USER MOD reduce.3.24.130724 H: found=0, std=0, add=1215, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1209 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 66 CYS SG : rot -165:sc= -1.04! USER MOD Set 1.2: A 141 HIS :FLIP no HD1:sc= -4.09! C(o=-6.7!,f=-5.1!) USER MOD Set 2.1: A 117 HIS : no HD1:sc= 0 X(o=0.99,f=0.7) USER MOD Set 2.2: A 128 SER OG : rot 4:sc= 0.988 USER MOD Set 3.1: A 25 MET CE :methyl -151:sc= 0 (180deg=-0.713) USER MOD Set 3.2: A 93 GLN :FLIP amide:sc= 0.133 F(o=-0.83,f=0.13) USER MOD Set 4.1: A 41 THR OG1 : rot 71:sc= 0.662 USER MOD Set 4.2: A 87 HIS : no HD1:sc= -4.44! C(o=-3.8!,f=-8.3!) USER MOD Set 5.1: A 46 MET CE :methyl -107:sc= -0.0504 (180deg=-2!) USER MOD Set 5.2: A 61 THR OG1 : rot 101:sc= 1.12 USER MOD Set 6.1: A 13 ASN :FLIP amide:sc= -6.02! C(o=-8.2!,f=-6.1!) USER MOD Set 6.2: A 21 TYR OH : rot -15:sc= -0.0401 USER MOD Single : A 1 GLY N :NH3+ 137:sc= 0.0226 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 SER OG : rot 56:sc= 0.404 USER MOD Single : A 11 ASN : amide:sc= 0.997 K(o=1,f=-0.3) USER MOD Single : A 15 SER OG : rot 180:sc=-0.00663 USER MOD Single : A 17 SER OG : rot -57:sc= 0.808 USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ -151:sc= -1.48 (180deg=-2.28!) USER MOD Single : A 31 LYS NZ :NH3+ -167:sc=-0.00603 (180deg=-0.125) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 ASN :FLIP amide:sc= 0.915 F(o=-0.74,f=0.91) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 ASN : amide:sc= -3.61! C(o=-3.6!,f=-8.7!) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 58 THR OG1 : rot 180:sc= -0.279 USER MOD Single : A 59 TYR OH : rot 30:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 72 THR OG1 : rot -170:sc= -0.0163 USER MOD Single : A 73 GLN :FLIP amide:sc= -0.7 F(o=-1.6!,f=-0.7) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN : amide:sc= -0.0311 X(o=-0.031,f=0) USER MOD Single : A 81 TYR OH : rot 173:sc= -0.938 USER MOD Single : A 84 ASN : amide:sc= -1.84 K(o=-1.8,f=-2.8!) USER MOD Single : A 86 SER OG : rot 24:sc= 0.564! USER MOD Single : A 90 ASN : amide:sc= -0.108 X(o=-0.11,f=-0.38) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 MET CE :methyl -176:sc= -2.44! (180deg=-2.46!) USER MOD Single : A 101 LYS NZ :NH3+ 157:sc= -0.0722 (180deg=-0.479) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 ASN : amide:sc= -1.35 K(o=-1.3,f=-6.8!) USER MOD Single : A 114 THR OG1 : rot -123:sc= 0.718 USER MOD Single : A 119 ASN : amide:sc= -2.09! C(o=-2.1!,f=-9.9!) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 GLN : amide:sc= -0.45 X(o=-0.45,f=-0.55) USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 ASN : amide:sc= -1.29! C(o=-1.3!,f=-9.6!) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 137 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 142 HIS : no HD1:sc= -0.486 X(o=-0.49,f=-0.5) USER MOD Single : A 143 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0161) USER MOD Single : A 145 CYS SG : rot 180:sc= -0.0478 USER MOD Single : A 146 THR OG1 : rot 180:sc= 0 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 ASN :FLIP amide:sc= -0.366 F(o=-1.5,f=-0.37) USER MOD Single : A 155 ASN : amide:sc= -1.13 K(o=-1.1,f=-7.8!) USER MOD Single : A 156 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 25.650 1.950 -29.817 1.00 0.00 N ATOM 2 CA GLY A 1 25.050 1.972 -28.496 1.00 0.00 C ATOM 3 C GLY A 1 25.931 2.655 -27.469 1.00 0.00 C ATOM 4 O GLY A 1 27.157 2.570 -27.539 1.00 0.00 O ATOM 0 H1 GLY A 1 25.509 1.014 -30.247 1.00 0.00 H new ATOM 0 H2 GLY A 1 25.203 2.676 -30.413 1.00 0.00 H new ATOM 0 H3 GLY A 1 26.669 2.145 -29.739 1.00 0.00 H new ATOM 0 HA2 GLY A 1 24.090 2.486 -28.545 1.00 0.00 H new ATOM 0 HA3 GLY A 1 24.849 0.950 -28.175 1.00 0.00 H new ATOM 8 N SER A 2 25.306 3.337 -26.515 1.00 0.00 N ATOM 9 CA SER A 2 26.042 4.042 -25.472 1.00 0.00 C ATOM 10 C SER A 2 25.504 3.685 -24.090 1.00 0.00 C ATOM 11 O SER A 2 24.504 2.978 -23.965 1.00 0.00 O ATOM 12 CB SER A 2 25.955 5.554 -25.691 1.00 0.00 C ATOM 13 OG SER A 2 26.931 5.992 -26.619 1.00 0.00 O ATOM 0 H SER A 2 24.292 3.416 -26.443 1.00 0.00 H new ATOM 0 HA SER A 2 27.086 3.733 -25.526 1.00 0.00 H new ATOM 0 HB2 SER A 2 24.961 5.815 -26.054 1.00 0.00 H new ATOM 0 HB3 SER A 2 26.094 6.071 -24.741 1.00 0.00 H new ATOM 0 HG SER A 2 26.853 6.961 -26.743 1.00 0.00 H new ATOM 19 N SER A 3 26.175 4.178 -23.054 1.00 0.00 N ATOM 20 CA SER A 3 25.768 3.908 -21.681 1.00 0.00 C ATOM 21 C SER A 3 24.407 4.531 -21.386 1.00 0.00 C ATOM 22 O SER A 3 24.289 5.744 -21.223 1.00 0.00 O ATOM 23 CB SER A 3 26.812 4.449 -20.701 1.00 0.00 C ATOM 24 OG SER A 3 26.777 3.739 -19.475 1.00 0.00 O ATOM 0 H SER A 3 27.003 4.767 -23.140 1.00 0.00 H new ATOM 0 HA SER A 3 25.689 2.828 -21.557 1.00 0.00 H new ATOM 0 HB2 SER A 3 27.805 4.370 -21.143 1.00 0.00 H new ATOM 0 HB3 SER A 3 26.629 5.508 -20.517 1.00 0.00 H new ATOM 0 HG SER A 3 27.454 4.102 -18.867 1.00 0.00 H new ATOM 30 N GLY A 4 23.380 3.689 -21.318 1.00 0.00 N ATOM 31 CA GLY A 4 22.040 4.173 -21.043 1.00 0.00 C ATOM 32 C GLY A 4 21.342 3.369 -19.964 1.00 0.00 C ATOM 33 O GLY A 4 20.882 2.254 -20.211 1.00 0.00 O ATOM 0 H GLY A 4 23.452 2.680 -21.449 1.00 0.00 H new ATOM 0 HA2 GLY A 4 22.090 5.218 -20.737 1.00 0.00 H new ATOM 0 HA3 GLY A 4 21.449 4.137 -21.958 1.00 0.00 H new ATOM 37 N SER A 5 21.265 3.934 -18.763 1.00 0.00 N ATOM 38 CA SER A 5 20.624 3.259 -17.641 1.00 0.00 C ATOM 39 C SER A 5 19.789 4.240 -16.823 1.00 0.00 C ATOM 40 O SER A 5 20.223 5.357 -16.541 1.00 0.00 O ATOM 41 CB SER A 5 21.675 2.598 -16.747 1.00 0.00 C ATOM 42 OG SER A 5 21.075 1.992 -15.616 1.00 0.00 O ATOM 0 H SER A 5 21.639 4.857 -18.542 1.00 0.00 H new ATOM 0 HA SER A 5 19.963 2.490 -18.041 1.00 0.00 H new ATOM 0 HB2 SER A 5 22.222 1.848 -17.318 1.00 0.00 H new ATOM 0 HB3 SER A 5 22.401 3.343 -16.422 1.00 0.00 H new ATOM 0 HG SER A 5 21.768 1.575 -15.062 1.00 0.00 H new ATOM 48 N SER A 6 18.588 3.813 -16.444 1.00 0.00 N ATOM 49 CA SER A 6 17.690 4.654 -15.662 1.00 0.00 C ATOM 50 C SER A 6 17.403 4.024 -14.302 1.00 0.00 C ATOM 51 O SER A 6 16.539 3.158 -14.177 1.00 0.00 O ATOM 52 CB SER A 6 16.380 4.880 -16.419 1.00 0.00 C ATOM 53 OG SER A 6 16.555 5.804 -17.478 1.00 0.00 O ATOM 0 H SER A 6 18.215 2.890 -16.666 1.00 0.00 H new ATOM 0 HA SER A 6 18.179 5.615 -15.502 1.00 0.00 H new ATOM 0 HB2 SER A 6 16.018 3.932 -16.816 1.00 0.00 H new ATOM 0 HB3 SER A 6 15.619 5.250 -15.732 1.00 0.00 H new ATOM 0 HG SER A 6 15.704 5.929 -17.947 1.00 0.00 H new ATOM 59 N GLY A 7 18.136 4.468 -13.285 1.00 0.00 N ATOM 60 CA GLY A 7 17.946 3.937 -11.948 1.00 0.00 C ATOM 61 C GLY A 7 17.230 4.911 -11.034 1.00 0.00 C ATOM 62 O GLY A 7 16.004 4.888 -10.931 1.00 0.00 O ATOM 0 H GLY A 7 18.857 5.185 -13.363 1.00 0.00 H new ATOM 0 HA2 GLY A 7 17.374 3.011 -12.006 1.00 0.00 H new ATOM 0 HA3 GLY A 7 18.916 3.687 -11.519 1.00 0.00 H new ATOM 66 N MET A 8 17.996 5.768 -10.367 1.00 0.00 N ATOM 67 CA MET A 8 17.426 6.755 -9.457 1.00 0.00 C ATOM 68 C MET A 8 16.215 6.184 -8.726 1.00 0.00 C ATOM 69 O MET A 8 15.261 6.903 -8.430 1.00 0.00 O ATOM 70 CB MET A 8 17.026 8.017 -10.223 1.00 0.00 C ATOM 71 CG MET A 8 15.794 7.833 -11.094 1.00 0.00 C ATOM 72 SD MET A 8 16.196 7.254 -12.754 1.00 0.00 S ATOM 73 CE MET A 8 16.559 8.805 -13.574 1.00 0.00 C ATOM 0 H MET A 8 19.013 5.799 -10.439 1.00 0.00 H new ATOM 0 HA MET A 8 18.186 7.013 -8.719 1.00 0.00 H new ATOM 0 HB2 MET A 8 16.841 8.821 -9.511 1.00 0.00 H new ATOM 0 HB3 MET A 8 17.860 8.332 -10.850 1.00 0.00 H new ATOM 0 HG2 MET A 8 15.121 7.120 -10.618 1.00 0.00 H new ATOM 0 HG3 MET A 8 15.258 8.780 -11.164 1.00 0.00 H new ATOM 0 HE1 MET A 8 16.826 8.613 -14.613 1.00 0.00 H new ATOM 0 HE2 MET A 8 15.681 9.450 -13.538 1.00 0.00 H new ATOM 0 HE3 MET A 8 17.391 9.297 -13.070 1.00 0.00 H new ATOM 83 N SER A 9 16.261 4.887 -8.438 1.00 0.00 N ATOM 84 CA SER A 9 15.165 4.219 -7.745 1.00 0.00 C ATOM 85 C SER A 9 15.506 3.999 -6.275 1.00 0.00 C ATOM 86 O SER A 9 16.674 4.022 -5.886 1.00 0.00 O ATOM 87 CB SER A 9 14.852 2.879 -8.414 1.00 0.00 C ATOM 88 OG SER A 9 14.067 3.062 -9.580 1.00 0.00 O ATOM 0 H SER A 9 17.045 4.278 -8.674 1.00 0.00 H new ATOM 0 HA SER A 9 14.286 4.860 -7.804 1.00 0.00 H new ATOM 0 HB2 SER A 9 15.782 2.373 -8.674 1.00 0.00 H new ATOM 0 HB3 SER A 9 14.323 2.234 -7.713 1.00 0.00 H new ATOM 0 HG SER A 9 14.527 3.675 -10.191 1.00 0.00 H new ATOM 94 N VAL A 10 14.477 3.784 -5.461 1.00 0.00 N ATOM 95 CA VAL A 10 14.666 3.558 -4.033 1.00 0.00 C ATOM 96 C VAL A 10 14.071 2.222 -3.604 1.00 0.00 C ATOM 97 O VAL A 10 13.136 1.719 -4.226 1.00 0.00 O ATOM 98 CB VAL A 10 14.028 4.684 -3.197 1.00 0.00 C ATOM 99 CG1 VAL A 10 14.654 6.026 -3.542 1.00 0.00 C ATOM 100 CG2 VAL A 10 12.522 4.717 -3.412 1.00 0.00 C ATOM 0 H VAL A 10 13.504 3.762 -5.766 1.00 0.00 H new ATOM 0 HA VAL A 10 15.741 3.547 -3.854 1.00 0.00 H new ATOM 0 HB VAL A 10 14.218 4.483 -2.143 1.00 0.00 H new ATOM 0 HG11 VAL A 10 14.191 6.809 -2.942 1.00 0.00 H new ATOM 0 HG12 VAL A 10 15.723 5.993 -3.333 1.00 0.00 H new ATOM 0 HG13 VAL A 10 14.498 6.239 -4.599 1.00 0.00 H new ATOM 0 HG21 VAL A 10 12.087 5.518 -2.814 1.00 0.00 H new ATOM 0 HG22 VAL A 10 12.309 4.894 -4.466 1.00 0.00 H new ATOM 0 HG23 VAL A 10 12.090 3.763 -3.110 1.00 0.00 H new ATOM 110 N ASN A 11 14.620 1.651 -2.537 1.00 0.00 N ATOM 111 CA ASN A 11 14.143 0.372 -2.024 1.00 0.00 C ATOM 112 C ASN A 11 12.618 0.320 -2.024 1.00 0.00 C ATOM 113 O ASN A 11 11.954 1.258 -1.583 1.00 0.00 O ATOM 114 CB ASN A 11 14.672 0.137 -0.608 1.00 0.00 C ATOM 115 CG ASN A 11 16.002 -0.593 -0.601 1.00 0.00 C ATOM 116 OD1 ASN A 11 16.813 -0.437 -1.514 1.00 0.00 O ATOM 117 ND2 ASN A 11 16.230 -1.396 0.432 1.00 0.00 N ATOM 0 H ASN A 11 15.395 2.054 -2.011 1.00 0.00 H new ATOM 0 HA ASN A 11 14.516 -0.415 -2.679 1.00 0.00 H new ATOM 0 HB2 ASN A 11 14.784 1.096 -0.101 1.00 0.00 H new ATOM 0 HB3 ASN A 11 13.941 -0.440 -0.041 1.00 0.00 H new ATOM 0 HD21 ASN A 11 17.107 -1.914 0.491 1.00 0.00 H new ATOM 0 HD22 ASN A 11 15.529 -1.494 1.166 1.00 0.00 H new ATOM 124 N VAL A 12 12.069 -0.784 -2.522 1.00 0.00 N ATOM 125 CA VAL A 12 10.623 -0.960 -2.578 1.00 0.00 C ATOM 126 C VAL A 12 9.956 -0.440 -1.309 1.00 0.00 C ATOM 127 O VAL A 12 8.860 0.116 -1.355 1.00 0.00 O ATOM 128 CB VAL A 12 10.245 -2.440 -2.775 1.00 0.00 C ATOM 129 CG1 VAL A 12 8.733 -2.604 -2.816 1.00 0.00 C ATOM 130 CG2 VAL A 12 10.884 -2.988 -4.042 1.00 0.00 C ATOM 0 H VAL A 12 12.604 -1.569 -2.892 1.00 0.00 H new ATOM 0 HA VAL A 12 10.267 -0.385 -3.433 1.00 0.00 H new ATOM 0 HB VAL A 12 10.625 -3.011 -1.928 1.00 0.00 H new ATOM 0 HG11 VAL A 12 8.485 -3.656 -2.956 1.00 0.00 H new ATOM 0 HG12 VAL A 12 8.303 -2.251 -1.878 1.00 0.00 H new ATOM 0 HG13 VAL A 12 8.326 -2.022 -3.643 1.00 0.00 H new ATOM 0 HG21 VAL A 12 10.607 -4.035 -4.166 1.00 0.00 H new ATOM 0 HG22 VAL A 12 10.536 -2.416 -4.902 1.00 0.00 H new ATOM 0 HG23 VAL A 12 11.968 -2.906 -3.967 1.00 0.00 H new ATOM 140 N ASN A 13 10.627 -0.626 -0.177 1.00 0.00 N ATOM 141 CA ASN A 13 10.100 -0.176 1.106 1.00 0.00 C ATOM 142 C ASN A 13 11.036 0.840 1.753 1.00 0.00 C ATOM 143 O ASN A 13 12.258 0.706 1.683 1.00 0.00 O ATOM 144 CB ASN A 13 9.896 -1.368 2.044 1.00 0.00 C ATOM 145 CG ASN A 13 9.633 -2.657 1.291 1.00 0.00 C ATOM 146 OD1 ASN A 13 8.764 -2.590 0.288 1.00 0.00 O flip ATOM 147 ND2 ASN A 13 10.203 -3.702 1.607 1.00 0.00 N flip ATOM 0 H ASN A 13 11.536 -1.085 -0.122 1.00 0.00 H new ATOM 0 HA ASN A 13 9.139 0.305 0.926 1.00 0.00 H new ATOM 0 HB2 ASN A 13 10.780 -1.490 2.670 1.00 0.00 H new ATOM 0 HB3 ASN A 13 9.059 -1.163 2.711 1.00 0.00 H new ATOM 0 HD21 ASN A 13 10.863 -3.708 2.384 1.00 0.00 H new ATOM 0 HD22 ASN A 13 10.015 -4.562 1.091 1.00 0.00 H new ATOM 154 N ARG A 14 10.454 1.855 2.383 1.00 0.00 N ATOM 155 CA ARG A 14 11.235 2.895 3.042 1.00 0.00 C ATOM 156 C ARG A 14 11.898 2.357 4.307 1.00 0.00 C ATOM 157 O ARG A 14 13.038 2.701 4.617 1.00 0.00 O ATOM 158 CB ARG A 14 10.345 4.090 3.388 1.00 0.00 C ATOM 159 CG ARG A 14 10.073 5.008 2.208 1.00 0.00 C ATOM 160 CD ARG A 14 11.326 5.758 1.784 1.00 0.00 C ATOM 161 NE ARG A 14 11.852 6.595 2.859 1.00 0.00 N ATOM 162 CZ ARG A 14 12.665 7.626 2.656 1.00 0.00 C ATOM 163 NH1 ARG A 14 13.042 7.946 1.426 1.00 0.00 N ATOM 164 NH2 ARG A 14 13.102 8.340 3.685 1.00 0.00 N ATOM 0 H ARG A 14 9.444 1.979 2.451 1.00 0.00 H new ATOM 0 HA ARG A 14 12.015 3.220 2.353 1.00 0.00 H new ATOM 0 HB2 ARG A 14 9.396 3.724 3.779 1.00 0.00 H new ATOM 0 HB3 ARG A 14 10.817 4.666 4.184 1.00 0.00 H new ATOM 0 HG2 ARG A 14 9.697 4.422 1.369 1.00 0.00 H new ATOM 0 HG3 ARG A 14 9.293 5.722 2.473 1.00 0.00 H new ATOM 0 HD2 ARG A 14 12.089 5.044 1.474 1.00 0.00 H new ATOM 0 HD3 ARG A 14 11.101 6.380 0.917 1.00 0.00 H new ATOM 0 HE ARG A 14 11.581 6.376 3.818 1.00 0.00 H new ATOM 0 HH11 ARG A 14 12.708 7.400 0.632 1.00 0.00 H new ATOM 0 HH12 ARG A 14 13.666 8.738 1.274 1.00 0.00 H new ATOM 0 HH21 ARG A 14 12.814 8.098 4.633 1.00 0.00 H new ATOM 0 HH22 ARG A 14 13.726 9.131 3.528 1.00 0.00 H new ATOM 178 N SER A 15 11.174 1.512 5.035 1.00 0.00 N ATOM 179 CA SER A 15 11.689 0.930 6.268 1.00 0.00 C ATOM 180 C SER A 15 13.003 0.196 6.016 1.00 0.00 C ATOM 181 O SER A 15 13.920 0.241 6.835 1.00 0.00 O ATOM 182 CB SER A 15 10.663 -0.031 6.872 1.00 0.00 C ATOM 183 OG SER A 15 10.506 -1.184 6.062 1.00 0.00 O ATOM 0 H SER A 15 10.229 1.216 4.792 1.00 0.00 H new ATOM 0 HA SER A 15 11.875 1.741 6.972 1.00 0.00 H new ATOM 0 HB2 SER A 15 10.981 -0.326 7.872 1.00 0.00 H new ATOM 0 HB3 SER A 15 9.704 0.476 6.979 1.00 0.00 H new ATOM 0 HG SER A 15 9.847 -1.783 6.470 1.00 0.00 H new ATOM 189 N VAL A 16 13.085 -0.481 4.874 1.00 0.00 N ATOM 190 CA VAL A 16 14.286 -1.224 4.512 1.00 0.00 C ATOM 191 C VAL A 16 15.162 -0.421 3.556 1.00 0.00 C ATOM 192 O VAL A 16 14.756 -0.112 2.436 1.00 0.00 O ATOM 193 CB VAL A 16 13.934 -2.573 3.857 1.00 0.00 C ATOM 194 CG1 VAL A 16 13.134 -2.355 2.582 1.00 0.00 C ATOM 195 CG2 VAL A 16 15.197 -3.372 3.573 1.00 0.00 C ATOM 0 H VAL A 16 12.335 -0.530 4.185 1.00 0.00 H new ATOM 0 HA VAL A 16 14.835 -1.408 5.435 1.00 0.00 H new ATOM 0 HB VAL A 16 13.318 -3.144 4.551 1.00 0.00 H new ATOM 0 HG11 VAL A 16 12.895 -3.319 2.133 1.00 0.00 H new ATOM 0 HG12 VAL A 16 12.211 -1.825 2.818 1.00 0.00 H new ATOM 0 HG13 VAL A 16 13.722 -1.764 1.880 1.00 0.00 H new ATOM 0 HG21 VAL A 16 14.930 -4.322 3.110 1.00 0.00 H new ATOM 0 HG22 VAL A 16 15.840 -2.808 2.898 1.00 0.00 H new ATOM 0 HG23 VAL A 16 15.727 -3.559 4.507 1.00 0.00 H new ATOM 205 N SER A 17 16.367 -0.086 4.007 1.00 0.00 N ATOM 206 CA SER A 17 17.300 0.685 3.194 1.00 0.00 C ATOM 207 C SER A 17 18.555 -0.128 2.890 1.00 0.00 C ATOM 208 O SER A 17 19.672 0.386 2.956 1.00 0.00 O ATOM 209 CB SER A 17 17.680 1.983 3.908 1.00 0.00 C ATOM 210 OG SER A 17 18.553 2.766 3.113 1.00 0.00 O ATOM 0 H SER A 17 16.720 -0.336 4.931 1.00 0.00 H new ATOM 0 HA SER A 17 16.808 0.928 2.252 1.00 0.00 H new ATOM 0 HB2 SER A 17 16.780 2.554 4.135 1.00 0.00 H new ATOM 0 HB3 SER A 17 18.159 1.752 4.859 1.00 0.00 H new ATOM 0 HG SER A 17 19.348 2.240 2.885 1.00 0.00 H new ATOM 216 N ASP A 18 18.362 -1.399 2.557 1.00 0.00 N ATOM 217 CA ASP A 18 19.477 -2.284 2.241 1.00 0.00 C ATOM 218 C ASP A 18 19.672 -2.396 0.732 1.00 0.00 C ATOM 219 O ASP A 18 18.705 -2.488 -0.023 1.00 0.00 O ATOM 220 CB ASP A 18 19.240 -3.671 2.840 1.00 0.00 C ATOM 221 CG ASP A 18 19.805 -3.801 4.241 1.00 0.00 C ATOM 222 OD1 ASP A 18 19.748 -2.809 4.998 1.00 0.00 O ATOM 223 OD2 ASP A 18 20.304 -4.894 4.581 1.00 0.00 O ATOM 0 H ASP A 18 17.444 -1.840 2.499 1.00 0.00 H new ATOM 0 HA ASP A 18 20.381 -1.858 2.676 1.00 0.00 H new ATOM 0 HB2 ASP A 18 18.170 -3.876 2.863 1.00 0.00 H new ATOM 0 HB3 ASP A 18 19.695 -4.424 2.197 1.00 0.00 H new ATOM 228 N GLN A 19 20.929 -2.385 0.301 1.00 0.00 N ATOM 229 CA GLN A 19 21.251 -2.482 -1.118 1.00 0.00 C ATOM 230 C GLN A 19 20.820 -3.832 -1.682 1.00 0.00 C ATOM 231 O GLN A 19 20.353 -3.922 -2.818 1.00 0.00 O ATOM 232 CB GLN A 19 22.751 -2.280 -1.338 1.00 0.00 C ATOM 233 CG GLN A 19 23.610 -3.368 -0.714 1.00 0.00 C ATOM 234 CD GLN A 19 25.066 -3.268 -1.124 1.00 0.00 C ATOM 235 OE1 GLN A 19 25.769 -2.335 -0.735 1.00 0.00 O ATOM 236 NE2 GLN A 19 25.527 -4.232 -1.912 1.00 0.00 N ATOM 0 H GLN A 19 21.741 -2.310 0.914 1.00 0.00 H new ATOM 0 HA GLN A 19 20.706 -1.698 -1.643 1.00 0.00 H new ATOM 0 HB2 GLN A 19 22.951 -2.241 -2.409 1.00 0.00 H new ATOM 0 HB3 GLN A 19 23.044 -1.315 -0.924 1.00 0.00 H new ATOM 0 HG2 GLN A 19 23.537 -3.305 0.372 1.00 0.00 H new ATOM 0 HG3 GLN A 19 23.221 -4.344 -1.004 1.00 0.00 H new ATOM 0 HE21 GLN A 19 24.909 -4.986 -2.210 1.00 0.00 H new ATOM 0 HE22 GLN A 19 26.500 -4.218 -2.219 1.00 0.00 H new ATOM 245 N PHE A 20 20.980 -4.881 -0.881 1.00 0.00 N ATOM 246 CA PHE A 20 20.609 -6.227 -1.301 1.00 0.00 C ATOM 247 C PHE A 20 19.272 -6.218 -2.038 1.00 0.00 C ATOM 248 O PHE A 20 19.145 -6.788 -3.122 1.00 0.00 O ATOM 249 CB PHE A 20 20.529 -7.158 -0.090 1.00 0.00 C ATOM 250 CG PHE A 20 21.865 -7.441 0.538 1.00 0.00 C ATOM 251 CD1 PHE A 20 22.683 -8.440 0.036 1.00 0.00 C ATOM 252 CD2 PHE A 20 22.301 -6.707 1.629 1.00 0.00 C ATOM 253 CE1 PHE A 20 23.913 -8.702 0.611 1.00 0.00 C ATOM 254 CE2 PHE A 20 23.529 -6.965 2.208 1.00 0.00 C ATOM 255 CZ PHE A 20 24.336 -7.964 1.699 1.00 0.00 C ATOM 0 H PHE A 20 21.364 -4.824 0.062 1.00 0.00 H new ATOM 0 HA PHE A 20 21.377 -6.593 -1.982 1.00 0.00 H new ATOM 0 HB2 PHE A 20 19.872 -6.713 0.657 1.00 0.00 H new ATOM 0 HB3 PHE A 20 20.073 -8.100 -0.395 1.00 0.00 H new ATOM 0 HD1 PHE A 20 22.356 -9.021 -0.814 1.00 0.00 H new ATOM 0 HD2 PHE A 20 21.674 -5.925 2.031 1.00 0.00 H new ATOM 0 HE1 PHE A 20 24.542 -9.483 0.210 1.00 0.00 H new ATOM 0 HE2 PHE A 20 23.858 -6.386 3.058 1.00 0.00 H new ATOM 0 HZ PHE A 20 25.296 -8.167 2.151 1.00 0.00 H new ATOM 265 N TYR A 21 18.280 -5.568 -1.442 1.00 0.00 N ATOM 266 CA TYR A 21 16.952 -5.486 -2.039 1.00 0.00 C ATOM 267 C TYR A 21 17.045 -5.301 -3.551 1.00 0.00 C ATOM 268 O TYR A 21 17.388 -4.222 -4.035 1.00 0.00 O ATOM 269 CB TYR A 21 16.161 -4.332 -1.420 1.00 0.00 C ATOM 270 CG TYR A 21 14.675 -4.597 -1.329 1.00 0.00 C ATOM 271 CD1 TYR A 21 13.952 -5.004 -2.443 1.00 0.00 C ATOM 272 CD2 TYR A 21 13.994 -4.441 -0.127 1.00 0.00 C ATOM 273 CE1 TYR A 21 12.594 -5.246 -2.364 1.00 0.00 C ATOM 274 CE2 TYR A 21 12.637 -4.682 -0.039 1.00 0.00 C ATOM 275 CZ TYR A 21 11.941 -5.084 -1.160 1.00 0.00 C ATOM 276 OH TYR A 21 10.589 -5.325 -1.077 1.00 0.00 O ATOM 0 H TYR A 21 18.370 -5.090 -0.546 1.00 0.00 H new ATOM 0 HA TYR A 21 16.432 -6.423 -1.837 1.00 0.00 H new ATOM 0 HB2 TYR A 21 16.548 -4.132 -0.421 1.00 0.00 H new ATOM 0 HB3 TYR A 21 16.325 -3.431 -2.011 1.00 0.00 H new ATOM 0 HD1 TYR A 21 14.460 -5.134 -3.387 1.00 0.00 H new ATOM 0 HD2 TYR A 21 14.535 -4.126 0.753 1.00 0.00 H new ATOM 0 HE1 TYR A 21 12.047 -5.560 -3.240 1.00 0.00 H new ATOM 0 HE2 TYR A 21 12.123 -4.556 0.903 1.00 0.00 H new ATOM 0 HH TYR A 21 10.208 -5.363 -1.979 1.00 0.00 H new ATOM 286 N ARG A 22 16.735 -6.361 -4.290 1.00 0.00 N ATOM 287 CA ARG A 22 16.784 -6.316 -5.747 1.00 0.00 C ATOM 288 C ARG A 22 15.687 -5.412 -6.300 1.00 0.00 C ATOM 289 O ARG A 22 15.966 -4.357 -6.870 1.00 0.00 O ATOM 290 CB ARG A 22 16.639 -7.725 -6.326 1.00 0.00 C ATOM 291 CG ARG A 22 16.649 -7.762 -7.846 1.00 0.00 C ATOM 292 CD ARG A 22 16.209 -9.119 -8.372 1.00 0.00 C ATOM 293 NE ARG A 22 15.706 -9.038 -9.741 1.00 0.00 N ATOM 294 CZ ARG A 22 15.589 -10.090 -10.544 1.00 0.00 C ATOM 295 NH1 ARG A 22 15.938 -11.296 -10.118 1.00 0.00 N ATOM 296 NH2 ARG A 22 15.123 -9.936 -11.777 1.00 0.00 N ATOM 0 H ARG A 22 16.448 -7.261 -3.905 1.00 0.00 H new ATOM 0 HA ARG A 22 17.750 -5.907 -6.041 1.00 0.00 H new ATOM 0 HB2 ARG A 22 17.450 -8.349 -5.950 1.00 0.00 H new ATOM 0 HB3 ARG A 22 15.708 -8.163 -5.966 1.00 0.00 H new ATOM 0 HG2 ARG A 22 15.987 -6.988 -8.234 1.00 0.00 H new ATOM 0 HG3 ARG A 22 17.651 -7.537 -8.210 1.00 0.00 H new ATOM 0 HD2 ARG A 22 17.049 -9.812 -8.335 1.00 0.00 H new ATOM 0 HD3 ARG A 22 15.432 -9.525 -7.724 1.00 0.00 H new ATOM 0 HE ARG A 22 15.430 -8.124 -10.100 1.00 0.00 H new ATOM 0 HH11 ARG A 22 16.298 -11.418 -9.171 1.00 0.00 H new ATOM 0 HH12 ARG A 22 15.847 -12.102 -10.737 1.00 0.00 H new ATOM 0 HH21 ARG A 22 14.854 -9.010 -12.109 1.00 0.00 H new ATOM 0 HH22 ARG A 22 15.033 -10.744 -12.393 1.00 0.00 H new ATOM 310 N TYR A 23 14.438 -5.832 -6.128 1.00 0.00 N ATOM 311 CA TYR A 23 13.299 -5.062 -6.613 1.00 0.00 C ATOM 312 C TYR A 23 13.335 -3.637 -6.070 1.00 0.00 C ATOM 313 O TYR A 23 13.692 -3.408 -4.915 1.00 0.00 O ATOM 314 CB TYR A 23 11.989 -5.741 -6.209 1.00 0.00 C ATOM 315 CG TYR A 23 12.057 -7.251 -6.232 1.00 0.00 C ATOM 316 CD1 TYR A 23 12.392 -7.933 -7.396 1.00 0.00 C ATOM 317 CD2 TYR A 23 11.787 -7.996 -5.091 1.00 0.00 C ATOM 318 CE1 TYR A 23 12.455 -9.313 -7.422 1.00 0.00 C ATOM 319 CE2 TYR A 23 11.849 -9.376 -5.107 1.00 0.00 C ATOM 320 CZ TYR A 23 12.183 -10.030 -6.275 1.00 0.00 C ATOM 321 OH TYR A 23 12.246 -11.404 -6.297 1.00 0.00 O ATOM 0 H TYR A 23 14.189 -6.701 -5.656 1.00 0.00 H new ATOM 0 HA TYR A 23 13.358 -5.019 -7.701 1.00 0.00 H new ATOM 0 HB2 TYR A 23 11.714 -5.413 -5.206 1.00 0.00 H new ATOM 0 HB3 TYR A 23 11.196 -5.411 -6.881 1.00 0.00 H new ATOM 0 HD1 TYR A 23 12.607 -7.375 -8.295 1.00 0.00 H new ATOM 0 HD2 TYR A 23 11.524 -7.487 -4.175 1.00 0.00 H new ATOM 0 HE1 TYR A 23 12.716 -9.828 -8.335 1.00 0.00 H new ATOM 0 HE2 TYR A 23 11.637 -9.940 -4.210 1.00 0.00 H new ATOM 0 HH TYR A 23 12.028 -11.756 -5.409 1.00 0.00 H new ATOM 331 N LYS A 24 12.960 -2.680 -6.913 1.00 0.00 N ATOM 332 CA LYS A 24 12.946 -1.276 -6.521 1.00 0.00 C ATOM 333 C LYS A 24 11.835 -0.520 -7.243 1.00 0.00 C ATOM 334 O LYS A 24 11.204 -1.050 -8.157 1.00 0.00 O ATOM 335 CB LYS A 24 14.299 -0.627 -6.823 1.00 0.00 C ATOM 336 CG LYS A 24 15.397 -1.032 -5.855 1.00 0.00 C ATOM 337 CD LYS A 24 16.433 0.068 -5.695 1.00 0.00 C ATOM 338 CE LYS A 24 17.545 -0.058 -6.724 1.00 0.00 C ATOM 339 NZ LYS A 24 17.187 0.601 -8.011 1.00 0.00 N ATOM 0 H LYS A 24 12.662 -2.852 -7.873 1.00 0.00 H new ATOM 0 HA LYS A 24 12.757 -1.226 -5.449 1.00 0.00 H new ATOM 0 HB2 LYS A 24 14.602 -0.893 -7.836 1.00 0.00 H new ATOM 0 HB3 LYS A 24 14.186 0.457 -6.799 1.00 0.00 H new ATOM 0 HG2 LYS A 24 14.960 -1.265 -4.884 1.00 0.00 H new ATOM 0 HG3 LYS A 24 15.882 -1.940 -6.213 1.00 0.00 H new ATOM 0 HD2 LYS A 24 15.951 1.040 -5.796 1.00 0.00 H new ATOM 0 HD3 LYS A 24 16.858 0.026 -4.692 1.00 0.00 H new ATOM 0 HE2 LYS A 24 18.458 0.388 -6.329 1.00 0.00 H new ATOM 0 HE3 LYS A 24 17.757 -1.112 -6.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 17.672 0.119 -8.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 16.158 0.547 -8.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 17.480 1.598 -7.984 1.00 0.00 H new ATOM 353 N MET A 25 11.604 0.721 -6.828 1.00 0.00 N ATOM 354 CA MET A 25 10.571 1.550 -7.438 1.00 0.00 C ATOM 355 C MET A 25 10.983 3.018 -7.442 1.00 0.00 C ATOM 356 O MET A 25 11.591 3.519 -6.495 1.00 0.00 O ATOM 357 CB MET A 25 9.245 1.382 -6.692 1.00 0.00 C ATOM 358 CG MET A 25 9.279 1.913 -5.268 1.00 0.00 C ATOM 359 SD MET A 25 7.653 2.427 -4.680 1.00 0.00 S ATOM 360 CE MET A 25 8.041 2.927 -3.005 1.00 0.00 C ATOM 0 H MET A 25 12.118 1.174 -6.072 1.00 0.00 H new ATOM 0 HA MET A 25 10.443 1.225 -8.470 1.00 0.00 H new ATOM 0 HB2 MET A 25 8.459 1.896 -7.244 1.00 0.00 H new ATOM 0 HB3 MET A 25 8.980 0.325 -6.671 1.00 0.00 H new ATOM 0 HG2 MET A 25 9.674 1.142 -4.606 1.00 0.00 H new ATOM 0 HG3 MET A 25 9.964 2.759 -5.216 1.00 0.00 H new ATOM 0 HE1 MET A 25 7.168 2.777 -2.369 1.00 0.00 H new ATOM 0 HE2 MET A 25 8.871 2.328 -2.629 1.00 0.00 H new ATOM 0 HE3 MET A 25 8.321 3.980 -2.995 1.00 0.00 H new ATOM 370 N PRO A 26 10.647 3.726 -8.530 1.00 0.00 N ATOM 371 CA PRO A 26 10.973 5.147 -8.683 1.00 0.00 C ATOM 372 C PRO A 26 10.166 6.031 -7.738 1.00 0.00 C ATOM 373 O PRO A 26 8.977 5.799 -7.520 1.00 0.00 O ATOM 374 CB PRO A 26 10.603 5.442 -10.138 1.00 0.00 C ATOM 375 CG PRO A 26 9.567 4.427 -10.479 1.00 0.00 C ATOM 376 CD PRO A 26 9.922 3.193 -9.696 1.00 0.00 C ATOM 0 HA PRO A 26 12.016 5.354 -8.445 1.00 0.00 H new ATOM 0 HB2 PRO A 26 10.217 6.455 -10.251 1.00 0.00 H new ATOM 0 HB3 PRO A 26 11.471 5.357 -10.792 1.00 0.00 H new ATOM 0 HG2 PRO A 26 8.571 4.783 -10.216 1.00 0.00 H new ATOM 0 HG3 PRO A 26 9.560 4.221 -11.549 1.00 0.00 H new ATOM 0 HD2 PRO A 26 9.033 2.637 -9.397 1.00 0.00 H new ATOM 0 HD3 PRO A 26 10.543 2.512 -10.278 1.00 0.00 H new ATOM 384 N ARG A 27 10.820 7.045 -7.181 1.00 0.00 N ATOM 385 CA ARG A 27 10.163 7.964 -6.260 1.00 0.00 C ATOM 386 C ARG A 27 8.979 8.654 -6.931 1.00 0.00 C ATOM 387 O ARG A 27 9.149 9.417 -7.883 1.00 0.00 O ATOM 388 CB ARG A 27 11.157 9.011 -5.754 1.00 0.00 C ATOM 389 CG ARG A 27 12.339 8.417 -5.006 1.00 0.00 C ATOM 390 CD ARG A 27 13.556 8.278 -5.907 1.00 0.00 C ATOM 391 NE ARG A 27 13.763 9.464 -6.734 1.00 0.00 N ATOM 392 CZ ARG A 27 14.351 10.572 -6.297 1.00 0.00 C ATOM 393 NH1 ARG A 27 14.789 10.645 -5.048 1.00 0.00 N ATOM 394 NH2 ARG A 27 14.503 11.609 -7.110 1.00 0.00 N ATOM 0 H ARG A 27 11.804 7.251 -7.352 1.00 0.00 H new ATOM 0 HA ARG A 27 9.792 7.386 -5.414 1.00 0.00 H new ATOM 0 HB2 ARG A 27 11.527 9.588 -6.602 1.00 0.00 H new ATOM 0 HB3 ARG A 27 10.635 9.708 -5.098 1.00 0.00 H new ATOM 0 HG2 ARG A 27 12.587 9.050 -4.154 1.00 0.00 H new ATOM 0 HG3 ARG A 27 12.066 7.439 -4.609 1.00 0.00 H new ATOM 0 HD2 ARG A 27 14.441 8.103 -5.296 1.00 0.00 H new ATOM 0 HD3 ARG A 27 13.434 7.405 -6.549 1.00 0.00 H new ATOM 0 HE ARG A 27 13.438 9.440 -7.701 1.00 0.00 H new ATOM 0 HH11 ARG A 27 14.675 9.849 -4.420 1.00 0.00 H new ATOM 0 HH12 ARG A 27 15.240 11.497 -4.715 1.00 0.00 H new ATOM 0 HH21 ARG A 27 14.168 11.556 -8.072 1.00 0.00 H new ATOM 0 HH22 ARG A 27 14.955 12.459 -6.773 1.00 0.00 H new ATOM 408 N LEU A 28 7.780 8.381 -6.430 1.00 0.00 N ATOM 409 CA LEU A 28 6.566 8.974 -6.981 1.00 0.00 C ATOM 410 C LEU A 28 6.661 10.497 -6.992 1.00 0.00 C ATOM 411 O LEU A 28 7.239 11.098 -6.086 1.00 0.00 O ATOM 412 CB LEU A 28 5.346 8.533 -6.171 1.00 0.00 C ATOM 413 CG LEU A 28 4.952 9.439 -5.004 1.00 0.00 C ATOM 414 CD1 LEU A 28 4.079 10.586 -5.489 1.00 0.00 C ATOM 415 CD2 LEU A 28 4.235 8.639 -3.927 1.00 0.00 C ATOM 0 H LEU A 28 7.622 7.752 -5.643 1.00 0.00 H new ATOM 0 HA LEU A 28 6.456 8.628 -8.009 1.00 0.00 H new ATOM 0 HB2 LEU A 28 4.495 8.455 -6.847 1.00 0.00 H new ATOM 0 HB3 LEU A 28 5.536 7.533 -5.781 1.00 0.00 H new ATOM 0 HG LEU A 28 5.861 9.859 -4.572 1.00 0.00 H new ATOM 0 HD11 LEU A 28 3.809 11.220 -4.644 1.00 0.00 H new ATOM 0 HD12 LEU A 28 4.628 11.175 -6.224 1.00 0.00 H new ATOM 0 HD13 LEU A 28 3.174 10.186 -5.947 1.00 0.00 H new ATOM 0 HD21 LEU A 28 3.962 9.300 -3.104 1.00 0.00 H new ATOM 0 HD22 LEU A 28 3.334 8.190 -4.346 1.00 0.00 H new ATOM 0 HD23 LEU A 28 4.894 7.853 -3.558 1.00 0.00 H new ATOM 427 N ILE A 29 6.089 11.113 -8.020 1.00 0.00 N ATOM 428 CA ILE A 29 6.106 12.565 -8.146 1.00 0.00 C ATOM 429 C ILE A 29 4.717 13.153 -7.921 1.00 0.00 C ATOM 430 O ILE A 29 3.715 12.591 -8.362 1.00 0.00 O ATOM 431 CB ILE A 29 6.619 13.004 -9.530 1.00 0.00 C ATOM 432 CG1 ILE A 29 8.034 12.471 -9.766 1.00 0.00 C ATOM 433 CG2 ILE A 29 6.592 14.520 -9.649 1.00 0.00 C ATOM 434 CD1 ILE A 29 8.392 12.337 -11.230 1.00 0.00 C ATOM 0 H ILE A 29 5.608 10.629 -8.778 1.00 0.00 H new ATOM 0 HA ILE A 29 6.785 12.940 -7.380 1.00 0.00 H new ATOM 0 HB ILE A 29 5.962 12.588 -10.293 1.00 0.00 H new ATOM 0 HG12 ILE A 29 8.750 13.137 -9.285 1.00 0.00 H new ATOM 0 HG13 ILE A 29 8.132 11.497 -9.286 1.00 0.00 H new ATOM 0 HG21 ILE A 29 6.958 14.814 -10.633 1.00 0.00 H new ATOM 0 HG22 ILE A 29 5.570 14.877 -9.520 1.00 0.00 H new ATOM 0 HG23 ILE A 29 7.229 14.957 -8.880 1.00 0.00 H new ATOM 0 HD11 ILE A 29 9.408 11.954 -11.322 1.00 0.00 H new ATOM 0 HD12 ILE A 29 7.699 11.647 -11.712 1.00 0.00 H new ATOM 0 HD13 ILE A 29 8.327 13.313 -11.711 1.00 0.00 H new ATOM 446 N ALA A 30 4.666 14.289 -7.233 1.00 0.00 N ATOM 447 CA ALA A 30 3.400 14.955 -6.953 1.00 0.00 C ATOM 448 C ALA A 30 3.448 16.421 -7.371 1.00 0.00 C ATOM 449 O ALA A 30 4.281 17.189 -6.888 1.00 0.00 O ATOM 450 CB ALA A 30 3.057 14.836 -5.476 1.00 0.00 C ATOM 0 H ALA A 30 5.486 14.767 -6.860 1.00 0.00 H new ATOM 0 HA ALA A 30 2.621 14.463 -7.536 1.00 0.00 H new ATOM 0 HB1 ALA A 30 2.109 15.338 -5.281 1.00 0.00 H new ATOM 0 HB2 ALA A 30 2.973 13.783 -5.206 1.00 0.00 H new ATOM 0 HB3 ALA A 30 3.843 15.301 -4.881 1.00 0.00 H new ATOM 456 N LYS A 31 2.549 16.805 -8.271 1.00 0.00 N ATOM 457 CA LYS A 31 2.488 18.179 -8.754 1.00 0.00 C ATOM 458 C LYS A 31 1.377 18.953 -8.052 1.00 0.00 C ATOM 459 O LYS A 31 0.312 18.407 -7.765 1.00 0.00 O ATOM 460 CB LYS A 31 2.260 18.200 -10.268 1.00 0.00 C ATOM 461 CG LYS A 31 2.868 19.409 -10.958 1.00 0.00 C ATOM 462 CD LYS A 31 2.668 19.351 -12.463 1.00 0.00 C ATOM 463 CE LYS A 31 3.582 18.320 -13.107 1.00 0.00 C ATOM 464 NZ LYS A 31 5.003 18.764 -13.111 1.00 0.00 N ATOM 0 H LYS A 31 1.852 16.183 -8.681 1.00 0.00 H new ATOM 0 HA LYS A 31 3.440 18.659 -8.529 1.00 0.00 H new ATOM 0 HB2 LYS A 31 2.681 17.294 -10.703 1.00 0.00 H new ATOM 0 HB3 LYS A 31 1.188 18.180 -10.466 1.00 0.00 H new ATOM 0 HG2 LYS A 31 2.415 20.319 -10.565 1.00 0.00 H new ATOM 0 HG3 LYS A 31 3.933 19.460 -10.733 1.00 0.00 H new ATOM 0 HD2 LYS A 31 1.629 19.106 -12.684 1.00 0.00 H new ATOM 0 HD3 LYS A 31 2.863 20.332 -12.895 1.00 0.00 H new ATOM 0 HE2 LYS A 31 3.498 17.375 -12.570 1.00 0.00 H new ATOM 0 HE3 LYS A 31 3.256 18.135 -14.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 5.556 18.151 -13.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 5.059 19.747 -13.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 5.388 18.704 -12.147 1.00 0.00 H new ATOM 478 N VAL A 32 1.632 20.229 -7.779 1.00 0.00 N ATOM 479 CA VAL A 32 0.652 21.079 -7.113 1.00 0.00 C ATOM 480 C VAL A 32 0.554 22.440 -7.792 1.00 0.00 C ATOM 481 O VAL A 32 1.500 22.893 -8.436 1.00 0.00 O ATOM 482 CB VAL A 32 1.004 21.282 -5.628 1.00 0.00 C ATOM 483 CG1 VAL A 32 -0.099 22.054 -4.918 1.00 0.00 C ATOM 484 CG2 VAL A 32 1.249 19.942 -4.950 1.00 0.00 C ATOM 0 H VAL A 32 2.509 20.697 -8.009 1.00 0.00 H new ATOM 0 HA VAL A 32 -0.310 20.571 -7.185 1.00 0.00 H new ATOM 0 HB VAL A 32 1.922 21.867 -5.567 1.00 0.00 H new ATOM 0 HG11 VAL A 32 0.167 22.188 -3.870 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -0.221 23.030 -5.389 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -1.034 21.498 -4.987 1.00 0.00 H new ATOM 0 HG21 VAL A 32 1.497 20.105 -3.901 1.00 0.00 H new ATOM 0 HG22 VAL A 32 0.350 19.329 -5.020 1.00 0.00 H new ATOM 0 HG23 VAL A 32 2.076 19.431 -5.443 1.00 0.00 H new ATOM 494 N GLU A 33 -0.597 23.088 -7.643 1.00 0.00 N ATOM 495 CA GLU A 33 -0.818 24.399 -8.242 1.00 0.00 C ATOM 496 C GLU A 33 -1.666 25.280 -7.328 1.00 0.00 C ATOM 497 O GLU A 33 -2.497 24.785 -6.568 1.00 0.00 O ATOM 498 CB GLU A 33 -1.501 24.253 -9.604 1.00 0.00 C ATOM 499 CG GLU A 33 -0.624 23.596 -10.657 1.00 0.00 C ATOM 500 CD GLU A 33 0.386 24.556 -11.256 1.00 0.00 C ATOM 501 OE1 GLU A 33 0.019 25.721 -11.513 1.00 0.00 O ATOM 502 OE2 GLU A 33 1.545 24.140 -11.467 1.00 0.00 O ATOM 0 H GLU A 33 -1.390 22.727 -7.113 1.00 0.00 H new ATOM 0 HA GLU A 33 0.153 24.876 -8.379 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -2.411 23.666 -9.483 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -1.802 25.239 -9.958 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -0.098 22.752 -10.211 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -1.254 23.195 -11.451 1.00 0.00 H new ATOM 509 N GLY A 34 -1.448 26.589 -7.409 1.00 0.00 N ATOM 510 CA GLY A 34 -2.198 27.518 -6.584 1.00 0.00 C ATOM 511 C GLY A 34 -2.227 27.105 -5.125 1.00 0.00 C ATOM 512 O GLY A 34 -1.543 26.163 -4.725 1.00 0.00 O ATOM 0 H GLY A 34 -0.766 27.023 -8.031 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -1.758 28.511 -6.669 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -3.219 27.589 -6.959 1.00 0.00 H new ATOM 516 N LYS A 35 -3.019 27.813 -4.327 1.00 0.00 N ATOM 517 CA LYS A 35 -3.135 27.516 -2.904 1.00 0.00 C ATOM 518 C LYS A 35 -4.516 27.895 -2.380 1.00 0.00 C ATOM 519 O LYS A 35 -4.820 29.073 -2.198 1.00 0.00 O ATOM 520 CB LYS A 35 -2.056 28.264 -2.117 1.00 0.00 C ATOM 521 CG LYS A 35 -2.216 29.774 -2.151 1.00 0.00 C ATOM 522 CD LYS A 35 -0.928 30.480 -1.762 1.00 0.00 C ATOM 523 CE LYS A 35 -1.182 31.929 -1.372 1.00 0.00 C ATOM 524 NZ LYS A 35 -1.551 32.763 -2.549 1.00 0.00 N ATOM 0 H LYS A 35 -3.590 28.597 -4.642 1.00 0.00 H new ATOM 0 HA LYS A 35 -2.997 26.443 -2.769 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -2.076 27.928 -1.080 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -1.077 28.001 -2.519 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -2.516 30.087 -3.151 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -3.015 30.072 -1.472 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -0.461 29.954 -0.929 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -0.226 30.444 -2.595 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -1.981 31.971 -0.632 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -0.289 32.340 -0.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -1.716 33.743 -2.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -0.778 32.743 -3.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -2.417 32.386 -2.984 1.00 0.00 H new ATOM 538 N GLY A 36 -5.349 26.887 -2.138 1.00 0.00 N ATOM 539 CA GLY A 36 -6.688 27.136 -1.636 1.00 0.00 C ATOM 540 C GLY A 36 -7.662 27.502 -2.738 1.00 0.00 C ATOM 541 O GLY A 36 -8.851 27.198 -2.651 1.00 0.00 O ATOM 0 H GLY A 36 -5.121 25.903 -2.281 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -7.049 26.248 -1.117 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -6.654 27.942 -0.903 1.00 0.00 H new ATOM 545 N ASN A 37 -7.157 28.159 -3.777 1.00 0.00 N ATOM 546 CA ASN A 37 -7.992 28.569 -4.900 1.00 0.00 C ATOM 547 C ASN A 37 -8.052 27.475 -5.962 1.00 0.00 C ATOM 548 O ASN A 37 -8.102 27.758 -7.158 1.00 0.00 O ATOM 549 CB ASN A 37 -7.455 29.863 -5.516 1.00 0.00 C ATOM 550 CG ASN A 37 -8.515 30.615 -6.297 1.00 0.00 C ATOM 551 OD1 ASN A 37 -8.757 31.864 -5.915 1.00 0.00 O flip ATOM 552 ND2 ASN A 37 -9.109 30.080 -7.232 1.00 0.00 N flip ATOM 0 H ASN A 37 -6.175 28.419 -3.865 1.00 0.00 H new ATOM 0 HA ASN A 37 -9.001 28.743 -4.525 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -7.067 30.505 -4.725 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -6.619 29.629 -6.176 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -8.891 29.118 -7.491 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -9.820 30.599 -7.748 1.00 0.00 H new ATOM 559 N GLY A 38 -8.049 26.223 -5.515 1.00 0.00 N ATOM 560 CA GLY A 38 -8.104 25.105 -6.438 1.00 0.00 C ATOM 561 C GLY A 38 -6.842 24.266 -6.409 1.00 0.00 C ATOM 562 O GLY A 38 -6.457 23.676 -7.419 1.00 0.00 O ATOM 0 H GLY A 38 -8.009 25.963 -4.529 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -8.960 24.477 -6.192 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -8.264 25.480 -7.449 1.00 0.00 H new ATOM 566 N ILE A 39 -6.196 24.212 -5.249 1.00 0.00 N ATOM 567 CA ILE A 39 -4.970 23.439 -5.092 1.00 0.00 C ATOM 568 C ILE A 39 -5.263 21.943 -5.064 1.00 0.00 C ATOM 569 O ILE A 39 -6.050 21.469 -4.244 1.00 0.00 O ATOM 570 CB ILE A 39 -4.219 23.829 -3.805 1.00 0.00 C ATOM 571 CG1 ILE A 39 -2.820 23.208 -3.798 1.00 0.00 C ATOM 572 CG2 ILE A 39 -5.006 23.389 -2.580 1.00 0.00 C ATOM 573 CD1 ILE A 39 -1.940 23.718 -2.678 1.00 0.00 C ATOM 0 H ILE A 39 -6.501 24.695 -4.404 1.00 0.00 H new ATOM 0 HA ILE A 39 -4.341 23.667 -5.952 1.00 0.00 H new ATOM 0 HB ILE A 39 -4.115 24.914 -3.776 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -2.912 22.125 -3.713 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -2.335 23.413 -4.753 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -4.463 23.671 -1.678 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -5.983 23.873 -2.582 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -5.137 22.307 -2.601 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -0.964 23.236 -2.734 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -1.818 24.797 -2.774 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -2.403 23.489 -1.718 1.00 0.00 H new ATOM 585 N LYS A 40 -4.624 21.203 -5.963 1.00 0.00 N ATOM 586 CA LYS A 40 -4.813 19.759 -6.041 1.00 0.00 C ATOM 587 C LYS A 40 -3.493 19.053 -6.334 1.00 0.00 C ATOM 588 O LYS A 40 -2.615 19.605 -6.999 1.00 0.00 O ATOM 589 CB LYS A 40 -5.839 19.416 -7.123 1.00 0.00 C ATOM 590 CG LYS A 40 -5.431 19.869 -8.514 1.00 0.00 C ATOM 591 CD LYS A 40 -6.503 19.549 -9.542 1.00 0.00 C ATOM 592 CE LYS A 40 -6.045 19.893 -10.951 1.00 0.00 C ATOM 593 NZ LYS A 40 -7.183 19.929 -11.911 1.00 0.00 N ATOM 0 H LYS A 40 -3.970 21.580 -6.649 1.00 0.00 H new ATOM 0 HA LYS A 40 -5.183 19.413 -5.076 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -5.997 18.338 -7.133 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -6.793 19.876 -6.866 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -5.241 20.942 -8.507 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -4.498 19.382 -8.797 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -6.755 18.490 -9.489 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -7.411 20.105 -9.308 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -5.545 20.862 -10.944 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -5.312 19.158 -11.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -6.829 20.167 -12.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -7.645 18.998 -11.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -7.871 20.648 -11.608 1.00 0.00 H new ATOM 607 N THR A 41 -3.359 17.828 -5.835 1.00 0.00 N ATOM 608 CA THR A 41 -2.147 17.046 -6.044 1.00 0.00 C ATOM 609 C THR A 41 -2.338 16.021 -7.156 1.00 0.00 C ATOM 610 O THR A 41 -3.225 15.171 -7.084 1.00 0.00 O ATOM 611 CB THR A 41 -1.720 16.317 -4.756 1.00 0.00 C ATOM 612 OG1 THR A 41 -1.564 17.258 -3.688 1.00 0.00 O ATOM 613 CG2 THR A 41 -0.416 15.563 -4.968 1.00 0.00 C ATOM 0 H THR A 41 -4.075 17.356 -5.283 1.00 0.00 H new ATOM 0 HA THR A 41 -1.364 17.748 -6.332 1.00 0.00 H new ATOM 0 HB THR A 41 -2.499 15.600 -4.496 1.00 0.00 H new ATOM 0 HG1 THR A 41 -2.444 17.591 -3.414 1.00 0.00 H new ATOM 0 HG21 THR A 41 -0.135 15.056 -4.045 1.00 0.00 H new ATOM 0 HG22 THR A 41 -0.546 14.827 -5.761 1.00 0.00 H new ATOM 0 HG23 THR A 41 0.369 16.265 -5.250 1.00 0.00 H new ATOM 621 N VAL A 42 -1.500 16.106 -8.184 1.00 0.00 N ATOM 622 CA VAL A 42 -1.576 15.184 -9.310 1.00 0.00 C ATOM 623 C VAL A 42 -0.377 14.242 -9.332 1.00 0.00 C ATOM 624 O VAL A 42 0.736 14.645 -9.671 1.00 0.00 O ATOM 625 CB VAL A 42 -1.644 15.940 -10.651 1.00 0.00 C ATOM 626 CG1 VAL A 42 -1.768 14.963 -11.810 1.00 0.00 C ATOM 627 CG2 VAL A 42 -2.803 16.926 -10.647 1.00 0.00 C ATOM 0 H VAL A 42 -0.760 16.804 -8.260 1.00 0.00 H new ATOM 0 HA VAL A 42 -2.489 14.603 -9.181 1.00 0.00 H new ATOM 0 HB VAL A 42 -0.719 16.502 -10.779 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -1.815 15.516 -12.748 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -0.902 14.301 -11.822 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -2.676 14.372 -11.692 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -2.837 17.452 -11.601 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -3.738 16.387 -10.496 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -2.665 17.646 -9.841 1.00 0.00 H new ATOM 637 N ILE A 43 -0.612 12.986 -8.967 1.00 0.00 N ATOM 638 CA ILE A 43 0.448 11.986 -8.946 1.00 0.00 C ATOM 639 C ILE A 43 0.871 11.603 -10.360 1.00 0.00 C ATOM 640 O ILE A 43 0.434 10.585 -10.896 1.00 0.00 O ATOM 641 CB ILE A 43 0.010 10.717 -8.192 1.00 0.00 C ATOM 642 CG1 ILE A 43 -0.594 11.086 -6.835 1.00 0.00 C ATOM 643 CG2 ILE A 43 1.189 9.773 -8.013 1.00 0.00 C ATOM 644 CD1 ILE A 43 -1.571 10.058 -6.308 1.00 0.00 C ATOM 0 H ILE A 43 -1.527 12.637 -8.682 1.00 0.00 H new ATOM 0 HA ILE A 43 1.294 12.434 -8.425 1.00 0.00 H new ATOM 0 HB ILE A 43 -0.752 10.208 -8.782 1.00 0.00 H new ATOM 0 HG12 ILE A 43 0.211 11.215 -6.111 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -1.102 12.047 -6.922 1.00 0.00 H new ATOM 0 HG21 ILE A 43 0.863 8.881 -7.478 1.00 0.00 H new ATOM 0 HG22 ILE A 43 1.579 9.488 -8.990 1.00 0.00 H new ATOM 0 HG23 ILE A 43 1.972 10.272 -7.442 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -1.959 10.386 -5.343 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -2.396 9.946 -7.012 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -1.063 9.101 -6.189 1.00 0.00 H new ATOM 656 N VAL A 44 1.726 12.426 -10.959 1.00 0.00 N ATOM 657 CA VAL A 44 2.211 12.173 -12.311 1.00 0.00 C ATOM 658 C VAL A 44 2.810 10.776 -12.426 1.00 0.00 C ATOM 659 O VAL A 44 2.387 9.976 -13.260 1.00 0.00 O ATOM 660 CB VAL A 44 3.270 13.210 -12.730 1.00 0.00 C ATOM 661 CG1 VAL A 44 3.821 12.882 -14.110 1.00 0.00 C ATOM 662 CG2 VAL A 44 2.682 14.612 -12.702 1.00 0.00 C ATOM 0 H VAL A 44 2.097 13.273 -10.530 1.00 0.00 H new ATOM 0 HA VAL A 44 1.352 12.253 -12.977 1.00 0.00 H new ATOM 0 HB VAL A 44 4.094 13.172 -12.017 1.00 0.00 H new ATOM 0 HG11 VAL A 44 4.568 13.625 -14.390 1.00 0.00 H new ATOM 0 HG12 VAL A 44 4.281 11.894 -14.093 1.00 0.00 H new ATOM 0 HG13 VAL A 44 3.009 12.892 -14.838 1.00 0.00 H new ATOM 0 HG21 VAL A 44 3.444 15.332 -13.001 1.00 0.00 H new ATOM 0 HG22 VAL A 44 1.840 14.667 -13.392 1.00 0.00 H new ATOM 0 HG23 VAL A 44 2.340 14.843 -11.693 1.00 0.00 H new ATOM 672 N ASN A 45 3.796 10.489 -11.583 1.00 0.00 N ATOM 673 CA ASN A 45 4.454 9.187 -11.591 1.00 0.00 C ATOM 674 C ASN A 45 3.624 8.154 -10.835 1.00 0.00 C ATOM 675 O ASN A 45 4.155 7.374 -10.046 1.00 0.00 O ATOM 676 CB ASN A 45 5.848 9.293 -10.968 1.00 0.00 C ATOM 677 CG ASN A 45 6.825 8.298 -11.564 1.00 0.00 C ATOM 678 OD1 ASN A 45 6.730 7.946 -12.740 1.00 0.00 O ATOM 679 ND2 ASN A 45 7.770 7.839 -10.753 1.00 0.00 N ATOM 0 H ASN A 45 4.157 11.140 -10.886 1.00 0.00 H new ATOM 0 HA ASN A 45 4.550 8.862 -12.627 1.00 0.00 H new ATOM 0 HB2 ASN A 45 6.231 10.304 -11.110 1.00 0.00 H new ATOM 0 HB3 ASN A 45 5.776 9.128 -9.893 1.00 0.00 H new ATOM 0 HD21 ASN A 45 8.455 7.167 -11.098 1.00 0.00 H new ATOM 0 HD22 ASN A 45 7.811 8.158 -9.785 1.00 0.00 H new ATOM 686 N MET A 46 2.319 8.155 -11.084 1.00 0.00 N ATOM 687 CA MET A 46 1.416 7.216 -10.429 1.00 0.00 C ATOM 688 C MET A 46 1.441 5.860 -11.126 1.00 0.00 C ATOM 689 O MET A 46 1.698 4.833 -10.498 1.00 0.00 O ATOM 690 CB MET A 46 -0.010 7.770 -10.418 1.00 0.00 C ATOM 691 CG MET A 46 -1.068 6.720 -10.123 1.00 0.00 C ATOM 692 SD MET A 46 -0.519 5.501 -8.913 1.00 0.00 S ATOM 693 CE MET A 46 -0.719 6.423 -7.390 1.00 0.00 C ATOM 0 H MET A 46 1.863 8.795 -11.734 1.00 0.00 H new ATOM 0 HA MET A 46 1.755 7.083 -9.402 1.00 0.00 H new ATOM 0 HB2 MET A 46 -0.078 8.562 -9.672 1.00 0.00 H new ATOM 0 HB3 MET A 46 -0.222 8.225 -11.386 1.00 0.00 H new ATOM 0 HG2 MET A 46 -1.969 7.211 -9.755 1.00 0.00 H new ATOM 0 HG3 MET A 46 -1.338 6.211 -11.049 1.00 0.00 H new ATOM 0 HE1 MET A 46 0.260 6.708 -7.006 1.00 0.00 H new ATOM 0 HE2 MET A 46 -1.308 7.320 -7.582 1.00 0.00 H new ATOM 0 HE3 MET A 46 -1.231 5.803 -6.654 1.00 0.00 H new ATOM 703 N VAL A 47 1.174 5.864 -12.428 1.00 0.00 N ATOM 704 CA VAL A 47 1.167 4.634 -13.211 1.00 0.00 C ATOM 705 C VAL A 47 2.550 3.992 -13.238 1.00 0.00 C ATOM 706 O VAL A 47 2.678 2.767 -13.228 1.00 0.00 O ATOM 707 CB VAL A 47 0.705 4.891 -14.658 1.00 0.00 C ATOM 708 CG1 VAL A 47 0.672 3.592 -15.447 1.00 0.00 C ATOM 709 CG2 VAL A 47 -0.658 5.566 -14.669 1.00 0.00 C ATOM 0 H VAL A 47 0.960 6.706 -12.963 1.00 0.00 H new ATOM 0 HA VAL A 47 0.463 3.956 -12.728 1.00 0.00 H new ATOM 0 HB VAL A 47 1.421 5.560 -15.136 1.00 0.00 H new ATOM 0 HG11 VAL A 47 0.343 3.794 -16.466 1.00 0.00 H new ATOM 0 HG12 VAL A 47 1.670 3.153 -15.467 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -0.021 2.896 -14.974 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -0.969 5.740 -15.699 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -1.386 4.924 -14.174 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -0.597 6.518 -14.142 1.00 0.00 H new ATOM 719 N ASP A 48 3.583 4.826 -13.270 1.00 0.00 N ATOM 720 CA ASP A 48 4.958 4.341 -13.296 1.00 0.00 C ATOM 721 C ASP A 48 5.235 3.428 -12.105 1.00 0.00 C ATOM 722 O ASP A 48 5.416 2.221 -12.264 1.00 0.00 O ATOM 723 CB ASP A 48 5.937 5.516 -13.292 1.00 0.00 C ATOM 724 CG ASP A 48 7.227 5.197 -14.022 1.00 0.00 C ATOM 725 OD1 ASP A 48 8.109 4.554 -13.415 1.00 0.00 O ATOM 726 OD2 ASP A 48 7.355 5.591 -15.200 1.00 0.00 O ATOM 0 H ASP A 48 3.494 5.842 -13.279 1.00 0.00 H new ATOM 0 HA ASP A 48 5.097 3.766 -14.212 1.00 0.00 H new ATOM 0 HB2 ASP A 48 5.464 6.381 -13.757 1.00 0.00 H new ATOM 0 HB3 ASP A 48 6.164 5.792 -12.262 1.00 0.00 H new ATOM 731 N VAL A 49 5.267 4.014 -10.912 1.00 0.00 N ATOM 732 CA VAL A 49 5.522 3.255 -9.694 1.00 0.00 C ATOM 733 C VAL A 49 4.652 2.004 -9.634 1.00 0.00 C ATOM 734 O VAL A 49 5.127 0.921 -9.296 1.00 0.00 O ATOM 735 CB VAL A 49 5.265 4.107 -8.437 1.00 0.00 C ATOM 736 CG1 VAL A 49 6.218 5.291 -8.391 1.00 0.00 C ATOM 737 CG2 VAL A 49 3.818 4.574 -8.398 1.00 0.00 C ATOM 0 H VAL A 49 5.119 5.012 -10.764 1.00 0.00 H new ATOM 0 HA VAL A 49 6.572 2.963 -9.717 1.00 0.00 H new ATOM 0 HB VAL A 49 5.448 3.491 -7.557 1.00 0.00 H new ATOM 0 HG11 VAL A 49 6.022 5.882 -7.496 1.00 0.00 H new ATOM 0 HG12 VAL A 49 7.246 4.930 -8.369 1.00 0.00 H new ATOM 0 HG13 VAL A 49 6.070 5.912 -9.275 1.00 0.00 H new ATOM 0 HG21 VAL A 49 3.654 5.175 -7.503 1.00 0.00 H new ATOM 0 HG22 VAL A 49 3.606 5.175 -9.282 1.00 0.00 H new ATOM 0 HG23 VAL A 49 3.156 3.708 -8.380 1.00 0.00 H new ATOM 747 N ALA A 50 3.375 2.163 -9.965 1.00 0.00 N ATOM 748 CA ALA A 50 2.438 1.046 -9.952 1.00 0.00 C ATOM 749 C ALA A 50 2.940 -0.103 -10.819 1.00 0.00 C ATOM 750 O ALA A 50 3.013 -1.247 -10.371 1.00 0.00 O ATOM 751 CB ALA A 50 1.065 1.504 -10.422 1.00 0.00 C ATOM 0 H ALA A 50 2.965 3.054 -10.245 1.00 0.00 H new ATOM 0 HA ALA A 50 2.357 0.684 -8.927 1.00 0.00 H new ATOM 0 HB1 ALA A 50 0.375 0.660 -10.407 1.00 0.00 H new ATOM 0 HB2 ALA A 50 0.696 2.286 -9.759 1.00 0.00 H new ATOM 0 HB3 ALA A 50 1.139 1.894 -11.437 1.00 0.00 H new ATOM 757 N LYS A 51 3.286 0.209 -12.063 1.00 0.00 N ATOM 758 CA LYS A 51 3.783 -0.798 -12.994 1.00 0.00 C ATOM 759 C LYS A 51 4.901 -1.620 -12.361 1.00 0.00 C ATOM 760 O LYS A 51 4.927 -2.845 -12.481 1.00 0.00 O ATOM 761 CB LYS A 51 4.289 -0.131 -14.275 1.00 0.00 C ATOM 762 CG LYS A 51 3.215 0.045 -15.335 1.00 0.00 C ATOM 763 CD LYS A 51 3.815 0.421 -16.680 1.00 0.00 C ATOM 764 CE LYS A 51 2.829 1.208 -17.529 1.00 0.00 C ATOM 765 NZ LYS A 51 3.364 1.480 -18.892 1.00 0.00 N ATOM 0 H LYS A 51 3.232 1.151 -12.450 1.00 0.00 H new ATOM 0 HA LYS A 51 2.959 -1.467 -13.240 1.00 0.00 H new ATOM 0 HB2 LYS A 51 4.705 0.845 -14.026 1.00 0.00 H new ATOM 0 HB3 LYS A 51 5.102 -0.728 -14.689 1.00 0.00 H new ATOM 0 HG2 LYS A 51 2.646 -0.879 -15.435 1.00 0.00 H new ATOM 0 HG3 LYS A 51 2.514 0.818 -15.019 1.00 0.00 H new ATOM 0 HD2 LYS A 51 4.717 1.013 -16.525 1.00 0.00 H new ATOM 0 HD3 LYS A 51 4.114 -0.482 -17.211 1.00 0.00 H new ATOM 0 HE2 LYS A 51 1.895 0.652 -17.610 1.00 0.00 H new ATOM 0 HE3 LYS A 51 2.597 2.152 -17.035 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 2.662 2.018 -19.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 4.242 2.032 -18.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 3.562 0.580 -19.373 1.00 0.00 H new ATOM 779 N ALA A 52 5.821 -0.940 -11.686 1.00 0.00 N ATOM 780 CA ALA A 52 6.938 -1.608 -11.031 1.00 0.00 C ATOM 781 C ALA A 52 6.445 -2.649 -10.031 1.00 0.00 C ATOM 782 O ALA A 52 7.056 -3.707 -9.869 1.00 0.00 O ATOM 783 CB ALA A 52 7.830 -0.589 -10.338 1.00 0.00 C ATOM 0 H ALA A 52 5.815 0.074 -11.578 1.00 0.00 H new ATOM 0 HA ALA A 52 7.520 -2.123 -11.795 1.00 0.00 H new ATOM 0 HB1 ALA A 52 8.660 -1.102 -9.853 1.00 0.00 H new ATOM 0 HB2 ALA A 52 8.219 0.115 -11.074 1.00 0.00 H new ATOM 0 HB3 ALA A 52 7.251 -0.048 -9.590 1.00 0.00 H new ATOM 789 N LEU A 53 5.339 -2.343 -9.363 1.00 0.00 N ATOM 790 CA LEU A 53 4.764 -3.253 -8.378 1.00 0.00 C ATOM 791 C LEU A 53 3.825 -4.254 -9.044 1.00 0.00 C ATOM 792 O LEU A 53 2.997 -4.878 -8.382 1.00 0.00 O ATOM 793 CB LEU A 53 4.010 -2.464 -7.306 1.00 0.00 C ATOM 794 CG LEU A 53 4.723 -1.229 -6.756 1.00 0.00 C ATOM 795 CD1 LEU A 53 3.723 -0.270 -6.128 1.00 0.00 C ATOM 796 CD2 LEU A 53 5.785 -1.632 -5.743 1.00 0.00 C ATOM 0 H LEU A 53 4.822 -1.472 -9.485 1.00 0.00 H new ATOM 0 HA LEU A 53 5.579 -3.804 -7.909 1.00 0.00 H new ATOM 0 HB2 LEU A 53 3.052 -2.151 -7.720 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.794 -3.135 -6.474 1.00 0.00 H new ATOM 0 HG LEU A 53 5.214 -0.719 -7.585 1.00 0.00 H new ATOM 0 HD11 LEU A 53 4.249 0.603 -5.742 1.00 0.00 H new ATOM 0 HD12 LEU A 53 3.000 0.045 -6.880 1.00 0.00 H new ATOM 0 HD13 LEU A 53 3.203 -0.770 -5.311 1.00 0.00 H new ATOM 0 HD21 LEU A 53 6.282 -0.740 -5.362 1.00 0.00 H new ATOM 0 HD22 LEU A 53 5.316 -2.166 -4.917 1.00 0.00 H new ATOM 0 HD23 LEU A 53 6.519 -2.279 -6.223 1.00 0.00 H new ATOM 808 N ASN A 54 3.962 -4.403 -10.357 1.00 0.00 N ATOM 809 CA ASN A 54 3.127 -5.330 -11.113 1.00 0.00 C ATOM 810 C ASN A 54 1.666 -5.216 -10.688 1.00 0.00 C ATOM 811 O ASN A 54 0.927 -6.200 -10.700 1.00 0.00 O ATOM 812 CB ASN A 54 3.616 -6.766 -10.916 1.00 0.00 C ATOM 813 CG ASN A 54 5.075 -6.937 -11.294 1.00 0.00 C ATOM 814 OD1 ASN A 54 5.572 -6.277 -12.206 1.00 0.00 O ATOM 815 ND2 ASN A 54 5.767 -7.826 -10.592 1.00 0.00 N ATOM 0 H ASN A 54 4.643 -3.894 -10.920 1.00 0.00 H new ATOM 0 HA ASN A 54 3.202 -5.069 -12.169 1.00 0.00 H new ATOM 0 HB2 ASN A 54 3.477 -7.054 -9.874 1.00 0.00 H new ATOM 0 HB3 ASN A 54 3.006 -7.440 -11.517 1.00 0.00 H new ATOM 0 HD21 ASN A 54 6.753 -7.985 -10.800 1.00 0.00 H new ATOM 0 HD22 ASN A 54 5.313 -8.351 -9.844 1.00 0.00 H new ATOM 822 N ARG A 55 1.257 -4.008 -10.313 1.00 0.00 N ATOM 823 CA ARG A 55 -0.115 -3.765 -9.884 1.00 0.00 C ATOM 824 C ARG A 55 -0.633 -2.443 -10.443 1.00 0.00 C ATOM 825 O ARG A 55 0.125 -1.505 -10.689 1.00 0.00 O ATOM 826 CB ARG A 55 -0.200 -3.753 -8.357 1.00 0.00 C ATOM 827 CG ARG A 55 -0.102 -5.135 -7.731 1.00 0.00 C ATOM 828 CD ARG A 55 -0.284 -5.077 -6.223 1.00 0.00 C ATOM 829 NE ARG A 55 0.092 -6.333 -5.578 1.00 0.00 N ATOM 830 CZ ARG A 55 -0.396 -6.734 -4.409 1.00 0.00 C ATOM 831 NH1 ARG A 55 -1.275 -5.982 -3.761 1.00 0.00 N ATOM 832 NH2 ARG A 55 -0.005 -7.889 -3.887 1.00 0.00 N ATOM 0 H ARG A 55 1.856 -3.183 -10.298 1.00 0.00 H new ATOM 0 HA ARG A 55 -0.738 -4.572 -10.269 1.00 0.00 H new ATOM 0 HB2 ARG A 55 0.600 -3.127 -7.962 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -1.142 -3.294 -8.057 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -0.860 -5.787 -8.165 1.00 0.00 H new ATOM 0 HG3 ARG A 55 0.868 -5.574 -7.965 1.00 0.00 H new ATOM 0 HD2 ARG A 55 0.319 -4.266 -5.816 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -1.324 -4.848 -5.992 1.00 0.00 H new ATOM 0 HE ARG A 55 0.766 -6.935 -6.051 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -1.578 -5.093 -4.160 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -1.648 -6.292 -2.864 1.00 0.00 H new ATOM 0 HH21 ARG A 55 0.671 -8.470 -4.383 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -0.380 -8.196 -2.990 1.00 0.00 H new ATOM 846 N PRO A 56 -1.956 -2.365 -10.649 1.00 0.00 N ATOM 847 CA PRO A 56 -2.606 -1.163 -11.180 1.00 0.00 C ATOM 848 C PRO A 56 -2.594 -0.009 -10.184 1.00 0.00 C ATOM 849 O PRO A 56 -2.698 -0.202 -8.973 1.00 0.00 O ATOM 850 CB PRO A 56 -4.041 -1.624 -11.448 1.00 0.00 C ATOM 851 CG PRO A 56 -4.254 -2.762 -10.510 1.00 0.00 C ATOM 852 CD PRO A 56 -2.921 -3.444 -10.377 1.00 0.00 C ATOM 0 HA PRO A 56 -2.095 -0.780 -12.063 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -4.755 -0.821 -11.265 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -4.170 -1.936 -12.485 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -4.610 -2.409 -9.542 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -5.007 -3.449 -10.895 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -2.783 -3.865 -9.381 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -2.817 -4.264 -11.087 1.00 0.00 H new ATOM 860 N PRO A 57 -2.464 1.221 -10.703 1.00 0.00 N ATOM 861 CA PRO A 57 -2.436 2.431 -9.876 1.00 0.00 C ATOM 862 C PRO A 57 -3.792 2.734 -9.246 1.00 0.00 C ATOM 863 O PRO A 57 -3.906 3.599 -8.378 1.00 0.00 O ATOM 864 CB PRO A 57 -2.050 3.531 -10.869 1.00 0.00 C ATOM 865 CG PRO A 57 -2.499 3.019 -12.194 1.00 0.00 C ATOM 866 CD PRO A 57 -2.335 1.525 -12.138 1.00 0.00 C ATOM 0 HA PRO A 57 -1.747 2.335 -9.036 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -2.537 4.475 -10.623 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -0.976 3.715 -10.859 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -3.537 3.291 -12.386 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -1.903 3.447 -13.000 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -3.097 1.015 -12.727 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -1.367 1.212 -12.530 1.00 0.00 H new ATOM 874 N THR A 58 -4.819 2.015 -9.689 1.00 0.00 N ATOM 875 CA THR A 58 -6.167 2.207 -9.169 1.00 0.00 C ATOM 876 C THR A 58 -6.258 1.781 -7.709 1.00 0.00 C ATOM 877 O THR A 58 -7.103 2.274 -6.960 1.00 0.00 O ATOM 878 CB THR A 58 -7.203 1.415 -9.989 1.00 0.00 C ATOM 879 OG1 THR A 58 -6.718 0.092 -10.246 1.00 0.00 O ATOM 880 CG2 THR A 58 -7.501 2.116 -11.306 1.00 0.00 C ATOM 0 H THR A 58 -4.743 1.294 -10.407 1.00 0.00 H new ATOM 0 HA THR A 58 -6.388 3.271 -9.249 1.00 0.00 H new ATOM 0 HB THR A 58 -8.124 1.357 -9.410 1.00 0.00 H new ATOM 0 HG1 THR A 58 -7.383 -0.405 -10.766 1.00 0.00 H new ATOM 0 HG21 THR A 58 -8.235 1.538 -11.868 1.00 0.00 H new ATOM 0 HG22 THR A 58 -7.898 3.111 -11.107 1.00 0.00 H new ATOM 0 HG23 THR A 58 -6.584 2.201 -11.888 1.00 0.00 H new ATOM 888 N TYR A 59 -5.385 0.864 -7.308 1.00 0.00 N ATOM 889 CA TYR A 59 -5.369 0.371 -5.936 1.00 0.00 C ATOM 890 C TYR A 59 -4.865 1.445 -4.977 1.00 0.00 C ATOM 891 O TYR A 59 -5.548 1.838 -4.031 1.00 0.00 O ATOM 892 CB TYR A 59 -4.489 -0.876 -5.831 1.00 0.00 C ATOM 893 CG TYR A 59 -5.235 -2.167 -6.079 1.00 0.00 C ATOM 894 CD1 TYR A 59 -6.493 -2.382 -5.528 1.00 0.00 C ATOM 895 CD2 TYR A 59 -4.684 -3.171 -6.864 1.00 0.00 C ATOM 896 CE1 TYR A 59 -7.178 -3.560 -5.752 1.00 0.00 C ATOM 897 CE2 TYR A 59 -5.362 -4.352 -7.094 1.00 0.00 C ATOM 898 CZ TYR A 59 -6.609 -4.542 -6.536 1.00 0.00 C ATOM 899 OH TYR A 59 -7.289 -5.717 -6.762 1.00 0.00 O ATOM 0 H TYR A 59 -4.679 0.447 -7.914 1.00 0.00 H new ATOM 0 HA TYR A 59 -6.390 0.112 -5.658 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -3.672 -0.795 -6.548 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -4.040 -0.911 -4.838 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -6.942 -1.615 -4.915 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -3.708 -3.026 -7.303 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -8.154 -3.712 -5.316 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -4.918 -5.122 -7.707 1.00 0.00 H new ATOM 0 HH TYR A 59 -8.254 -5.546 -6.741 1.00 0.00 H new ATOM 909 N PRO A 60 -3.641 1.933 -5.227 1.00 0.00 N ATOM 910 CA PRO A 60 -3.018 2.970 -4.398 1.00 0.00 C ATOM 911 C PRO A 60 -3.698 4.326 -4.557 1.00 0.00 C ATOM 912 O PRO A 60 -4.065 4.967 -3.573 1.00 0.00 O ATOM 913 CB PRO A 60 -1.581 3.027 -4.923 1.00 0.00 C ATOM 914 CG PRO A 60 -1.671 2.536 -6.327 1.00 0.00 C ATOM 915 CD PRO A 60 -2.771 1.511 -6.337 1.00 0.00 C ATOM 0 HA PRO A 60 -3.089 2.740 -3.335 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -1.185 4.042 -4.883 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -0.917 2.402 -4.327 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -1.893 3.354 -7.013 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -0.726 2.098 -6.649 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -3.306 1.505 -7.287 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -2.383 0.504 -6.183 1.00 0.00 H new ATOM 923 N THR A 61 -3.863 4.757 -5.804 1.00 0.00 N ATOM 924 CA THR A 61 -4.498 6.037 -6.092 1.00 0.00 C ATOM 925 C THR A 61 -5.730 6.248 -5.219 1.00 0.00 C ATOM 926 O THR A 61 -5.863 7.274 -4.552 1.00 0.00 O ATOM 927 CB THR A 61 -4.908 6.140 -7.573 1.00 0.00 C ATOM 928 OG1 THR A 61 -3.744 6.132 -8.406 1.00 0.00 O ATOM 929 CG2 THR A 61 -5.710 7.408 -7.825 1.00 0.00 C ATOM 0 H THR A 61 -3.566 4.238 -6.630 1.00 0.00 H new ATOM 0 HA THR A 61 -3.763 6.811 -5.872 1.00 0.00 H new ATOM 0 HB THR A 61 -5.532 5.280 -7.815 1.00 0.00 H new ATOM 0 HG1 THR A 61 -3.626 5.240 -8.795 1.00 0.00 H new ATOM 0 HG21 THR A 61 -5.988 7.459 -8.878 1.00 0.00 H new ATOM 0 HG22 THR A 61 -6.611 7.397 -7.211 1.00 0.00 H new ATOM 0 HG23 THR A 61 -5.106 8.278 -7.567 1.00 0.00 H new ATOM 937 N LYS A 62 -6.630 5.270 -5.227 1.00 0.00 N ATOM 938 CA LYS A 62 -7.851 5.347 -4.435 1.00 0.00 C ATOM 939 C LYS A 62 -7.531 5.383 -2.944 1.00 0.00 C ATOM 940 O LYS A 62 -8.196 6.075 -2.172 1.00 0.00 O ATOM 941 CB LYS A 62 -8.760 4.155 -4.743 1.00 0.00 C ATOM 942 CG LYS A 62 -10.046 4.145 -3.935 1.00 0.00 C ATOM 943 CD LYS A 62 -10.982 5.262 -4.363 1.00 0.00 C ATOM 944 CE LYS A 62 -12.381 5.064 -3.798 1.00 0.00 C ATOM 945 NZ LYS A 62 -13.213 6.291 -3.935 1.00 0.00 N ATOM 0 H LYS A 62 -6.536 4.414 -5.774 1.00 0.00 H new ATOM 0 HA LYS A 62 -8.368 6.269 -4.701 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -9.008 4.163 -5.804 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -8.213 3.232 -4.550 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -10.546 3.184 -4.056 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -9.812 4.251 -2.876 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -10.585 6.220 -4.027 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -11.030 5.301 -5.451 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -12.867 4.236 -4.314 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -12.312 4.788 -2.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -14.158 6.115 -3.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -12.762 7.075 -3.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -13.300 6.541 -4.941 1.00 0.00 H new ATOM 959 N TYR A 63 -6.508 4.635 -2.545 1.00 0.00 N ATOM 960 CA TYR A 63 -6.101 4.581 -1.146 1.00 0.00 C ATOM 961 C TYR A 63 -5.827 5.980 -0.603 1.00 0.00 C ATOM 962 O TYR A 63 -6.400 6.390 0.406 1.00 0.00 O ATOM 963 CB TYR A 63 -4.854 3.708 -0.989 1.00 0.00 C ATOM 964 CG TYR A 63 -4.619 3.237 0.428 1.00 0.00 C ATOM 965 CD1 TYR A 63 -5.490 2.341 1.036 1.00 0.00 C ATOM 966 CD2 TYR A 63 -3.527 3.688 1.159 1.00 0.00 C ATOM 967 CE1 TYR A 63 -5.279 1.908 2.331 1.00 0.00 C ATOM 968 CE2 TYR A 63 -3.308 3.259 2.453 1.00 0.00 C ATOM 969 CZ TYR A 63 -4.187 2.369 3.035 1.00 0.00 C ATOM 970 OH TYR A 63 -3.973 1.941 4.325 1.00 0.00 O ATOM 0 H TYR A 63 -5.946 4.058 -3.171 1.00 0.00 H new ATOM 0 HA TYR A 63 -6.918 4.143 -0.574 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -4.944 2.839 -1.641 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -3.983 4.270 -1.325 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -6.346 1.977 0.487 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -2.838 4.386 0.707 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -5.966 1.212 2.789 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -2.453 3.618 3.007 1.00 0.00 H new ATOM 0 HH TYR A 63 -3.160 2.360 4.678 1.00 0.00 H new ATOM 980 N PHE A 64 -4.947 6.709 -1.282 1.00 0.00 N ATOM 981 CA PHE A 64 -4.596 8.063 -0.870 1.00 0.00 C ATOM 982 C PHE A 64 -5.839 8.843 -0.451 1.00 0.00 C ATOM 983 O PHE A 64 -5.900 9.389 0.650 1.00 0.00 O ATOM 984 CB PHE A 64 -3.879 8.795 -2.006 1.00 0.00 C ATOM 985 CG PHE A 64 -2.390 8.599 -2.000 1.00 0.00 C ATOM 986 CD1 PHE A 64 -1.663 8.746 -0.829 1.00 0.00 C ATOM 987 CD2 PHE A 64 -1.717 8.267 -3.164 1.00 0.00 C ATOM 988 CE1 PHE A 64 -0.293 8.567 -0.821 1.00 0.00 C ATOM 989 CE2 PHE A 64 -0.346 8.086 -3.162 1.00 0.00 C ATOM 990 CZ PHE A 64 0.366 8.235 -1.988 1.00 0.00 C ATOM 0 H PHE A 64 -4.464 6.385 -2.120 1.00 0.00 H new ATOM 0 HA PHE A 64 -3.926 7.993 -0.013 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -4.279 8.450 -2.959 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -4.097 9.861 -1.936 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -2.173 9.003 0.087 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -2.270 8.148 -4.084 1.00 0.00 H new ATOM 0 HE1 PHE A 64 0.262 8.687 0.098 1.00 0.00 H new ATOM 0 HE2 PHE A 64 0.167 7.829 -4.077 1.00 0.00 H new ATOM 0 HZ PHE A 64 1.436 8.092 -1.983 1.00 0.00 H new ATOM 1000 N GLY A 65 -6.827 8.892 -1.339 1.00 0.00 N ATOM 1001 CA GLY A 65 -8.054 9.608 -1.045 1.00 0.00 C ATOM 1002 C GLY A 65 -8.678 9.174 0.267 1.00 0.00 C ATOM 1003 O GLY A 65 -9.256 9.990 0.987 1.00 0.00 O ATOM 0 H GLY A 65 -6.799 8.448 -2.257 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -7.847 10.678 -1.009 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -8.767 9.448 -1.854 1.00 0.00 H new ATOM 1007 N CYS A 66 -8.564 7.888 0.578 1.00 0.00 N ATOM 1008 CA CYS A 66 -9.124 7.347 1.811 1.00 0.00 C ATOM 1009 C CYS A 66 -8.506 8.022 3.031 1.00 0.00 C ATOM 1010 O CYS A 66 -9.197 8.688 3.800 1.00 0.00 O ATOM 1011 CB CYS A 66 -8.896 5.836 1.879 1.00 0.00 C ATOM 1012 SG CYS A 66 -9.768 5.018 3.236 1.00 0.00 S ATOM 0 H CYS A 66 -8.089 7.200 -0.007 1.00 0.00 H new ATOM 0 HA CYS A 66 -10.196 7.546 1.812 1.00 0.00 H new ATOM 0 HB2 CYS A 66 -9.212 5.389 0.936 1.00 0.00 H new ATOM 0 HB3 CYS A 66 -7.828 5.645 1.980 1.00 0.00 H new ATOM 0 HG CYS A 66 -9.273 3.829 3.416 1.00 0.00 H new ATOM 1018 N GLU A 67 -7.200 7.842 3.202 1.00 0.00 N ATOM 1019 CA GLU A 67 -6.489 8.433 4.330 1.00 0.00 C ATOM 1020 C GLU A 67 -6.667 9.948 4.353 1.00 0.00 C ATOM 1021 O GLU A 67 -6.892 10.543 5.408 1.00 0.00 O ATOM 1022 CB GLU A 67 -5.001 8.084 4.264 1.00 0.00 C ATOM 1023 CG GLU A 67 -4.724 6.590 4.306 1.00 0.00 C ATOM 1024 CD GLU A 67 -5.365 5.911 5.500 1.00 0.00 C ATOM 1025 OE1 GLU A 67 -4.767 5.949 6.596 1.00 0.00 O ATOM 1026 OE2 GLU A 67 -6.465 5.341 5.340 1.00 0.00 O ATOM 0 H GLU A 67 -6.613 7.292 2.574 1.00 0.00 H new ATOM 0 HA GLU A 67 -6.911 8.021 5.247 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -4.580 8.498 3.348 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -4.486 8.564 5.096 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -5.094 6.130 3.390 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -3.647 6.425 4.334 1.00 0.00 H new ATOM 1033 N LEU A 68 -6.563 10.567 3.182 1.00 0.00 N ATOM 1034 CA LEU A 68 -6.712 12.014 3.065 1.00 0.00 C ATOM 1035 C LEU A 68 -8.168 12.429 3.254 1.00 0.00 C ATOM 1036 O LEU A 68 -8.455 13.546 3.681 1.00 0.00 O ATOM 1037 CB LEU A 68 -6.206 12.490 1.703 1.00 0.00 C ATOM 1038 CG LEU A 68 -4.723 12.253 1.417 1.00 0.00 C ATOM 1039 CD1 LEU A 68 -4.412 12.518 -0.048 1.00 0.00 C ATOM 1040 CD2 LEU A 68 -3.861 13.130 2.313 1.00 0.00 C ATOM 0 H LEU A 68 -6.376 10.090 2.300 1.00 0.00 H new ATOM 0 HA LEU A 68 -6.116 12.480 3.850 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -6.789 11.993 0.927 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -6.406 13.558 1.617 1.00 0.00 H new ATOM 0 HG LEU A 68 -4.494 11.209 1.633 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -3.352 12.344 -0.232 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -5.003 11.848 -0.672 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -4.658 13.552 -0.291 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -2.808 12.948 2.096 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -4.094 14.179 2.128 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -4.062 12.892 3.357 1.00 0.00 H new ATOM 1052 N GLY A 69 -9.083 11.519 2.934 1.00 0.00 N ATOM 1053 CA GLY A 69 -10.498 11.809 3.077 1.00 0.00 C ATOM 1054 C GLY A 69 -10.997 12.788 2.033 1.00 0.00 C ATOM 1055 O GLY A 69 -11.866 13.613 2.313 1.00 0.00 O ATOM 0 H GLY A 69 -8.870 10.587 2.579 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -11.065 10.881 3.001 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -10.684 12.216 4.071 1.00 0.00 H new ATOM 1059 N ALA A 70 -10.446 12.698 0.827 1.00 0.00 N ATOM 1060 CA ALA A 70 -10.841 13.583 -0.261 1.00 0.00 C ATOM 1061 C ALA A 70 -11.290 12.786 -1.481 1.00 0.00 C ATOM 1062 O ALA A 70 -11.256 11.556 -1.477 1.00 0.00 O ATOM 1063 CB ALA A 70 -9.694 14.513 -0.629 1.00 0.00 C ATOM 0 H ALA A 70 -9.725 12.021 0.579 1.00 0.00 H new ATOM 0 HA ALA A 70 -11.685 14.183 0.080 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -10.004 15.168 -1.443 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -9.421 15.115 0.238 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -8.834 13.923 -0.946 1.00 0.00 H new ATOM 1069 N GLN A 71 -11.711 13.495 -2.524 1.00 0.00 N ATOM 1070 CA GLN A 71 -12.168 12.852 -3.750 1.00 0.00 C ATOM 1071 C GLN A 71 -11.025 12.715 -4.751 1.00 0.00 C ATOM 1072 O GLN A 71 -10.077 13.501 -4.739 1.00 0.00 O ATOM 1073 CB GLN A 71 -13.314 13.650 -4.373 1.00 0.00 C ATOM 1074 CG GLN A 71 -13.467 13.430 -5.869 1.00 0.00 C ATOM 1075 CD GLN A 71 -14.884 13.668 -6.353 1.00 0.00 C ATOM 1076 OE1 GLN A 71 -15.646 14.412 -5.735 1.00 0.00 O ATOM 1077 NE2 GLN A 71 -15.244 13.037 -7.464 1.00 0.00 N ATOM 0 H GLN A 71 -11.745 14.514 -2.544 1.00 0.00 H new ATOM 0 HA GLN A 71 -12.526 11.854 -3.496 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -14.246 13.378 -3.877 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -13.151 14.711 -4.185 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -12.789 14.097 -6.401 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -13.170 12.410 -6.115 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -14.580 12.430 -7.944 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -16.185 13.159 -7.838 1.00 0.00 H new ATOM 1086 N THR A 72 -11.122 11.712 -5.618 1.00 0.00 N ATOM 1087 CA THR A 72 -10.096 11.471 -6.625 1.00 0.00 C ATOM 1088 C THR A 72 -10.708 11.357 -8.017 1.00 0.00 C ATOM 1089 O THR A 72 -11.887 11.035 -8.161 1.00 0.00 O ATOM 1090 CB THR A 72 -9.300 10.188 -6.321 1.00 0.00 C ATOM 1091 OG1 THR A 72 -10.195 9.080 -6.173 1.00 0.00 O ATOM 1092 CG2 THR A 72 -8.474 10.351 -5.054 1.00 0.00 C ATOM 0 H THR A 72 -11.901 11.054 -5.643 1.00 0.00 H new ATOM 0 HA THR A 72 -9.419 12.325 -6.597 1.00 0.00 H new ATOM 0 HB THR A 72 -8.624 10.000 -7.155 1.00 0.00 H new ATOM 0 HG1 THR A 72 -9.703 8.306 -5.827 1.00 0.00 H new ATOM 0 HG21 THR A 72 -7.921 9.432 -4.860 1.00 0.00 H new ATOM 0 HG22 THR A 72 -7.774 11.177 -5.180 1.00 0.00 H new ATOM 0 HG23 THR A 72 -9.135 10.561 -4.213 1.00 0.00 H new ATOM 1100 N GLN A 73 -9.899 11.624 -9.037 1.00 0.00 N ATOM 1101 CA GLN A 73 -10.363 11.551 -10.418 1.00 0.00 C ATOM 1102 C GLN A 73 -9.603 10.479 -11.192 1.00 0.00 C ATOM 1103 O GLN A 73 -8.372 10.469 -11.214 1.00 0.00 O ATOM 1104 CB GLN A 73 -10.196 12.907 -11.106 1.00 0.00 C ATOM 1105 CG GLN A 73 -10.842 12.975 -12.481 1.00 0.00 C ATOM 1106 CD GLN A 73 -10.704 14.341 -13.123 1.00 0.00 C ATOM 1107 OE1 GLN A 73 -9.742 14.475 -14.029 1.00 0.00 O flip ATOM 1108 NE2 GLN A 73 -11.453 15.267 -12.809 1.00 0.00 N flip ATOM 0 H GLN A 73 -8.920 11.892 -8.934 1.00 0.00 H new ATOM 0 HA GLN A 73 -11.420 11.284 -10.406 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -10.627 13.682 -10.472 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -9.133 13.128 -11.202 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -10.388 12.225 -13.129 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -11.899 12.723 -12.395 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -12.179 15.120 -12.108 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -11.347 16.181 -13.250 1.00 0.00 H new ATOM 1117 N PHE A 74 -10.344 9.576 -11.824 1.00 0.00 N ATOM 1118 CA PHE A 74 -9.741 8.497 -12.598 1.00 0.00 C ATOM 1119 C PHE A 74 -10.002 8.685 -14.090 1.00 0.00 C ATOM 1120 O PHE A 74 -11.141 8.589 -14.548 1.00 0.00 O ATOM 1121 CB PHE A 74 -10.288 7.144 -12.140 1.00 0.00 C ATOM 1122 CG PHE A 74 -9.693 6.664 -10.847 1.00 0.00 C ATOM 1123 CD1 PHE A 74 -9.623 7.504 -9.747 1.00 0.00 C ATOM 1124 CD2 PHE A 74 -9.205 5.372 -10.730 1.00 0.00 C ATOM 1125 CE1 PHE A 74 -9.076 7.065 -8.556 1.00 0.00 C ATOM 1126 CE2 PHE A 74 -8.657 4.928 -9.542 1.00 0.00 C ATOM 1127 CZ PHE A 74 -8.593 5.775 -8.453 1.00 0.00 C ATOM 0 H PHE A 74 -11.364 9.570 -11.816 1.00 0.00 H new ATOM 0 HA PHE A 74 -8.664 8.522 -12.430 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -11.370 7.217 -12.028 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -10.098 6.402 -12.916 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -10.000 8.513 -9.821 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -9.254 4.704 -11.578 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -9.026 7.730 -7.707 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -8.279 3.919 -9.465 1.00 0.00 H new ATOM 0 HZ PHE A 74 -8.166 5.430 -7.523 1.00 0.00 H new ATOM 1137 N ASP A 75 -8.941 8.954 -14.841 1.00 0.00 N ATOM 1138 CA ASP A 75 -9.054 9.156 -16.281 1.00 0.00 C ATOM 1139 C ASP A 75 -8.078 8.257 -17.034 1.00 0.00 C ATOM 1140 O ASP A 75 -6.973 8.675 -17.379 1.00 0.00 O ATOM 1141 CB ASP A 75 -8.794 10.621 -16.635 1.00 0.00 C ATOM 1142 CG ASP A 75 -10.076 11.420 -16.771 1.00 0.00 C ATOM 1143 OD1 ASP A 75 -10.568 11.931 -15.743 1.00 0.00 O ATOM 1144 OD2 ASP A 75 -10.585 11.534 -17.905 1.00 0.00 O ATOM 0 H ASP A 75 -7.992 9.037 -14.477 1.00 0.00 H new ATOM 0 HA ASP A 75 -10.068 8.893 -16.581 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -8.168 11.072 -15.865 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -8.236 10.672 -17.570 1.00 0.00 H new ATOM 1149 N VAL A 76 -8.494 7.020 -17.286 1.00 0.00 N ATOM 1150 CA VAL A 76 -7.657 6.062 -17.998 1.00 0.00 C ATOM 1151 C VAL A 76 -7.321 6.560 -19.399 1.00 0.00 C ATOM 1152 O VAL A 76 -6.216 6.348 -19.898 1.00 0.00 O ATOM 1153 CB VAL A 76 -8.344 4.687 -18.105 1.00 0.00 C ATOM 1154 CG1 VAL A 76 -7.464 3.709 -18.868 1.00 0.00 C ATOM 1155 CG2 VAL A 76 -8.677 4.150 -16.721 1.00 0.00 C ATOM 0 H VAL A 76 -9.406 6.658 -17.007 1.00 0.00 H new ATOM 0 HA VAL A 76 -6.737 5.957 -17.423 1.00 0.00 H new ATOM 0 HB VAL A 76 -9.276 4.807 -18.657 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -7.965 2.743 -18.934 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -7.280 4.092 -19.872 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -6.515 3.590 -18.346 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -9.162 3.178 -16.815 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -7.760 4.044 -16.142 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -9.348 4.843 -16.214 1.00 0.00 H new ATOM 1165 N LYS A 77 -8.283 7.225 -20.030 1.00 0.00 N ATOM 1166 CA LYS A 77 -8.090 7.757 -21.374 1.00 0.00 C ATOM 1167 C LYS A 77 -6.704 8.376 -21.521 1.00 0.00 C ATOM 1168 O LYS A 77 -5.986 8.093 -22.478 1.00 0.00 O ATOM 1169 CB LYS A 77 -9.164 8.801 -21.691 1.00 0.00 C ATOM 1170 CG LYS A 77 -9.140 9.280 -23.132 1.00 0.00 C ATOM 1171 CD LYS A 77 -10.447 9.954 -23.517 1.00 0.00 C ATOM 1172 CE LYS A 77 -10.433 11.435 -23.171 1.00 0.00 C ATOM 1173 NZ LYS A 77 -11.298 12.227 -24.088 1.00 0.00 N ATOM 0 H LYS A 77 -9.204 7.408 -19.632 1.00 0.00 H new ATOM 0 HA LYS A 77 -8.176 6.931 -22.080 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -10.145 8.378 -21.474 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -9.032 9.658 -21.030 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -8.315 9.978 -23.271 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -8.957 8.434 -23.795 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -10.620 9.831 -24.586 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -11.275 9.467 -23.002 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -10.772 11.571 -22.144 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -9.411 11.810 -23.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -11.261 13.231 -23.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -10.960 12.118 -25.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -12.278 11.886 -24.021 1.00 0.00 H new ATOM 1187 N ASN A 78 -6.335 9.223 -20.565 1.00 0.00 N ATOM 1188 CA ASN A 78 -5.034 9.882 -20.588 1.00 0.00 C ATOM 1189 C ASN A 78 -4.161 9.402 -19.432 1.00 0.00 C ATOM 1190 O ASN A 78 -3.199 10.068 -19.051 1.00 0.00 O ATOM 1191 CB ASN A 78 -5.207 11.400 -20.516 1.00 0.00 C ATOM 1192 CG ASN A 78 -5.620 11.999 -21.847 1.00 0.00 C ATOM 1193 OD1 ASN A 78 -4.787 12.508 -22.596 1.00 0.00 O ATOM 1194 ND2 ASN A 78 -6.912 11.940 -22.146 1.00 0.00 N ATOM 0 H ASN A 78 -6.918 9.469 -19.765 1.00 0.00 H new ATOM 0 HA ASN A 78 -4.540 9.624 -21.525 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -5.957 11.642 -19.763 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -4.271 11.855 -20.191 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -7.250 12.326 -23.028 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -7.567 11.508 -21.494 1.00 0.00 H new ATOM 1201 N ASP A 79 -4.504 8.244 -18.880 1.00 0.00 N ATOM 1202 CA ASP A 79 -3.751 7.674 -17.769 1.00 0.00 C ATOM 1203 C ASP A 79 -3.328 8.760 -16.785 1.00 0.00 C ATOM 1204 O ASP A 79 -2.197 8.766 -16.300 1.00 0.00 O ATOM 1205 CB ASP A 79 -2.519 6.931 -18.288 1.00 0.00 C ATOM 1206 CG ASP A 79 -2.882 5.767 -19.190 1.00 0.00 C ATOM 1207 OD1 ASP A 79 -3.895 5.093 -18.910 1.00 0.00 O ATOM 1208 OD2 ASP A 79 -2.152 5.530 -20.175 1.00 0.00 O ATOM 0 H ASP A 79 -5.299 7.681 -19.184 1.00 0.00 H new ATOM 0 HA ASP A 79 -4.398 6.969 -17.248 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -1.883 7.626 -18.835 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -1.937 6.564 -17.443 1.00 0.00 H new ATOM 1213 N ARG A 80 -4.245 9.678 -16.496 1.00 0.00 N ATOM 1214 CA ARG A 80 -3.966 10.771 -15.572 1.00 0.00 C ATOM 1215 C ARG A 80 -4.791 10.628 -14.296 1.00 0.00 C ATOM 1216 O ARG A 80 -6.009 10.450 -14.349 1.00 0.00 O ATOM 1217 CB ARG A 80 -4.262 12.117 -16.236 1.00 0.00 C ATOM 1218 CG ARG A 80 -5.676 12.228 -16.783 1.00 0.00 C ATOM 1219 CD ARG A 80 -6.143 13.674 -16.828 1.00 0.00 C ATOM 1220 NE ARG A 80 -5.496 14.426 -17.900 1.00 0.00 N ATOM 1221 CZ ARG A 80 -5.935 14.443 -19.153 1.00 0.00 C ATOM 1222 NH1 ARG A 80 -7.016 13.753 -19.491 1.00 0.00 N ATOM 1223 NH2 ARG A 80 -5.292 15.151 -20.073 1.00 0.00 N ATOM 0 H ARG A 80 -5.187 9.687 -16.888 1.00 0.00 H new ATOM 0 HA ARG A 80 -2.909 10.729 -15.308 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -4.098 12.914 -15.511 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -3.553 12.275 -17.049 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -5.714 11.801 -17.785 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -6.355 11.644 -16.161 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -7.224 13.702 -16.967 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -5.933 14.153 -15.872 1.00 0.00 H new ATOM 0 HE ARG A 80 -4.662 14.967 -17.674 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -7.513 13.207 -18.787 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -7.350 13.768 -20.455 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -4.460 15.683 -19.818 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -5.630 15.163 -21.035 1.00 0.00 H new ATOM 1237 N TYR A 81 -4.121 10.707 -13.152 1.00 0.00 N ATOM 1238 CA TYR A 81 -4.792 10.584 -11.863 1.00 0.00 C ATOM 1239 C TYR A 81 -4.628 11.858 -11.040 1.00 0.00 C ATOM 1240 O TYR A 81 -3.534 12.417 -10.952 1.00 0.00 O ATOM 1241 CB TYR A 81 -4.238 9.387 -11.089 1.00 0.00 C ATOM 1242 CG TYR A 81 -4.354 8.077 -11.834 1.00 0.00 C ATOM 1243 CD1 TYR A 81 -3.574 7.820 -12.954 1.00 0.00 C ATOM 1244 CD2 TYR A 81 -5.246 7.095 -11.418 1.00 0.00 C ATOM 1245 CE1 TYR A 81 -3.677 6.625 -13.639 1.00 0.00 C ATOM 1246 CE2 TYR A 81 -5.355 5.897 -12.095 1.00 0.00 C ATOM 1247 CZ TYR A 81 -4.569 5.666 -13.205 1.00 0.00 C ATOM 1248 OH TYR A 81 -4.676 4.474 -13.884 1.00 0.00 O ATOM 0 H TYR A 81 -3.114 10.856 -13.091 1.00 0.00 H new ATOM 0 HA TYR A 81 -5.855 10.428 -12.048 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -3.189 9.570 -10.855 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -4.767 9.303 -10.139 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -2.874 8.568 -13.296 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -5.864 7.273 -10.550 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -3.063 6.442 -14.509 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -6.052 5.144 -11.757 1.00 0.00 H new ATOM 0 HH TYR A 81 -5.263 3.866 -13.388 1.00 0.00 H new ATOM 1258 N ILE A 82 -5.722 12.310 -10.438 1.00 0.00 N ATOM 1259 CA ILE A 82 -5.700 13.516 -9.620 1.00 0.00 C ATOM 1260 C ILE A 82 -6.267 13.248 -8.229 1.00 0.00 C ATOM 1261 O ILE A 82 -7.253 12.526 -8.078 1.00 0.00 O ATOM 1262 CB ILE A 82 -6.500 14.657 -10.276 1.00 0.00 C ATOM 1263 CG1 ILE A 82 -6.012 14.894 -11.707 1.00 0.00 C ATOM 1264 CG2 ILE A 82 -6.381 15.930 -9.453 1.00 0.00 C ATOM 1265 CD1 ILE A 82 -7.078 15.448 -12.626 1.00 0.00 C ATOM 0 H ILE A 82 -6.635 11.859 -10.501 1.00 0.00 H new ATOM 0 HA ILE A 82 -4.656 13.818 -9.533 1.00 0.00 H new ATOM 0 HB ILE A 82 -7.551 14.369 -10.313 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.169 15.584 -11.685 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -5.644 13.954 -12.117 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -6.952 16.726 -9.930 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -6.772 15.753 -8.451 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -5.333 16.224 -9.387 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -6.661 15.591 -13.623 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -7.912 14.749 -12.679 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -7.430 16.405 -12.240 1.00 0.00 H new ATOM 1277 N VAL A 83 -5.638 13.836 -7.216 1.00 0.00 N ATOM 1278 CA VAL A 83 -6.081 13.663 -5.838 1.00 0.00 C ATOM 1279 C VAL A 83 -6.474 14.998 -5.216 1.00 0.00 C ATOM 1280 O VAL A 83 -5.618 15.830 -4.915 1.00 0.00 O ATOM 1281 CB VAL A 83 -4.986 13.008 -4.975 1.00 0.00 C ATOM 1282 CG1 VAL A 83 -5.470 12.830 -3.544 1.00 0.00 C ATOM 1283 CG2 VAL A 83 -4.562 11.676 -5.573 1.00 0.00 C ATOM 0 H VAL A 83 -4.820 14.436 -7.324 1.00 0.00 H new ATOM 0 HA VAL A 83 -6.952 13.008 -5.864 1.00 0.00 H new ATOM 0 HB VAL A 83 -4.117 13.666 -4.960 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -4.683 12.366 -2.949 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -5.719 13.803 -3.121 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -6.355 12.193 -3.536 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -3.788 11.228 -4.950 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -5.422 11.008 -5.620 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -4.172 11.836 -6.578 1.00 0.00 H new ATOM 1293 N ASN A 84 -7.774 15.196 -5.024 1.00 0.00 N ATOM 1294 CA ASN A 84 -8.281 16.431 -4.437 1.00 0.00 C ATOM 1295 C ASN A 84 -7.551 16.754 -3.137 1.00 0.00 C ATOM 1296 O ASN A 84 -7.312 15.874 -2.311 1.00 0.00 O ATOM 1297 CB ASN A 84 -9.784 16.317 -4.176 1.00 0.00 C ATOM 1298 CG ASN A 84 -10.588 16.226 -5.459 1.00 0.00 C ATOM 1299 OD1 ASN A 84 -10.032 16.039 -6.541 1.00 0.00 O ATOM 1300 ND2 ASN A 84 -11.904 16.359 -5.343 1.00 0.00 N ATOM 0 H ASN A 84 -8.496 14.517 -5.266 1.00 0.00 H new ATOM 0 HA ASN A 84 -8.103 17.241 -5.145 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -9.978 15.435 -3.565 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -10.117 17.182 -3.602 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -12.497 16.307 -6.171 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -12.322 16.513 -4.425 1.00 0.00 H new ATOM 1307 N GLY A 85 -7.199 18.025 -2.962 1.00 0.00 N ATOM 1308 CA GLY A 85 -6.501 18.443 -1.760 1.00 0.00 C ATOM 1309 C GLY A 85 -5.024 18.683 -2.002 1.00 0.00 C ATOM 1310 O GLY A 85 -4.457 18.179 -2.971 1.00 0.00 O ATOM 0 H GLY A 85 -7.385 18.772 -3.631 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -6.957 19.356 -1.378 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -6.621 17.681 -0.990 1.00 0.00 H new ATOM 1314 N SER A 86 -4.400 19.458 -1.120 1.00 0.00 N ATOM 1315 CA SER A 86 -2.981 19.769 -1.246 1.00 0.00 C ATOM 1316 C SER A 86 -2.134 18.768 -0.465 1.00 0.00 C ATOM 1317 O SER A 86 -2.313 18.593 0.740 1.00 0.00 O ATOM 1318 CB SER A 86 -2.702 21.188 -0.746 1.00 0.00 C ATOM 1319 OG SER A 86 -2.783 21.256 0.667 1.00 0.00 O ATOM 0 H SER A 86 -4.855 19.882 -0.311 1.00 0.00 H new ATOM 0 HA SER A 86 -2.712 19.703 -2.300 1.00 0.00 H new ATOM 0 HB2 SER A 86 -1.711 21.504 -1.072 1.00 0.00 H new ATOM 0 HB3 SER A 86 -3.419 21.880 -1.188 1.00 0.00 H new ATOM 0 HG SER A 86 -2.629 20.366 1.047 1.00 0.00 H new ATOM 1325 N HIS A 87 -1.212 18.112 -1.163 1.00 0.00 N ATOM 1326 CA HIS A 87 -0.336 17.129 -0.537 1.00 0.00 C ATOM 1327 C HIS A 87 1.037 17.120 -1.203 1.00 0.00 C ATOM 1328 O HIS A 87 1.148 17.293 -2.417 1.00 0.00 O ATOM 1329 CB HIS A 87 -0.961 15.735 -0.614 1.00 0.00 C ATOM 1330 CG HIS A 87 -2.459 15.750 -0.595 1.00 0.00 C ATOM 1331 ND1 HIS A 87 -3.195 16.042 0.533 1.00 0.00 N ATOM 1332 CD2 HIS A 87 -3.358 15.507 -1.577 1.00 0.00 C ATOM 1333 CE1 HIS A 87 -4.483 15.976 0.246 1.00 0.00 C ATOM 1334 NE2 HIS A 87 -4.609 15.654 -1.029 1.00 0.00 N ATOM 0 H HIS A 87 -1.053 18.244 -2.162 1.00 0.00 H new ATOM 0 HA HIS A 87 -0.211 17.407 0.510 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -0.622 15.243 -1.526 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -0.601 15.137 0.223 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -3.134 15.246 -2.601 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -5.294 16.155 0.936 1.00 0.00 H new ATOM 0 HE2 HIS A 87 -5.492 15.534 -1.526 1.00 0.00 H new ATOM 1342 N GLU A 88 2.078 16.919 -0.402 1.00 0.00 N ATOM 1343 CA GLU A 88 3.442 16.891 -0.915 1.00 0.00 C ATOM 1344 C GLU A 88 3.893 15.458 -1.183 1.00 0.00 C ATOM 1345 O GLU A 88 3.570 14.543 -0.426 1.00 0.00 O ATOM 1346 CB GLU A 88 4.397 17.561 0.075 1.00 0.00 C ATOM 1347 CG GLU A 88 4.515 16.826 1.399 1.00 0.00 C ATOM 1348 CD GLU A 88 4.825 17.755 2.557 1.00 0.00 C ATOM 1349 OE1 GLU A 88 4.071 18.733 2.750 1.00 0.00 O ATOM 1350 OE2 GLU A 88 5.819 17.506 3.269 1.00 0.00 O ATOM 0 H GLU A 88 2.003 16.773 0.605 1.00 0.00 H new ATOM 0 HA GLU A 88 3.460 17.442 -1.856 1.00 0.00 H new ATOM 0 HB2 GLU A 88 5.385 17.635 -0.379 1.00 0.00 H new ATOM 0 HB3 GLU A 88 4.056 18.579 0.263 1.00 0.00 H new ATOM 0 HG2 GLU A 88 3.583 16.298 1.601 1.00 0.00 H new ATOM 0 HG3 GLU A 88 5.299 16.072 1.323 1.00 0.00 H new ATOM 1357 N ALA A 89 4.641 15.272 -2.266 1.00 0.00 N ATOM 1358 CA ALA A 89 5.137 13.951 -2.633 1.00 0.00 C ATOM 1359 C ALA A 89 5.596 13.175 -1.404 1.00 0.00 C ATOM 1360 O ALA A 89 5.202 12.028 -1.200 1.00 0.00 O ATOM 1361 CB ALA A 89 6.275 14.076 -3.636 1.00 0.00 C ATOM 0 H ALA A 89 4.917 16.019 -2.904 1.00 0.00 H new ATOM 0 HA ALA A 89 4.319 13.398 -3.094 1.00 0.00 H new ATOM 0 HB1 ALA A 89 6.636 13.083 -3.902 1.00 0.00 H new ATOM 0 HB2 ALA A 89 5.917 14.583 -4.532 1.00 0.00 H new ATOM 0 HB3 ALA A 89 7.088 14.652 -3.194 1.00 0.00 H new ATOM 1367 N ASN A 90 6.431 13.809 -0.587 1.00 0.00 N ATOM 1368 CA ASN A 90 6.945 13.177 0.623 1.00 0.00 C ATOM 1369 C ASN A 90 5.821 12.502 1.403 1.00 0.00 C ATOM 1370 O ASN A 90 5.911 11.325 1.751 1.00 0.00 O ATOM 1371 CB ASN A 90 7.645 14.211 1.506 1.00 0.00 C ATOM 1372 CG ASN A 90 8.743 14.953 0.769 1.00 0.00 C ATOM 1373 OD1 ASN A 90 9.475 14.367 -0.029 1.00 0.00 O ATOM 1374 ND2 ASN A 90 8.863 16.249 1.034 1.00 0.00 N ATOM 0 H ASN A 90 6.766 14.760 -0.741 1.00 0.00 H new ATOM 0 HA ASN A 90 7.666 12.415 0.327 1.00 0.00 H new ATOM 0 HB2 ASN A 90 6.910 14.927 1.874 1.00 0.00 H new ATOM 0 HB3 ASN A 90 8.069 13.713 2.378 1.00 0.00 H new ATOM 0 HD21 ASN A 90 9.584 16.800 0.569 1.00 0.00 H new ATOM 0 HD22 ASN A 90 8.234 16.693 1.703 1.00 0.00 H new ATOM 1381 N LYS A 91 4.761 13.257 1.674 1.00 0.00 N ATOM 1382 CA LYS A 91 3.617 12.733 2.412 1.00 0.00 C ATOM 1383 C LYS A 91 3.009 11.534 1.692 1.00 0.00 C ATOM 1384 O LYS A 91 2.770 10.489 2.299 1.00 0.00 O ATOM 1385 CB LYS A 91 2.559 13.824 2.593 1.00 0.00 C ATOM 1386 CG LYS A 91 1.484 13.466 3.604 1.00 0.00 C ATOM 1387 CD LYS A 91 0.619 14.667 3.948 1.00 0.00 C ATOM 1388 CE LYS A 91 0.083 14.580 5.369 1.00 0.00 C ATOM 1389 NZ LYS A 91 1.088 15.032 6.370 1.00 0.00 N ATOM 0 H LYS A 91 4.670 14.234 1.394 1.00 0.00 H new ATOM 0 HA LYS A 91 3.966 12.407 3.392 1.00 0.00 H new ATOM 0 HB2 LYS A 91 3.049 14.745 2.907 1.00 0.00 H new ATOM 0 HB3 LYS A 91 2.088 14.025 1.631 1.00 0.00 H new ATOM 0 HG2 LYS A 91 0.858 12.669 3.204 1.00 0.00 H new ATOM 0 HG3 LYS A 91 1.950 13.081 4.511 1.00 0.00 H new ATOM 0 HD2 LYS A 91 1.202 15.581 3.833 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -0.214 14.730 3.247 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -0.816 15.190 5.456 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -0.208 13.552 5.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 0.684 14.957 7.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 1.936 14.434 6.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 1.347 16.021 6.180 1.00 0.00 H new ATOM 1403 N LEU A 92 2.761 11.690 0.397 1.00 0.00 N ATOM 1404 CA LEU A 92 2.182 10.619 -0.406 1.00 0.00 C ATOM 1405 C LEU A 92 2.974 9.326 -0.243 1.00 0.00 C ATOM 1406 O LEU A 92 2.418 8.287 0.111 1.00 0.00 O ATOM 1407 CB LEU A 92 2.143 11.024 -1.881 1.00 0.00 C ATOM 1408 CG LEU A 92 1.220 12.191 -2.233 1.00 0.00 C ATOM 1409 CD1 LEU A 92 1.476 12.664 -3.655 1.00 0.00 C ATOM 1410 CD2 LEU A 92 -0.237 11.790 -2.057 1.00 0.00 C ATOM 0 H LEU A 92 2.952 12.548 -0.120 1.00 0.00 H new ATOM 0 HA LEU A 92 1.164 10.446 -0.056 1.00 0.00 H new ATOM 0 HB2 LEU A 92 3.155 11.281 -2.193 1.00 0.00 H new ATOM 0 HB3 LEU A 92 1.839 10.157 -2.467 1.00 0.00 H new ATOM 0 HG LEU A 92 1.434 13.016 -1.554 1.00 0.00 H new ATOM 0 HD11 LEU A 92 0.810 13.495 -3.888 1.00 0.00 H new ATOM 0 HD12 LEU A 92 2.511 12.992 -3.749 1.00 0.00 H new ATOM 0 HD13 LEU A 92 1.291 11.845 -4.350 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -0.880 12.633 -2.312 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -0.465 10.949 -2.712 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -0.412 11.501 -1.021 1.00 0.00 H new ATOM 1422 N GLN A 93 4.276 9.399 -0.501 1.00 0.00 N ATOM 1423 CA GLN A 93 5.145 8.234 -0.381 1.00 0.00 C ATOM 1424 C GLN A 93 5.121 7.682 1.041 1.00 0.00 C ATOM 1425 O GLN A 93 5.219 6.472 1.249 1.00 0.00 O ATOM 1426 CB GLN A 93 6.578 8.598 -0.775 1.00 0.00 C ATOM 1427 CG GLN A 93 7.488 7.391 -0.939 1.00 0.00 C ATOM 1428 CD GLN A 93 6.832 6.267 -1.716 1.00 0.00 C ATOM 1429 OE1 GLN A 93 7.054 6.243 -3.025 1.00 0.00 O flip ATOM 1430 NE2 GLN A 93 6.133 5.428 -1.146 1.00 0.00 N flip ATOM 0 H GLN A 93 4.752 10.252 -0.794 1.00 0.00 H new ATOM 0 HA GLN A 93 4.774 7.464 -1.057 1.00 0.00 H new ATOM 0 HB2 GLN A 93 6.558 9.158 -1.710 1.00 0.00 H new ATOM 0 HB3 GLN A 93 6.998 9.259 -0.017 1.00 0.00 H new ATOM 0 HG2 GLN A 93 8.401 7.696 -1.450 1.00 0.00 H new ATOM 0 HG3 GLN A 93 7.780 7.025 0.045 1.00 0.00 H new ATOM 0 HE21 GLN A 93 5.989 5.484 -0.138 1.00 0.00 H new ATOM 0 HE22 GLN A 93 5.698 4.677 -1.682 1.00 0.00 H new ATOM 1439 N ASP A 94 4.989 8.575 2.015 1.00 0.00 N ATOM 1440 CA ASP A 94 4.952 8.177 3.417 1.00 0.00 C ATOM 1441 C ASP A 94 3.715 7.332 3.709 1.00 0.00 C ATOM 1442 O ASP A 94 3.804 6.287 4.353 1.00 0.00 O ATOM 1443 CB ASP A 94 4.966 9.411 4.321 1.00 0.00 C ATOM 1444 CG ASP A 94 6.361 9.972 4.512 1.00 0.00 C ATOM 1445 OD1 ASP A 94 7.142 9.965 3.537 1.00 0.00 O ATOM 1446 OD2 ASP A 94 6.673 10.418 5.636 1.00 0.00 O ATOM 0 H ASP A 94 4.906 9.580 1.859 1.00 0.00 H new ATOM 0 HA ASP A 94 5.838 7.576 3.622 1.00 0.00 H new ATOM 0 HB2 ASP A 94 4.324 10.180 3.891 1.00 0.00 H new ATOM 0 HB3 ASP A 94 4.546 9.151 5.293 1.00 0.00 H new ATOM 1451 N MET A 95 2.564 7.792 3.231 1.00 0.00 N ATOM 1452 CA MET A 95 1.310 7.078 3.441 1.00 0.00 C ATOM 1453 C MET A 95 1.244 5.828 2.570 1.00 0.00 C ATOM 1454 O MET A 95 1.033 4.722 3.069 1.00 0.00 O ATOM 1455 CB MET A 95 0.121 7.991 3.134 1.00 0.00 C ATOM 1456 CG MET A 95 -0.011 9.161 4.097 1.00 0.00 C ATOM 1457 SD MET A 95 -1.725 9.663 4.348 1.00 0.00 S ATOM 1458 CE MET A 95 -2.233 9.986 2.661 1.00 0.00 C ATOM 0 H MET A 95 2.473 8.656 2.696 1.00 0.00 H new ATOM 0 HA MET A 95 1.265 6.774 4.487 1.00 0.00 H new ATOM 0 HB2 MET A 95 0.221 8.376 2.119 1.00 0.00 H new ATOM 0 HB3 MET A 95 -0.796 7.402 3.163 1.00 0.00 H new ATOM 0 HG2 MET A 95 0.428 8.888 5.057 1.00 0.00 H new ATOM 0 HG3 MET A 95 0.559 10.008 3.715 1.00 0.00 H new ATOM 0 HE1 MET A 95 -3.251 10.375 2.656 1.00 0.00 H new ATOM 0 HE2 MET A 95 -1.562 10.719 2.213 1.00 0.00 H new ATOM 0 HE3 MET A 95 -2.195 9.061 2.086 1.00 0.00 H new ATOM 1468 N LEU A 96 1.424 6.011 1.266 1.00 0.00 N ATOM 1469 CA LEU A 96 1.384 4.897 0.325 1.00 0.00 C ATOM 1470 C LEU A 96 2.138 3.691 0.877 1.00 0.00 C ATOM 1471 O LEU A 96 1.700 2.550 0.726 1.00 0.00 O ATOM 1472 CB LEU A 96 1.984 5.317 -1.018 1.00 0.00 C ATOM 1473 CG LEU A 96 1.912 4.279 -2.139 1.00 0.00 C ATOM 1474 CD1 LEU A 96 0.471 4.060 -2.572 1.00 0.00 C ATOM 1475 CD2 LEU A 96 2.766 4.712 -3.322 1.00 0.00 C ATOM 0 H LEU A 96 1.599 6.920 0.837 1.00 0.00 H new ATOM 0 HA LEU A 96 0.342 4.614 0.178 1.00 0.00 H new ATOM 0 HB2 LEU A 96 1.476 6.221 -1.354 1.00 0.00 H new ATOM 0 HB3 LEU A 96 3.030 5.580 -0.860 1.00 0.00 H new ATOM 0 HG LEU A 96 2.303 3.335 -1.760 1.00 0.00 H new ATOM 0 HD11 LEU A 96 0.440 3.318 -3.370 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -0.114 3.705 -1.724 1.00 0.00 H new ATOM 0 HD13 LEU A 96 0.053 5.000 -2.933 1.00 0.00 H new ATOM 0 HD21 LEU A 96 2.703 3.962 -4.110 1.00 0.00 H new ATOM 0 HD22 LEU A 96 2.405 5.668 -3.701 1.00 0.00 H new ATOM 0 HD23 LEU A 96 3.803 4.817 -3.003 1.00 0.00 H new ATOM 1487 N ASP A 97 3.272 3.951 1.518 1.00 0.00 N ATOM 1488 CA ASP A 97 4.085 2.887 2.095 1.00 0.00 C ATOM 1489 C ASP A 97 3.209 1.845 2.783 1.00 0.00 C ATOM 1490 O ASP A 97 3.411 0.643 2.620 1.00 0.00 O ATOM 1491 CB ASP A 97 5.088 3.468 3.094 1.00 0.00 C ATOM 1492 CG ASP A 97 6.298 2.574 3.285 1.00 0.00 C ATOM 1493 OD1 ASP A 97 6.898 2.163 2.271 1.00 0.00 O ATOM 1494 OD2 ASP A 97 6.643 2.285 4.450 1.00 0.00 O ATOM 0 H ASP A 97 3.649 4.889 1.651 1.00 0.00 H new ATOM 0 HA ASP A 97 4.629 2.400 1.286 1.00 0.00 H new ATOM 0 HB2 ASP A 97 5.415 4.448 2.748 1.00 0.00 H new ATOM 0 HB3 ASP A 97 4.595 3.617 4.055 1.00 0.00 H new ATOM 1499 N GLY A 98 2.233 2.316 3.555 1.00 0.00 N ATOM 1500 CA GLY A 98 1.341 1.412 4.257 1.00 0.00 C ATOM 1501 C GLY A 98 0.668 0.424 3.327 1.00 0.00 C ATOM 1502 O GLY A 98 0.638 -0.777 3.600 1.00 0.00 O ATOM 0 H GLY A 98 2.045 3.307 3.706 1.00 0.00 H new ATOM 0 HA2 GLY A 98 1.904 0.867 5.015 1.00 0.00 H new ATOM 0 HA3 GLY A 98 0.580 1.991 4.780 1.00 0.00 H new ATOM 1506 N PHE A 99 0.124 0.927 2.224 1.00 0.00 N ATOM 1507 CA PHE A 99 -0.556 0.080 1.251 1.00 0.00 C ATOM 1508 C PHE A 99 0.397 -0.967 0.682 1.00 0.00 C ATOM 1509 O PHE A 99 0.037 -2.135 0.533 1.00 0.00 O ATOM 1510 CB PHE A 99 -1.133 0.931 0.117 1.00 0.00 C ATOM 1511 CG PHE A 99 -1.496 0.135 -1.104 1.00 0.00 C ATOM 1512 CD1 PHE A 99 -0.513 -0.311 -1.973 1.00 0.00 C ATOM 1513 CD2 PHE A 99 -2.819 -0.166 -1.383 1.00 0.00 C ATOM 1514 CE1 PHE A 99 -0.845 -1.043 -3.098 1.00 0.00 C ATOM 1515 CE2 PHE A 99 -3.156 -0.898 -2.506 1.00 0.00 C ATOM 1516 CZ PHE A 99 -2.167 -1.337 -3.364 1.00 0.00 C ATOM 0 H PHE A 99 0.141 1.918 1.981 1.00 0.00 H new ATOM 0 HA PHE A 99 -1.371 -0.434 1.761 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -2.020 1.451 0.479 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -0.406 1.695 -0.160 1.00 0.00 H new ATOM 0 HD1 PHE A 99 0.523 -0.084 -1.769 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -3.596 0.175 -0.715 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -0.070 -1.385 -3.768 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -4.191 -1.126 -2.712 1.00 0.00 H new ATOM 0 HZ PHE A 99 -2.428 -1.910 -4.242 1.00 0.00 H new ATOM 1526 N ILE A 100 1.615 -0.539 0.365 1.00 0.00 N ATOM 1527 CA ILE A 100 2.620 -1.439 -0.188 1.00 0.00 C ATOM 1528 C ILE A 100 3.195 -2.350 0.892 1.00 0.00 C ATOM 1529 O ILE A 100 3.972 -3.260 0.603 1.00 0.00 O ATOM 1530 CB ILE A 100 3.770 -0.659 -0.851 1.00 0.00 C ATOM 1531 CG1 ILE A 100 3.214 0.371 -1.837 1.00 0.00 C ATOM 1532 CG2 ILE A 100 4.722 -1.615 -1.555 1.00 0.00 C ATOM 1533 CD1 ILE A 100 4.273 1.279 -2.423 1.00 0.00 C ATOM 0 H ILE A 100 1.929 0.424 0.482 1.00 0.00 H new ATOM 0 HA ILE A 100 2.120 -2.045 -0.944 1.00 0.00 H new ATOM 0 HB ILE A 100 4.325 -0.130 -0.076 1.00 0.00 H new ATOM 0 HG12 ILE A 100 2.706 -0.151 -2.647 1.00 0.00 H new ATOM 0 HG13 ILE A 100 2.465 0.979 -1.330 1.00 0.00 H new ATOM 0 HG21 ILE A 100 5.530 -1.049 -2.019 1.00 0.00 H new ATOM 0 HG22 ILE A 100 5.139 -2.313 -0.829 1.00 0.00 H new ATOM 0 HG23 ILE A 100 4.180 -2.169 -2.322 1.00 0.00 H new ATOM 0 HD11 ILE A 100 3.808 1.983 -3.113 1.00 0.00 H new ATOM 0 HD12 ILE A 100 4.766 1.829 -1.621 1.00 0.00 H new ATOM 0 HD13 ILE A 100 5.010 0.680 -2.958 1.00 0.00 H new ATOM 1545 N LYS A 101 2.807 -2.099 2.138 1.00 0.00 N ATOM 1546 CA LYS A 101 3.281 -2.897 3.262 1.00 0.00 C ATOM 1547 C LYS A 101 2.309 -4.031 3.572 1.00 0.00 C ATOM 1548 O LYS A 101 2.697 -5.064 4.119 1.00 0.00 O ATOM 1549 CB LYS A 101 3.463 -2.015 4.500 1.00 0.00 C ATOM 1550 CG LYS A 101 4.402 -2.608 5.536 1.00 0.00 C ATOM 1551 CD LYS A 101 3.655 -3.479 6.532 1.00 0.00 C ATOM 1552 CE LYS A 101 4.365 -3.523 7.877 1.00 0.00 C ATOM 1553 NZ LYS A 101 4.352 -2.197 8.554 1.00 0.00 N ATOM 0 H LYS A 101 2.165 -1.349 2.395 1.00 0.00 H new ATOM 0 HA LYS A 101 4.243 -3.330 2.987 1.00 0.00 H new ATOM 0 HB2 LYS A 101 3.845 -1.042 4.190 1.00 0.00 H new ATOM 0 HB3 LYS A 101 2.490 -1.843 4.960 1.00 0.00 H new ATOM 0 HG2 LYS A 101 5.169 -3.200 5.037 1.00 0.00 H new ATOM 0 HG3 LYS A 101 4.914 -1.805 6.066 1.00 0.00 H new ATOM 0 HD2 LYS A 101 2.644 -3.095 6.666 1.00 0.00 H new ATOM 0 HD3 LYS A 101 3.562 -4.490 6.135 1.00 0.00 H new ATOM 0 HE2 LYS A 101 3.884 -4.263 8.517 1.00 0.00 H new ATOM 0 HE3 LYS A 101 5.396 -3.847 7.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 4.475 -2.329 9.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 5.128 -1.611 8.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 3.444 -1.724 8.373 1.00 0.00 H new ATOM 1567 N LYS A 102 1.043 -3.833 3.219 1.00 0.00 N ATOM 1568 CA LYS A 102 0.015 -4.839 3.456 1.00 0.00 C ATOM 1569 C LYS A 102 -0.382 -5.529 2.155 1.00 0.00 C ATOM 1570 O LYS A 102 -0.359 -6.756 2.059 1.00 0.00 O ATOM 1571 CB LYS A 102 -1.215 -4.198 4.103 1.00 0.00 C ATOM 1572 CG LYS A 102 -1.886 -3.152 3.229 1.00 0.00 C ATOM 1573 CD LYS A 102 -2.918 -2.354 4.007 1.00 0.00 C ATOM 1574 CE LYS A 102 -2.258 -1.339 4.929 1.00 0.00 C ATOM 1575 NZ LYS A 102 -3.086 -1.066 6.136 1.00 0.00 N ATOM 0 H LYS A 102 0.704 -2.984 2.767 1.00 0.00 H new ATOM 0 HA LYS A 102 0.425 -5.589 4.133 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -1.938 -4.978 4.342 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -0.921 -3.737 5.046 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -1.132 -2.477 2.824 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -2.366 -3.639 2.380 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -3.581 -1.839 3.312 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -3.537 -3.032 4.594 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -1.280 -1.709 5.236 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -2.091 -0.409 4.385 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -2.602 -0.370 6.739 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -4.010 -0.689 5.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -3.224 -1.948 6.669 1.00 0.00 H new ATOM 1589 N PHE A 103 -0.743 -4.732 1.155 1.00 0.00 N ATOM 1590 CA PHE A 103 -1.145 -5.266 -0.141 1.00 0.00 C ATOM 1591 C PHE A 103 0.022 -5.975 -0.822 1.00 0.00 C ATOM 1592 O PHE A 103 -0.040 -7.173 -1.097 1.00 0.00 O ATOM 1593 CB PHE A 103 -1.669 -4.143 -1.039 1.00 0.00 C ATOM 1594 CG PHE A 103 -3.014 -3.621 -0.622 1.00 0.00 C ATOM 1595 CD1 PHE A 103 -3.122 -2.669 0.378 1.00 0.00 C ATOM 1596 CD2 PHE A 103 -4.170 -4.081 -1.232 1.00 0.00 C ATOM 1597 CE1 PHE A 103 -4.359 -2.187 0.764 1.00 0.00 C ATOM 1598 CE2 PHE A 103 -5.409 -3.603 -0.851 1.00 0.00 C ATOM 1599 CZ PHE A 103 -5.504 -2.654 0.148 1.00 0.00 C ATOM 0 H PHE A 103 -0.765 -3.714 1.217 1.00 0.00 H new ATOM 0 HA PHE A 103 -1.942 -5.991 0.024 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -0.952 -3.322 -1.036 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -1.731 -4.508 -2.064 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -2.230 -2.299 0.862 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -4.102 -4.822 -2.015 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -4.430 -1.446 1.546 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -6.302 -3.971 -1.334 1.00 0.00 H new ATOM 0 HZ PHE A 103 -6.471 -2.278 0.447 1.00 0.00 H new ATOM 1609 N VAL A 104 1.086 -5.225 -1.093 1.00 0.00 N ATOM 1610 CA VAL A 104 2.268 -5.780 -1.742 1.00 0.00 C ATOM 1611 C VAL A 104 3.038 -6.692 -0.793 1.00 0.00 C ATOM 1612 O VAL A 104 2.998 -7.916 -0.922 1.00 0.00 O ATOM 1613 CB VAL A 104 3.207 -4.667 -2.243 1.00 0.00 C ATOM 1614 CG1 VAL A 104 4.438 -5.266 -2.906 1.00 0.00 C ATOM 1615 CG2 VAL A 104 2.473 -3.742 -3.201 1.00 0.00 C ATOM 0 H VAL A 104 1.153 -4.231 -0.873 1.00 0.00 H new ATOM 0 HA VAL A 104 1.918 -6.361 -2.595 1.00 0.00 H new ATOM 0 HB VAL A 104 3.535 -4.079 -1.386 1.00 0.00 H new ATOM 0 HG11 VAL A 104 5.090 -4.465 -3.254 1.00 0.00 H new ATOM 0 HG12 VAL A 104 4.975 -5.884 -2.186 1.00 0.00 H new ATOM 0 HG13 VAL A 104 4.133 -5.879 -3.754 1.00 0.00 H new ATOM 0 HG21 VAL A 104 3.152 -2.962 -3.545 1.00 0.00 H new ATOM 0 HG22 VAL A 104 2.115 -4.314 -4.057 1.00 0.00 H new ATOM 0 HG23 VAL A 104 1.626 -3.286 -2.689 1.00 0.00 H new ATOM 1625 N LEU A 105 3.739 -6.088 0.160 1.00 0.00 N ATOM 1626 CA LEU A 105 4.519 -6.845 1.132 1.00 0.00 C ATOM 1627 C LEU A 105 3.629 -7.806 1.915 1.00 0.00 C ATOM 1628 O LEU A 105 2.438 -7.554 2.100 1.00 0.00 O ATOM 1629 CB LEU A 105 5.232 -5.894 2.095 1.00 0.00 C ATOM 1630 CG LEU A 105 6.315 -5.006 1.482 1.00 0.00 C ATOM 1631 CD1 LEU A 105 6.937 -4.112 2.543 1.00 0.00 C ATOM 1632 CD2 LEU A 105 7.381 -5.855 0.805 1.00 0.00 C ATOM 0 H LEU A 105 3.783 -5.076 0.280 1.00 0.00 H new ATOM 0 HA LEU A 105 5.263 -7.428 0.589 1.00 0.00 H new ATOM 0 HB2 LEU A 105 4.484 -5.252 2.560 1.00 0.00 H new ATOM 0 HB3 LEU A 105 5.683 -6.486 2.891 1.00 0.00 H new ATOM 0 HG LEU A 105 5.852 -4.370 0.727 1.00 0.00 H new ATOM 0 HD11 LEU A 105 7.706 -3.487 2.088 1.00 0.00 H new ATOM 0 HD12 LEU A 105 6.167 -3.478 2.982 1.00 0.00 H new ATOM 0 HD13 LEU A 105 7.385 -4.729 3.322 1.00 0.00 H new ATOM 0 HD21 LEU A 105 8.144 -5.206 0.374 1.00 0.00 H new ATOM 0 HD22 LEU A 105 7.840 -6.517 1.540 1.00 0.00 H new ATOM 0 HD23 LEU A 105 6.924 -6.451 0.015 1.00 0.00 H new ATOM 1644 N CYS A 106 4.216 -8.906 2.373 1.00 0.00 N ATOM 1645 CA CYS A 106 3.478 -9.905 3.138 1.00 0.00 C ATOM 1646 C CYS A 106 3.627 -9.662 4.637 1.00 0.00 C ATOM 1647 O CYS A 106 4.717 -9.394 5.142 1.00 0.00 O ATOM 1648 CB CYS A 106 3.968 -11.311 2.787 1.00 0.00 C ATOM 1649 SG CYS A 106 3.089 -12.645 3.662 1.00 0.00 S ATOM 0 H CYS A 106 5.201 -9.129 2.228 1.00 0.00 H new ATOM 0 HA CYS A 106 2.423 -9.819 2.877 1.00 0.00 H new ATOM 0 HB2 CYS A 106 3.861 -11.464 1.713 1.00 0.00 H new ATOM 0 HB3 CYS A 106 5.032 -11.381 3.015 1.00 0.00 H new ATOM 1654 N PRO A 107 2.505 -9.757 5.366 1.00 0.00 N ATOM 1655 CA PRO A 107 2.485 -9.552 6.817 1.00 0.00 C ATOM 1656 C PRO A 107 3.187 -10.676 7.571 1.00 0.00 C ATOM 1657 O PRO A 107 3.189 -10.703 8.802 1.00 0.00 O ATOM 1658 CB PRO A 107 0.991 -9.535 7.152 1.00 0.00 C ATOM 1659 CG PRO A 107 0.350 -10.326 6.064 1.00 0.00 C ATOM 1660 CD PRO A 107 1.171 -10.073 4.830 1.00 0.00 C ATOM 0 HA PRO A 107 3.012 -8.643 7.108 1.00 0.00 H new ATOM 0 HB2 PRO A 107 0.799 -9.978 8.129 1.00 0.00 H new ATOM 0 HB3 PRO A 107 0.604 -8.517 7.182 1.00 0.00 H new ATOM 0 HG2 PRO A 107 0.333 -11.388 6.311 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -0.685 -10.017 5.915 1.00 0.00 H new ATOM 0 HD2 PRO A 107 1.196 -10.946 4.178 1.00 0.00 H new ATOM 0 HD3 PRO A 107 0.769 -9.248 4.242 1.00 0.00 H new ATOM 1668 N GLU A 108 3.782 -11.601 6.825 1.00 0.00 N ATOM 1669 CA GLU A 108 4.488 -12.728 7.426 1.00 0.00 C ATOM 1670 C GLU A 108 5.954 -12.739 7.003 1.00 0.00 C ATOM 1671 O GLU A 108 6.852 -12.837 7.840 1.00 0.00 O ATOM 1672 CB GLU A 108 3.821 -14.046 7.028 1.00 0.00 C ATOM 1673 CG GLU A 108 2.612 -14.398 7.878 1.00 0.00 C ATOM 1674 CD GLU A 108 2.958 -14.564 9.345 1.00 0.00 C ATOM 1675 OE1 GLU A 108 4.054 -15.086 9.639 1.00 0.00 O ATOM 1676 OE2 GLU A 108 2.135 -14.172 10.198 1.00 0.00 O ATOM 0 H GLU A 108 3.790 -11.593 5.805 1.00 0.00 H new ATOM 0 HA GLU A 108 4.441 -12.618 8.509 1.00 0.00 H new ATOM 0 HB2 GLU A 108 3.515 -13.988 5.983 1.00 0.00 H new ATOM 0 HB3 GLU A 108 4.553 -14.850 7.102 1.00 0.00 H new ATOM 0 HG2 GLU A 108 1.859 -13.617 7.772 1.00 0.00 H new ATOM 0 HG3 GLU A 108 2.168 -15.322 7.507 1.00 0.00 H new ATOM 1683 N CYS A 109 6.189 -12.639 5.699 1.00 0.00 N ATOM 1684 CA CYS A 109 7.544 -12.638 5.163 1.00 0.00 C ATOM 1685 C CYS A 109 7.908 -11.265 4.606 1.00 0.00 C ATOM 1686 O CYS A 109 9.082 -10.960 4.399 1.00 0.00 O ATOM 1687 CB CYS A 109 7.683 -13.698 4.069 1.00 0.00 C ATOM 1688 SG CYS A 109 6.462 -13.545 2.726 1.00 0.00 S ATOM 0 H CYS A 109 5.457 -12.558 4.993 1.00 0.00 H new ATOM 0 HA CYS A 109 8.230 -12.874 5.977 1.00 0.00 H new ATOM 0 HB2 CYS A 109 8.685 -13.637 3.644 1.00 0.00 H new ATOM 0 HB3 CYS A 109 7.589 -14.685 4.521 1.00 0.00 H new ATOM 1693 N GLU A 110 6.893 -10.442 4.366 1.00 0.00 N ATOM 1694 CA GLU A 110 7.106 -9.102 3.832 1.00 0.00 C ATOM 1695 C GLU A 110 7.741 -9.163 2.445 1.00 0.00 C ATOM 1696 O GLU A 110 8.706 -8.455 2.161 1.00 0.00 O ATOM 1697 CB GLU A 110 7.994 -8.288 4.775 1.00 0.00 C ATOM 1698 CG GLU A 110 7.232 -7.634 5.915 1.00 0.00 C ATOM 1699 CD GLU A 110 8.061 -6.601 6.654 1.00 0.00 C ATOM 1700 OE1 GLU A 110 8.875 -6.997 7.513 1.00 0.00 O ATOM 1701 OE2 GLU A 110 7.894 -5.395 6.372 1.00 0.00 O ATOM 0 H GLU A 110 5.915 -10.679 4.533 1.00 0.00 H new ATOM 0 HA GLU A 110 6.135 -8.614 3.747 1.00 0.00 H new ATOM 0 HB2 GLU A 110 8.763 -8.940 5.190 1.00 0.00 H new ATOM 0 HB3 GLU A 110 8.507 -7.516 4.202 1.00 0.00 H new ATOM 0 HG2 GLU A 110 6.333 -7.159 5.521 1.00 0.00 H new ATOM 0 HG3 GLU A 110 6.905 -8.402 6.616 1.00 0.00 H new ATOM 1708 N ASN A 111 7.191 -10.016 1.587 1.00 0.00 N ATOM 1709 CA ASN A 111 7.703 -10.172 0.230 1.00 0.00 C ATOM 1710 C ASN A 111 6.783 -9.494 -0.780 1.00 0.00 C ATOM 1711 O ASN A 111 5.560 -9.627 -0.730 1.00 0.00 O ATOM 1712 CB ASN A 111 7.852 -11.655 -0.114 1.00 0.00 C ATOM 1713 CG ASN A 111 8.886 -11.896 -1.197 1.00 0.00 C ATOM 1714 OD1 ASN A 111 8.608 -11.727 -2.384 1.00 0.00 O ATOM 1715 ND2 ASN A 111 10.086 -12.294 -0.791 1.00 0.00 N ATOM 0 H ASN A 111 6.391 -10.610 1.807 1.00 0.00 H new ATOM 0 HA ASN A 111 8.682 -9.695 0.181 1.00 0.00 H new ATOM 0 HB2 ASN A 111 8.134 -12.207 0.783 1.00 0.00 H new ATOM 0 HB3 ASN A 111 6.889 -12.048 -0.441 1.00 0.00 H new ATOM 0 HD21 ASN A 111 10.822 -12.473 -1.474 1.00 0.00 H new ATOM 0 HD22 ASN A 111 10.272 -12.421 0.204 1.00 0.00 H new ATOM 1722 N PRO A 112 7.383 -8.749 -1.721 1.00 0.00 N ATOM 1723 CA PRO A 112 6.636 -8.036 -2.761 1.00 0.00 C ATOM 1724 C PRO A 112 6.007 -8.985 -3.776 1.00 0.00 C ATOM 1725 O PRO A 112 5.338 -8.550 -4.712 1.00 0.00 O ATOM 1726 CB PRO A 112 7.704 -7.168 -3.432 1.00 0.00 C ATOM 1727 CG PRO A 112 8.986 -7.884 -3.182 1.00 0.00 C ATOM 1728 CD PRO A 112 8.837 -8.545 -1.840 1.00 0.00 C ATOM 0 HA PRO A 112 5.803 -7.468 -2.348 1.00 0.00 H new ATOM 0 HB2 PRO A 112 7.513 -7.060 -4.500 1.00 0.00 H new ATOM 0 HB3 PRO A 112 7.722 -6.164 -3.008 1.00 0.00 H new ATOM 0 HG2 PRO A 112 9.179 -8.622 -3.961 1.00 0.00 H new ATOM 0 HG3 PRO A 112 9.827 -7.191 -3.184 1.00 0.00 H new ATOM 0 HD2 PRO A 112 9.380 -9.489 -1.794 1.00 0.00 H new ATOM 0 HD3 PRO A 112 9.222 -7.916 -1.037 1.00 0.00 H new ATOM 1736 N GLU A 113 6.225 -10.281 -3.582 1.00 0.00 N ATOM 1737 CA GLU A 113 5.678 -11.291 -4.481 1.00 0.00 C ATOM 1738 C GLU A 113 4.500 -12.014 -3.835 1.00 0.00 C ATOM 1739 O GLU A 113 4.663 -13.073 -3.229 1.00 0.00 O ATOM 1740 CB GLU A 113 6.761 -12.301 -4.868 1.00 0.00 C ATOM 1741 CG GLU A 113 7.895 -11.697 -5.679 1.00 0.00 C ATOM 1742 CD GLU A 113 7.580 -11.627 -7.161 1.00 0.00 C ATOM 1743 OE1 GLU A 113 7.392 -12.696 -7.778 1.00 0.00 O ATOM 1744 OE2 GLU A 113 7.523 -10.503 -7.702 1.00 0.00 O ATOM 0 H GLU A 113 6.776 -10.657 -2.811 1.00 0.00 H new ATOM 0 HA GLU A 113 5.323 -10.787 -5.380 1.00 0.00 H new ATOM 0 HB2 GLU A 113 7.171 -12.746 -3.962 1.00 0.00 H new ATOM 0 HB3 GLU A 113 6.305 -13.108 -5.442 1.00 0.00 H new ATOM 0 HG2 GLU A 113 8.107 -10.694 -5.309 1.00 0.00 H new ATOM 0 HG3 GLU A 113 8.798 -12.289 -5.531 1.00 0.00 H new ATOM 1751 N THR A 114 3.312 -11.433 -3.968 1.00 0.00 N ATOM 1752 CA THR A 114 2.106 -12.019 -3.397 1.00 0.00 C ATOM 1753 C THR A 114 0.968 -12.035 -4.412 1.00 0.00 C ATOM 1754 O THR A 114 1.122 -11.563 -5.539 1.00 0.00 O ATOM 1755 CB THR A 114 1.648 -11.253 -2.142 1.00 0.00 C ATOM 1756 OG1 THR A 114 1.524 -9.857 -2.439 1.00 0.00 O ATOM 1757 CG2 THR A 114 2.634 -11.448 -1.000 1.00 0.00 C ATOM 0 H THR A 114 3.159 -10.556 -4.467 1.00 0.00 H new ATOM 0 HA THR A 114 2.355 -13.043 -3.118 1.00 0.00 H new ATOM 0 HB THR A 114 0.679 -11.647 -1.836 1.00 0.00 H new ATOM 0 HG1 THR A 114 2.091 -9.341 -1.828 1.00 0.00 H new ATOM 0 HG21 THR A 114 2.290 -10.898 -0.124 1.00 0.00 H new ATOM 0 HG22 THR A 114 2.705 -12.508 -0.758 1.00 0.00 H new ATOM 0 HG23 THR A 114 3.615 -11.078 -1.299 1.00 0.00 H new ATOM 1765 N ASP A 115 -0.173 -12.580 -4.006 1.00 0.00 N ATOM 1766 CA ASP A 115 -1.338 -12.655 -4.879 1.00 0.00 C ATOM 1767 C ASP A 115 -2.593 -12.179 -4.154 1.00 0.00 C ATOM 1768 O ASP A 115 -2.668 -12.224 -2.926 1.00 0.00 O ATOM 1769 CB ASP A 115 -1.535 -14.087 -5.380 1.00 0.00 C ATOM 1770 CG ASP A 115 -0.374 -14.569 -6.227 1.00 0.00 C ATOM 1771 OD1 ASP A 115 0.607 -15.082 -5.651 1.00 0.00 O ATOM 1772 OD2 ASP A 115 -0.447 -14.433 -7.466 1.00 0.00 O ATOM 0 H ASP A 115 -0.316 -12.977 -3.077 1.00 0.00 H new ATOM 0 HA ASP A 115 -1.164 -12.000 -5.733 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -1.660 -14.753 -4.527 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -2.454 -14.141 -5.964 1.00 0.00 H new ATOM 1777 N LEU A 116 -3.576 -11.722 -4.922 1.00 0.00 N ATOM 1778 CA LEU A 116 -4.828 -11.236 -4.353 1.00 0.00 C ATOM 1779 C LEU A 116 -6.018 -12.001 -4.923 1.00 0.00 C ATOM 1780 O LEU A 116 -6.010 -12.406 -6.086 1.00 0.00 O ATOM 1781 CB LEU A 116 -4.990 -9.740 -4.629 1.00 0.00 C ATOM 1782 CG LEU A 116 -3.847 -8.842 -4.152 1.00 0.00 C ATOM 1783 CD1 LEU A 116 -4.001 -7.438 -4.716 1.00 0.00 C ATOM 1784 CD2 LEU A 116 -3.796 -8.806 -2.632 1.00 0.00 C ATOM 0 H LEU A 116 -3.530 -11.678 -5.940 1.00 0.00 H new ATOM 0 HA LEU A 116 -4.796 -11.399 -3.276 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -5.111 -9.600 -5.703 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -5.912 -9.402 -4.157 1.00 0.00 H new ATOM 0 HG LEU A 116 -2.907 -9.257 -4.517 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -3.179 -6.813 -4.366 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -3.987 -7.480 -5.805 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -4.947 -7.013 -4.381 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -2.977 -8.163 -2.311 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -4.737 -8.416 -2.246 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -3.637 -9.814 -2.249 1.00 0.00 H new ATOM 1796 N HIS A 117 -7.042 -12.193 -4.097 1.00 0.00 N ATOM 1797 CA HIS A 117 -8.242 -12.907 -4.519 1.00 0.00 C ATOM 1798 C HIS A 117 -9.495 -12.094 -4.212 1.00 0.00 C ATOM 1799 O HIS A 117 -9.620 -11.509 -3.136 1.00 0.00 O ATOM 1800 CB HIS A 117 -8.321 -14.268 -3.828 1.00 0.00 C ATOM 1801 CG HIS A 117 -7.306 -15.252 -4.324 1.00 0.00 C ATOM 1802 ND1 HIS A 117 -7.320 -15.766 -5.603 1.00 0.00 N ATOM 1803 CD2 HIS A 117 -6.242 -15.816 -3.705 1.00 0.00 C ATOM 1804 CE1 HIS A 117 -6.309 -16.604 -5.750 1.00 0.00 C ATOM 1805 NE2 HIS A 117 -5.639 -16.652 -4.612 1.00 0.00 N ATOM 0 H HIS A 117 -7.065 -11.864 -3.132 1.00 0.00 H new ATOM 0 HA HIS A 117 -8.184 -13.058 -5.597 1.00 0.00 H new ATOM 0 HB2 HIS A 117 -8.187 -14.130 -2.755 1.00 0.00 H new ATOM 0 HB3 HIS A 117 -9.318 -14.683 -3.974 1.00 0.00 H new ATOM 0 HD2 HIS A 117 -5.926 -15.641 -2.687 1.00 0.00 H new ATOM 0 HE1 HIS A 117 -6.071 -17.156 -6.647 1.00 0.00 H new ATOM 0 HE2 HIS A 117 -4.809 -17.218 -4.436 1.00 0.00 H new ATOM 1813 N VAL A 118 -10.421 -12.060 -5.165 1.00 0.00 N ATOM 1814 CA VAL A 118 -11.665 -11.318 -4.996 1.00 0.00 C ATOM 1815 C VAL A 118 -12.859 -12.261 -4.897 1.00 0.00 C ATOM 1816 O VAL A 118 -12.904 -13.292 -5.567 1.00 0.00 O ATOM 1817 CB VAL A 118 -11.896 -10.336 -6.159 1.00 0.00 C ATOM 1818 CG1 VAL A 118 -12.161 -11.092 -7.452 1.00 0.00 C ATOM 1819 CG2 VAL A 118 -13.045 -9.392 -5.840 1.00 0.00 C ATOM 0 H VAL A 118 -10.333 -12.538 -6.062 1.00 0.00 H new ATOM 0 HA VAL A 118 -11.573 -10.754 -4.068 1.00 0.00 H new ATOM 0 HB VAL A 118 -10.993 -9.740 -6.292 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -12.322 -10.381 -8.263 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -11.304 -11.723 -7.687 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -13.048 -11.715 -7.334 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -13.194 -8.705 -6.673 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -13.956 -9.969 -5.678 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -12.810 -8.824 -4.940 1.00 0.00 H new ATOM 1829 N ASN A 119 -13.823 -11.901 -4.057 1.00 0.00 N ATOM 1830 CA ASN A 119 -15.019 -12.716 -3.871 1.00 0.00 C ATOM 1831 C ASN A 119 -16.279 -11.861 -3.959 1.00 0.00 C ATOM 1832 O ASN A 119 -16.597 -11.084 -3.058 1.00 0.00 O ATOM 1833 CB ASN A 119 -14.968 -13.431 -2.519 1.00 0.00 C ATOM 1834 CG ASN A 119 -13.793 -14.385 -2.414 1.00 0.00 C ATOM 1835 OD1 ASN A 119 -12.736 -14.153 -3.001 1.00 0.00 O ATOM 1836 ND2 ASN A 119 -13.975 -15.465 -1.664 1.00 0.00 N ATOM 0 H ASN A 119 -13.800 -11.051 -3.494 1.00 0.00 H new ATOM 0 HA ASN A 119 -15.050 -13.459 -4.667 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -14.904 -12.691 -1.722 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -15.896 -13.983 -2.368 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -13.221 -16.144 -1.556 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -14.869 -15.616 -1.196 1.00 0.00 H new ATOM 1843 N PRO A 120 -17.016 -12.005 -5.070 1.00 0.00 N ATOM 1844 CA PRO A 120 -18.254 -11.256 -5.303 1.00 0.00 C ATOM 1845 C PRO A 120 -19.383 -11.701 -4.379 1.00 0.00 C ATOM 1846 O PRO A 120 -20.119 -10.875 -3.839 1.00 0.00 O ATOM 1847 CB PRO A 120 -18.596 -11.579 -6.759 1.00 0.00 C ATOM 1848 CG PRO A 120 -17.950 -12.897 -7.017 1.00 0.00 C ATOM 1849 CD PRO A 120 -16.697 -12.913 -6.186 1.00 0.00 C ATOM 0 HA PRO A 120 -18.129 -10.191 -5.107 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -19.674 -11.630 -6.910 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -18.215 -10.813 -7.434 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -18.612 -13.717 -6.740 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -17.718 -13.018 -8.075 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -16.462 -13.917 -5.833 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -15.834 -12.565 -6.753 1.00 0.00 H new ATOM 1857 N LYS A 121 -19.514 -13.011 -4.201 1.00 0.00 N ATOM 1858 CA LYS A 121 -20.552 -13.566 -3.341 1.00 0.00 C ATOM 1859 C LYS A 121 -20.318 -13.177 -1.885 1.00 0.00 C ATOM 1860 O LYS A 121 -21.104 -12.435 -1.295 1.00 0.00 O ATOM 1861 CB LYS A 121 -20.591 -15.090 -3.473 1.00 0.00 C ATOM 1862 CG LYS A 121 -21.355 -15.576 -4.692 1.00 0.00 C ATOM 1863 CD LYS A 121 -22.803 -15.889 -4.355 1.00 0.00 C ATOM 1864 CE LYS A 121 -23.713 -14.706 -4.649 1.00 0.00 C ATOM 1865 NZ LYS A 121 -24.877 -14.658 -3.722 1.00 0.00 N ATOM 0 H LYS A 121 -18.914 -13.708 -4.641 1.00 0.00 H new ATOM 0 HA LYS A 121 -21.510 -13.155 -3.659 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -19.570 -15.468 -3.520 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -21.046 -15.512 -2.577 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -21.318 -14.816 -5.472 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -20.873 -16.468 -5.093 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -23.132 -16.754 -4.930 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -22.883 -16.157 -3.302 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -23.144 -13.780 -4.565 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -24.070 -14.769 -5.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -25.473 -13.838 -3.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -25.435 -15.530 -3.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -24.538 -14.572 -2.743 1.00 0.00 H new ATOM 1879 N LYS A 122 -19.231 -13.682 -1.310 1.00 0.00 N ATOM 1880 CA LYS A 122 -18.891 -13.386 0.077 1.00 0.00 C ATOM 1881 C LYS A 122 -18.547 -11.910 0.249 1.00 0.00 C ATOM 1882 O LYS A 122 -18.476 -11.407 1.370 1.00 0.00 O ATOM 1883 CB LYS A 122 -17.713 -14.251 0.531 1.00 0.00 C ATOM 1884 CG LYS A 122 -18.130 -15.601 1.087 1.00 0.00 C ATOM 1885 CD LYS A 122 -18.784 -16.466 0.023 1.00 0.00 C ATOM 1886 CE LYS A 122 -18.588 -17.947 0.309 1.00 0.00 C ATOM 1887 NZ LYS A 122 -18.889 -18.787 -0.882 1.00 0.00 N ATOM 0 H LYS A 122 -18.570 -14.298 -1.783 1.00 0.00 H new ATOM 0 HA LYS A 122 -19.760 -13.613 0.694 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -17.041 -14.407 -0.313 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -17.149 -13.712 1.292 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -17.257 -16.115 1.489 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -18.823 -15.456 1.915 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -19.850 -16.242 -0.025 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -18.363 -16.224 -0.953 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -17.560 -18.122 0.627 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -19.232 -18.245 1.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -18.743 -19.789 -0.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -19.877 -18.639 -1.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -18.257 -18.520 -1.664 1.00 0.00 H new ATOM 1901 N GLN A 123 -18.335 -11.222 -0.868 1.00 0.00 N ATOM 1902 CA GLN A 123 -17.999 -9.803 -0.839 1.00 0.00 C ATOM 1903 C GLN A 123 -16.831 -9.539 0.105 1.00 0.00 C ATOM 1904 O GLN A 123 -16.866 -8.607 0.909 1.00 0.00 O ATOM 1905 CB GLN A 123 -19.214 -8.978 -0.409 1.00 0.00 C ATOM 1906 CG GLN A 123 -20.403 -9.113 -1.346 1.00 0.00 C ATOM 1907 CD GLN A 123 -20.380 -8.094 -2.468 1.00 0.00 C ATOM 1908 OE1 GLN A 123 -21.045 -7.059 -2.396 1.00 0.00 O ATOM 1909 NE2 GLN A 123 -19.613 -8.380 -3.513 1.00 0.00 N ATOM 0 H GLN A 123 -18.390 -11.624 -1.804 1.00 0.00 H new ATOM 0 HA GLN A 123 -17.704 -9.505 -1.845 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -19.515 -9.285 0.593 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -18.927 -7.928 -0.348 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -20.413 -10.116 -1.772 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -21.325 -8.999 -0.776 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -19.079 -9.249 -3.531 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -19.558 -7.731 -4.298 1.00 0.00 H new ATOM 1918 N THR A 124 -15.795 -10.367 0.002 1.00 0.00 N ATOM 1919 CA THR A 124 -14.616 -10.224 0.847 1.00 0.00 C ATOM 1920 C THR A 124 -13.337 -10.432 0.045 1.00 0.00 C ATOM 1921 O THR A 124 -13.329 -11.151 -0.954 1.00 0.00 O ATOM 1922 CB THR A 124 -14.642 -11.223 2.019 1.00 0.00 C ATOM 1923 OG1 THR A 124 -14.807 -12.556 1.524 1.00 0.00 O ATOM 1924 CG2 THR A 124 -15.768 -10.893 2.987 1.00 0.00 C ATOM 0 H THR A 124 -15.749 -11.143 -0.658 1.00 0.00 H new ATOM 0 HA THR A 124 -14.632 -9.209 1.244 1.00 0.00 H new ATOM 0 HB THR A 124 -13.694 -11.149 2.551 1.00 0.00 H new ATOM 0 HG1 THR A 124 -14.821 -13.185 2.276 1.00 0.00 H new ATOM 0 HG21 THR A 124 -15.766 -11.612 3.806 1.00 0.00 H new ATOM 0 HG22 THR A 124 -15.623 -9.889 3.385 1.00 0.00 H new ATOM 0 HG23 THR A 124 -16.723 -10.941 2.464 1.00 0.00 H new ATOM 1932 N ILE A 125 -12.257 -9.798 0.490 1.00 0.00 N ATOM 1933 CA ILE A 125 -10.971 -9.916 -0.187 1.00 0.00 C ATOM 1934 C ILE A 125 -10.014 -10.805 0.601 1.00 0.00 C ATOM 1935 O ILE A 125 -9.997 -10.779 1.831 1.00 0.00 O ATOM 1936 CB ILE A 125 -10.317 -8.537 -0.396 1.00 0.00 C ATOM 1937 CG1 ILE A 125 -11.246 -7.624 -1.199 1.00 0.00 C ATOM 1938 CG2 ILE A 125 -8.976 -8.688 -1.099 1.00 0.00 C ATOM 1939 CD1 ILE A 125 -10.988 -6.151 -0.973 1.00 0.00 C ATOM 0 H ILE A 125 -12.247 -9.198 1.315 1.00 0.00 H new ATOM 0 HA ILE A 125 -11.166 -10.368 -1.159 1.00 0.00 H new ATOM 0 HB ILE A 125 -10.145 -8.081 0.579 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -11.132 -7.846 -2.260 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -12.280 -7.848 -0.935 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -8.526 -7.705 -1.240 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -8.315 -9.306 -0.492 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -9.125 -9.161 -2.070 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -11.683 -5.564 -1.574 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -11.130 -5.914 0.081 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -9.965 -5.912 -1.264 1.00 0.00 H new ATOM 1951 N GLY A 126 -9.218 -11.591 -0.117 1.00 0.00 N ATOM 1952 CA GLY A 126 -8.268 -12.476 0.531 1.00 0.00 C ATOM 1953 C GLY A 126 -6.942 -12.539 -0.200 1.00 0.00 C ATOM 1954 O GLY A 126 -6.896 -12.435 -1.425 1.00 0.00 O ATOM 0 H GLY A 126 -9.214 -11.631 -1.136 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -8.100 -12.137 1.553 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -8.693 -13.478 0.593 1.00 0.00 H new ATOM 1958 N ASN A 127 -5.860 -12.708 0.553 1.00 0.00 N ATOM 1959 CA ASN A 127 -4.526 -12.782 -0.031 1.00 0.00 C ATOM 1960 C ASN A 127 -3.894 -14.147 0.226 1.00 0.00 C ATOM 1961 O ASN A 127 -4.189 -14.800 1.228 1.00 0.00 O ATOM 1962 CB ASN A 127 -3.634 -11.679 0.541 1.00 0.00 C ATOM 1963 CG ASN A 127 -3.841 -11.481 2.030 1.00 0.00 C ATOM 1964 OD1 ASN A 127 -4.674 -12.147 2.645 1.00 0.00 O ATOM 1965 ND2 ASN A 127 -3.082 -10.563 2.616 1.00 0.00 N ATOM 0 H ASN A 127 -5.881 -12.796 1.569 1.00 0.00 H new ATOM 0 HA ASN A 127 -4.620 -12.642 -1.108 1.00 0.00 H new ATOM 0 HB2 ASN A 127 -2.589 -11.926 0.352 1.00 0.00 H new ATOM 0 HB3 ASN A 127 -3.839 -10.743 0.021 1.00 0.00 H new ATOM 0 HD21 ASN A 127 -3.176 -10.386 3.616 1.00 0.00 H new ATOM 0 HD22 ASN A 127 -2.404 -10.035 2.066 1.00 0.00 H new ATOM 1972 N SER A 128 -3.023 -14.572 -0.684 1.00 0.00 N ATOM 1973 CA SER A 128 -2.352 -15.860 -0.557 1.00 0.00 C ATOM 1974 C SER A 128 -0.880 -15.746 -0.943 1.00 0.00 C ATOM 1975 O SER A 128 -0.547 -15.509 -2.104 1.00 0.00 O ATOM 1976 CB SER A 128 -3.041 -16.906 -1.434 1.00 0.00 C ATOM 1977 OG SER A 128 -2.699 -16.734 -2.799 1.00 0.00 O ATOM 0 H SER A 128 -2.766 -14.043 -1.517 1.00 0.00 H new ATOM 0 HA SER A 128 -2.413 -16.173 0.485 1.00 0.00 H new ATOM 0 HB2 SER A 128 -2.753 -17.905 -1.107 1.00 0.00 H new ATOM 0 HB3 SER A 128 -4.122 -16.830 -1.314 1.00 0.00 H new ATOM 0 HG SER A 128 -2.038 -16.015 -2.883 1.00 0.00 H new ATOM 1983 N CYS A 129 -0.003 -15.915 0.041 1.00 0.00 N ATOM 1984 CA CYS A 129 1.434 -15.831 -0.193 1.00 0.00 C ATOM 1985 C CYS A 129 2.047 -17.223 -0.317 1.00 0.00 C ATOM 1986 O CYS A 129 1.532 -18.193 0.241 1.00 0.00 O ATOM 1987 CB CYS A 129 2.112 -15.063 0.943 1.00 0.00 C ATOM 1988 SG CYS A 129 3.893 -15.408 1.114 1.00 0.00 S ATOM 0 H CYS A 129 -0.262 -16.111 1.008 1.00 0.00 H new ATOM 0 HA CYS A 129 1.594 -15.298 -1.130 1.00 0.00 H new ATOM 0 HB2 CYS A 129 1.974 -13.994 0.778 1.00 0.00 H new ATOM 0 HB3 CYS A 129 1.614 -15.308 1.881 1.00 0.00 H new ATOM 1993 N LYS A 130 3.150 -17.314 -1.052 1.00 0.00 N ATOM 1994 CA LYS A 130 3.836 -18.586 -1.249 1.00 0.00 C ATOM 1995 C LYS A 130 5.155 -18.617 -0.485 1.00 0.00 C ATOM 1996 O LYS A 130 5.531 -19.642 0.082 1.00 0.00 O ATOM 1997 CB LYS A 130 4.092 -18.825 -2.739 1.00 0.00 C ATOM 1998 CG LYS A 130 2.823 -18.884 -3.572 1.00 0.00 C ATOM 1999 CD LYS A 130 3.127 -19.199 -5.028 1.00 0.00 C ATOM 2000 CE LYS A 130 3.757 -18.010 -5.736 1.00 0.00 C ATOM 2001 NZ LYS A 130 4.501 -18.423 -6.959 1.00 0.00 N ATOM 0 H LYS A 130 3.588 -16.522 -1.521 1.00 0.00 H new ATOM 0 HA LYS A 130 3.195 -19.379 -0.864 1.00 0.00 H new ATOM 0 HB2 LYS A 130 4.731 -18.029 -3.122 1.00 0.00 H new ATOM 0 HB3 LYS A 130 4.640 -19.760 -2.860 1.00 0.00 H new ATOM 0 HG2 LYS A 130 2.155 -19.644 -3.166 1.00 0.00 H new ATOM 0 HG3 LYS A 130 2.299 -17.931 -3.507 1.00 0.00 H new ATOM 0 HD2 LYS A 130 3.800 -20.055 -5.083 1.00 0.00 H new ATOM 0 HD3 LYS A 130 2.207 -19.483 -5.540 1.00 0.00 H new ATOM 0 HE2 LYS A 130 2.980 -17.296 -6.008 1.00 0.00 H new ATOM 0 HE3 LYS A 130 4.436 -17.499 -5.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 4.916 -17.584 -7.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 5.259 -19.085 -6.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 3.848 -18.888 -7.622 1.00 0.00 H new ATOM 2015 N ALA A 131 5.853 -17.486 -0.472 1.00 0.00 N ATOM 2016 CA ALA A 131 7.129 -17.383 0.226 1.00 0.00 C ATOM 2017 C ALA A 131 7.082 -18.111 1.565 1.00 0.00 C ATOM 2018 O ALA A 131 7.895 -18.997 1.831 1.00 0.00 O ATOM 2019 CB ALA A 131 7.503 -15.923 0.430 1.00 0.00 C ATOM 0 H ALA A 131 5.556 -16.628 -0.937 1.00 0.00 H new ATOM 0 HA ALA A 131 7.892 -17.859 -0.390 1.00 0.00 H new ATOM 0 HB1 ALA A 131 8.458 -15.862 0.952 1.00 0.00 H new ATOM 0 HB2 ALA A 131 7.587 -15.430 -0.539 1.00 0.00 H new ATOM 0 HB3 ALA A 131 6.733 -15.429 1.023 1.00 0.00 H new ATOM 2025 N CYS A 132 6.125 -17.732 2.406 1.00 0.00 N ATOM 2026 CA CYS A 132 5.972 -18.348 3.719 1.00 0.00 C ATOM 2027 C CYS A 132 4.736 -19.242 3.760 1.00 0.00 C ATOM 2028 O CYS A 132 4.733 -20.285 4.411 1.00 0.00 O ATOM 2029 CB CYS A 132 5.872 -17.271 4.801 1.00 0.00 C ATOM 2030 SG CYS A 132 4.461 -16.138 4.595 1.00 0.00 S ATOM 0 H CYS A 132 5.444 -17.001 2.201 1.00 0.00 H new ATOM 0 HA CYS A 132 6.851 -18.964 3.909 1.00 0.00 H new ATOM 0 HB2 CYS A 132 5.796 -17.755 5.775 1.00 0.00 H new ATOM 0 HB3 CYS A 132 6.794 -16.689 4.806 1.00 0.00 H new ATOM 2035 N GLY A 133 3.686 -18.824 3.058 1.00 0.00 N ATOM 2036 CA GLY A 133 2.459 -19.597 3.027 1.00 0.00 C ATOM 2037 C GLY A 133 1.387 -19.021 3.931 1.00 0.00 C ATOM 2038 O GLY A 133 0.883 -19.704 4.822 1.00 0.00 O ATOM 0 H GLY A 133 3.664 -17.964 2.511 1.00 0.00 H new ATOM 0 HA2 GLY A 133 2.084 -19.637 2.004 1.00 0.00 H new ATOM 0 HA3 GLY A 133 2.672 -20.623 3.329 1.00 0.00 H new ATOM 2042 N TYR A 134 1.039 -17.759 3.702 1.00 0.00 N ATOM 2043 CA TYR A 134 0.022 -17.089 4.504 1.00 0.00 C ATOM 2044 C TYR A 134 -1.291 -16.976 3.737 1.00 0.00 C ATOM 2045 O TYR A 134 -1.338 -16.410 2.644 1.00 0.00 O ATOM 2046 CB TYR A 134 0.505 -15.698 4.919 1.00 0.00 C ATOM 2047 CG TYR A 134 -0.612 -14.767 5.331 1.00 0.00 C ATOM 2048 CD1 TYR A 134 -1.393 -14.123 4.380 1.00 0.00 C ATOM 2049 CD2 TYR A 134 -0.888 -14.533 6.673 1.00 0.00 C ATOM 2050 CE1 TYR A 134 -2.415 -13.271 4.753 1.00 0.00 C ATOM 2051 CE2 TYR A 134 -1.908 -13.684 7.055 1.00 0.00 C ATOM 2052 CZ TYR A 134 -2.669 -13.055 6.091 1.00 0.00 C ATOM 2053 OH TYR A 134 -3.686 -12.208 6.467 1.00 0.00 O ATOM 0 H TYR A 134 1.446 -17.180 2.968 1.00 0.00 H new ATOM 0 HA TYR A 134 -0.152 -17.688 5.398 1.00 0.00 H new ATOM 0 HB2 TYR A 134 1.207 -15.798 5.747 1.00 0.00 H new ATOM 0 HB3 TYR A 134 1.052 -15.250 4.090 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -1.198 -14.291 3.331 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -0.294 -15.024 7.430 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -3.012 -12.777 4.001 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -2.109 -13.513 8.102 1.00 0.00 H new ATOM 0 HH TYR A 134 -3.733 -12.167 7.445 1.00 0.00 H new ATOM 2063 N ARG A 135 -2.357 -17.518 4.317 1.00 0.00 N ATOM 2064 CA ARG A 135 -3.672 -17.479 3.689 1.00 0.00 C ATOM 2065 C ARG A 135 -4.721 -16.941 4.657 1.00 0.00 C ATOM 2066 O ARG A 135 -4.964 -17.524 5.713 1.00 0.00 O ATOM 2067 CB ARG A 135 -4.073 -18.876 3.210 1.00 0.00 C ATOM 2068 CG ARG A 135 -3.592 -19.199 1.805 1.00 0.00 C ATOM 2069 CD ARG A 135 -2.098 -19.480 1.778 1.00 0.00 C ATOM 2070 NE ARG A 135 -1.697 -20.195 0.569 1.00 0.00 N ATOM 2071 CZ ARG A 135 -1.837 -21.506 0.410 1.00 0.00 C ATOM 2072 NH1 ARG A 135 -2.366 -22.242 1.378 1.00 0.00 N ATOM 2073 NH2 ARG A 135 -1.449 -22.084 -0.719 1.00 0.00 N ATOM 0 H ARG A 135 -2.336 -17.989 5.221 1.00 0.00 H new ATOM 0 HA ARG A 135 -3.618 -16.809 2.831 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -3.672 -19.617 3.902 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -5.159 -18.964 3.243 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -4.133 -20.065 1.424 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -3.818 -18.365 1.141 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -1.551 -18.539 1.841 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -1.824 -20.067 2.654 1.00 0.00 H new ATOM 0 HE ARG A 135 -1.287 -19.658 -0.195 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -2.667 -21.801 2.247 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -2.472 -23.249 1.253 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -1.042 -21.521 -1.466 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -1.557 -23.091 -0.840 1.00 0.00 H new ATOM 2087 N GLY A 136 -5.341 -15.823 4.289 1.00 0.00 N ATOM 2088 CA GLY A 136 -6.356 -15.224 5.136 1.00 0.00 C ATOM 2089 C GLY A 136 -7.192 -14.196 4.400 1.00 0.00 C ATOM 2090 O GLY A 136 -7.245 -14.195 3.170 1.00 0.00 O ATOM 0 H GLY A 136 -5.158 -15.322 3.420 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -7.008 -16.006 5.526 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -5.877 -14.752 5.994 1.00 0.00 H new ATOM 2094 N MET A 137 -7.848 -13.321 5.154 1.00 0.00 N ATOM 2095 CA MET A 137 -8.687 -12.283 4.565 1.00 0.00 C ATOM 2096 C MET A 137 -8.114 -10.897 4.845 1.00 0.00 C ATOM 2097 O MET A 137 -7.844 -10.547 5.994 1.00 0.00 O ATOM 2098 CB MET A 137 -10.113 -12.378 5.111 1.00 0.00 C ATOM 2099 CG MET A 137 -10.196 -12.230 6.621 1.00 0.00 C ATOM 2100 SD MET A 137 -11.762 -12.821 7.292 1.00 0.00 S ATOM 2101 CE MET A 137 -11.318 -14.490 7.767 1.00 0.00 C ATOM 0 H MET A 137 -7.815 -13.309 6.173 1.00 0.00 H new ATOM 0 HA MET A 137 -8.708 -12.437 3.486 1.00 0.00 H new ATOM 0 HB2 MET A 137 -10.724 -11.606 4.644 1.00 0.00 H new ATOM 0 HB3 MET A 137 -10.540 -13.339 4.824 1.00 0.00 H new ATOM 0 HG2 MET A 137 -9.377 -12.782 7.082 1.00 0.00 H new ATOM 0 HG3 MET A 137 -10.064 -11.181 6.887 1.00 0.00 H new ATOM 0 HE1 MET A 137 -12.185 -14.988 8.200 1.00 0.00 H new ATOM 0 HE2 MET A 137 -10.984 -15.042 6.888 1.00 0.00 H new ATOM 0 HE3 MET A 137 -10.514 -14.457 8.502 1.00 0.00 H new ATOM 2111 N LEU A 138 -7.931 -10.113 3.788 1.00 0.00 N ATOM 2112 CA LEU A 138 -7.390 -8.765 3.921 1.00 0.00 C ATOM 2113 C LEU A 138 -8.386 -7.844 4.617 1.00 0.00 C ATOM 2114 O LEU A 138 -9.579 -7.861 4.313 1.00 0.00 O ATOM 2115 CB LEU A 138 -7.032 -8.200 2.545 1.00 0.00 C ATOM 2116 CG LEU A 138 -5.593 -8.429 2.079 1.00 0.00 C ATOM 2117 CD1 LEU A 138 -5.449 -8.087 0.604 1.00 0.00 C ATOM 2118 CD2 LEU A 138 -4.624 -7.608 2.916 1.00 0.00 C ATOM 0 H LEU A 138 -8.149 -10.387 2.830 1.00 0.00 H new ATOM 0 HA LEU A 138 -6.488 -8.821 4.531 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -7.705 -8.638 1.808 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -7.223 -7.127 2.554 1.00 0.00 H new ATOM 0 HG LEU A 138 -5.352 -9.484 2.212 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -4.419 -8.256 0.290 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -6.115 -8.719 0.017 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -5.709 -7.040 0.446 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -3.605 -7.784 2.570 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -4.864 -6.549 2.816 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -4.708 -7.902 3.962 1.00 0.00 H new ATOM 2130 N ASP A 139 -7.889 -7.040 5.551 1.00 0.00 N ATOM 2131 CA ASP A 139 -8.735 -6.109 6.288 1.00 0.00 C ATOM 2132 C ASP A 139 -8.755 -4.741 5.613 1.00 0.00 C ATOM 2133 O ASP A 139 -8.121 -3.796 6.083 1.00 0.00 O ATOM 2134 CB ASP A 139 -8.244 -5.974 7.730 1.00 0.00 C ATOM 2135 CG ASP A 139 -6.804 -5.506 7.810 1.00 0.00 C ATOM 2136 OD1 ASP A 139 -6.018 -5.850 6.903 1.00 0.00 O ATOM 2137 OD2 ASP A 139 -6.463 -4.797 8.780 1.00 0.00 O ATOM 0 H ASP A 139 -6.904 -7.015 5.815 1.00 0.00 H new ATOM 0 HA ASP A 139 -9.750 -6.505 6.294 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -8.882 -5.270 8.264 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -8.339 -6.935 8.235 1.00 0.00 H new ATOM 2142 N THR A 140 -9.486 -4.643 4.508 1.00 0.00 N ATOM 2143 CA THR A 140 -9.587 -3.392 3.767 1.00 0.00 C ATOM 2144 C THR A 140 -10.863 -2.641 4.127 1.00 0.00 C ATOM 2145 O THR A 140 -11.968 -3.156 3.956 1.00 0.00 O ATOM 2146 CB THR A 140 -9.561 -3.636 2.246 1.00 0.00 C ATOM 2147 OG1 THR A 140 -8.337 -4.280 1.874 1.00 0.00 O ATOM 2148 CG2 THR A 140 -9.702 -2.327 1.485 1.00 0.00 C ATOM 0 H THR A 140 -10.017 -5.415 4.106 1.00 0.00 H new ATOM 0 HA THR A 140 -8.723 -2.789 4.046 1.00 0.00 H new ATOM 0 HB THR A 140 -10.403 -4.279 1.989 1.00 0.00 H new ATOM 0 HG1 THR A 140 -8.329 -4.433 0.906 1.00 0.00 H new ATOM 0 HG21 THR A 140 -9.681 -2.525 0.413 1.00 0.00 H new ATOM 0 HG22 THR A 140 -10.648 -1.853 1.748 1.00 0.00 H new ATOM 0 HG23 THR A 140 -8.878 -1.663 1.748 1.00 0.00 H new ATOM 2156 N HIS A 141 -10.704 -1.419 4.627 1.00 0.00 N ATOM 2157 CA HIS A 141 -11.845 -0.595 5.011 1.00 0.00 C ATOM 2158 C HIS A 141 -12.932 -0.640 3.941 1.00 0.00 C ATOM 2159 O HIS A 141 -12.662 -0.423 2.759 1.00 0.00 O ATOM 2160 CB HIS A 141 -11.402 0.849 5.245 1.00 0.00 C ATOM 2161 CG HIS A 141 -10.231 1.260 4.407 1.00 0.00 C ATOM 2162 ND1 HIS A 141 -8.901 1.168 4.638 1.00 0.00 N flip ATOM 2163 CD2 HIS A 141 -10.363 1.847 3.166 1.00 0.00 C flip ATOM 2164 CE1 HIS A 141 -8.260 1.694 3.543 1.00 0.00 C flip ATOM 2165 NE2 HIS A 141 -9.165 2.096 2.669 1.00 0.00 N flip ATOM 0 H HIS A 141 -9.796 -0.978 4.776 1.00 0.00 H new ATOM 0 HA HIS A 141 -12.256 -0.995 5.938 1.00 0.00 H new ATOM 0 HB2 HIS A 141 -12.239 1.515 5.037 1.00 0.00 H new ATOM 0 HB3 HIS A 141 -11.148 0.976 6.297 1.00 0.00 H new ATOM 0 HD2 HIS A 141 -11.300 2.069 2.677 1.00 0.00 H new ATOM 0 HE1 HIS A 141 -7.190 1.767 3.417 1.00 0.00 H new ATOM 0 HE2 HIS A 141 -8.972 2.526 1.764 1.00 0.00 H new ATOM 2173 N HIS A 142 -14.160 -0.923 4.363 1.00 0.00 N ATOM 2174 CA HIS A 142 -15.287 -0.996 3.440 1.00 0.00 C ATOM 2175 C HIS A 142 -15.179 0.080 2.364 1.00 0.00 C ATOM 2176 O HIS A 142 -15.362 -0.193 1.177 1.00 0.00 O ATOM 2177 CB HIS A 142 -16.606 -0.845 4.199 1.00 0.00 C ATOM 2178 CG HIS A 142 -16.620 -1.550 5.521 1.00 0.00 C ATOM 2179 ND1 HIS A 142 -17.018 -0.943 6.693 1.00 0.00 N ATOM 2180 CD2 HIS A 142 -16.285 -2.819 5.851 1.00 0.00 C ATOM 2181 CE1 HIS A 142 -16.925 -1.808 7.688 1.00 0.00 C ATOM 2182 NE2 HIS A 142 -16.483 -2.954 7.203 1.00 0.00 N ATOM 0 H HIS A 142 -14.400 -1.105 5.337 1.00 0.00 H new ATOM 0 HA HIS A 142 -15.265 -1.972 2.956 1.00 0.00 H new ATOM 0 HB2 HIS A 142 -16.804 0.215 4.359 1.00 0.00 H new ATOM 0 HB3 HIS A 142 -17.417 -1.231 3.582 1.00 0.00 H new ATOM 0 HD2 HIS A 142 -15.928 -3.583 5.176 1.00 0.00 H new ATOM 0 HE1 HIS A 142 -17.169 -1.611 8.722 1.00 0.00 H new ATOM 0 HE2 HIS A 142 -16.316 -3.802 7.745 1.00 0.00 H new ATOM 2190 N LYS A 143 -14.883 1.304 2.787 1.00 0.00 N ATOM 2191 CA LYS A 143 -14.750 2.423 1.860 1.00 0.00 C ATOM 2192 C LYS A 143 -14.050 1.986 0.577 1.00 0.00 C ATOM 2193 O LYS A 143 -14.485 2.323 -0.525 1.00 0.00 O ATOM 2194 CB LYS A 143 -13.971 3.565 2.516 1.00 0.00 C ATOM 2195 CG LYS A 143 -14.841 4.505 3.332 1.00 0.00 C ATOM 2196 CD LYS A 143 -14.952 4.050 4.777 1.00 0.00 C ATOM 2197 CE LYS A 143 -15.719 5.056 5.621 1.00 0.00 C ATOM 2198 NZ LYS A 143 -14.904 6.268 5.916 1.00 0.00 N ATOM 0 H LYS A 143 -14.730 1.547 3.766 1.00 0.00 H new ATOM 0 HA LYS A 143 -15.750 2.773 1.606 1.00 0.00 H new ATOM 0 HB2 LYS A 143 -13.201 3.144 3.162 1.00 0.00 H new ATOM 0 HB3 LYS A 143 -13.460 4.137 1.741 1.00 0.00 H new ATOM 0 HG2 LYS A 143 -14.423 5.511 3.298 1.00 0.00 H new ATOM 0 HG3 LYS A 143 -15.836 4.558 2.889 1.00 0.00 H new ATOM 0 HD2 LYS A 143 -15.453 3.083 4.817 1.00 0.00 H new ATOM 0 HD3 LYS A 143 -13.954 3.910 5.193 1.00 0.00 H new ATOM 0 HE2 LYS A 143 -16.630 5.349 5.099 1.00 0.00 H new ATOM 0 HE3 LYS A 143 -16.025 4.587 6.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 -15.436 6.899 6.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 -14.015 5.985 6.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 -14.691 6.767 5.029 1.00 0.00 H new ATOM 2212 N LEU A 144 -12.965 1.235 0.727 1.00 0.00 N ATOM 2213 CA LEU A 144 -12.205 0.751 -0.420 1.00 0.00 C ATOM 2214 C LEU A 144 -12.662 -0.647 -0.826 1.00 0.00 C ATOM 2215 O LEU A 144 -12.900 -0.916 -2.004 1.00 0.00 O ATOM 2216 CB LEU A 144 -10.710 0.737 -0.098 1.00 0.00 C ATOM 2217 CG LEU A 144 -9.773 0.440 -1.269 1.00 0.00 C ATOM 2218 CD1 LEU A 144 -9.804 1.577 -2.279 1.00 0.00 C ATOM 2219 CD2 LEU A 144 -8.355 0.204 -0.772 1.00 0.00 C ATOM 0 H LEU A 144 -12.592 0.948 1.632 1.00 0.00 H new ATOM 0 HA LEU A 144 -12.384 1.429 -1.255 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -10.440 1.707 0.320 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -10.533 -0.006 0.680 1.00 0.00 H new ATOM 0 HG LEU A 144 -10.118 -0.468 -1.764 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -9.131 1.348 -3.105 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -10.818 1.698 -2.660 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -9.485 2.501 -1.797 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -7.703 -0.006 -1.620 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -7.999 1.093 -0.252 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -8.346 -0.645 -0.088 1.00 0.00 H new ATOM 2231 N CYS A 145 -12.785 -1.532 0.157 1.00 0.00 N ATOM 2232 CA CYS A 145 -13.216 -2.902 -0.097 1.00 0.00 C ATOM 2233 C CYS A 145 -14.329 -2.938 -1.138 1.00 0.00 C ATOM 2234 O CYS A 145 -14.237 -3.651 -2.138 1.00 0.00 O ATOM 2235 CB CYS A 145 -13.693 -3.558 1.200 1.00 0.00 C ATOM 2236 SG CYS A 145 -13.788 -5.362 1.124 1.00 0.00 S ATOM 0 H CYS A 145 -12.592 -1.325 1.137 1.00 0.00 H new ATOM 0 HA CYS A 145 -12.363 -3.459 -0.485 1.00 0.00 H new ATOM 0 HB2 CYS A 145 -13.018 -3.274 2.008 1.00 0.00 H new ATOM 0 HB3 CYS A 145 -14.677 -3.164 1.453 1.00 0.00 H new ATOM 0 HG CYS A 145 -14.198 -5.824 2.268 1.00 0.00 H new ATOM 2242 N THR A 146 -15.383 -2.164 -0.897 1.00 0.00 N ATOM 2243 CA THR A 146 -16.516 -2.109 -1.812 1.00 0.00 C ATOM 2244 C THR A 146 -16.055 -1.863 -3.244 1.00 0.00 C ATOM 2245 O THR A 146 -16.457 -2.572 -4.167 1.00 0.00 O ATOM 2246 CB THR A 146 -17.511 -1.005 -1.409 1.00 0.00 C ATOM 2247 OG1 THR A 146 -18.607 -0.972 -2.330 1.00 0.00 O ATOM 2248 CG2 THR A 146 -16.828 0.354 -1.376 1.00 0.00 C ATOM 0 H THR A 146 -15.475 -1.567 -0.075 1.00 0.00 H new ATOM 0 HA THR A 146 -17.015 -3.076 -1.755 1.00 0.00 H new ATOM 0 HB THR A 146 -17.884 -1.231 -0.410 1.00 0.00 H new ATOM 0 HG1 THR A 146 -19.236 -0.268 -2.065 1.00 0.00 H new ATOM 0 HG21 THR A 146 -17.551 1.118 -1.089 1.00 0.00 H new ATOM 0 HG22 THR A 146 -16.014 0.334 -0.652 1.00 0.00 H new ATOM 0 HG23 THR A 146 -16.429 0.585 -2.364 1.00 0.00 H new ATOM 2256 N PHE A 147 -15.209 -0.854 -3.423 1.00 0.00 N ATOM 2257 CA PHE A 147 -14.693 -0.514 -4.744 1.00 0.00 C ATOM 2258 C PHE A 147 -13.989 -1.711 -5.378 1.00 0.00 C ATOM 2259 O PHE A 147 -14.313 -2.115 -6.495 1.00 0.00 O ATOM 2260 CB PHE A 147 -13.726 0.668 -4.649 1.00 0.00 C ATOM 2261 CG PHE A 147 -12.847 0.822 -5.856 1.00 0.00 C ATOM 2262 CD1 PHE A 147 -11.648 0.133 -5.949 1.00 0.00 C ATOM 2263 CD2 PHE A 147 -13.218 1.656 -6.899 1.00 0.00 C ATOM 2264 CE1 PHE A 147 -10.836 0.273 -7.059 1.00 0.00 C ATOM 2265 CE2 PHE A 147 -12.411 1.799 -8.011 1.00 0.00 C ATOM 2266 CZ PHE A 147 -11.218 1.107 -8.091 1.00 0.00 C ATOM 0 H PHE A 147 -14.866 -0.257 -2.670 1.00 0.00 H new ATOM 0 HA PHE A 147 -15.537 -0.235 -5.375 1.00 0.00 H new ATOM 0 HB2 PHE A 147 -14.298 1.585 -4.507 1.00 0.00 H new ATOM 0 HB3 PHE A 147 -13.099 0.544 -3.766 1.00 0.00 H new ATOM 0 HD1 PHE A 147 -11.345 -0.521 -5.145 1.00 0.00 H new ATOM 0 HD2 PHE A 147 -14.149 2.200 -6.842 1.00 0.00 H new ATOM 0 HE1 PHE A 147 -9.904 -0.269 -7.119 1.00 0.00 H new ATOM 0 HE2 PHE A 147 -12.712 2.451 -8.817 1.00 0.00 H new ATOM 0 HZ PHE A 147 -10.585 1.218 -8.959 1.00 0.00 H new ATOM 2276 N ILE A 148 -13.025 -2.273 -4.656 1.00 0.00 N ATOM 2277 CA ILE A 148 -12.276 -3.423 -5.147 1.00 0.00 C ATOM 2278 C ILE A 148 -13.214 -4.511 -5.660 1.00 0.00 C ATOM 2279 O ILE A 148 -13.034 -5.032 -6.762 1.00 0.00 O ATOM 2280 CB ILE A 148 -11.372 -4.015 -4.050 1.00 0.00 C ATOM 2281 CG1 ILE A 148 -10.373 -2.965 -3.560 1.00 0.00 C ATOM 2282 CG2 ILE A 148 -10.643 -5.245 -4.571 1.00 0.00 C ATOM 2283 CD1 ILE A 148 -9.647 -3.366 -2.295 1.00 0.00 C ATOM 0 H ILE A 148 -12.745 -1.951 -3.730 1.00 0.00 H new ATOM 0 HA ILE A 148 -11.653 -3.068 -5.967 1.00 0.00 H new ATOM 0 HB ILE A 148 -11.996 -4.316 -3.209 1.00 0.00 H new ATOM 0 HG12 ILE A 148 -9.641 -2.777 -4.345 1.00 0.00 H new ATOM 0 HG13 ILE A 148 -10.900 -2.027 -3.385 1.00 0.00 H new ATOM 0 HG21 ILE A 148 -10.008 -5.652 -3.784 1.00 0.00 H new ATOM 0 HG22 ILE A 148 -11.371 -5.997 -4.876 1.00 0.00 H new ATOM 0 HG23 ILE A 148 -10.028 -4.968 -5.427 1.00 0.00 H new ATOM 0 HD11 ILE A 148 -8.955 -2.575 -2.006 1.00 0.00 H new ATOM 0 HD12 ILE A 148 -10.370 -3.526 -1.495 1.00 0.00 H new ATOM 0 HD13 ILE A 148 -9.091 -4.287 -2.471 1.00 0.00 H new ATOM 2295 N LEU A 149 -14.215 -4.849 -4.855 1.00 0.00 N ATOM 2296 CA LEU A 149 -15.183 -5.875 -5.227 1.00 0.00 C ATOM 2297 C LEU A 149 -15.859 -5.531 -6.551 1.00 0.00 C ATOM 2298 O LEU A 149 -15.876 -6.338 -7.480 1.00 0.00 O ATOM 2299 CB LEU A 149 -16.236 -6.033 -4.130 1.00 0.00 C ATOM 2300 CG LEU A 149 -15.779 -6.749 -2.858 1.00 0.00 C ATOM 2301 CD1 LEU A 149 -16.669 -6.373 -1.684 1.00 0.00 C ATOM 2302 CD2 LEU A 149 -15.776 -8.257 -3.067 1.00 0.00 C ATOM 0 H LEU A 149 -14.378 -4.428 -3.940 1.00 0.00 H new ATOM 0 HA LEU A 149 -14.648 -6.817 -5.347 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -16.597 -5.042 -3.855 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -17.084 -6.577 -4.544 1.00 0.00 H new ATOM 0 HG LEU A 149 -14.761 -6.432 -2.631 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -16.328 -6.892 -0.788 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -16.620 -5.296 -1.520 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -17.698 -6.660 -1.901 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -15.448 -8.750 -2.152 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -16.782 -8.591 -3.319 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -15.095 -8.510 -3.880 1.00 0.00 H new ATOM 2314 N LYS A 150 -16.413 -4.326 -6.630 1.00 0.00 N ATOM 2315 CA LYS A 150 -17.088 -3.871 -7.840 1.00 0.00 C ATOM 2316 C LYS A 150 -16.210 -4.092 -9.068 1.00 0.00 C ATOM 2317 O LYS A 150 -16.647 -4.675 -10.058 1.00 0.00 O ATOM 2318 CB LYS A 150 -17.452 -2.390 -7.720 1.00 0.00 C ATOM 2319 CG LYS A 150 -18.663 -2.131 -6.841 1.00 0.00 C ATOM 2320 CD LYS A 150 -19.951 -2.562 -7.524 1.00 0.00 C ATOM 2321 CE LYS A 150 -20.454 -1.498 -8.487 1.00 0.00 C ATOM 2322 NZ LYS A 150 -21.282 -2.083 -9.577 1.00 0.00 N ATOM 0 H LYS A 150 -16.408 -3.646 -5.870 1.00 0.00 H new ATOM 0 HA LYS A 150 -18.001 -4.454 -7.958 1.00 0.00 H new ATOM 0 HB2 LYS A 150 -16.598 -1.846 -7.317 1.00 0.00 H new ATOM 0 HB3 LYS A 150 -17.644 -1.990 -8.716 1.00 0.00 H new ATOM 0 HG2 LYS A 150 -18.552 -2.669 -5.899 1.00 0.00 H new ATOM 0 HG3 LYS A 150 -18.717 -1.070 -6.598 1.00 0.00 H new ATOM 0 HD2 LYS A 150 -19.783 -3.494 -8.065 1.00 0.00 H new ATOM 0 HD3 LYS A 150 -20.714 -2.763 -6.771 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -21.042 -0.762 -7.939 1.00 0.00 H new ATOM 0 HE3 LYS A 150 -19.605 -0.969 -8.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -21.606 -1.325 -10.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -20.713 -2.767 -10.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -22.106 -2.566 -9.166 1.00 0.00 H new ATOM 2336 N ASN A 151 -14.969 -3.622 -8.994 1.00 0.00 N ATOM 2337 CA ASN A 151 -14.029 -3.769 -10.100 1.00 0.00 C ATOM 2338 C ASN A 151 -12.860 -4.666 -9.704 1.00 0.00 C ATOM 2339 O ASN A 151 -11.919 -4.242 -9.033 1.00 0.00 O ATOM 2340 CB ASN A 151 -13.508 -2.399 -10.539 1.00 0.00 C ATOM 2341 CG ASN A 151 -13.115 -1.525 -9.364 1.00 0.00 C ATOM 2342 OD1 ASN A 151 -14.069 -0.753 -8.856 1.00 0.00 O flip ATOM 2343 ND2 ASN A 151 -11.968 -1.544 -8.918 1.00 0.00 N flip ATOM 0 H ASN A 151 -14.591 -3.136 -8.181 1.00 0.00 H new ATOM 0 HA ASN A 151 -14.556 -4.234 -10.933 1.00 0.00 H new ATOM 0 HB2 ASN A 151 -12.646 -2.534 -11.192 1.00 0.00 H new ATOM 0 HB3 ASN A 151 -14.275 -1.892 -11.124 1.00 0.00 H new ATOM 0 HD21 ASN A 151 -11.267 -2.153 -9.340 1.00 0.00 H new ATOM 0 HD22 ASN A 151 -11.719 -0.951 -8.127 1.00 0.00 H new ATOM 2350 N PRO A 152 -12.919 -5.937 -10.130 1.00 0.00 N ATOM 2351 CA PRO A 152 -11.874 -6.920 -9.834 1.00 0.00 C ATOM 2352 C PRO A 152 -10.575 -6.628 -10.578 1.00 0.00 C ATOM 2353 O PRO A 152 -10.518 -5.777 -11.466 1.00 0.00 O ATOM 2354 CB PRO A 152 -12.481 -8.240 -10.316 1.00 0.00 C ATOM 2355 CG PRO A 152 -13.465 -7.844 -11.363 1.00 0.00 C ATOM 2356 CD PRO A 152 -14.011 -6.511 -10.934 1.00 0.00 C ATOM 0 HA PRO A 152 -11.603 -6.920 -8.778 1.00 0.00 H new ATOM 0 HB2 PRO A 152 -11.716 -8.903 -10.722 1.00 0.00 H new ATOM 0 HB3 PRO A 152 -12.966 -8.775 -9.499 1.00 0.00 H new ATOM 0 HG2 PRO A 152 -12.988 -7.774 -12.341 1.00 0.00 H new ATOM 0 HG3 PRO A 152 -14.262 -8.583 -11.449 1.00 0.00 H new ATOM 0 HD2 PRO A 152 -14.253 -5.882 -11.790 1.00 0.00 H new ATOM 0 HD3 PRO A 152 -14.925 -6.620 -10.350 1.00 0.00 H new ATOM 2364 N PRO A 153 -9.506 -7.350 -10.210 1.00 0.00 N ATOM 2365 CA PRO A 153 -8.189 -7.187 -10.832 1.00 0.00 C ATOM 2366 C PRO A 153 -8.159 -7.694 -12.270 1.00 0.00 C ATOM 2367 O PRO A 153 -8.468 -8.856 -12.533 1.00 0.00 O ATOM 2368 CB PRO A 153 -7.271 -8.034 -9.947 1.00 0.00 C ATOM 2369 CG PRO A 153 -8.169 -9.055 -9.339 1.00 0.00 C ATOM 2370 CD PRO A 153 -9.501 -8.382 -9.160 1.00 0.00 C ATOM 0 HA PRO A 153 -7.895 -6.139 -10.895 1.00 0.00 H new ATOM 0 HB2 PRO A 153 -6.478 -8.501 -10.531 1.00 0.00 H new ATOM 0 HB3 PRO A 153 -6.787 -7.426 -9.182 1.00 0.00 H new ATOM 0 HG2 PRO A 153 -8.257 -9.930 -9.983 1.00 0.00 H new ATOM 0 HG3 PRO A 153 -7.775 -9.401 -8.383 1.00 0.00 H new ATOM 0 HD2 PRO A 153 -10.326 -9.084 -9.283 1.00 0.00 H new ATOM 0 HD3 PRO A 153 -9.600 -7.945 -8.166 1.00 0.00 H new ATOM 2378 N GLU A 154 -7.785 -6.816 -13.195 1.00 0.00 N ATOM 2379 CA GLU A 154 -7.716 -7.177 -14.606 1.00 0.00 C ATOM 2380 C GLU A 154 -6.272 -7.165 -15.100 1.00 0.00 C ATOM 2381 O GLU A 154 -5.984 -6.684 -16.195 1.00 0.00 O ATOM 2382 CB GLU A 154 -8.561 -6.215 -15.443 1.00 0.00 C ATOM 2383 CG GLU A 154 -10.044 -6.548 -15.442 1.00 0.00 C ATOM 2384 CD GLU A 154 -10.789 -5.885 -14.299 1.00 0.00 C ATOM 2385 OE1 GLU A 154 -10.356 -4.801 -13.857 1.00 0.00 O ATOM 2386 OE2 GLU A 154 -11.807 -6.452 -13.849 1.00 0.00 O ATOM 0 H GLU A 154 -7.525 -5.851 -12.993 1.00 0.00 H new ATOM 0 HA GLU A 154 -8.112 -8.187 -14.717 1.00 0.00 H new ATOM 0 HB2 GLU A 154 -8.425 -5.202 -15.065 1.00 0.00 H new ATOM 0 HB3 GLU A 154 -8.196 -6.224 -16.470 1.00 0.00 H new ATOM 0 HG2 GLU A 154 -10.484 -6.234 -16.388 1.00 0.00 H new ATOM 0 HG3 GLU A 154 -10.170 -7.629 -15.375 1.00 0.00 H new ATOM 2393 N ASN A 155 -5.369 -7.697 -14.284 1.00 0.00 N ATOM 2394 CA ASN A 155 -3.955 -7.747 -14.637 1.00 0.00 C ATOM 2395 C ASN A 155 -3.649 -8.978 -15.486 1.00 0.00 C ATOM 2396 O ASN A 155 -4.055 -10.091 -15.152 1.00 0.00 O ATOM 2397 CB ASN A 155 -3.092 -7.758 -13.373 1.00 0.00 C ATOM 2398 CG ASN A 155 -1.614 -7.614 -13.681 1.00 0.00 C ATOM 2399 OD1 ASN A 155 -1.196 -7.713 -14.834 1.00 0.00 O ATOM 2400 ND2 ASN A 155 -0.815 -7.379 -12.647 1.00 0.00 N ATOM 0 H ASN A 155 -5.591 -8.100 -13.374 1.00 0.00 H new ATOM 0 HA ASN A 155 -3.721 -6.857 -15.221 1.00 0.00 H new ATOM 0 HB2 ASN A 155 -3.404 -6.946 -12.716 1.00 0.00 H new ATOM 0 HB3 ASN A 155 -3.258 -8.689 -12.831 1.00 0.00 H new ATOM 0 HD21 ASN A 155 0.189 -7.273 -12.792 1.00 0.00 H new ATOM 0 HD22 ASN A 155 -1.205 -7.304 -11.708 1.00 0.00 H new ATOM 2407 N SER A 156 -2.930 -8.768 -16.584 1.00 0.00 N ATOM 2408 CA SER A 156 -2.573 -9.860 -17.483 1.00 0.00 C ATOM 2409 C SER A 156 -2.174 -11.104 -16.695 1.00 0.00 C ATOM 2410 O SER A 156 -2.699 -12.193 -16.926 1.00 0.00 O ATOM 2411 CB SER A 156 -1.426 -9.436 -18.403 1.00 0.00 C ATOM 2412 OG SER A 156 -1.137 -10.444 -19.356 1.00 0.00 O ATOM 0 H SER A 156 -2.583 -7.853 -16.873 1.00 0.00 H new ATOM 0 HA SER A 156 -3.447 -10.100 -18.089 1.00 0.00 H new ATOM 0 HB2 SER A 156 -1.690 -8.511 -18.916 1.00 0.00 H new ATOM 0 HB3 SER A 156 -0.537 -9.228 -17.808 1.00 0.00 H new ATOM 0 HG SER A 156 -0.402 -10.148 -19.932 1.00 0.00 H new ATOM 2418 N ASP A 157 -1.243 -10.933 -15.763 1.00 0.00 N ATOM 2419 CA ASP A 157 -0.774 -12.041 -14.939 1.00 0.00 C ATOM 2420 C ASP A 157 -1.208 -11.861 -13.488 1.00 0.00 C ATOM 2421 O ASP A 157 -2.111 -12.565 -13.038 1.00 0.00 O ATOM 2422 CB ASP A 157 0.749 -12.154 -15.018 1.00 0.00 C ATOM 2423 CG ASP A 157 1.452 -11.026 -14.289 1.00 0.00 C ATOM 2424 OD1 ASP A 157 0.909 -9.901 -14.272 1.00 0.00 O ATOM 2425 OD2 ASP A 157 2.545 -11.268 -13.736 1.00 0.00 O ATOM 0 H ASP A 157 -0.798 -10.038 -15.559 1.00 0.00 H new ATOM 0 HA ASP A 157 -1.219 -12.959 -15.321 1.00 0.00 H new ATOM 0 HB2 ASP A 157 1.062 -13.108 -14.593 1.00 0.00 H new ATOM 0 HB3 ASP A 157 1.057 -12.154 -16.064 1.00 0.00 H new TER 2430 ASP A 157 HETATM 2431 ZN ZN A 301 4.500 -14.498 3.147 1.00 0.00 ZN