15 O ATOM 2150 CB THR A 150 -9.259 -5.344 4.784 1.00 0.17 C ATOM 2151 OG1 THR A 150 -9.197 -6.477 5.658 1.00 0.20 O ATOM 2152 CG2 THR A 150 -8.748 -4.099 5.487 1.00 0.19 C ATOM 0 H THR A 150 -10.737 -5.830 2.320 1.00 0.13 H new ATOM 0 HA THR A 150 -11.388 -5.282 5.116 1.00 0.15 H new ATOM 0 HB THR A 150 -8.617 -5.527 3.922 1.00 0.17 H new ATOM 0 HG1 THR A 150 -10.051 -6.957 5.633 1.00 0.20 H new ATOM 0 HG21 THR A 150 -7.728 -4.268 5.831 1.00 0.19 H new ATOM 0 HG22 THR A 150 -8.762 -3.258 4.794 1.00 0.19 H new ATOM 0 HG23 THR A 150 -9.387 -3.876 6.342 1.00 0.19 H new ATOM 2160 N SER A 151 -11.780 -2.970 4.257 1.00 0.15 N ATOM 2161 CA SER A 151 -12.053 -1.660 3.703 1.00 0.16 C ATOM 2162 C SER A 151 -11.557 -0.549 4.615 1.00 0.20 C ATOM 2163 O SER A 151 -11.773 -0.574 5.811 1.00 0.45 O ATOM 2164 CB SER A 151 -13.547 -1.510 3.442 1.00 0.20 C ATOM 2165 OG SER A 151 -13.820 -0.323 2.721 1.00 1.06 O ATOM 0 H SER A 151 -12.350 -3.226 5.063 1.00 0.15 H new ATOM 0 HA SER A 151 -11.512 -1.572 2.761 1.00 0.16 H new ATOM 0 HB2 SER A 151 -13.910 -2.372 2.882 1.00 0.20 H new ATOM 0 HB3 SER A 151 -14.086 -1.496 4.390 1.00 0.20 H new ATOM 0 HG SER A 151 -14.789 -0.187 2.670 1.00 1.06 H new ATOM 2171 N GLY A 152 -10.903 0.434 4.026 1.00 0.14 N ATOM 2172 CA GLY A 152 -10.410 1.559 4.781 1.00 0.15 C ATOM 2173 C GLY A 152 -11.055 2.841 4.314 1.00 0.13 C ATOM 2174 O GLY A 152 -10.879 3.236 3.165 1.00 0.15 O ATOM 0 H GLY A 152 -10.703 0.472 3.026 1.00 0.14 H new ATOM 0 HA2 GLY A 152 -10.614 1.409 5.841 1.00 0.15 H new ATOM 0 HA3 GLY A 152 -9.328 1.630 4.672 1.00 0.15 H new ATOM 2178 N PRO A 153 -11.846 3.493 5.164 1.00 0.16 N ATOM 2179 CA PRO A 153 -12.529 4.726 4.811 1.00 0.19 C ATOM 2180 C PRO A 153 -11.731 5.974 5.172 1.00 0.19 C ATOM 2181 O PRO A 153 -12.299 7.055 5.324 1.00 0.24 O ATOM 2182 CB PRO A 153 -13.792 4.636 5.661 1.00 0.23 C ATOM 2183 CG PRO A 153 -13.350 3.944 6.910 1.00 0.25 C ATOM 2184 CD PRO A 153 -12.178 3.066 6.535 1.00 0.22 C ATOM 0 HA PRO A 153 -12.700 4.818 3.738 1.00 0.19 H new ATOM 0 HB2 PRO A 153 -14.197 5.625 5.876 1.00 0.23 H new ATOM 0 HB3 PRO A 153 -14.575 4.075 5.151 1.00 0.23 H new ATOM 0 HG2 PRO A 153 -13.061 4.669 7.671 1.00 0.25 H new ATOM 0 HG3 PRO A 153 -14.161 3.348 7.329 1.00 0.25 H new ATOM 0 HD2 PRO A 153 -11.337 3.209 7.214 1.00 0.22 H new ATOM 0 HD3 PRO A 153 -12.441 2.009 6.572 1.00 0.22 H new ATOM 2192 N LYS A 154 -10.419 5.827 5.309 1.00 0.17 N ATOM 2193 CA LYS A 154 -9.583 6.932 5.757 1.00 0.17 C ATOM 2194 C LYS A 154 -8.216 6.935 5.072 1.00 0.18 C ATOM 2195 O LYS A 154 -8.011 6.266 4.059 1.00 0.21 O ATOM 2196 CB LYS A 154 -9.396 6.876 7.282 1.00 0.19 C ATOM 2197 CG LYS A 154 -10.618 7.288 8.080 1.00 0.21 C ATOM 2198 CD LYS A 154 -10.314 7.311 9.566 1.00 0.29 C ATOM 2199 CE LYS A 154 -11.539 7.675 10.378 1.00 0.40 C ATOM 2200 NZ LYS A 154 -11.241 7.730 11.831 1.00 0.70 N ATOM 0 H LYS A 154 -9.915 4.961 5.118 1.00 0.17 H new ATOM 0 HA LYS A 154 -10.096 7.854 5.482 1.00 0.17 H new ATOM 0 HB2 LYS A 154 -9.118 5.860 7.564 1.00 0.19 H new ATOM 0 HB3 LYS A 154 -8.563 7.522 7.557 1.00 0.19 H new ATOM 0 HG2 LYS A 154 -10.951 8.275 7.758 1.00 0.21 H new ATOM 0 HG3 LYS A 154 -11.436 6.595 7.883 1.00 0.21 H new ATOM 0 HD2 LYS A 154 -9.947 6.333 9.878 1.00 0.29 H new ATOM 0 HD3 LYS A 154 -9.518 8.029 9.764 1.00 0.29 H new ATOM 0 HE2 LYS A 154 -11.920 8.642 10.048 1.00 0.40 H new ATOM 0 HE3 LYS A 154 -12.326 6.944 10.196 1.00 0.40 H new ATOM 0 HZ1 LYS A 154 -12.104 7.982 12.353 1.00 0.70 H new ATOM 0 HZ2 LYS A 154 -10.902 6.801 12.151 1.00 0.70 H new ATOM 0 HZ3 LYS A 154 -10.508 8.446 12.008 1.00 0.70 H new ATOM 2214 N GLN A 155 -7.293 7.707 5.640 1.00 0.18 N ATOM 2215 CA GLN A 155 -5.948 7.849 5.099 1.00 0.18 C ATOM 2216 C GLN A 155 -5.027 6.759 5.655 1.00 0.15 C ATOM 2217 O GLN A 155 -5.483 5.690 6.043 1.00 0.17 O ATOM 2218 CB GLN A 155 -5.381 9.225 5.479 1.00 0.20 C ATOM 2219 CG GLN A 155 -6.349 10.393 5.303 1.00 0.23 C ATOM 2220 CD GLN A 155 -6.342 11.023 3.916 1.00 0.75 C ATOM 2221 OE1 GLN A 155 -6.560 12.225 3.778 1.00 1.78 O ATOM 2222 NE2 GLN A 155 -6.112 10.235 2.878 1.00 0.92 N ATOM 0 H GLN A 155 -7.458 8.250 6.487 1.00 0.18 H new ATOM 0 HA GLN A 155 -6.000 7.753 4.014 1.00 0.18 H new ATOM 0 HB2 GLN A 155 -5.059 9.194 6.520 1.00 0.20 H new ATOM 0 HB3 GLN A 155 -4.493 9.415 4.876 1.00 0.20 H new ATOM 0 HG2 GLN A 155 -7.359 10.047 5.525 1.00 0.23 H new ATOM 0 HG3 GLN A 155 -6.107 11.161 6.037 1.00 0.23 H new ATOM 0 HE21 GLN A 155 -5.934 9.241 3.022 1.00 0.92 H new ATOM 0 HE22 GLN A 155 -6.113 10.622 1.934 1.00 0.92 H new ATOM 2231 N PHE A 156 -3.727 7.044 5.678 1.00 0.14 N ATOM 2232 CA PHE A 156 -2.746 6.162 6.307 1.00 0.11 C ATOM 2233 C PHE A 156 -3.069 6.021 7.789 1.00 0.14 C ATOM 2234 O PHE A 156 -3.011 7.010 8.517 1.00 0.20 O ATOM 2235 CB PHE A 156 -1.349 6.745 6.143 1.00 0.11 C ATOM 2236 CG PHE A 156 -1.018 7.164 4.735 1.00 0.14 C ATOM 2237 CD1 PHE A 156 -0.532 6.242 3.821 1.00 0.23 C ATOM 2238 CD2 PHE A 156 -1.187 8.476 4.329 1.00 0.24 C ATOM 2239 CE1 PHE A 156 -0.219 6.623 2.529 1.00 0.27 C ATOM 2240 CE2 PHE A 156 -0.879 8.862 3.038 1.00 0.30 C ATOM 2241 CZ PHE A 156 -0.420 7.937 2.132 1.00 0.26 C ATOM 0 H PHE A 156 -3.326 7.886 5.265 1.00 0.14 H new ATOM 0 HA PHE A 156 -2.784 5.182 5.830 1.00 0.11 H new ATOM 0 HB2 PHE A 156 -1.248 7.608 6.801 1.00 0.11 H new ATOM 0 HB3 PHE A 156 -0.618 6.006 6.472 1.00 0.11 H new ATOM 0 HD1 PHE A 156 -0.396 5.214 4.122 1.00 0.23 H new ATOM 0 HD2 PHE A 156 -1.564 9.207 5.029 1.00 0.24 H new ATOM 0 HE1 PHE A 156 0.180 5.901 1.832 1.00 0.27 H new ATOM 0 HE2 PHE A 156 -0.999 9.893 2.741 1.00 0.30 H new ATOM 0 HZ PHE A 156 -0.216 8.232 1.113 1.00 0.26 H new ATOM 2251 N CYS A 157 -3.399 4.807 8.229 1.00 0.17 N ATOM 2252 CA CYS A 157 -3.880 4.569 9.600 1.00 0.24 C ATOM 2253 C CYS A 157 -2.772 4.715 10.646 1.00 0.37 C ATOM 2254 O CYS A 157 -2.594 3.840 11.494 1.00 0.81 O ATOM 2255 CB CYS A 157 -4.470 3.169 9.731 1.00 0.28 C ATOM 2256 SG CYS A 157 -5.655 2.690 8.436 1.00 0.31 S ATOM 0 H CYS A 157 -3.343 3.965 7.656 1.00 0.17 H new ATOM 0 HA CYS A 157 -4.641 5.327 9.786 1.00 0.24 H new ATOM 0 HB2 CYS A 157 -3.652 2.448 9.734 1.00 0.28 H new ATOM 0 HB3 CYS A 157 -4.966 3.092 10.699 1.00 0.28 H new ATOM 2261 N ASP A 158 -2.058 5.826 10.593 1.00 0.42 N ATOM 2262 CA ASP A 158 -0.968 6.111 11.519 1.00 0.51 C ATOM 2263 C ASP A 158 -0.351 7.453 11.166 1.00 0.40 C ATOM 2264 O ASP A 158 0.157 8.163 12.025 1.00 0.53 O ATOM 2265 CB ASP A 158 0.103 5.018 11.462 1.00 0.71 C ATOM 2266 CG ASP A 158 1.144 5.158 12.555 1.00 1.00 C ATOM 2267 OD1 ASP A 158 0.762 5.229 13.743 1.00 1.24 O ATOM 2268 OD2 ASP A 158 2.352 5.163 12.238 1.00 1.43 O ATOM 0 H ASP A 158 -2.216 6.561 9.904 1.00 0.42 H new ATOM 0 HA ASP A 158 -1.369 6.140 12.532 1.00 0.51 H new ATOM 0 HB2 ASP A 158 -0.375 4.042 11.545 1.00 0.71 H new ATOM 0 HB3 ASP A 158 0.596 5.049 10.491 1.00 0.71 H new ATOM 2273 N GLU A 159 -0.424 7.792 9.886 1.00 0.31 N ATOM 2274 CA GLU A 159 0.140 9.033 9.384 1.00 0.41 C ATOM 2275 C GLU A 159 -0.936 10.107 9.285 1.00 0.55 C ATOM 2276 O GLU A 159 -0.672 11.290 9.503 1.00 0.98 O ATOM 2277 CB GLU A 159 0.745 8.791 8.002 1.00 0.49 C ATOM 2278 CG GLU A 159 1.564 7.515 7.907 1.00 0.49 C ATOM 2279 CD GLU A 159 2.900 7.580 8.626 1.00 0.57 C ATOM 2280 OE1 GLU A 159 3.941 7.347 7.971 1.00 0.83 O ATOM 2281 OE2 GLU A 159 2.925 7.859 9.842 1.00 0.95 O ATOM 0 H GLU A 159 -0.873 7.218 9.173 1.00 0.31 H new ATOM 0 HA GLU A 159 0.912 9.373 10.074 1.00 0.41 H new ATOM 0 HB2 GLU A 159 -0.058 8.752 7.266 1.00 0.49 H new ATOM 0 HB3 GLU A 159 1.378 9.639 7.739 1.00 0.49 H new ATOM 0 HG2 GLU A 159 0.982 6.691 8.319 1.00 0.49 H new ATOM 0 HG3 GLU A 159 1.740 7.287 6.856 1.00 0.49 H new ATOM 2288 N GLY A 160 -2.154 9.685 8.960 1.00 0.40 N ATOM 2289 CA GLY A 160 -3.227 10.631 8.740 1.00 0.49 C ATOM 2290 C GLY A 160 -4.578 10.114 9.197 1.00 0.53 C ATOM 2291 O GLY A 160 -5.365 10.850 9.794 1.00 0.75 O ATOM 0 H GLY A 160 -2.415 8.705 8.846 1.00 0.40 H new ATOM 0 HA2 GLY A 160 -3.001 11.557 9.269 1.00 0.49 H new ATOM 0 HA3 GLY A 160 -3.277 10.874 7.679 1.00 0.49 H new ATOM 2295 N GLY A 161 -4.849 8.848 8.917 1.00 0.39 N ATOM 2296 CA GLY A 161 -6.124 8.268 9.273 1.00 0.53 C ATOM 2297 C GLY A 161 -6.113 7.707 10.676 1.00 0.67 C ATOM 2298 O GLY A 161 -7.158 7.760 11.355 1.00 1.29 O ATOM 2299 OXT GLY A 161 -5.053 7.212 11.112 1.00 1.35 O ATOM 0 H GLY A 161 -4.205 8.211 8.448 1.00 0.39 H new ATOM 0 HA2 GLY A 161 -6.904 9.025 9.190 1.00 0.53 H new ATOM 0 HA3 GLY A 161 -6.373 7.476 8.567 1.00 0.53 H new TER 2303 GLY A 161