USER MOD reduce.3.24.130724 H: found=0, std=0, add=1215, rem=0, adj=36 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 145 CYS SG : rot 180:sc= -1.72 USER MOD Set 1.2: A 146 THR OG1 : rot 92:sc= 0.00192 USER MOD Set 2.1: A 117 HIS : no HE2:sc= 0.2 K(o=0.23,f=-3.1) USER MOD Set 2.2: A 128 SER OG : rot -162:sc= 0.0322! USER MOD Set 3.1: A 25 MET CE :methyl -100:sc= -0.0393 (180deg=0) USER MOD Set 3.2: A 93 GLN : amide:sc= -0.759 K(o=-0.8,f=-1.7) USER MOD Set 4.1: A 66 CYS SG : rot 160:sc= -0.375 USER MOD Set 4.2: A 141 HIS : no HE2:sc= -4.45 K(o=-4.8,f=-7.8!) USER MOD Set 5.1: A 46 MET CE :methyl -104:sc= -0.115 (180deg=-0.522) USER MOD Set 5.2: A 61 THR OG1 : rot 118:sc= 0.954 USER MOD Set 6.1: A 11 ASN : amide:sc= -3.81! C(o=-3.3!,f=-5!) USER MOD Set 6.2: A 24 LYS NZ :NH3+ -129:sc= 0.536 (180deg=0) USER MOD Set 7.1: A 13 ASN : amide:sc= -4.74! C(o=-4.9!,f=-8.5!) USER MOD Set 7.2: A 21 TYR OH : rot 180:sc= -0.166 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (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 180:sc= 0 USER MOD Single : A 15 SER OG : rot -57:sc= 0.011 USER MOD Single : A 17 SER OG : rot 180:sc= 0 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 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ -165:sc= -0.0135 (180deg=-0.13) USER MOD Single : A 37 ASN : amide:sc= -0.335 K(o=-0.34,f=-3!) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 THR OG1 : rot 70:sc= 1.86 USER MOD Single : A 45 ASN : amide:sc= -3.71! C(o=-3.7!,f=-8.3!) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= -0.143 K(o=-0.14,f=-1.7!) USER MOD Single : A 58 THR OG1 : rot 180:sc= -0.159 USER MOD Single : A 59 TYR OH : rot 15:sc= -0.0393 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) USER MOD Single : A 72 THR OG1 : rot -170:sc=-0.00889 USER MOD Single : A 73 GLN : amide:sc=-0.000841 X(o=-0.00084,f=-0.00084) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 TYR OH : rot -5:sc= -0.291 USER MOD Single : A 84 ASN : amide:sc= -0.853 X(o=-0.85,f=-0.85) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 HIS : no HD1:sc= 0.447 K(o=0.45,f=-4!) USER MOD Single : A 90 ASN : amide:sc= -0.255 X(o=-0.25,f=-0.25) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 MET CE :methyl 148:sc= -2.99 (180deg=-5.15!) USER MOD Single : A 101 LYS NZ :NH3+ -116:sc= 0.00327 (180deg=-0.877) USER MOD Single : A 102 LYS NZ :NH3+ 178:sc= 1.01 (180deg=0.943) USER MOD Single : A 111 ASN : amide:sc= -2.97 K(o=-3,f=-4.3!) USER MOD Single : A 114 THR OG1 : rot -95:sc= 0.253 USER MOD Single : A 119 ASN : amide:sc= 0 K(o=0,f=-1.2) 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= -5.46! K(o=-5.5!,f=-1.8) USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 ASN : amide:sc= -0.0857 K(o=-0.086,f=-6.9!) USER MOD Single : A 130 LYS NZ :NH3+ -164:sc=-0.00856 (180deg=-0.38) 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 X(o=0,f=0) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 ASN : amide:sc= -1.24 K(o=-1.2,f=0.093) USER MOD Single : A 155 ASN : amide:sc= -0.548 K(o=-0.55,f=-4.8!) USER MOD Single : A 156 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 30.074 16.978 -2.699 1.00 0.00 N ATOM 2 CA GLY A 1 29.579 16.617 -4.014 1.00 0.00 C ATOM 3 C GLY A 1 28.087 16.844 -4.156 1.00 0.00 C ATOM 4 O GLY A 1 27.647 17.954 -4.452 1.00 0.00 O ATOM 0 H1 GLY A 1 31.098 16.804 -2.654 1.00 0.00 H new ATOM 0 H2 GLY A 1 29.886 17.985 -2.522 1.00 0.00 H new ATOM 0 H3 GLY A 1 29.593 16.404 -1.977 1.00 0.00 H new ATOM 0 HA2 GLY A 1 30.105 17.200 -4.769 1.00 0.00 H new ATOM 0 HA3 GLY A 1 29.804 15.568 -4.208 1.00 0.00 H new ATOM 8 N SER A 2 27.307 15.789 -3.944 1.00 0.00 N ATOM 9 CA SER A 2 25.856 15.877 -4.055 1.00 0.00 C ATOM 10 C SER A 2 25.308 16.980 -3.154 1.00 0.00 C ATOM 11 O SER A 2 25.393 16.895 -1.929 1.00 0.00 O ATOM 12 CB SER A 2 25.213 14.538 -3.689 1.00 0.00 C ATOM 13 OG SER A 2 23.998 14.346 -4.392 1.00 0.00 O ATOM 0 H SER A 2 27.656 14.863 -3.694 1.00 0.00 H new ATOM 0 HA SER A 2 25.610 16.120 -5.089 1.00 0.00 H new ATOM 0 HB2 SER A 2 25.902 13.725 -3.919 1.00 0.00 H new ATOM 0 HB3 SER A 2 25.025 14.503 -2.616 1.00 0.00 H new ATOM 0 HG SER A 2 23.608 13.482 -4.142 1.00 0.00 H new ATOM 19 N SER A 3 24.747 18.015 -3.771 1.00 0.00 N ATOM 20 CA SER A 3 24.188 19.137 -3.027 1.00 0.00 C ATOM 21 C SER A 3 23.065 18.673 -2.105 1.00 0.00 C ATOM 22 O SER A 3 22.989 19.080 -0.946 1.00 0.00 O ATOM 23 CB SER A 3 23.664 20.205 -3.990 1.00 0.00 C ATOM 24 OG SER A 3 22.758 19.646 -4.926 1.00 0.00 O ATOM 0 H SER A 3 24.668 18.100 -4.784 1.00 0.00 H new ATOM 0 HA SER A 3 24.982 19.567 -2.416 1.00 0.00 H new ATOM 0 HB2 SER A 3 23.168 20.996 -3.427 1.00 0.00 H new ATOM 0 HB3 SER A 3 24.499 20.665 -4.518 1.00 0.00 H new ATOM 0 HG SER A 3 22.436 20.348 -5.529 1.00 0.00 H new ATOM 30 N GLY A 4 22.193 17.816 -2.629 1.00 0.00 N ATOM 31 CA GLY A 4 21.085 17.309 -1.840 1.00 0.00 C ATOM 32 C GLY A 4 20.851 15.827 -2.055 1.00 0.00 C ATOM 33 O GLY A 4 21.049 15.022 -1.144 1.00 0.00 O ATOM 0 H GLY A 4 22.234 17.464 -3.585 1.00 0.00 H new ATOM 0 HA2 GLY A 4 21.281 17.493 -0.784 1.00 0.00 H new ATOM 0 HA3 GLY A 4 20.179 17.858 -2.097 1.00 0.00 H new ATOM 37 N SER A 5 20.426 15.466 -3.261 1.00 0.00 N ATOM 38 CA SER A 5 20.159 14.070 -3.591 1.00 0.00 C ATOM 39 C SER A 5 20.201 13.851 -5.100 1.00 0.00 C ATOM 40 O SER A 5 19.778 14.709 -5.875 1.00 0.00 O ATOM 41 CB SER A 5 18.796 13.646 -3.040 1.00 0.00 C ATOM 42 OG SER A 5 18.760 12.253 -2.785 1.00 0.00 O ATOM 0 H SER A 5 20.259 16.120 -4.026 1.00 0.00 H new ATOM 0 HA SER A 5 20.935 13.458 -3.131 1.00 0.00 H new ATOM 0 HB2 SER A 5 18.586 14.193 -2.121 1.00 0.00 H new ATOM 0 HB3 SER A 5 18.014 13.909 -3.753 1.00 0.00 H new ATOM 0 HG SER A 5 17.879 12.008 -2.432 1.00 0.00 H new ATOM 48 N SER A 6 20.714 12.696 -5.509 1.00 0.00 N ATOM 49 CA SER A 6 20.816 12.364 -6.926 1.00 0.00 C ATOM 50 C SER A 6 19.659 11.468 -7.358 1.00 0.00 C ATOM 51 O SER A 6 19.326 10.496 -6.683 1.00 0.00 O ATOM 52 CB SER A 6 22.149 11.669 -7.214 1.00 0.00 C ATOM 53 OG SER A 6 22.170 11.131 -8.524 1.00 0.00 O ATOM 0 H SER A 6 21.066 11.974 -4.880 1.00 0.00 H new ATOM 0 HA SER A 6 20.767 13.292 -7.496 1.00 0.00 H new ATOM 0 HB2 SER A 6 22.967 12.380 -7.096 1.00 0.00 H new ATOM 0 HB3 SER A 6 22.312 10.873 -6.488 1.00 0.00 H new ATOM 0 HG SER A 6 23.032 10.694 -8.684 1.00 0.00 H new ATOM 59 N GLY A 7 19.050 11.805 -8.491 1.00 0.00 N ATOM 60 CA GLY A 7 17.936 11.023 -8.995 1.00 0.00 C ATOM 61 C GLY A 7 18.183 9.531 -8.894 1.00 0.00 C ATOM 62 O GLY A 7 18.957 8.970 -9.669 1.00 0.00 O ATOM 0 H GLY A 7 19.308 12.605 -9.069 1.00 0.00 H new ATOM 0 HA2 GLY A 7 17.035 11.278 -8.437 1.00 0.00 H new ATOM 0 HA3 GLY A 7 17.751 11.288 -10.036 1.00 0.00 H new ATOM 66 N MET A 8 17.525 8.888 -7.936 1.00 0.00 N ATOM 67 CA MET A 8 17.678 7.451 -7.736 1.00 0.00 C ATOM 68 C MET A 8 16.388 6.836 -7.201 1.00 0.00 C ATOM 69 O MET A 8 15.399 7.536 -6.985 1.00 0.00 O ATOM 70 CB MET A 8 18.830 7.168 -6.771 1.00 0.00 C ATOM 71 CG MET A 8 18.604 7.725 -5.375 1.00 0.00 C ATOM 72 SD MET A 8 20.140 7.932 -4.452 1.00 0.00 S ATOM 73 CE MET A 8 19.567 7.665 -2.776 1.00 0.00 C ATOM 0 H MET A 8 16.881 9.338 -7.286 1.00 0.00 H new ATOM 0 HA MET A 8 17.903 6.997 -8.701 1.00 0.00 H new ATOM 0 HB2 MET A 8 18.980 6.091 -6.703 1.00 0.00 H new ATOM 0 HB3 MET A 8 19.747 7.593 -7.179 1.00 0.00 H new ATOM 0 HG2 MET A 8 18.097 8.687 -5.450 1.00 0.00 H new ATOM 0 HG3 MET A 8 17.941 7.057 -4.825 1.00 0.00 H new ATOM 0 HE1 MET A 8 20.405 7.760 -2.085 1.00 0.00 H new ATOM 0 HE2 MET A 8 18.807 8.406 -2.529 1.00 0.00 H new ATOM 0 HE3 MET A 8 19.140 6.666 -2.692 1.00 0.00 H new ATOM 83 N SER A 9 16.407 5.524 -6.989 1.00 0.00 N ATOM 84 CA SER A 9 15.238 4.815 -6.483 1.00 0.00 C ATOM 85 C SER A 9 15.428 4.430 -5.019 1.00 0.00 C ATOM 86 O SER A 9 16.549 4.199 -4.566 1.00 0.00 O ATOM 87 CB SER A 9 14.972 3.563 -7.321 1.00 0.00 C ATOM 88 OG SER A 9 16.109 2.719 -7.352 1.00 0.00 O ATOM 0 H SER A 9 17.219 4.931 -7.160 1.00 0.00 H new ATOM 0 HA SER A 9 14.379 5.482 -6.557 1.00 0.00 H new ATOM 0 HB2 SER A 9 14.123 3.019 -6.908 1.00 0.00 H new ATOM 0 HB3 SER A 9 14.702 3.852 -8.337 1.00 0.00 H new ATOM 0 HG SER A 9 15.913 1.925 -7.892 1.00 0.00 H new ATOM 94 N VAL A 10 14.323 4.362 -4.283 1.00 0.00 N ATOM 95 CA VAL A 10 14.366 4.004 -2.870 1.00 0.00 C ATOM 96 C VAL A 10 13.844 2.590 -2.646 1.00 0.00 C ATOM 97 O VAL A 10 13.154 2.029 -3.497 1.00 0.00 O ATOM 98 CB VAL A 10 13.541 4.986 -2.017 1.00 0.00 C ATOM 99 CG1 VAL A 10 14.050 6.408 -2.197 1.00 0.00 C ATOM 100 CG2 VAL A 10 12.065 4.890 -2.373 1.00 0.00 C ATOM 0 H VAL A 10 13.387 4.550 -4.642 1.00 0.00 H new ATOM 0 HA VAL A 10 15.410 4.056 -2.562 1.00 0.00 H new ATOM 0 HB VAL A 10 13.657 4.715 -0.968 1.00 0.00 H new ATOM 0 HG11 VAL A 10 13.455 7.087 -1.587 1.00 0.00 H new ATOM 0 HG12 VAL A 10 15.094 6.463 -1.888 1.00 0.00 H new ATOM 0 HG13 VAL A 10 13.966 6.694 -3.245 1.00 0.00 H new ATOM 0 HG21 VAL A 10 11.497 5.590 -1.761 1.00 0.00 H new ATOM 0 HG22 VAL A 10 11.928 5.135 -3.426 1.00 0.00 H new ATOM 0 HG23 VAL A 10 11.711 3.876 -2.187 1.00 0.00 H new ATOM 110 N ASN A 11 14.177 2.017 -1.493 1.00 0.00 N ATOM 111 CA ASN A 11 13.741 0.667 -1.156 1.00 0.00 C ATOM 112 C ASN A 11 12.224 0.545 -1.254 1.00 0.00 C ATOM 113 O ASN A 11 11.490 1.449 -0.855 1.00 0.00 O ATOM 114 CB ASN A 11 14.204 0.297 0.254 1.00 0.00 C ATOM 115 CG ASN A 11 15.711 0.151 0.349 1.00 0.00 C ATOM 116 OD1 ASN A 11 16.454 0.775 -0.408 1.00 0.00 O ATOM 117 ND2 ASN A 11 16.167 -0.677 1.282 1.00 0.00 N ATOM 0 H ASN A 11 14.747 2.467 -0.777 1.00 0.00 H new ATOM 0 HA ASN A 11 14.190 -0.022 -1.871 1.00 0.00 H new ATOM 0 HB2 ASN A 11 13.871 1.062 0.955 1.00 0.00 H new ATOM 0 HB3 ASN A 11 13.732 -0.638 0.555 1.00 0.00 H new ATOM 0 HD21 ASN A 11 17.171 -0.817 1.393 1.00 0.00 H new ATOM 0 HD22 ASN A 11 15.513 -1.173 1.887 1.00 0.00 H new ATOM 124 N VAL A 12 11.759 -0.581 -1.788 1.00 0.00 N ATOM 125 CA VAL A 12 10.329 -0.823 -1.937 1.00 0.00 C ATOM 126 C VAL A 12 9.552 -0.275 -0.746 1.00 0.00 C ATOM 127 O VAL A 12 8.501 0.344 -0.909 1.00 0.00 O ATOM 128 CB VAL A 12 10.027 -2.326 -2.084 1.00 0.00 C ATOM 129 CG1 VAL A 12 8.541 -2.552 -2.318 1.00 0.00 C ATOM 130 CG2 VAL A 12 10.850 -2.926 -3.215 1.00 0.00 C ATOM 0 H VAL A 12 12.352 -1.339 -2.124 1.00 0.00 H new ATOM 0 HA VAL A 12 10.013 -0.305 -2.843 1.00 0.00 H new ATOM 0 HB VAL A 12 10.305 -2.827 -1.157 1.00 0.00 H new ATOM 0 HG11 VAL A 12 8.347 -3.620 -2.419 1.00 0.00 H new ATOM 0 HG12 VAL A 12 7.976 -2.159 -1.473 1.00 0.00 H new ATOM 0 HG13 VAL A 12 8.234 -2.039 -3.230 1.00 0.00 H new ATOM 0 HG21 VAL A 12 10.624 -3.989 -3.305 1.00 0.00 H new ATOM 0 HG22 VAL A 12 10.605 -2.422 -4.150 1.00 0.00 H new ATOM 0 HG23 VAL A 12 11.911 -2.797 -3.001 1.00 0.00 H new ATOM 140 N ASN A 13 10.076 -0.506 0.454 1.00 0.00 N ATOM 141 CA ASN A 13 9.431 -0.034 1.674 1.00 0.00 C ATOM 142 C ASN A 13 10.302 0.997 2.386 1.00 0.00 C ATOM 143 O ASN A 13 11.530 0.918 2.350 1.00 0.00 O ATOM 144 CB ASN A 13 9.143 -1.210 2.610 1.00 0.00 C ATOM 145 CG ASN A 13 9.064 -2.532 1.871 1.00 0.00 C ATOM 146 OD1 ASN A 13 8.512 -2.610 0.774 1.00 0.00 O ATOM 147 ND2 ASN A 13 9.617 -3.579 2.472 1.00 0.00 N ATOM 0 H ASN A 13 10.945 -1.017 0.607 1.00 0.00 H new ATOM 0 HA ASN A 13 8.490 0.441 1.398 1.00 0.00 H new ATOM 0 HB2 ASN A 13 9.924 -1.267 3.368 1.00 0.00 H new ATOM 0 HB3 ASN A 13 8.203 -1.033 3.133 1.00 0.00 H new ATOM 0 HD21 ASN A 13 9.595 -4.495 2.024 1.00 0.00 H new ATOM 0 HD22 ASN A 13 10.064 -3.467 3.382 1.00 0.00 H new ATOM 154 N ARG A 14 9.656 1.962 3.033 1.00 0.00 N ATOM 155 CA ARG A 14 10.371 3.009 3.753 1.00 0.00 C ATOM 156 C ARG A 14 10.796 2.525 5.136 1.00 0.00 C ATOM 157 O ARG A 14 11.688 3.101 5.760 1.00 0.00 O ATOM 158 CB ARG A 14 9.495 4.256 3.884 1.00 0.00 C ATOM 159 CG ARG A 14 9.111 4.874 2.550 1.00 0.00 C ATOM 160 CD ARG A 14 10.239 5.723 1.984 1.00 0.00 C ATOM 161 NE ARG A 14 11.413 4.922 1.652 1.00 0.00 N ATOM 162 CZ ARG A 14 12.650 5.407 1.623 1.00 0.00 C ATOM 163 NH1 ARG A 14 12.872 6.683 1.906 1.00 0.00 N ATOM 164 NH2 ARG A 14 13.667 4.614 1.311 1.00 0.00 N ATOM 0 H ARG A 14 8.640 2.040 3.073 1.00 0.00 H new ATOM 0 HA ARG A 14 11.266 3.260 3.184 1.00 0.00 H new ATOM 0 HB2 ARG A 14 8.587 3.996 4.429 1.00 0.00 H new ATOM 0 HB3 ARG A 14 10.023 5.000 4.481 1.00 0.00 H new ATOM 0 HG2 ARG A 14 8.857 4.085 1.842 1.00 0.00 H new ATOM 0 HG3 ARG A 14 8.219 5.488 2.676 1.00 0.00 H new ATOM 0 HD2 ARG A 14 9.890 6.241 1.091 1.00 0.00 H new ATOM 0 HD3 ARG A 14 10.516 6.488 2.709 1.00 0.00 H new ATOM 0 HE ARG A 14 11.277 3.936 1.430 1.00 0.00 H new ATOM 0 HH11 ARG A 14 12.092 7.295 2.147 1.00 0.00 H new ATOM 0 HH12 ARG A 14 13.822 7.053 1.883 1.00 0.00 H new ATOM 0 HH21 ARG A 14 13.500 3.632 1.093 1.00 0.00 H new ATOM 0 HH22 ARG A 14 14.616 4.987 1.289 1.00 0.00 H new ATOM 178 N SER A 15 10.152 1.463 5.609 1.00 0.00 N ATOM 179 CA SER A 15 10.460 0.903 6.920 1.00 0.00 C ATOM 180 C SER A 15 11.062 -0.492 6.787 1.00 0.00 C ATOM 181 O SER A 15 10.656 -1.425 7.481 1.00 0.00 O ATOM 182 CB SER A 15 9.198 0.846 7.783 1.00 0.00 C ATOM 183 OG SER A 15 9.524 0.733 9.157 1.00 0.00 O ATOM 0 H SER A 15 9.414 0.973 5.104 1.00 0.00 H new ATOM 0 HA SER A 15 11.192 1.551 7.402 1.00 0.00 H new ATOM 0 HB2 SER A 15 8.602 1.744 7.620 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.585 -0.003 7.481 1.00 0.00 H new ATOM 0 HG SER A 15 10.078 -0.063 9.297 1.00 0.00 H new ATOM 189 N VAL A 16 12.034 -0.627 5.891 1.00 0.00 N ATOM 190 CA VAL A 16 12.695 -1.908 5.667 1.00 0.00 C ATOM 191 C VAL A 16 14.038 -1.966 6.385 1.00 0.00 C ATOM 192 O VAL A 16 14.835 -1.030 6.311 1.00 0.00 O ATOM 193 CB VAL A 16 12.916 -2.170 4.165 1.00 0.00 C ATOM 194 CG1 VAL A 16 13.805 -1.094 3.560 1.00 0.00 C ATOM 195 CG2 VAL A 16 13.513 -3.552 3.948 1.00 0.00 C ATOM 0 H VAL A 16 12.382 0.135 5.308 1.00 0.00 H new ATOM 0 HA VAL A 16 12.038 -2.679 6.070 1.00 0.00 H new ATOM 0 HB VAL A 16 11.950 -2.134 3.661 1.00 0.00 H new ATOM 0 HG11 VAL A 16 13.950 -1.296 2.499 1.00 0.00 H new ATOM 0 HG12 VAL A 16 13.332 -0.120 3.683 1.00 0.00 H new ATOM 0 HG13 VAL A 16 14.771 -1.094 4.064 1.00 0.00 H new ATOM 0 HG21 VAL A 16 13.662 -3.720 2.882 1.00 0.00 H new ATOM 0 HG22 VAL A 16 14.471 -3.620 4.464 1.00 0.00 H new ATOM 0 HG23 VAL A 16 12.834 -4.308 4.343 1.00 0.00 H new ATOM 205 N SER A 17 14.284 -3.073 7.079 1.00 0.00 N ATOM 206 CA SER A 17 15.531 -3.253 7.814 1.00 0.00 C ATOM 207 C SER A 17 16.693 -3.508 6.858 1.00 0.00 C ATOM 208 O SER A 17 17.776 -2.944 7.015 1.00 0.00 O ATOM 209 CB SER A 17 15.403 -4.414 8.801 1.00 0.00 C ATOM 210 OG SER A 17 14.986 -5.598 8.144 1.00 0.00 O ATOM 0 H SER A 17 13.637 -3.858 7.148 1.00 0.00 H new ATOM 0 HA SER A 17 15.733 -2.336 8.368 1.00 0.00 H new ATOM 0 HB2 SER A 17 16.361 -4.585 9.292 1.00 0.00 H new ATOM 0 HB3 SER A 17 14.687 -4.155 9.581 1.00 0.00 H new ATOM 0 HG SER A 17 14.913 -6.326 8.796 1.00 0.00 H new ATOM 216 N ASP A 18 16.459 -4.363 5.868 1.00 0.00 N ATOM 217 CA ASP A 18 17.484 -4.694 4.886 1.00 0.00 C ATOM 218 C ASP A 18 17.747 -3.513 3.956 1.00 0.00 C ATOM 219 O ASP A 18 17.045 -3.325 2.963 1.00 0.00 O ATOM 220 CB ASP A 18 17.064 -5.917 4.070 1.00 0.00 C ATOM 221 CG ASP A 18 18.250 -6.734 3.598 1.00 0.00 C ATOM 222 OD1 ASP A 18 19.227 -6.861 4.366 1.00 0.00 O ATOM 223 OD2 ASP A 18 18.202 -7.247 2.461 1.00 0.00 O ATOM 0 H ASP A 18 15.568 -4.839 5.725 1.00 0.00 H new ATOM 0 HA ASP A 18 18.405 -4.924 5.422 1.00 0.00 H new ATOM 0 HB2 ASP A 18 16.411 -6.546 4.674 1.00 0.00 H new ATOM 0 HB3 ASP A 18 16.484 -5.592 3.206 1.00 0.00 H new ATOM 228 N GLN A 19 18.762 -2.721 4.287 1.00 0.00 N ATOM 229 CA GLN A 19 19.116 -1.557 3.482 1.00 0.00 C ATOM 230 C GLN A 19 19.542 -1.976 2.079 1.00 0.00 C ATOM 231 O GLN A 19 19.557 -1.162 1.155 1.00 0.00 O ATOM 232 CB GLN A 19 20.240 -0.768 4.155 1.00 0.00 C ATOM 233 CG GLN A 19 21.509 -1.577 4.368 1.00 0.00 C ATOM 234 CD GLN A 19 22.709 -0.707 4.687 1.00 0.00 C ATOM 235 OE1 GLN A 19 23.456 -0.308 3.794 1.00 0.00 O ATOM 236 NE2 GLN A 19 22.900 -0.409 5.967 1.00 0.00 N ATOM 0 H GLN A 19 19.353 -2.864 5.106 1.00 0.00 H new ATOM 0 HA GLN A 19 18.235 -0.921 3.400 1.00 0.00 H new ATOM 0 HB2 GLN A 19 20.474 0.106 3.547 1.00 0.00 H new ATOM 0 HB3 GLN A 19 19.888 -0.400 5.119 1.00 0.00 H new ATOM 0 HG2 GLN A 19 21.352 -2.285 5.182 1.00 0.00 H new ATOM 0 HG3 GLN A 19 21.717 -2.162 3.472 1.00 0.00 H new ATOM 0 HE21 GLN A 19 22.255 -0.762 6.674 1.00 0.00 H new ATOM 0 HE22 GLN A 19 23.691 0.172 6.243 1.00 0.00 H new ATOM 245 N PHE A 20 19.889 -3.249 1.926 1.00 0.00 N ATOM 246 CA PHE A 20 20.317 -3.776 0.635 1.00 0.00 C ATOM 247 C PHE A 20 19.135 -4.357 -0.134 1.00 0.00 C ATOM 248 O PHE A 20 19.292 -5.288 -0.925 1.00 0.00 O ATOM 249 CB PHE A 20 21.391 -4.848 0.829 1.00 0.00 C ATOM 250 CG PHE A 20 22.306 -4.577 1.989 1.00 0.00 C ATOM 251 CD1 PHE A 20 21.907 -4.866 3.284 1.00 0.00 C ATOM 252 CD2 PHE A 20 23.565 -4.035 1.784 1.00 0.00 C ATOM 253 CE1 PHE A 20 22.747 -4.617 4.353 1.00 0.00 C ATOM 254 CE2 PHE A 20 24.409 -3.785 2.850 1.00 0.00 C ATOM 255 CZ PHE A 20 24.000 -4.077 4.136 1.00 0.00 C ATOM 0 H PHE A 20 19.882 -3.936 2.680 1.00 0.00 H new ATOM 0 HA PHE A 20 20.735 -2.953 0.055 1.00 0.00 H new ATOM 0 HB2 PHE A 20 20.907 -5.813 0.976 1.00 0.00 H new ATOM 0 HB3 PHE A 20 21.985 -4.925 -0.082 1.00 0.00 H new ATOM 0 HD1 PHE A 20 20.930 -5.290 3.460 1.00 0.00 H new ATOM 0 HD2 PHE A 20 23.890 -3.805 0.780 1.00 0.00 H new ATOM 0 HE1 PHE A 20 22.424 -4.845 5.358 1.00 0.00 H new ATOM 0 HE2 PHE A 20 25.387 -3.362 2.677 1.00 0.00 H new ATOM 0 HZ PHE A 20 24.658 -3.884 4.970 1.00 0.00 H new ATOM 265 N TYR A 21 17.951 -3.803 0.104 1.00 0.00 N ATOM 266 CA TYR A 21 16.741 -4.268 -0.564 1.00 0.00 C ATOM 267 C TYR A 21 17.009 -4.558 -2.038 1.00 0.00 C ATOM 268 O TYR A 21 17.344 -3.658 -2.808 1.00 0.00 O ATOM 269 CB TYR A 21 15.629 -3.226 -0.432 1.00 0.00 C ATOM 270 CG TYR A 21 14.238 -3.809 -0.542 1.00 0.00 C ATOM 271 CD1 TYR A 21 13.950 -4.800 -1.472 1.00 0.00 C ATOM 272 CD2 TYR A 21 13.212 -3.369 0.285 1.00 0.00 C ATOM 273 CE1 TYR A 21 12.680 -5.334 -1.577 1.00 0.00 C ATOM 274 CE2 TYR A 21 11.939 -3.899 0.189 1.00 0.00 C ATOM 275 CZ TYR A 21 11.679 -4.881 -0.744 1.00 0.00 C ATOM 276 OH TYR A 21 10.413 -5.411 -0.844 1.00 0.00 O ATOM 0 H TYR A 21 17.803 -3.031 0.755 1.00 0.00 H new ATOM 0 HA TYR A 21 16.423 -5.193 -0.083 1.00 0.00 H new ATOM 0 HB2 TYR A 21 15.728 -2.721 0.529 1.00 0.00 H new ATOM 0 HB3 TYR A 21 15.759 -2.468 -1.205 1.00 0.00 H new ATOM 0 HD1 TYR A 21 14.732 -5.159 -2.124 1.00 0.00 H new ATOM 0 HD2 TYR A 21 13.413 -2.599 1.016 1.00 0.00 H new ATOM 0 HE1 TYR A 21 12.473 -6.102 -2.307 1.00 0.00 H new ATOM 0 HE2 TYR A 21 11.153 -3.546 0.840 1.00 0.00 H new ATOM 0 HH TYR A 21 9.827 -4.984 -0.185 1.00 0.00 H new ATOM 286 N ARG A 22 16.859 -5.821 -2.422 1.00 0.00 N ATOM 287 CA ARG A 22 17.084 -6.231 -3.802 1.00 0.00 C ATOM 288 C ARG A 22 16.171 -5.464 -4.754 1.00 0.00 C ATOM 289 O ARG A 22 16.640 -4.795 -5.676 1.00 0.00 O ATOM 290 CB ARG A 22 16.849 -7.735 -3.955 1.00 0.00 C ATOM 291 CG ARG A 22 17.427 -8.316 -5.235 1.00 0.00 C ATOM 292 CD ARG A 22 16.464 -8.157 -6.402 1.00 0.00 C ATOM 293 NE ARG A 22 16.706 -6.925 -7.148 1.00 0.00 N ATOM 294 CZ ARG A 22 17.624 -6.812 -8.102 1.00 0.00 C ATOM 295 NH1 ARG A 22 18.381 -7.851 -8.424 1.00 0.00 N ATOM 296 NH2 ARG A 22 17.784 -5.657 -8.736 1.00 0.00 N ATOM 0 H ARG A 22 16.583 -6.578 -1.797 1.00 0.00 H new ATOM 0 HA ARG A 22 18.119 -6.004 -4.057 1.00 0.00 H new ATOM 0 HB2 ARG A 22 17.288 -8.251 -3.101 1.00 0.00 H new ATOM 0 HB3 ARG A 22 15.777 -7.931 -3.929 1.00 0.00 H new ATOM 0 HG2 ARG A 22 18.369 -7.820 -5.469 1.00 0.00 H new ATOM 0 HG3 ARG A 22 17.651 -9.372 -5.088 1.00 0.00 H new ATOM 0 HD2 ARG A 22 16.562 -9.011 -7.072 1.00 0.00 H new ATOM 0 HD3 ARG A 22 15.440 -8.160 -6.030 1.00 0.00 H new ATOM 0 HE ARG A 22 16.139 -6.107 -6.925 1.00 0.00 H new ATOM 0 HH11 ARG A 22 18.260 -8.740 -7.939 1.00 0.00 H new ATOM 0 HH12 ARG A 22 19.085 -7.762 -9.157 1.00 0.00 H new ATOM 0 HH21 ARG A 22 17.202 -4.856 -8.491 1.00 0.00 H new ATOM 0 HH22 ARG A 22 18.489 -5.571 -9.468 1.00 0.00 H new ATOM 310 N TYR A 23 14.867 -5.566 -4.525 1.00 0.00 N ATOM 311 CA TYR A 23 13.888 -4.884 -5.363 1.00 0.00 C ATOM 312 C TYR A 23 13.830 -3.396 -5.033 1.00 0.00 C ATOM 313 O TYR A 23 13.746 -3.009 -3.867 1.00 0.00 O ATOM 314 CB TYR A 23 12.505 -5.513 -5.183 1.00 0.00 C ATOM 315 CG TYR A 23 12.506 -7.021 -5.293 1.00 0.00 C ATOM 316 CD1 TYR A 23 13.126 -7.659 -6.360 1.00 0.00 C ATOM 317 CD2 TYR A 23 11.888 -7.807 -4.328 1.00 0.00 C ATOM 318 CE1 TYR A 23 13.128 -9.036 -6.465 1.00 0.00 C ATOM 319 CE2 TYR A 23 11.887 -9.186 -4.424 1.00 0.00 C ATOM 320 CZ TYR A 23 12.508 -9.795 -5.494 1.00 0.00 C ATOM 321 OH TYR A 23 12.510 -11.168 -5.594 1.00 0.00 O ATOM 0 H TYR A 23 14.463 -6.115 -3.766 1.00 0.00 H new ATOM 0 HA TYR A 23 14.197 -4.995 -6.402 1.00 0.00 H new ATOM 0 HB2 TYR A 23 12.110 -5.229 -4.208 1.00 0.00 H new ATOM 0 HB3 TYR A 23 11.828 -5.103 -5.933 1.00 0.00 H new ATOM 0 HD1 TYR A 23 13.615 -7.068 -7.120 1.00 0.00 H new ATOM 0 HD2 TYR A 23 11.400 -7.333 -3.489 1.00 0.00 H new ATOM 0 HE1 TYR A 23 13.612 -9.516 -7.303 1.00 0.00 H new ATOM 0 HE2 TYR A 23 11.403 -9.783 -3.665 1.00 0.00 H new ATOM 0 HH TYR A 23 12.032 -11.552 -4.829 1.00 0.00 H new ATOM 331 N LYS A 24 13.874 -2.565 -6.068 1.00 0.00 N ATOM 332 CA LYS A 24 13.825 -1.118 -5.891 1.00 0.00 C ATOM 333 C LYS A 24 12.674 -0.512 -6.689 1.00 0.00 C ATOM 334 O LYS A 24 12.248 -1.067 -7.701 1.00 0.00 O ATOM 335 CB LYS A 24 15.149 -0.485 -6.324 1.00 0.00 C ATOM 336 CG LYS A 24 16.362 -1.077 -5.628 1.00 0.00 C ATOM 337 CD LYS A 24 16.615 -0.410 -4.286 1.00 0.00 C ATOM 338 CE LYS A 24 18.090 -0.442 -3.917 1.00 0.00 C ATOM 339 NZ LYS A 24 18.306 -0.165 -2.470 1.00 0.00 N ATOM 0 H LYS A 24 13.944 -2.869 -7.039 1.00 0.00 H new ATOM 0 HA LYS A 24 13.660 -0.911 -4.834 1.00 0.00 H new ATOM 0 HB2 LYS A 24 15.264 -0.605 -7.401 1.00 0.00 H new ATOM 0 HB3 LYS A 24 15.113 0.586 -6.124 1.00 0.00 H new ATOM 0 HG2 LYS A 24 16.213 -2.147 -5.481 1.00 0.00 H new ATOM 0 HG3 LYS A 24 17.240 -0.962 -6.264 1.00 0.00 H new ATOM 0 HD2 LYS A 24 16.270 0.623 -4.321 1.00 0.00 H new ATOM 0 HD3 LYS A 24 16.034 -0.914 -3.513 1.00 0.00 H new ATOM 0 HE2 LYS A 24 18.505 -1.419 -4.166 1.00 0.00 H new ATOM 0 HE3 LYS A 24 18.629 0.295 -4.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 19.019 0.584 -2.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 17.412 0.144 -2.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 18.639 -1.029 -1.997 1.00 0.00 H new ATOM 353 N MET A 25 12.178 0.631 -6.227 1.00 0.00 N ATOM 354 CA MET A 25 11.079 1.314 -6.899 1.00 0.00 C ATOM 355 C MET A 25 11.397 2.793 -7.097 1.00 0.00 C ATOM 356 O MET A 25 12.002 3.441 -6.243 1.00 0.00 O ATOM 357 CB MET A 25 9.787 1.162 -6.094 1.00 0.00 C ATOM 358 CG MET A 25 9.895 1.675 -4.668 1.00 0.00 C ATOM 359 SD MET A 25 9.453 3.417 -4.522 1.00 0.00 S ATOM 360 CE MET A 25 8.551 3.409 -2.974 1.00 0.00 C ATOM 0 H MET A 25 12.520 1.104 -5.390 1.00 0.00 H new ATOM 0 HA MET A 25 10.945 0.855 -7.879 1.00 0.00 H new ATOM 0 HB2 MET A 25 8.986 1.697 -6.604 1.00 0.00 H new ATOM 0 HB3 MET A 25 9.504 0.110 -6.072 1.00 0.00 H new ATOM 0 HG2 MET A 25 9.245 1.084 -4.023 1.00 0.00 H new ATOM 0 HG3 MET A 25 10.915 1.532 -4.310 1.00 0.00 H new ATOM 0 HE1 MET A 25 7.480 3.407 -3.177 1.00 0.00 H new ATOM 0 HE2 MET A 25 8.814 2.518 -2.404 1.00 0.00 H new ATOM 0 HE3 MET A 25 8.809 4.298 -2.398 1.00 0.00 H new ATOM 370 N PRO A 26 10.981 3.340 -8.249 1.00 0.00 N ATOM 371 CA PRO A 26 11.210 4.748 -8.585 1.00 0.00 C ATOM 372 C PRO A 26 10.380 5.693 -7.722 1.00 0.00 C ATOM 373 O PRO A 26 9.155 5.731 -7.830 1.00 0.00 O ATOM 374 CB PRO A 26 10.775 4.839 -10.049 1.00 0.00 C ATOM 375 CG PRO A 26 9.794 3.731 -10.222 1.00 0.00 C ATOM 376 CD PRO A 26 10.253 2.626 -9.311 1.00 0.00 C ATOM 0 HA PRO A 26 12.245 5.044 -8.415 1.00 0.00 H new ATOM 0 HB2 PRO A 26 10.323 5.806 -10.268 1.00 0.00 H new ATOM 0 HB3 PRO A 26 11.624 4.724 -10.722 1.00 0.00 H new ATOM 0 HG2 PRO A 26 8.787 4.057 -9.963 1.00 0.00 H new ATOM 0 HG3 PRO A 26 9.763 3.395 -11.258 1.00 0.00 H new ATOM 0 HD2 PRO A 26 9.412 2.060 -8.911 1.00 0.00 H new ATOM 0 HD3 PRO A 26 10.896 1.917 -9.832 1.00 0.00 H new ATOM 384 N ARG A 27 11.056 6.453 -6.867 1.00 0.00 N ATOM 385 CA ARG A 27 10.380 7.397 -5.985 1.00 0.00 C ATOM 386 C ARG A 27 9.224 8.084 -6.708 1.00 0.00 C ATOM 387 O ARG A 27 9.413 8.703 -7.755 1.00 0.00 O ATOM 388 CB ARG A 27 11.368 8.446 -5.471 1.00 0.00 C ATOM 389 CG ARG A 27 12.711 7.865 -5.057 1.00 0.00 C ATOM 390 CD ARG A 27 13.558 8.892 -4.322 1.00 0.00 C ATOM 391 NE ARG A 27 13.528 10.197 -4.977 1.00 0.00 N ATOM 392 CZ ARG A 27 13.820 11.336 -4.359 1.00 0.00 C ATOM 393 NH1 ARG A 27 14.164 11.330 -3.079 1.00 0.00 N ATOM 394 NH2 ARG A 27 13.770 12.484 -5.023 1.00 0.00 N ATOM 0 H ARG A 27 12.071 6.434 -6.766 1.00 0.00 H new ATOM 0 HA ARG A 27 9.978 6.840 -5.138 1.00 0.00 H new ATOM 0 HB2 ARG A 27 11.529 9.193 -6.248 1.00 0.00 H new ATOM 0 HB3 ARG A 27 10.926 8.962 -4.619 1.00 0.00 H new ATOM 0 HG2 ARG A 27 12.552 6.997 -4.417 1.00 0.00 H new ATOM 0 HG3 ARG A 27 13.246 7.515 -5.940 1.00 0.00 H new ATOM 0 HD2 ARG A 27 13.198 8.992 -3.298 1.00 0.00 H new ATOM 0 HD3 ARG A 27 14.588 8.539 -4.265 1.00 0.00 H new ATOM 0 HE ARG A 27 13.269 10.236 -5.963 1.00 0.00 H new ATOM 0 HH11 ARG A 27 14.205 10.449 -2.566 1.00 0.00 H new ATOM 0 HH12 ARG A 27 14.388 12.206 -2.607 1.00 0.00 H new ATOM 0 HH21 ARG A 27 13.507 12.492 -6.009 1.00 0.00 H new ATOM 0 HH22 ARG A 27 13.994 13.358 -4.548 1.00 0.00 H new ATOM 408 N LEU A 28 8.028 7.969 -6.141 1.00 0.00 N ATOM 409 CA LEU A 28 6.840 8.577 -6.731 1.00 0.00 C ATOM 410 C LEU A 28 6.951 10.099 -6.730 1.00 0.00 C ATOM 411 O LEU A 28 7.666 10.678 -5.912 1.00 0.00 O ATOM 412 CB LEU A 28 5.588 8.145 -5.966 1.00 0.00 C ATOM 413 CG LEU A 28 5.151 9.061 -4.823 1.00 0.00 C ATOM 414 CD1 LEU A 28 4.443 10.293 -5.366 1.00 0.00 C ATOM 415 CD2 LEU A 28 4.249 8.310 -3.853 1.00 0.00 C ATOM 0 H LEU A 28 7.855 7.461 -5.274 1.00 0.00 H new ATOM 0 HA LEU A 28 6.762 8.237 -7.764 1.00 0.00 H new ATOM 0 HB2 LEU A 28 4.764 8.063 -6.675 1.00 0.00 H new ATOM 0 HB3 LEU A 28 5.760 7.148 -5.560 1.00 0.00 H new ATOM 0 HG LEU A 28 6.041 9.387 -4.284 1.00 0.00 H new ATOM 0 HD11 LEU A 28 4.139 10.933 -4.537 1.00 0.00 H new ATOM 0 HD12 LEU A 28 5.120 10.843 -6.020 1.00 0.00 H new ATOM 0 HD13 LEU A 28 3.562 9.987 -5.930 1.00 0.00 H new ATOM 0 HD21 LEU A 28 3.947 8.977 -3.046 1.00 0.00 H new ATOM 0 HD22 LEU A 28 3.364 7.955 -4.380 1.00 0.00 H new ATOM 0 HD23 LEU A 28 4.790 7.459 -3.438 1.00 0.00 H new ATOM 427 N ILE A 29 6.237 10.739 -7.650 1.00 0.00 N ATOM 428 CA ILE A 29 6.253 12.193 -7.753 1.00 0.00 C ATOM 429 C ILE A 29 4.853 12.772 -7.577 1.00 0.00 C ATOM 430 O ILE A 29 3.857 12.114 -7.876 1.00 0.00 O ATOM 431 CB ILE A 29 6.821 12.656 -9.108 1.00 0.00 C ATOM 432 CG1 ILE A 29 8.303 12.290 -9.215 1.00 0.00 C ATOM 433 CG2 ILE A 29 6.626 14.155 -9.279 1.00 0.00 C ATOM 434 CD1 ILE A 29 8.781 12.117 -10.640 1.00 0.00 C ATOM 0 H ILE A 29 5.641 10.274 -8.334 1.00 0.00 H new ATOM 0 HA ILE A 29 6.898 12.558 -6.954 1.00 0.00 H new ATOM 0 HB ILE A 29 6.281 12.146 -9.906 1.00 0.00 H new ATOM 0 HG12 ILE A 29 8.897 13.067 -8.733 1.00 0.00 H new ATOM 0 HG13 ILE A 29 8.481 11.366 -8.666 1.00 0.00 H new ATOM 0 HG21 ILE A 29 7.032 14.467 -10.241 1.00 0.00 H new ATOM 0 HG22 ILE A 29 5.562 14.390 -9.241 1.00 0.00 H new ATOM 0 HG23 ILE A 29 7.143 14.683 -8.478 1.00 0.00 H new ATOM 0 HD11 ILE A 29 9.840 11.859 -10.640 1.00 0.00 H new ATOM 0 HD12 ILE A 29 8.213 11.320 -11.120 1.00 0.00 H new ATOM 0 HD13 ILE A 29 8.635 13.048 -11.188 1.00 0.00 H new ATOM 446 N ALA A 30 4.786 14.007 -7.092 1.00 0.00 N ATOM 447 CA ALA A 30 3.509 14.676 -6.880 1.00 0.00 C ATOM 448 C ALA A 30 3.530 16.092 -7.447 1.00 0.00 C ATOM 449 O ALA A 30 4.339 16.924 -7.037 1.00 0.00 O ATOM 450 CB ALA A 30 3.167 14.704 -5.398 1.00 0.00 C ATOM 0 H ALA A 30 5.602 14.565 -6.838 1.00 0.00 H new ATOM 0 HA ALA A 30 2.740 14.112 -7.408 1.00 0.00 H new ATOM 0 HB1 ALA A 30 2.211 15.207 -5.255 1.00 0.00 H new ATOM 0 HB2 ALA A 30 3.101 13.684 -5.021 1.00 0.00 H new ATOM 0 HB3 ALA A 30 3.944 15.242 -4.855 1.00 0.00 H new ATOM 456 N LYS A 31 2.636 16.358 -8.393 1.00 0.00 N ATOM 457 CA LYS A 31 2.551 17.674 -9.017 1.00 0.00 C ATOM 458 C LYS A 31 1.333 18.439 -8.509 1.00 0.00 C ATOM 459 O LYS A 31 0.249 17.874 -8.362 1.00 0.00 O ATOM 460 CB LYS A 31 2.480 17.535 -10.540 1.00 0.00 C ATOM 461 CG LYS A 31 3.026 18.740 -11.286 1.00 0.00 C ATOM 462 CD LYS A 31 2.802 18.616 -12.784 1.00 0.00 C ATOM 463 CE LYS A 31 3.710 17.561 -13.398 1.00 0.00 C ATOM 464 NZ LYS A 31 5.013 18.135 -13.832 1.00 0.00 N ATOM 0 H LYS A 31 1.960 15.680 -8.745 1.00 0.00 H new ATOM 0 HA LYS A 31 3.447 18.234 -8.750 1.00 0.00 H new ATOM 0 HB2 LYS A 31 3.037 16.648 -10.842 1.00 0.00 H new ATOM 0 HB3 LYS A 31 1.443 17.375 -10.834 1.00 0.00 H new ATOM 0 HG2 LYS A 31 2.544 19.646 -10.919 1.00 0.00 H new ATOM 0 HG3 LYS A 31 4.092 18.842 -11.084 1.00 0.00 H new ATOM 0 HD2 LYS A 31 1.761 18.358 -12.977 1.00 0.00 H new ATOM 0 HD3 LYS A 31 2.986 19.578 -13.261 1.00 0.00 H new ATOM 0 HE2 LYS A 31 3.887 16.767 -12.672 1.00 0.00 H new ATOM 0 HE3 LYS A 31 3.211 17.106 -14.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 5.603 17.384 -14.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 4.847 18.875 -14.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 5.501 18.547 -13.011 1.00 0.00 H new ATOM 478 N VAL A 32 1.518 19.728 -8.244 1.00 0.00 N ATOM 479 CA VAL A 32 0.434 20.572 -7.755 1.00 0.00 C ATOM 480 C VAL A 32 0.191 21.751 -8.690 1.00 0.00 C ATOM 481 O VAL A 32 1.134 22.362 -9.192 1.00 0.00 O ATOM 482 CB VAL A 32 0.732 21.104 -6.341 1.00 0.00 C ATOM 483 CG1 VAL A 32 -0.412 21.977 -5.847 1.00 0.00 C ATOM 484 CG2 VAL A 32 0.987 19.952 -5.381 1.00 0.00 C ATOM 0 H VAL A 32 2.409 20.211 -8.360 1.00 0.00 H new ATOM 0 HA VAL A 32 -0.461 19.950 -7.720 1.00 0.00 H new ATOM 0 HB VAL A 32 1.633 21.717 -6.384 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -0.184 22.344 -4.846 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -0.542 22.822 -6.523 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -1.331 21.391 -5.818 1.00 0.00 H new ATOM 0 HG21 VAL A 32 1.196 20.346 -4.387 1.00 0.00 H new ATOM 0 HG22 VAL A 32 0.106 19.311 -5.340 1.00 0.00 H new ATOM 0 HG23 VAL A 32 1.842 19.372 -5.728 1.00 0.00 H new ATOM 494 N GLU A 33 -1.080 22.066 -8.919 1.00 0.00 N ATOM 495 CA GLU A 33 -1.446 23.174 -9.794 1.00 0.00 C ATOM 496 C GLU A 33 -2.553 24.018 -9.169 1.00 0.00 C ATOM 497 O GLU A 33 -3.528 23.488 -8.637 1.00 0.00 O ATOM 498 CB GLU A 33 -1.899 22.647 -11.157 1.00 0.00 C ATOM 499 CG GLU A 33 -0.833 21.847 -11.886 1.00 0.00 C ATOM 500 CD GLU A 33 0.264 22.724 -12.459 1.00 0.00 C ATOM 501 OE1 GLU A 33 1.191 23.083 -11.704 1.00 0.00 O ATOM 502 OE2 GLU A 33 0.195 23.050 -13.662 1.00 0.00 O ATOM 0 H GLU A 33 -1.873 21.570 -8.511 1.00 0.00 H new ATOM 0 HA GLU A 33 -0.566 23.803 -9.929 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -2.781 22.021 -11.020 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -2.199 23.489 -11.781 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -0.393 21.124 -11.199 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -1.298 21.279 -12.692 1.00 0.00 H new ATOM 509 N GLY A 34 -2.394 25.336 -9.237 1.00 0.00 N ATOM 510 CA GLY A 34 -3.386 26.233 -8.674 1.00 0.00 C ATOM 511 C GLY A 34 -3.244 26.385 -7.173 1.00 0.00 C ATOM 512 O GLY A 34 -2.379 25.762 -6.556 1.00 0.00 O ATOM 0 H GLY A 34 -1.596 25.799 -9.672 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -3.296 27.212 -9.145 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -4.383 25.858 -8.906 1.00 0.00 H new ATOM 516 N LYS A 35 -4.094 27.217 -6.581 1.00 0.00 N ATOM 517 CA LYS A 35 -4.061 27.451 -5.142 1.00 0.00 C ATOM 518 C LYS A 35 -5.389 27.066 -4.498 1.00 0.00 C ATOM 519 O LYS A 35 -6.264 26.496 -5.148 1.00 0.00 O ATOM 520 CB LYS A 35 -3.747 28.920 -4.850 1.00 0.00 C ATOM 521 CG LYS A 35 -2.870 29.123 -3.627 1.00 0.00 C ATOM 522 CD LYS A 35 -3.223 30.407 -2.894 1.00 0.00 C ATOM 523 CE LYS A 35 -2.413 31.585 -3.413 1.00 0.00 C ATOM 524 NZ LYS A 35 -0.992 31.517 -2.975 1.00 0.00 N ATOM 0 H LYS A 35 -4.815 27.741 -7.076 1.00 0.00 H new ATOM 0 HA LYS A 35 -3.276 26.827 -4.716 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -3.253 29.357 -5.718 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -4.682 29.462 -4.710 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -2.984 28.275 -2.952 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -1.823 29.152 -3.930 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -4.286 30.615 -3.013 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -3.040 30.280 -1.827 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -2.457 31.604 -4.502 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -2.858 32.515 -3.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -0.538 32.441 -3.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -0.951 31.270 -1.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -0.492 30.792 -3.529 1.00 0.00 H new ATOM 538 N GLY A 36 -5.533 27.383 -3.214 1.00 0.00 N ATOM 539 CA GLY A 36 -6.757 27.064 -2.504 1.00 0.00 C ATOM 540 C GLY A 36 -7.993 27.269 -3.358 1.00 0.00 C ATOM 541 O GLY A 36 -9.039 26.675 -3.100 1.00 0.00 O ATOM 0 H GLY A 36 -4.823 27.855 -2.654 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -6.719 26.028 -2.168 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -6.828 27.686 -1.612 1.00 0.00 H new ATOM 545 N ASN A 37 -7.873 28.114 -4.377 1.00 0.00 N ATOM 546 CA ASN A 37 -8.990 28.398 -5.270 1.00 0.00 C ATOM 547 C ASN A 37 -9.159 27.286 -6.300 1.00 0.00 C ATOM 548 O ASN A 37 -9.477 27.544 -7.460 1.00 0.00 O ATOM 549 CB ASN A 37 -8.776 29.737 -5.978 1.00 0.00 C ATOM 550 CG ASN A 37 -8.748 30.905 -5.012 1.00 0.00 C ATOM 551 OD1 ASN A 37 -8.325 30.765 -3.864 1.00 0.00 O ATOM 552 ND2 ASN A 37 -9.199 32.066 -5.473 1.00 0.00 N ATOM 0 H ASN A 37 -7.013 28.614 -4.605 1.00 0.00 H new ATOM 0 HA ASN A 37 -9.898 28.453 -4.670 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -7.838 29.706 -6.533 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -9.572 29.891 -6.706 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -9.204 32.888 -4.868 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -9.540 32.136 -6.432 1.00 0.00 H new ATOM 559 N GLY A 38 -8.944 26.048 -5.867 1.00 0.00 N ATOM 560 CA GLY A 38 -9.077 24.914 -6.764 1.00 0.00 C ATOM 561 C GLY A 38 -7.778 24.153 -6.933 1.00 0.00 C ATOM 562 O GLY A 38 -7.507 23.603 -8.001 1.00 0.00 O ATOM 0 H GLY A 38 -8.680 25.809 -4.911 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -9.842 24.239 -6.381 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -9.419 25.263 -7.738 1.00 0.00 H new ATOM 566 N ILE A 39 -6.970 24.121 -5.878 1.00 0.00 N ATOM 567 CA ILE A 39 -5.692 23.422 -5.916 1.00 0.00 C ATOM 568 C ILE A 39 -5.892 21.910 -5.915 1.00 0.00 C ATOM 569 O ILE A 39 -6.540 21.359 -5.025 1.00 0.00 O ATOM 570 CB ILE A 39 -4.802 23.811 -4.721 1.00 0.00 C ATOM 571 CG1 ILE A 39 -3.399 23.224 -4.888 1.00 0.00 C ATOM 572 CG2 ILE A 39 -5.428 23.338 -3.417 1.00 0.00 C ATOM 573 CD1 ILE A 39 -2.370 23.846 -3.971 1.00 0.00 C ATOM 0 H ILE A 39 -7.178 24.571 -4.987 1.00 0.00 H new ATOM 0 HA ILE A 39 -5.197 23.720 -6.840 1.00 0.00 H new ATOM 0 HB ILE A 39 -4.719 24.897 -4.689 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -3.439 22.151 -4.701 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -3.080 23.356 -5.922 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -4.787 23.621 -2.582 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -6.408 23.800 -3.295 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -5.539 22.254 -3.439 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -1.400 23.381 -4.145 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -2.302 24.915 -4.173 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -2.666 23.691 -2.934 1.00 0.00 H new ATOM 585 N LYS A 40 -5.330 21.244 -6.917 1.00 0.00 N ATOM 586 CA LYS A 40 -5.443 19.795 -7.032 1.00 0.00 C ATOM 587 C LYS A 40 -4.085 19.165 -7.324 1.00 0.00 C ATOM 588 O LYS A 40 -3.269 19.732 -8.052 1.00 0.00 O ATOM 589 CB LYS A 40 -6.437 19.426 -8.136 1.00 0.00 C ATOM 590 CG LYS A 40 -6.017 19.903 -9.516 1.00 0.00 C ATOM 591 CD LYS A 40 -7.057 19.554 -10.567 1.00 0.00 C ATOM 592 CE LYS A 40 -6.842 20.344 -11.849 1.00 0.00 C ATOM 593 NZ LYS A 40 -8.036 20.296 -12.737 1.00 0.00 N ATOM 0 H LYS A 40 -4.791 21.685 -7.662 1.00 0.00 H new ATOM 0 HA LYS A 40 -5.806 19.407 -6.080 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -6.559 18.343 -8.157 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -7.411 19.852 -7.894 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -5.864 20.982 -9.498 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -5.062 19.450 -9.783 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -7.012 18.487 -10.784 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -8.054 19.758 -10.176 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -6.614 21.381 -11.603 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -5.978 19.945 -12.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -7.849 20.846 -13.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -8.239 19.309 -12.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -8.855 20.700 -12.239 1.00 0.00 H new ATOM 607 N THR A 41 -3.849 17.987 -6.754 1.00 0.00 N ATOM 608 CA THR A 41 -2.591 17.280 -6.954 1.00 0.00 C ATOM 609 C THR A 41 -2.714 16.239 -8.061 1.00 0.00 C ATOM 610 O THR A 41 -3.799 15.717 -8.317 1.00 0.00 O ATOM 611 CB THR A 41 -2.126 16.584 -5.660 1.00 0.00 C ATOM 612 OG1 THR A 41 -2.167 17.507 -4.566 1.00 0.00 O ATOM 613 CG2 THR A 41 -0.715 16.037 -5.817 1.00 0.00 C ATOM 0 H THR A 41 -4.513 17.503 -6.150 1.00 0.00 H new ATOM 0 HA THR A 41 -1.852 18.027 -7.243 1.00 0.00 H new ATOM 0 HB THR A 41 -2.800 15.752 -5.458 1.00 0.00 H new ATOM 0 HG1 THR A 41 -3.100 17.708 -4.342 1.00 0.00 H new ATOM 0 HG21 THR A 41 -0.408 15.550 -4.891 1.00 0.00 H new ATOM 0 HG22 THR A 41 -0.694 15.313 -6.632 1.00 0.00 H new ATOM 0 HG23 THR A 41 -0.030 16.855 -6.041 1.00 0.00 H new ATOM 621 N VAL A 42 -1.596 15.941 -8.714 1.00 0.00 N ATOM 622 CA VAL A 42 -1.579 14.960 -9.793 1.00 0.00 C ATOM 623 C VAL A 42 -0.364 14.045 -9.684 1.00 0.00 C ATOM 624 O VAL A 42 0.764 14.459 -9.954 1.00 0.00 O ATOM 625 CB VAL A 42 -1.570 15.644 -11.173 1.00 0.00 C ATOM 626 CG1 VAL A 42 -1.367 14.618 -12.276 1.00 0.00 C ATOM 627 CG2 VAL A 42 -2.859 16.423 -11.388 1.00 0.00 C ATOM 0 H VAL A 42 -0.690 16.365 -8.515 1.00 0.00 H new ATOM 0 HA VAL A 42 -2.488 14.366 -9.696 1.00 0.00 H new ATOM 0 HB VAL A 42 -0.737 16.347 -11.207 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -1.363 15.120 -13.244 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -0.415 14.108 -12.128 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -2.177 13.889 -12.248 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -2.837 16.900 -12.368 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -3.709 15.742 -11.335 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -2.957 17.185 -10.615 1.00 0.00 H new ATOM 637 N ILE A 43 -0.603 12.799 -9.288 1.00 0.00 N ATOM 638 CA ILE A 43 0.471 11.824 -9.146 1.00 0.00 C ATOM 639 C ILE A 43 0.947 11.328 -10.507 1.00 0.00 C ATOM 640 O ILE A 43 0.431 10.343 -11.036 1.00 0.00 O ATOM 641 CB ILE A 43 0.027 10.617 -8.298 1.00 0.00 C ATOM 642 CG1 ILE A 43 -0.563 11.090 -6.968 1.00 0.00 C ATOM 643 CG2 ILE A 43 1.200 9.678 -8.059 1.00 0.00 C ATOM 644 CD1 ILE A 43 -1.595 10.144 -6.395 1.00 0.00 C ATOM 0 H ILE A 43 -1.531 12.441 -9.060 1.00 0.00 H new ATOM 0 HA ILE A 43 1.292 12.331 -8.640 1.00 0.00 H new ATOM 0 HB ILE A 43 -0.744 10.073 -8.843 1.00 0.00 H new ATOM 0 HG12 ILE A 43 0.244 11.215 -6.246 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -1.019 12.070 -7.110 1.00 0.00 H new ATOM 0 HG21 ILE A 43 0.871 8.830 -7.458 1.00 0.00 H new ATOM 0 HG22 ILE A 43 1.580 9.319 -9.016 1.00 0.00 H new ATOM 0 HG23 ILE A 43 1.991 10.211 -7.531 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -1.970 10.543 -5.452 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -2.421 10.037 -7.098 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -1.138 9.170 -6.221 1.00 0.00 H new ATOM 656 N VAL A 44 1.936 12.016 -11.069 1.00 0.00 N ATOM 657 CA VAL A 44 2.485 11.643 -12.367 1.00 0.00 C ATOM 658 C VAL A 44 3.068 10.235 -12.334 1.00 0.00 C ATOM 659 O VAL A 44 2.795 9.419 -13.213 1.00 0.00 O ATOM 660 CB VAL A 44 3.579 12.630 -12.818 1.00 0.00 C ATOM 661 CG1 VAL A 44 4.120 12.239 -14.184 1.00 0.00 C ATOM 662 CG2 VAL A 44 3.039 14.052 -12.836 1.00 0.00 C ATOM 0 H VAL A 44 2.373 12.835 -10.646 1.00 0.00 H new ATOM 0 HA VAL A 44 1.661 11.674 -13.080 1.00 0.00 H new ATOM 0 HB VAL A 44 4.400 12.587 -12.103 1.00 0.00 H new ATOM 0 HG11 VAL A 44 4.891 12.947 -14.486 1.00 0.00 H new ATOM 0 HG12 VAL A 44 4.547 11.237 -14.133 1.00 0.00 H new ATOM 0 HG13 VAL A 44 3.310 12.252 -14.913 1.00 0.00 H new ATOM 0 HG21 VAL A 44 3.825 14.736 -13.157 1.00 0.00 H new ATOM 0 HG22 VAL A 44 2.200 14.114 -13.529 1.00 0.00 H new ATOM 0 HG23 VAL A 44 2.705 14.327 -11.836 1.00 0.00 H new ATOM 672 N ASN A 45 3.873 9.958 -11.313 1.00 0.00 N ATOM 673 CA ASN A 45 4.495 8.647 -11.165 1.00 0.00 C ATOM 674 C ASN A 45 3.552 7.673 -10.467 1.00 0.00 C ATOM 675 O ASN A 45 3.973 6.885 -9.620 1.00 0.00 O ATOM 676 CB ASN A 45 5.800 8.766 -10.376 1.00 0.00 C ATOM 677 CG ASN A 45 6.821 7.721 -10.785 1.00 0.00 C ATOM 678 OD1 ASN A 45 6.470 6.583 -11.096 1.00 0.00 O ATOM 679 ND2 ASN A 45 8.092 8.105 -10.787 1.00 0.00 N ATOM 0 H ASN A 45 4.110 10.623 -10.577 1.00 0.00 H new ATOM 0 HA ASN A 45 4.714 8.261 -12.161 1.00 0.00 H new ATOM 0 HB2 ASN A 45 6.222 9.760 -10.525 1.00 0.00 H new ATOM 0 HB3 ASN A 45 5.588 8.666 -9.311 1.00 0.00 H new ATOM 0 HD21 ASN A 45 8.823 7.446 -11.054 1.00 0.00 H new ATOM 0 HD22 ASN A 45 8.337 9.059 -10.522 1.00 0.00 H new ATOM 686 N MET A 46 2.274 7.732 -10.828 1.00 0.00 N ATOM 687 CA MET A 46 1.271 6.854 -10.237 1.00 0.00 C ATOM 688 C MET A 46 1.226 5.514 -10.966 1.00 0.00 C ATOM 689 O MET A 46 1.359 4.457 -10.350 1.00 0.00 O ATOM 690 CB MET A 46 -0.107 7.517 -10.279 1.00 0.00 C ATOM 691 CG MET A 46 -1.253 6.552 -10.028 1.00 0.00 C ATOM 692 SD MET A 46 -0.856 5.310 -8.782 1.00 0.00 S ATOM 693 CE MET A 46 -1.009 6.274 -7.281 1.00 0.00 C ATOM 0 H MET A 46 1.909 8.379 -11.527 1.00 0.00 H new ATOM 0 HA MET A 46 1.548 6.674 -9.198 1.00 0.00 H new ATOM 0 HB2 MET A 46 -0.142 8.311 -9.533 1.00 0.00 H new ATOM 0 HB3 MET A 46 -0.245 7.987 -11.253 1.00 0.00 H new ATOM 0 HG2 MET A 46 -2.132 7.113 -9.709 1.00 0.00 H new ATOM 0 HG3 MET A 46 -1.514 6.054 -10.962 1.00 0.00 H new ATOM 0 HE1 MET A 46 -0.016 6.517 -6.902 1.00 0.00 H new ATOM 0 HE2 MET A 46 -1.552 7.195 -7.494 1.00 0.00 H new ATOM 0 HE3 MET A 46 -1.552 5.698 -6.532 1.00 0.00 H new ATOM 703 N VAL A 47 1.036 5.566 -12.280 1.00 0.00 N ATOM 704 CA VAL A 47 0.973 4.357 -13.092 1.00 0.00 C ATOM 705 C VAL A 47 2.329 3.663 -13.149 1.00 0.00 C ATOM 706 O VAL A 47 2.411 2.434 -13.123 1.00 0.00 O ATOM 707 CB VAL A 47 0.507 4.667 -14.527 1.00 0.00 C ATOM 708 CG1 VAL A 47 0.395 3.387 -15.341 1.00 0.00 C ATOM 709 CG2 VAL A 47 -0.819 5.413 -14.506 1.00 0.00 C ATOM 0 H VAL A 47 0.923 6.433 -12.805 1.00 0.00 H new ATOM 0 HA VAL A 47 0.248 3.695 -12.618 1.00 0.00 H new ATOM 0 HB VAL A 47 1.251 5.307 -15.002 1.00 0.00 H new ATOM 0 HG11 VAL A 47 0.065 3.626 -16.352 1.00 0.00 H new ATOM 0 HG12 VAL A 47 1.368 2.897 -15.384 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -0.328 2.719 -14.872 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -1.134 5.624 -15.528 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -1.574 4.800 -14.013 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -0.701 6.350 -13.962 1.00 0.00 H new ATOM 719 N ASP A 48 3.391 4.457 -13.228 1.00 0.00 N ATOM 720 CA ASP A 48 4.745 3.919 -13.287 1.00 0.00 C ATOM 721 C ASP A 48 5.040 3.053 -12.067 1.00 0.00 C ATOM 722 O ASP A 48 5.187 1.835 -12.177 1.00 0.00 O ATOM 723 CB ASP A 48 5.765 5.055 -13.380 1.00 0.00 C ATOM 724 CG ASP A 48 6.084 5.432 -14.813 1.00 0.00 C ATOM 725 OD1 ASP A 48 6.775 4.645 -15.494 1.00 0.00 O ATOM 726 OD2 ASP A 48 5.642 6.513 -15.255 1.00 0.00 O ATOM 0 H ASP A 48 3.340 5.475 -13.253 1.00 0.00 H new ATOM 0 HA ASP A 48 4.823 3.297 -14.179 1.00 0.00 H new ATOM 0 HB2 ASP A 48 5.380 5.929 -12.855 1.00 0.00 H new ATOM 0 HB3 ASP A 48 6.683 4.757 -12.873 1.00 0.00 H new ATOM 731 N VAL A 49 5.126 3.689 -10.903 1.00 0.00 N ATOM 732 CA VAL A 49 5.403 2.976 -9.661 1.00 0.00 C ATOM 733 C VAL A 49 4.539 1.726 -9.540 1.00 0.00 C ATOM 734 O VAL A 49 5.010 0.673 -9.111 1.00 0.00 O ATOM 735 CB VAL A 49 5.162 3.874 -8.433 1.00 0.00 C ATOM 736 CG1 VAL A 49 6.174 5.009 -8.394 1.00 0.00 C ATOM 737 CG2 VAL A 49 3.741 4.416 -8.441 1.00 0.00 C ATOM 0 H VAL A 49 5.008 4.696 -10.794 1.00 0.00 H new ATOM 0 HA VAL A 49 6.453 2.686 -9.690 1.00 0.00 H new ATOM 0 HB VAL A 49 5.292 3.272 -7.533 1.00 0.00 H new ATOM 0 HG11 VAL A 49 5.988 5.633 -7.520 1.00 0.00 H new ATOM 0 HG12 VAL A 49 7.181 4.597 -8.338 1.00 0.00 H new ATOM 0 HG13 VAL A 49 6.079 5.612 -9.297 1.00 0.00 H new ATOM 0 HG21 VAL A 49 3.588 5.048 -7.566 1.00 0.00 H new ATOM 0 HG22 VAL A 49 3.580 5.003 -9.346 1.00 0.00 H new ATOM 0 HG23 VAL A 49 3.035 3.586 -8.417 1.00 0.00 H new ATOM 747 N ALA A 50 3.273 1.849 -9.922 1.00 0.00 N ATOM 748 CA ALA A 50 2.343 0.728 -9.859 1.00 0.00 C ATOM 749 C ALA A 50 2.858 -0.458 -10.667 1.00 0.00 C ATOM 750 O ALA A 50 2.980 -1.569 -10.150 1.00 0.00 O ATOM 751 CB ALA A 50 0.970 1.153 -10.358 1.00 0.00 C ATOM 0 H ALA A 50 2.867 2.714 -10.279 1.00 0.00 H new ATOM 0 HA ALA A 50 2.258 0.416 -8.818 1.00 0.00 H new ATOM 0 HB1 ALA A 50 0.286 0.306 -10.305 1.00 0.00 H new ATOM 0 HB2 ALA A 50 0.592 1.964 -9.736 1.00 0.00 H new ATOM 0 HB3 ALA A 50 1.047 1.493 -11.391 1.00 0.00 H new ATOM 757 N LYS A 51 3.159 -0.216 -11.938 1.00 0.00 N ATOM 758 CA LYS A 51 3.662 -1.264 -12.819 1.00 0.00 C ATOM 759 C LYS A 51 4.747 -2.083 -12.126 1.00 0.00 C ATOM 760 O LYS A 51 4.768 -3.309 -12.222 1.00 0.00 O ATOM 761 CB LYS A 51 4.214 -0.654 -14.109 1.00 0.00 C ATOM 762 CG LYS A 51 3.177 -0.520 -15.211 1.00 0.00 C ATOM 763 CD LYS A 51 3.475 0.663 -16.116 1.00 0.00 C ATOM 764 CE LYS A 51 2.966 0.426 -17.530 1.00 0.00 C ATOM 765 NZ LYS A 51 1.545 0.845 -17.685 1.00 0.00 N ATOM 0 H LYS A 51 3.063 0.697 -12.382 1.00 0.00 H new ATOM 0 HA LYS A 51 2.832 -1.927 -13.064 1.00 0.00 H new ATOM 0 HB2 LYS A 51 4.626 0.331 -13.888 1.00 0.00 H new ATOM 0 HB3 LYS A 51 5.037 -1.271 -14.469 1.00 0.00 H new ATOM 0 HG2 LYS A 51 3.153 -1.435 -15.803 1.00 0.00 H new ATOM 0 HG3 LYS A 51 2.188 -0.401 -14.769 1.00 0.00 H new ATOM 0 HD2 LYS A 51 3.012 1.561 -15.707 1.00 0.00 H new ATOM 0 HD3 LYS A 51 4.550 0.842 -16.140 1.00 0.00 H new ATOM 0 HE2 LYS A 51 3.586 0.977 -18.237 1.00 0.00 H new ATOM 0 HE3 LYS A 51 3.062 -0.631 -17.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 1.235 0.668 -18.662 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 0.949 0.301 -17.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 1.457 1.859 -17.473 1.00 0.00 H new ATOM 779 N ALA A 52 5.644 -1.396 -11.427 1.00 0.00 N ATOM 780 CA ALA A 52 6.729 -2.059 -10.716 1.00 0.00 C ATOM 781 C ALA A 52 6.189 -3.067 -9.706 1.00 0.00 C ATOM 782 O ALA A 52 6.767 -4.136 -9.511 1.00 0.00 O ATOM 783 CB ALA A 52 7.610 -1.033 -10.020 1.00 0.00 C ATOM 0 H ALA A 52 5.640 -0.380 -11.338 1.00 0.00 H new ATOM 0 HA ALA A 52 7.330 -2.601 -11.446 1.00 0.00 H new ATOM 0 HB1 ALA A 52 8.416 -1.543 -9.493 1.00 0.00 H new ATOM 0 HB2 ALA A 52 8.033 -0.354 -10.761 1.00 0.00 H new ATOM 0 HB3 ALA A 52 7.013 -0.465 -9.307 1.00 0.00 H new ATOM 789 N LEU A 53 5.078 -2.718 -9.067 1.00 0.00 N ATOM 790 CA LEU A 53 4.459 -3.592 -8.076 1.00 0.00 C ATOM 791 C LEU A 53 3.472 -4.550 -8.736 1.00 0.00 C ATOM 792 O LEU A 53 2.627 -5.143 -8.067 1.00 0.00 O ATOM 793 CB LEU A 53 3.744 -2.761 -7.009 1.00 0.00 C ATOM 794 CG LEU A 53 4.508 -1.545 -6.484 1.00 0.00 C ATOM 795 CD1 LEU A 53 3.543 -0.507 -5.930 1.00 0.00 C ATOM 796 CD2 LEU A 53 5.511 -1.964 -5.419 1.00 0.00 C ATOM 0 H LEU A 53 4.587 -1.836 -9.217 1.00 0.00 H new ATOM 0 HA LEU A 53 5.247 -4.179 -7.603 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.794 -2.419 -7.419 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.511 -3.411 -6.166 1.00 0.00 H new ATOM 0 HG LEU A 53 5.055 -1.098 -7.314 1.00 0.00 H new ATOM 0 HD11 LEU A 53 4.104 0.351 -5.561 1.00 0.00 H new ATOM 0 HD12 LEU A 53 2.864 -0.184 -6.719 1.00 0.00 H new ATOM 0 HD13 LEU A 53 2.969 -0.944 -5.113 1.00 0.00 H new ATOM 0 HD21 LEU A 53 6.045 -1.086 -5.057 1.00 0.00 H new ATOM 0 HD22 LEU A 53 4.985 -2.436 -4.589 1.00 0.00 H new ATOM 0 HD23 LEU A 53 6.222 -2.671 -5.847 1.00 0.00 H new ATOM 808 N ASN A 54 3.588 -4.698 -10.052 1.00 0.00 N ATOM 809 CA ASN A 54 2.707 -5.585 -10.802 1.00 0.00 C ATOM 810 C ASN A 54 1.254 -5.398 -10.375 1.00 0.00 C ATOM 811 O ASN A 54 0.464 -6.341 -10.396 1.00 0.00 O ATOM 812 CB ASN A 54 3.125 -7.043 -10.600 1.00 0.00 C ATOM 813 CG ASN A 54 2.679 -7.936 -11.742 1.00 0.00 C ATOM 814 OD1 ASN A 54 2.525 -7.482 -12.875 1.00 0.00 O ATOM 815 ND2 ASN A 54 2.471 -9.214 -11.446 1.00 0.00 N ATOM 0 H ASN A 54 4.284 -4.215 -10.621 1.00 0.00 H new ATOM 0 HA ASN A 54 2.792 -5.332 -11.859 1.00 0.00 H new ATOM 0 HB2 ASN A 54 4.209 -7.097 -10.502 1.00 0.00 H new ATOM 0 HB3 ASN A 54 2.702 -7.413 -9.666 1.00 0.00 H new ATOM 0 HD21 ASN A 54 2.171 -9.864 -12.173 1.00 0.00 H new ATOM 0 HD22 ASN A 54 2.612 -9.546 -10.492 1.00 0.00 H new ATOM 822 N ARG A 55 0.910 -4.173 -9.990 1.00 0.00 N ATOM 823 CA ARG A 55 -0.447 -3.862 -9.558 1.00 0.00 C ATOM 824 C ARG A 55 -0.921 -2.542 -10.162 1.00 0.00 C ATOM 825 O ARG A 55 -0.130 -1.642 -10.446 1.00 0.00 O ATOM 826 CB ARG A 55 -0.516 -3.790 -8.032 1.00 0.00 C ATOM 827 CG ARG A 55 -0.661 -5.147 -7.364 1.00 0.00 C ATOM 828 CD ARG A 55 -1.133 -5.013 -5.925 1.00 0.00 C ATOM 829 NE ARG A 55 -0.777 -6.179 -5.121 1.00 0.00 N ATOM 830 CZ ARG A 55 0.472 -6.497 -4.801 1.00 0.00 C ATOM 831 NH1 ARG A 55 1.479 -5.740 -5.214 1.00 0.00 N ATOM 832 NH2 ARG A 55 0.716 -7.574 -4.065 1.00 0.00 N ATOM 0 H ARG A 55 1.552 -3.381 -9.969 1.00 0.00 H new ATOM 0 HA ARG A 55 -1.104 -4.659 -9.907 1.00 0.00 H new ATOM 0 HB2 ARG A 55 0.386 -3.305 -7.659 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -1.358 -3.161 -7.744 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -1.370 -5.756 -7.925 1.00 0.00 H new ATOM 0 HG3 ARG A 55 0.296 -5.669 -7.387 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -0.694 -4.119 -5.481 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -2.215 -4.879 -5.909 1.00 0.00 H new ATOM 0 HE ARG A 55 -1.529 -6.782 -4.787 1.00 0.00 H new ATOM 0 HH11 ARG A 55 1.295 -4.911 -5.779 1.00 0.00 H new ATOM 0 HH12 ARG A 55 2.437 -5.987 -4.967 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -0.056 -8.158 -3.745 1.00 0.00 H new ATOM 0 HH22 ARG A 55 1.676 -7.817 -3.820 1.00 0.00 H new ATOM 846 N PRO A 56 -2.241 -2.423 -10.363 1.00 0.00 N ATOM 847 CA PRO A 56 -2.850 -1.218 -10.935 1.00 0.00 C ATOM 848 C PRO A 56 -2.789 -0.030 -9.981 1.00 0.00 C ATOM 849 O PRO A 56 -2.901 -0.174 -8.764 1.00 0.00 O ATOM 850 CB PRO A 56 -4.302 -1.635 -11.178 1.00 0.00 C ATOM 851 CG PRO A 56 -4.551 -2.730 -10.199 1.00 0.00 C ATOM 852 CD PRO A 56 -3.243 -3.456 -10.048 1.00 0.00 C ATOM 0 HA PRO A 56 -2.332 -0.887 -11.835 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -4.985 -0.800 -11.021 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -4.449 -1.978 -12.202 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -4.888 -2.329 -9.243 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -5.332 -3.402 -10.556 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -3.114 -3.846 -9.038 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -3.173 -4.304 -10.729 1.00 0.00 H new ATOM 860 N PRO A 57 -2.607 1.173 -10.545 1.00 0.00 N ATOM 861 CA PRO A 57 -2.529 2.410 -9.762 1.00 0.00 C ATOM 862 C PRO A 57 -3.870 2.792 -9.146 1.00 0.00 C ATOM 863 O PRO A 57 -3.964 3.756 -8.385 1.00 0.00 O ATOM 864 CB PRO A 57 -2.097 3.456 -10.793 1.00 0.00 C ATOM 865 CG PRO A 57 -2.567 2.916 -12.100 1.00 0.00 C ATOM 866 CD PRO A 57 -2.466 1.419 -11.990 1.00 0.00 C ATOM 0 HA PRO A 57 -1.846 2.315 -8.918 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -2.544 4.428 -10.582 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -1.016 3.594 -10.788 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -3.593 3.224 -12.303 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -1.953 3.289 -12.920 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -3.249 0.920 -12.561 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -1.512 1.052 -12.369 1.00 0.00 H new ATOM 874 N THR A 58 -4.908 2.030 -9.478 1.00 0.00 N ATOM 875 CA THR A 58 -6.244 2.290 -8.958 1.00 0.00 C ATOM 876 C THR A 58 -6.350 1.891 -7.490 1.00 0.00 C ATOM 877 O THR A 58 -7.111 2.488 -6.728 1.00 0.00 O ATOM 878 CB THR A 58 -7.317 1.532 -9.762 1.00 0.00 C ATOM 879 OG1 THR A 58 -6.934 0.161 -9.920 1.00 0.00 O ATOM 880 CG2 THR A 58 -7.519 2.168 -11.129 1.00 0.00 C ATOM 0 H THR A 58 -4.848 1.228 -10.105 1.00 0.00 H new ATOM 0 HA THR A 58 -6.417 3.362 -9.054 1.00 0.00 H new ATOM 0 HB THR A 58 -8.256 1.585 -9.212 1.00 0.00 H new ATOM 0 HG1 THR A 58 -7.622 -0.314 -10.431 1.00 0.00 H new ATOM 0 HG21 THR A 58 -8.281 1.615 -11.678 1.00 0.00 H new ATOM 0 HG22 THR A 58 -7.839 3.203 -11.005 1.00 0.00 H new ATOM 0 HG23 THR A 58 -6.581 2.142 -11.684 1.00 0.00 H new ATOM 888 N TYR A 59 -5.582 0.880 -7.100 1.00 0.00 N ATOM 889 CA TYR A 59 -5.590 0.401 -5.723 1.00 0.00 C ATOM 890 C TYR A 59 -5.001 1.445 -4.779 1.00 0.00 C ATOM 891 O TYR A 59 -5.614 1.839 -3.786 1.00 0.00 O ATOM 892 CB TYR A 59 -4.804 -0.906 -5.610 1.00 0.00 C ATOM 893 CG TYR A 59 -5.596 -2.126 -6.023 1.00 0.00 C ATOM 894 CD1 TYR A 59 -6.907 -2.304 -5.599 1.00 0.00 C ATOM 895 CD2 TYR A 59 -5.033 -3.101 -6.838 1.00 0.00 C ATOM 896 CE1 TYR A 59 -7.633 -3.418 -5.973 1.00 0.00 C ATOM 897 CE2 TYR A 59 -5.752 -4.217 -7.218 1.00 0.00 C ATOM 898 CZ TYR A 59 -7.052 -4.371 -6.783 1.00 0.00 C ATOM 899 OH TYR A 59 -7.773 -5.481 -7.159 1.00 0.00 O ATOM 0 H TYR A 59 -4.946 0.376 -7.718 1.00 0.00 H new ATOM 0 HA TYR A 59 -6.626 0.220 -5.435 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -3.910 -0.837 -6.229 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -4.470 -1.031 -4.580 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -7.366 -1.559 -4.966 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -4.015 -2.984 -7.180 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -8.650 -3.542 -5.633 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -5.299 -4.965 -7.852 1.00 0.00 H new ATOM 0 HH TYR A 59 -8.724 -5.331 -6.976 1.00 0.00 H new ATOM 909 N PRO A 60 -3.781 1.906 -5.095 1.00 0.00 N ATOM 910 CA PRO A 60 -3.081 2.911 -4.290 1.00 0.00 C ATOM 911 C PRO A 60 -3.733 4.286 -4.385 1.00 0.00 C ATOM 912 O PRO A 60 -4.014 4.924 -3.370 1.00 0.00 O ATOM 913 CB PRO A 60 -1.678 2.940 -4.901 1.00 0.00 C ATOM 914 CG PRO A 60 -1.866 2.476 -6.304 1.00 0.00 C ATOM 915 CD PRO A 60 -2.992 1.481 -6.264 1.00 0.00 C ATOM 0 HA PRO A 60 -3.093 2.664 -3.228 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -1.253 3.943 -4.869 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -0.995 2.288 -4.356 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -2.106 3.311 -6.962 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -0.955 2.019 -6.689 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -3.584 1.507 -7.179 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -2.624 0.461 -6.151 1.00 0.00 H new ATOM 923 N THR A 61 -3.971 4.740 -5.612 1.00 0.00 N ATOM 924 CA THR A 61 -4.589 6.040 -5.840 1.00 0.00 C ATOM 925 C THR A 61 -5.802 6.238 -4.938 1.00 0.00 C ATOM 926 O THR A 61 -5.927 7.260 -4.263 1.00 0.00 O ATOM 927 CB THR A 61 -5.022 6.206 -7.308 1.00 0.00 C ATOM 928 OG1 THR A 61 -3.873 6.195 -8.163 1.00 0.00 O ATOM 929 CG2 THR A 61 -5.792 7.504 -7.502 1.00 0.00 C ATOM 0 H THR A 61 -3.745 4.226 -6.463 1.00 0.00 H new ATOM 0 HA THR A 61 -3.837 6.793 -5.603 1.00 0.00 H new ATOM 0 HB THR A 61 -5.675 5.372 -7.567 1.00 0.00 H new ATOM 0 HG1 THR A 61 -3.926 5.430 -8.773 1.00 0.00 H new ATOM 0 HG21 THR A 61 -6.087 7.599 -8.547 1.00 0.00 H new ATOM 0 HG22 THR A 61 -6.682 7.497 -6.873 1.00 0.00 H new ATOM 0 HG23 THR A 61 -5.159 8.347 -7.226 1.00 0.00 H new ATOM 937 N LYS A 62 -6.694 5.253 -4.930 1.00 0.00 N ATOM 938 CA LYS A 62 -7.898 5.317 -4.110 1.00 0.00 C ATOM 939 C LYS A 62 -7.543 5.445 -2.632 1.00 0.00 C ATOM 940 O LYS A 62 -8.165 6.213 -1.898 1.00 0.00 O ATOM 941 CB LYS A 62 -8.759 4.072 -4.332 1.00 0.00 C ATOM 942 CG LYS A 62 -10.196 4.236 -3.870 1.00 0.00 C ATOM 943 CD LYS A 62 -10.972 5.172 -4.782 1.00 0.00 C ATOM 944 CE LYS A 62 -12.464 5.125 -4.491 1.00 0.00 C ATOM 945 NZ LYS A 62 -13.207 6.185 -5.226 1.00 0.00 N ATOM 0 H LYS A 62 -6.606 4.400 -5.483 1.00 0.00 H new ATOM 0 HA LYS A 62 -8.464 6.200 -4.408 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -8.754 3.821 -5.393 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -8.310 3.231 -3.803 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -10.685 3.262 -3.846 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -10.210 4.625 -2.852 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -10.607 6.191 -4.654 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -10.794 4.898 -5.822 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -12.857 4.147 -4.769 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -12.629 5.242 -3.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -14.220 6.119 -5.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -12.850 7.120 -4.943 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -13.071 6.058 -6.249 1.00 0.00 H new ATOM 959 N TYR A 63 -6.538 4.689 -2.202 1.00 0.00 N ATOM 960 CA TYR A 63 -6.101 4.718 -0.812 1.00 0.00 C ATOM 961 C TYR A 63 -5.878 6.151 -0.340 1.00 0.00 C ATOM 962 O TYR A 63 -6.520 6.613 0.604 1.00 0.00 O ATOM 963 CB TYR A 63 -4.814 3.908 -0.643 1.00 0.00 C ATOM 964 CG TYR A 63 -4.616 3.369 0.756 1.00 0.00 C ATOM 965 CD1 TYR A 63 -5.488 2.427 1.288 1.00 0.00 C ATOM 966 CD2 TYR A 63 -3.559 3.803 1.546 1.00 0.00 C ATOM 967 CE1 TYR A 63 -5.312 1.932 2.566 1.00 0.00 C ATOM 968 CE2 TYR A 63 -3.374 3.313 2.824 1.00 0.00 C ATOM 969 CZ TYR A 63 -4.254 2.378 3.330 1.00 0.00 C ATOM 970 OH TYR A 63 -4.074 1.888 4.603 1.00 0.00 O ATOM 0 H TYR A 63 -6.011 4.049 -2.797 1.00 0.00 H new ATOM 0 HA TYR A 63 -6.887 4.272 -0.202 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -4.824 3.075 -1.346 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -3.963 4.536 -0.905 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -6.318 2.076 0.692 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -2.870 4.536 1.154 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -5.999 1.200 2.964 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -2.545 3.660 3.424 1.00 0.00 H new ATOM 0 HH TYR A 63 -3.283 2.304 5.005 1.00 0.00 H new ATOM 980 N PHE A 64 -4.963 6.850 -1.003 1.00 0.00 N ATOM 981 CA PHE A 64 -4.654 8.231 -0.653 1.00 0.00 C ATOM 982 C PHE A 64 -5.926 9.007 -0.324 1.00 0.00 C ATOM 983 O PHE A 64 -6.044 9.604 0.745 1.00 0.00 O ATOM 984 CB PHE A 64 -3.908 8.916 -1.800 1.00 0.00 C ATOM 985 CG PHE A 64 -2.578 8.289 -2.109 1.00 0.00 C ATOM 986 CD1 PHE A 64 -1.731 7.891 -1.087 1.00 0.00 C ATOM 987 CD2 PHE A 64 -2.175 8.099 -3.421 1.00 0.00 C ATOM 988 CE1 PHE A 64 -0.507 7.315 -1.369 1.00 0.00 C ATOM 989 CE2 PHE A 64 -0.952 7.523 -3.708 1.00 0.00 C ATOM 990 CZ PHE A 64 -0.117 7.129 -2.681 1.00 0.00 C ATOM 0 H PHE A 64 -4.422 6.482 -1.786 1.00 0.00 H new ATOM 0 HA PHE A 64 -4.017 8.221 0.231 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -4.530 8.889 -2.695 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -3.756 9.966 -1.549 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -2.031 8.033 -0.059 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -2.824 8.404 -4.228 1.00 0.00 H new ATOM 0 HE1 PHE A 64 0.145 7.010 -0.564 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -0.649 7.381 -4.735 1.00 0.00 H new ATOM 0 HZ PHE A 64 0.838 6.677 -2.903 1.00 0.00 H new ATOM 1000 N GLY A 65 -6.877 8.994 -1.253 1.00 0.00 N ATOM 1001 CA GLY A 65 -8.128 9.700 -1.045 1.00 0.00 C ATOM 1002 C GLY A 65 -8.829 9.273 0.230 1.00 0.00 C ATOM 1003 O GLY A 65 -9.407 10.100 0.935 1.00 0.00 O ATOM 0 H GLY A 65 -6.803 8.507 -2.146 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -7.935 10.772 -1.008 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -8.787 9.524 -1.895 1.00 0.00 H new ATOM 1007 N CYS A 66 -8.779 7.979 0.525 1.00 0.00 N ATOM 1008 CA CYS A 66 -9.417 7.443 1.723 1.00 0.00 C ATOM 1009 C CYS A 66 -8.797 8.039 2.982 1.00 0.00 C ATOM 1010 O CYS A 66 -9.485 8.667 3.786 1.00 0.00 O ATOM 1011 CB CYS A 66 -9.295 5.918 1.752 1.00 0.00 C ATOM 1012 SG CYS A 66 -10.627 5.088 2.649 1.00 0.00 S ATOM 0 H CYS A 66 -8.304 7.282 -0.048 1.00 0.00 H new ATOM 0 HA CYS A 66 -10.472 7.715 1.696 1.00 0.00 H new ATOM 0 HB2 CYS A 66 -9.275 5.546 0.728 1.00 0.00 H new ATOM 0 HB3 CYS A 66 -8.342 5.649 2.208 1.00 0.00 H new ATOM 0 HG CYS A 66 -10.691 3.844 2.277 1.00 0.00 H new ATOM 1018 N GLU A 67 -7.494 7.837 3.147 1.00 0.00 N ATOM 1019 CA GLU A 67 -6.782 8.353 4.310 1.00 0.00 C ATOM 1020 C GLU A 67 -6.898 9.873 4.389 1.00 0.00 C ATOM 1021 O GLU A 67 -7.151 10.433 5.456 1.00 0.00 O ATOM 1022 CB GLU A 67 -5.308 7.945 4.257 1.00 0.00 C ATOM 1023 CG GLU A 67 -5.091 6.442 4.308 1.00 0.00 C ATOM 1024 CD GLU A 67 -5.155 5.797 2.937 1.00 0.00 C ATOM 1025 OE1 GLU A 67 -4.472 6.290 2.016 1.00 0.00 O ATOM 1026 OE2 GLU A 67 -5.890 4.798 2.786 1.00 0.00 O ATOM 0 H GLU A 67 -6.910 7.320 2.490 1.00 0.00 H new ATOM 0 HA GLU A 67 -7.238 7.924 5.202 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -4.864 8.337 3.342 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -4.781 8.408 5.091 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -4.121 6.234 4.759 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -5.845 5.991 4.953 1.00 0.00 H new ATOM 1033 N LEU A 68 -6.710 10.534 3.252 1.00 0.00 N ATOM 1034 CA LEU A 68 -6.792 11.989 3.190 1.00 0.00 C ATOM 1035 C LEU A 68 -8.235 12.460 3.345 1.00 0.00 C ATOM 1036 O LEU A 68 -8.489 13.578 3.789 1.00 0.00 O ATOM 1037 CB LEU A 68 -6.217 12.496 1.867 1.00 0.00 C ATOM 1038 CG LEU A 68 -4.738 12.198 1.619 1.00 0.00 C ATOM 1039 CD1 LEU A 68 -4.437 12.194 0.128 1.00 0.00 C ATOM 1040 CD2 LEU A 68 -3.862 13.212 2.340 1.00 0.00 C ATOM 0 H LEU A 68 -6.500 10.085 2.360 1.00 0.00 H new ATOM 0 HA LEU A 68 -6.206 12.397 4.013 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -6.796 12.061 1.052 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -6.362 13.575 1.821 1.00 0.00 H new ATOM 0 HG LEU A 68 -4.515 11.208 2.016 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -3.380 11.980 -0.029 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -5.039 11.429 -0.363 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -4.676 13.170 -0.294 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -2.813 12.985 2.153 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -4.087 14.213 1.973 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -4.058 13.165 3.411 1.00 0.00 H new ATOM 1052 N GLY A 69 -9.177 11.596 2.976 1.00 0.00 N ATOM 1053 CA GLY A 69 -10.582 11.941 3.084 1.00 0.00 C ATOM 1054 C GLY A 69 -10.987 13.032 2.112 1.00 0.00 C ATOM 1055 O GLY A 69 -11.765 13.921 2.456 1.00 0.00 O ATOM 0 H GLY A 69 -8.992 10.664 2.605 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -11.186 11.053 2.901 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -10.796 12.268 4.102 1.00 0.00 H new ATOM 1059 N ALA A 70 -10.457 12.965 0.895 1.00 0.00 N ATOM 1060 CA ALA A 70 -10.769 13.954 -0.129 1.00 0.00 C ATOM 1061 C ALA A 70 -11.288 13.286 -1.398 1.00 0.00 C ATOM 1062 O ALA A 70 -11.469 12.070 -1.439 1.00 0.00 O ATOM 1063 CB ALA A 70 -9.540 14.797 -0.439 1.00 0.00 C ATOM 0 H ALA A 70 -9.810 12.236 0.594 1.00 0.00 H new ATOM 0 HA ALA A 70 -11.555 14.604 0.256 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -9.787 15.532 -1.205 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -9.214 15.311 0.465 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -8.738 14.152 -0.799 1.00 0.00 H new ATOM 1069 N GLN A 71 -11.527 14.090 -2.429 1.00 0.00 N ATOM 1070 CA GLN A 71 -12.027 13.576 -3.698 1.00 0.00 C ATOM 1071 C GLN A 71 -10.877 13.152 -4.605 1.00 0.00 C ATOM 1072 O GLN A 71 -9.708 13.384 -4.294 1.00 0.00 O ATOM 1073 CB GLN A 71 -12.883 14.632 -4.399 1.00 0.00 C ATOM 1074 CG GLN A 71 -14.348 14.595 -3.995 1.00 0.00 C ATOM 1075 CD GLN A 71 -15.111 15.821 -4.456 1.00 0.00 C ATOM 1076 OE1 GLN A 71 -15.159 16.126 -5.648 1.00 0.00 O ATOM 1077 NE2 GLN A 71 -15.715 16.532 -3.510 1.00 0.00 N ATOM 0 H GLN A 71 -11.382 15.100 -2.410 1.00 0.00 H new ATOM 0 HA GLN A 71 -12.642 12.701 -3.489 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -12.479 15.620 -4.178 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -12.809 14.491 -5.477 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -14.814 13.703 -4.414 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -14.420 14.513 -2.910 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -15.649 16.243 -2.534 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -16.245 17.367 -3.760 1.00 0.00 H new ATOM 1086 N THR A 72 -11.215 12.528 -5.730 1.00 0.00 N ATOM 1087 CA THR A 72 -10.211 12.070 -6.682 1.00 0.00 C ATOM 1088 C THR A 72 -10.786 11.989 -8.091 1.00 0.00 C ATOM 1089 O THR A 72 -12.003 11.990 -8.275 1.00 0.00 O ATOM 1090 CB THR A 72 -9.651 10.691 -6.288 1.00 0.00 C ATOM 1091 OG1 THR A 72 -10.707 9.723 -6.260 1.00 0.00 O ATOM 1092 CG2 THR A 72 -8.975 10.749 -4.926 1.00 0.00 C ATOM 0 H THR A 72 -12.177 12.328 -6.004 1.00 0.00 H new ATOM 0 HA THR A 72 -9.402 12.801 -6.664 1.00 0.00 H new ATOM 0 HB THR A 72 -8.910 10.399 -7.032 1.00 0.00 H new ATOM 0 HG1 THR A 72 -10.378 8.891 -5.859 1.00 0.00 H new ATOM 0 HG21 THR A 72 -8.588 9.763 -4.670 1.00 0.00 H new ATOM 0 HG22 THR A 72 -8.153 11.465 -4.958 1.00 0.00 H new ATOM 0 HG23 THR A 72 -9.699 11.061 -4.173 1.00 0.00 H new ATOM 1100 N GLN A 73 -9.903 11.919 -9.082 1.00 0.00 N ATOM 1101 CA GLN A 73 -10.325 11.838 -10.476 1.00 0.00 C ATOM 1102 C GLN A 73 -9.542 10.760 -11.219 1.00 0.00 C ATOM 1103 O GLN A 73 -8.338 10.603 -11.018 1.00 0.00 O ATOM 1104 CB GLN A 73 -10.138 13.189 -11.167 1.00 0.00 C ATOM 1105 CG GLN A 73 -11.099 13.420 -12.322 1.00 0.00 C ATOM 1106 CD GLN A 73 -10.737 14.638 -13.148 1.00 0.00 C ATOM 1107 OE1 GLN A 73 -10.447 14.530 -14.340 1.00 0.00 O ATOM 1108 NE2 GLN A 73 -10.751 15.807 -12.518 1.00 0.00 N ATOM 0 H GLN A 73 -8.892 11.917 -8.946 1.00 0.00 H new ATOM 0 HA GLN A 73 -11.382 11.572 -10.495 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -10.268 13.984 -10.433 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -9.115 13.260 -11.537 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -11.107 12.539 -12.964 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -12.109 13.538 -11.931 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -10.997 15.851 -11.529 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -10.515 16.661 -13.023 1.00 0.00 H new ATOM 1117 N PHE A 74 -10.234 10.020 -12.078 1.00 0.00 N ATOM 1118 CA PHE A 74 -9.604 8.956 -12.851 1.00 0.00 C ATOM 1119 C PHE A 74 -9.899 9.117 -14.340 1.00 0.00 C ATOM 1120 O PHE A 74 -11.057 9.193 -14.750 1.00 0.00 O ATOM 1121 CB PHE A 74 -10.093 7.588 -12.368 1.00 0.00 C ATOM 1122 CG PHE A 74 -9.659 7.256 -10.969 1.00 0.00 C ATOM 1123 CD1 PHE A 74 -10.332 7.782 -9.878 1.00 0.00 C ATOM 1124 CD2 PHE A 74 -8.578 6.419 -10.745 1.00 0.00 C ATOM 1125 CE1 PHE A 74 -9.934 7.479 -8.590 1.00 0.00 C ATOM 1126 CE2 PHE A 74 -8.176 6.112 -9.459 1.00 0.00 C ATOM 1127 CZ PHE A 74 -8.856 6.642 -8.380 1.00 0.00 C ATOM 0 H PHE A 74 -11.231 10.137 -12.257 1.00 0.00 H new ATOM 0 HA PHE A 74 -8.526 9.023 -12.703 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -11.182 7.562 -12.418 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -9.724 6.819 -13.047 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -11.177 8.436 -10.036 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -8.043 6.002 -11.585 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -10.466 7.897 -7.748 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -7.331 5.459 -9.298 1.00 0.00 H new ATOM 0 HZ PHE A 74 -8.545 6.402 -7.374 1.00 0.00 H new ATOM 1137 N ASP A 75 -8.842 9.169 -15.143 1.00 0.00 N ATOM 1138 CA ASP A 75 -8.986 9.321 -16.586 1.00 0.00 C ATOM 1139 C ASP A 75 -8.105 8.320 -17.328 1.00 0.00 C ATOM 1140 O ASP A 75 -7.002 8.651 -17.763 1.00 0.00 O ATOM 1141 CB ASP A 75 -8.627 10.746 -17.009 1.00 0.00 C ATOM 1142 CG ASP A 75 -9.396 11.198 -18.235 1.00 0.00 C ATOM 1143 OD1 ASP A 75 -9.662 10.351 -19.113 1.00 0.00 O ATOM 1144 OD2 ASP A 75 -9.732 12.398 -18.317 1.00 0.00 O ATOM 0 H ASP A 75 -7.877 9.108 -14.819 1.00 0.00 H new ATOM 0 HA ASP A 75 -10.026 9.125 -16.845 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -8.831 11.429 -16.184 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -7.558 10.803 -17.213 1.00 0.00 H new ATOM 1149 N VAL A 76 -8.600 7.094 -17.469 1.00 0.00 N ATOM 1150 CA VAL A 76 -7.858 6.045 -18.158 1.00 0.00 C ATOM 1151 C VAL A 76 -7.414 6.505 -19.542 1.00 0.00 C ATOM 1152 O VAL A 76 -6.344 6.126 -20.020 1.00 0.00 O ATOM 1153 CB VAL A 76 -8.701 4.764 -18.301 1.00 0.00 C ATOM 1154 CG1 VAL A 76 -7.937 3.707 -19.084 1.00 0.00 C ATOM 1155 CG2 VAL A 76 -9.105 4.237 -16.932 1.00 0.00 C ATOM 0 H VAL A 76 -9.511 6.803 -17.115 1.00 0.00 H new ATOM 0 HA VAL A 76 -6.979 5.827 -17.551 1.00 0.00 H new ATOM 0 HB VAL A 76 -9.608 5.006 -18.854 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -8.548 2.809 -19.175 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -7.703 4.089 -20.078 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -7.012 3.465 -18.561 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -9.700 3.332 -17.052 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -8.211 4.009 -16.351 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -9.694 4.992 -16.411 1.00 0.00 H new ATOM 1165 N LYS A 77 -8.241 7.324 -20.181 1.00 0.00 N ATOM 1166 CA LYS A 77 -7.934 7.839 -21.510 1.00 0.00 C ATOM 1167 C LYS A 77 -6.523 8.417 -21.557 1.00 0.00 C ATOM 1168 O LYS A 77 -5.724 8.059 -22.421 1.00 0.00 O ATOM 1169 CB LYS A 77 -8.949 8.911 -21.912 1.00 0.00 C ATOM 1170 CG LYS A 77 -9.140 9.036 -23.414 1.00 0.00 C ATOM 1171 CD LYS A 77 -10.253 10.012 -23.755 1.00 0.00 C ATOM 1172 CE LYS A 77 -10.925 9.653 -25.072 1.00 0.00 C ATOM 1173 NZ LYS A 77 -10.172 10.183 -26.242 1.00 0.00 N ATOM 0 H LYS A 77 -9.131 7.646 -19.800 1.00 0.00 H new ATOM 0 HA LYS A 77 -7.992 7.010 -22.215 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -9.909 8.682 -21.450 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -8.626 9.873 -21.514 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -8.209 9.369 -23.874 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -9.371 8.058 -23.835 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -10.994 10.014 -22.956 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -9.847 11.022 -23.816 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -11.007 8.569 -25.154 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -11.940 10.051 -25.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -10.662 9.917 -27.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -10.115 11.219 -26.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -9.212 9.783 -26.247 1.00 0.00 H new ATOM 1187 N ASN A 78 -6.224 9.312 -20.621 1.00 0.00 N ATOM 1188 CA ASN A 78 -4.909 9.939 -20.556 1.00 0.00 C ATOM 1189 C ASN A 78 -4.089 9.364 -19.405 1.00 0.00 C ATOM 1190 O ASN A 78 -3.038 9.899 -19.050 1.00 0.00 O ATOM 1191 CB ASN A 78 -5.050 11.453 -20.389 1.00 0.00 C ATOM 1192 CG ASN A 78 -5.399 12.148 -21.692 1.00 0.00 C ATOM 1193 OD1 ASN A 78 -4.518 12.496 -22.478 1.00 0.00 O ATOM 1194 ND2 ASN A 78 -6.690 12.354 -21.925 1.00 0.00 N ATOM 0 H ASN A 78 -6.874 9.619 -19.898 1.00 0.00 H new ATOM 0 HA ASN A 78 -4.388 9.730 -21.490 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -5.822 11.664 -19.649 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -4.117 11.862 -20.001 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -6.986 12.818 -22.784 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -7.386 12.048 -21.245 1.00 0.00 H new ATOM 1201 N ASP A 79 -4.576 8.272 -18.827 1.00 0.00 N ATOM 1202 CA ASP A 79 -3.888 7.623 -17.717 1.00 0.00 C ATOM 1203 C ASP A 79 -3.454 8.646 -16.673 1.00 0.00 C ATOM 1204 O ASP A 79 -2.384 8.524 -16.077 1.00 0.00 O ATOM 1205 CB ASP A 79 -2.671 6.848 -18.227 1.00 0.00 C ATOM 1206 CG ASP A 79 -2.372 5.622 -17.387 1.00 0.00 C ATOM 1207 OD1 ASP A 79 -3.250 5.215 -16.597 1.00 0.00 O ATOM 1208 OD2 ASP A 79 -1.261 5.068 -17.521 1.00 0.00 O ATOM 0 H ASP A 79 -5.445 7.817 -19.109 1.00 0.00 H new ATOM 0 HA ASP A 79 -4.583 6.926 -17.249 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -2.844 6.544 -19.259 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -1.801 7.504 -18.229 1.00 0.00 H new ATOM 1213 N ARG A 80 -4.291 9.656 -16.458 1.00 0.00 N ATOM 1214 CA ARG A 80 -3.993 10.702 -15.487 1.00 0.00 C ATOM 1215 C ARG A 80 -4.816 10.515 -14.216 1.00 0.00 C ATOM 1216 O ARG A 80 -6.035 10.349 -14.272 1.00 0.00 O ATOM 1217 CB ARG A 80 -4.272 12.080 -16.090 1.00 0.00 C ATOM 1218 CG ARG A 80 -5.653 12.205 -16.712 1.00 0.00 C ATOM 1219 CD ARG A 80 -5.943 13.634 -17.142 1.00 0.00 C ATOM 1220 NE ARG A 80 -5.038 14.083 -18.197 1.00 0.00 N ATOM 1221 CZ ARG A 80 -5.244 15.174 -18.927 1.00 0.00 C ATOM 1222 NH1 ARG A 80 -6.317 15.923 -18.718 1.00 0.00 N ATOM 1223 NH2 ARG A 80 -4.374 15.517 -19.868 1.00 0.00 N ATOM 0 H ARG A 80 -5.181 9.772 -16.943 1.00 0.00 H new ATOM 0 HA ARG A 80 -2.936 10.633 -15.228 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -4.163 12.836 -15.312 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -3.520 12.294 -16.850 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -5.726 11.542 -17.574 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -6.407 11.879 -15.995 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -6.972 13.705 -17.493 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -5.853 14.297 -16.281 1.00 0.00 H new ATOM 0 HE ARG A 80 -4.202 13.529 -18.384 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -6.988 15.663 -17.995 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -6.472 16.760 -19.280 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -3.547 14.943 -20.031 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -4.532 16.355 -20.428 1.00 0.00 H new ATOM 1237 N TYR A 81 -4.142 10.542 -13.072 1.00 0.00 N ATOM 1238 CA TYR A 81 -4.810 10.372 -11.787 1.00 0.00 C ATOM 1239 C TYR A 81 -4.640 11.614 -10.917 1.00 0.00 C ATOM 1240 O TYR A 81 -3.524 11.972 -10.538 1.00 0.00 O ATOM 1241 CB TYR A 81 -4.257 9.146 -11.059 1.00 0.00 C ATOM 1242 CG TYR A 81 -4.428 7.856 -11.830 1.00 0.00 C ATOM 1243 CD1 TYR A 81 -3.787 7.663 -13.048 1.00 0.00 C ATOM 1244 CD2 TYR A 81 -5.230 6.832 -11.342 1.00 0.00 C ATOM 1245 CE1 TYR A 81 -3.941 6.487 -13.757 1.00 0.00 C ATOM 1246 CE2 TYR A 81 -5.387 5.652 -12.043 1.00 0.00 C ATOM 1247 CZ TYR A 81 -4.741 5.484 -13.250 1.00 0.00 C ATOM 1248 OH TYR A 81 -4.897 4.311 -13.952 1.00 0.00 O ATOM 0 H TYR A 81 -3.133 10.680 -13.008 1.00 0.00 H new ATOM 0 HA TYR A 81 -5.873 10.225 -11.975 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -3.197 9.301 -10.857 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -4.755 9.052 -10.094 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -3.158 8.445 -13.447 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -5.739 6.961 -10.398 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -3.438 6.354 -14.703 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -6.012 4.865 -11.648 1.00 0.00 H new ATOM 0 HH TYR A 81 -4.436 4.382 -14.814 1.00 0.00 H new ATOM 1258 N ILE A 82 -5.754 12.265 -10.603 1.00 0.00 N ATOM 1259 CA ILE A 82 -5.730 13.465 -9.775 1.00 0.00 C ATOM 1260 C ILE A 82 -6.330 13.197 -8.399 1.00 0.00 C ATOM 1261 O ILE A 82 -7.302 12.453 -8.268 1.00 0.00 O ATOM 1262 CB ILE A 82 -6.497 14.623 -10.440 1.00 0.00 C ATOM 1263 CG1 ILE A 82 -5.996 14.841 -11.870 1.00 0.00 C ATOM 1264 CG2 ILE A 82 -6.349 15.896 -9.621 1.00 0.00 C ATOM 1265 CD1 ILE A 82 -7.026 15.473 -12.781 1.00 0.00 C ATOM 0 H ILE A 82 -6.685 11.982 -10.909 1.00 0.00 H new ATOM 0 HA ILE A 82 -4.684 13.749 -9.663 1.00 0.00 H new ATOM 0 HB ILE A 82 -7.555 14.362 -10.481 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.109 15.474 -11.843 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -5.691 13.882 -12.290 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -6.897 16.705 -10.104 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -6.750 15.733 -8.620 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -5.295 16.163 -9.551 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -6.603 15.598 -13.778 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -7.905 14.830 -12.838 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -7.314 16.447 -12.385 1.00 0.00 H new ATOM 1277 N VAL A 83 -5.744 13.809 -7.375 1.00 0.00 N ATOM 1278 CA VAL A 83 -6.222 13.639 -6.008 1.00 0.00 C ATOM 1279 C VAL A 83 -6.647 14.973 -5.404 1.00 0.00 C ATOM 1280 O VAL A 83 -5.809 15.770 -4.984 1.00 0.00 O ATOM 1281 CB VAL A 83 -5.144 13.002 -5.112 1.00 0.00 C ATOM 1282 CG1 VAL A 83 -5.647 12.873 -3.682 1.00 0.00 C ATOM 1283 CG2 VAL A 83 -4.726 11.647 -5.663 1.00 0.00 C ATOM 0 H VAL A 83 -4.938 14.427 -7.466 1.00 0.00 H new ATOM 0 HA VAL A 83 -7.084 12.974 -6.055 1.00 0.00 H new ATOM 0 HB VAL A 83 -4.269 13.652 -5.107 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -4.872 12.421 -3.063 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -5.892 13.861 -3.292 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -6.538 12.245 -3.665 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -3.964 11.211 -5.017 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -5.592 10.986 -5.699 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -4.323 11.772 -6.668 1.00 0.00 H new ATOM 1293 N ASN A 84 -7.954 15.209 -5.364 1.00 0.00 N ATOM 1294 CA ASN A 84 -8.490 16.448 -4.811 1.00 0.00 C ATOM 1295 C ASN A 84 -7.654 16.922 -3.627 1.00 0.00 C ATOM 1296 O ASN A 84 -7.287 16.134 -2.757 1.00 0.00 O ATOM 1297 CB ASN A 84 -9.944 16.249 -4.376 1.00 0.00 C ATOM 1298 CG ASN A 84 -10.790 17.486 -4.607 1.00 0.00 C ATOM 1299 OD1 ASN A 84 -10.897 18.350 -3.737 1.00 0.00 O ATOM 1300 ND2 ASN A 84 -11.398 17.575 -5.785 1.00 0.00 N ATOM 0 H ASN A 84 -8.661 14.559 -5.708 1.00 0.00 H new ATOM 0 HA ASN A 84 -8.451 17.211 -5.589 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -10.373 15.411 -4.925 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -9.971 15.985 -3.319 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -11.982 18.384 -5.998 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -11.281 16.835 -6.477 1.00 0.00 H new ATOM 1307 N GLY A 85 -7.355 18.218 -3.601 1.00 0.00 N ATOM 1308 CA GLY A 85 -6.564 18.775 -2.520 1.00 0.00 C ATOM 1309 C GLY A 85 -5.091 18.861 -2.863 1.00 0.00 C ATOM 1310 O GLY A 85 -4.653 18.331 -3.885 1.00 0.00 O ATOM 0 H GLY A 85 -7.647 18.891 -4.309 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -6.936 19.771 -2.278 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -6.691 18.162 -1.628 1.00 0.00 H new ATOM 1314 N SER A 86 -4.323 19.531 -2.010 1.00 0.00 N ATOM 1315 CA SER A 86 -2.891 19.689 -2.231 1.00 0.00 C ATOM 1316 C SER A 86 -2.096 18.720 -1.361 1.00 0.00 C ATOM 1317 O SER A 86 -2.147 18.786 -0.132 1.00 0.00 O ATOM 1318 CB SER A 86 -2.463 21.127 -1.934 1.00 0.00 C ATOM 1319 OG SER A 86 -1.060 21.215 -1.754 1.00 0.00 O ATOM 0 H SER A 86 -4.669 19.973 -1.159 1.00 0.00 H new ATOM 0 HA SER A 86 -2.684 19.464 -3.277 1.00 0.00 H new ATOM 0 HB2 SER A 86 -2.769 21.777 -2.753 1.00 0.00 H new ATOM 0 HB3 SER A 86 -2.971 21.483 -1.038 1.00 0.00 H new ATOM 0 HG SER A 86 -0.812 22.144 -1.567 1.00 0.00 H new ATOM 1325 N HIS A 87 -1.362 17.819 -2.007 1.00 0.00 N ATOM 1326 CA HIS A 87 -0.556 16.836 -1.293 1.00 0.00 C ATOM 1327 C HIS A 87 0.831 16.715 -1.917 1.00 0.00 C ATOM 1328 O HIS A 87 0.971 16.682 -3.139 1.00 0.00 O ATOM 1329 CB HIS A 87 -1.251 15.474 -1.299 1.00 0.00 C ATOM 1330 CG HIS A 87 -2.737 15.560 -1.138 1.00 0.00 C ATOM 1331 ND1 HIS A 87 -3.346 15.940 0.040 1.00 0.00 N ATOM 1332 CD2 HIS A 87 -3.739 15.313 -2.015 1.00 0.00 C ATOM 1333 CE1 HIS A 87 -4.657 15.922 -0.119 1.00 0.00 C ATOM 1334 NE2 HIS A 87 -4.922 15.545 -1.358 1.00 0.00 N ATOM 0 H HIS A 87 -1.309 17.750 -3.023 1.00 0.00 H new ATOM 0 HA HIS A 87 -0.444 17.174 -0.263 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -1.024 14.964 -2.235 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -0.841 14.863 -0.495 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -3.628 14.993 -3.041 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -5.388 16.173 0.635 1.00 0.00 H new ATOM 0 HE2 HIS A 87 -5.854 15.443 -1.760 1.00 0.00 H new ATOM 1342 N GLU A 88 1.853 16.651 -1.068 1.00 0.00 N ATOM 1343 CA GLU A 88 3.229 16.535 -1.538 1.00 0.00 C ATOM 1344 C GLU A 88 3.664 15.074 -1.592 1.00 0.00 C ATOM 1345 O GLU A 88 3.209 14.249 -0.800 1.00 0.00 O ATOM 1346 CB GLU A 88 4.170 17.325 -0.626 1.00 0.00 C ATOM 1347 CG GLU A 88 4.330 16.718 0.757 1.00 0.00 C ATOM 1348 CD GLU A 88 4.604 17.761 1.824 1.00 0.00 C ATOM 1349 OE1 GLU A 88 5.731 18.296 1.855 1.00 0.00 O ATOM 1350 OE2 GLU A 88 3.689 18.041 2.627 1.00 0.00 O ATOM 0 H GLU A 88 1.754 16.677 -0.053 1.00 0.00 H new ATOM 0 HA GLU A 88 3.278 16.948 -2.545 1.00 0.00 H new ATOM 0 HB2 GLU A 88 5.149 17.392 -1.099 1.00 0.00 H new ATOM 0 HB3 GLU A 88 3.794 18.343 -0.525 1.00 0.00 H new ATOM 0 HG2 GLU A 88 3.425 16.168 1.015 1.00 0.00 H new ATOM 0 HG3 GLU A 88 5.147 15.997 0.741 1.00 0.00 H new ATOM 1357 N ALA A 89 4.548 14.760 -2.534 1.00 0.00 N ATOM 1358 CA ALA A 89 5.046 13.400 -2.692 1.00 0.00 C ATOM 1359 C ALA A 89 5.563 12.847 -1.368 1.00 0.00 C ATOM 1360 O ALA A 89 5.211 11.739 -0.968 1.00 0.00 O ATOM 1361 CB ALA A 89 6.141 13.358 -3.748 1.00 0.00 C ATOM 0 H ALA A 89 4.934 15.430 -3.199 1.00 0.00 H new ATOM 0 HA ALA A 89 4.217 12.772 -3.019 1.00 0.00 H new ATOM 0 HB1 ALA A 89 6.504 12.336 -3.855 1.00 0.00 H new ATOM 0 HB2 ALA A 89 5.741 13.703 -4.701 1.00 0.00 H new ATOM 0 HB3 ALA A 89 6.964 14.005 -3.445 1.00 0.00 H new ATOM 1367 N ASN A 90 6.402 13.627 -0.694 1.00 0.00 N ATOM 1368 CA ASN A 90 6.968 13.215 0.585 1.00 0.00 C ATOM 1369 C ASN A 90 5.897 12.606 1.484 1.00 0.00 C ATOM 1370 O ASN A 90 6.159 11.662 2.230 1.00 0.00 O ATOM 1371 CB ASN A 90 7.621 14.408 1.286 1.00 0.00 C ATOM 1372 CG ASN A 90 8.539 15.189 0.365 1.00 0.00 C ATOM 1373 OD1 ASN A 90 9.546 14.667 -0.113 1.00 0.00 O ATOM 1374 ND2 ASN A 90 8.193 16.446 0.112 1.00 0.00 N ATOM 0 H ASN A 90 6.705 14.548 -1.012 1.00 0.00 H new ATOM 0 HA ASN A 90 7.727 12.457 0.390 1.00 0.00 H new ATOM 0 HB2 ASN A 90 6.845 15.071 1.668 1.00 0.00 H new ATOM 0 HB3 ASN A 90 8.189 14.054 2.146 1.00 0.00 H new ATOM 0 HD21 ASN A 90 8.771 17.021 -0.501 1.00 0.00 H new ATOM 0 HD22 ASN A 90 7.349 16.837 0.531 1.00 0.00 H new ATOM 1381 N LYS A 91 4.688 13.153 1.408 1.00 0.00 N ATOM 1382 CA LYS A 91 3.575 12.664 2.212 1.00 0.00 C ATOM 1383 C LYS A 91 2.950 11.424 1.580 1.00 0.00 C ATOM 1384 O LYS A 91 2.728 10.417 2.253 1.00 0.00 O ATOM 1385 CB LYS A 91 2.516 13.757 2.372 1.00 0.00 C ATOM 1386 CG LYS A 91 1.343 13.345 3.246 1.00 0.00 C ATOM 1387 CD LYS A 91 0.499 14.543 3.647 1.00 0.00 C ATOM 1388 CE LYS A 91 -0.798 14.112 4.316 1.00 0.00 C ATOM 1389 NZ LYS A 91 -1.817 15.197 4.300 1.00 0.00 N ATOM 0 H LYS A 91 4.455 13.936 0.797 1.00 0.00 H new ATOM 0 HA LYS A 91 3.961 12.394 3.195 1.00 0.00 H new ATOM 0 HB2 LYS A 91 2.983 14.644 2.800 1.00 0.00 H new ATOM 0 HB3 LYS A 91 2.143 14.037 1.387 1.00 0.00 H new ATOM 0 HG2 LYS A 91 0.724 12.626 2.710 1.00 0.00 H new ATOM 0 HG3 LYS A 91 1.713 12.844 4.140 1.00 0.00 H new ATOM 0 HD2 LYS A 91 1.067 15.178 4.327 1.00 0.00 H new ATOM 0 HD3 LYS A 91 0.273 15.142 2.765 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -1.195 13.234 3.807 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -0.595 13.819 5.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -2.686 14.864 4.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -1.449 16.027 4.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -2.029 15.459 3.316 1.00 0.00 H new ATOM 1403 N LEU A 92 2.669 11.505 0.284 1.00 0.00 N ATOM 1404 CA LEU A 92 2.071 10.388 -0.440 1.00 0.00 C ATOM 1405 C LEU A 92 2.849 9.100 -0.193 1.00 0.00 C ATOM 1406 O LEU A 92 2.269 8.070 0.149 1.00 0.00 O ATOM 1407 CB LEU A 92 2.026 10.692 -1.938 1.00 0.00 C ATOM 1408 CG LEU A 92 0.988 11.723 -2.384 1.00 0.00 C ATOM 1409 CD1 LEU A 92 1.221 12.123 -3.832 1.00 0.00 C ATOM 1410 CD2 LEU A 92 -0.420 11.176 -2.199 1.00 0.00 C ATOM 0 H LEU A 92 2.845 12.332 -0.287 1.00 0.00 H new ATOM 0 HA LEU A 92 1.054 10.251 -0.073 1.00 0.00 H new ATOM 0 HB2 LEU A 92 3.011 11.041 -2.247 1.00 0.00 H new ATOM 0 HB3 LEU A 92 1.836 9.761 -2.472 1.00 0.00 H new ATOM 0 HG LEU A 92 1.096 12.612 -1.762 1.00 0.00 H new ATOM 0 HD11 LEU A 92 0.473 12.857 -4.132 1.00 0.00 H new ATOM 0 HD12 LEU A 92 2.216 12.556 -3.934 1.00 0.00 H new ATOM 0 HD13 LEU A 92 1.141 11.243 -4.470 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -1.146 11.923 -2.521 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -0.540 10.272 -2.796 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -0.584 10.941 -1.147 1.00 0.00 H new ATOM 1422 N GLN A 93 4.165 9.167 -0.368 1.00 0.00 N ATOM 1423 CA GLN A 93 5.023 8.006 -0.163 1.00 0.00 C ATOM 1424 C GLN A 93 4.897 7.482 1.264 1.00 0.00 C ATOM 1425 O GLN A 93 4.844 6.272 1.489 1.00 0.00 O ATOM 1426 CB GLN A 93 6.480 8.362 -0.461 1.00 0.00 C ATOM 1427 CG GLN A 93 7.365 7.151 -0.706 1.00 0.00 C ATOM 1428 CD GLN A 93 6.728 6.142 -1.641 1.00 0.00 C ATOM 1429 OE1 GLN A 93 5.981 5.263 -1.210 1.00 0.00 O ATOM 1430 NE2 GLN A 93 7.021 6.264 -2.931 1.00 0.00 N ATOM 0 H GLN A 93 4.660 10.013 -0.651 1.00 0.00 H new ATOM 0 HA GLN A 93 4.701 7.222 -0.849 1.00 0.00 H new ATOM 0 HB2 GLN A 93 6.515 9.010 -1.337 1.00 0.00 H new ATOM 0 HB3 GLN A 93 6.884 8.933 0.375 1.00 0.00 H new ATOM 0 HG2 GLN A 93 8.316 7.480 -1.126 1.00 0.00 H new ATOM 0 HG3 GLN A 93 7.586 6.669 0.246 1.00 0.00 H new ATOM 0 HE21 GLN A 93 7.645 7.008 -3.244 1.00 0.00 H new ATOM 0 HE22 GLN A 93 6.622 5.614 -3.608 1.00 0.00 H new ATOM 1439 N ASP A 94 4.850 8.399 2.224 1.00 0.00 N ATOM 1440 CA ASP A 94 4.731 8.029 3.629 1.00 0.00 C ATOM 1441 C ASP A 94 3.463 7.216 3.871 1.00 0.00 C ATOM 1442 O ASP A 94 3.487 6.204 4.572 1.00 0.00 O ATOM 1443 CB ASP A 94 4.724 9.280 4.509 1.00 0.00 C ATOM 1444 CG ASP A 94 6.122 9.790 4.802 1.00 0.00 C ATOM 1445 OD1 ASP A 94 7.039 9.495 4.008 1.00 0.00 O ATOM 1446 OD2 ASP A 94 6.299 10.482 5.826 1.00 0.00 O ATOM 0 H ASP A 94 4.893 9.404 2.055 1.00 0.00 H new ATOM 0 HA ASP A 94 5.592 7.414 3.891 1.00 0.00 H new ATOM 0 HB2 ASP A 94 4.150 10.064 4.016 1.00 0.00 H new ATOM 0 HB3 ASP A 94 4.217 9.057 5.448 1.00 0.00 H new ATOM 1451 N MET A 95 2.357 7.666 3.288 1.00 0.00 N ATOM 1452 CA MET A 95 1.079 6.979 3.440 1.00 0.00 C ATOM 1453 C MET A 95 1.064 5.677 2.646 1.00 0.00 C ATOM 1454 O MET A 95 0.814 4.604 3.198 1.00 0.00 O ATOM 1455 CB MET A 95 -0.067 7.883 2.982 1.00 0.00 C ATOM 1456 CG MET A 95 -0.536 8.858 4.050 1.00 0.00 C ATOM 1457 SD MET A 95 -2.271 9.311 3.864 1.00 0.00 S ATOM 1458 CE MET A 95 -2.285 9.908 2.176 1.00 0.00 C ATOM 0 H MET A 95 2.319 8.503 2.706 1.00 0.00 H new ATOM 0 HA MET A 95 0.945 6.741 4.495 1.00 0.00 H new ATOM 0 HB2 MET A 95 0.253 8.445 2.104 1.00 0.00 H new ATOM 0 HB3 MET A 95 -0.908 7.262 2.674 1.00 0.00 H new ATOM 0 HG2 MET A 95 -0.384 8.414 5.034 1.00 0.00 H new ATOM 0 HG3 MET A 95 0.077 9.758 4.009 1.00 0.00 H new ATOM 0 HE1 MET A 95 -3.253 9.694 1.722 1.00 0.00 H new ATOM 0 HE2 MET A 95 -2.111 10.984 2.169 1.00 0.00 H new ATOM 0 HE3 MET A 95 -1.500 9.410 1.607 1.00 0.00 H new ATOM 1468 N LEU A 96 1.332 5.777 1.348 1.00 0.00 N ATOM 1469 CA LEU A 96 1.349 4.607 0.478 1.00 0.00 C ATOM 1470 C LEU A 96 1.935 3.398 1.201 1.00 0.00 C ATOM 1471 O LEU A 96 1.465 2.273 1.032 1.00 0.00 O ATOM 1472 CB LEU A 96 2.157 4.899 -0.787 1.00 0.00 C ATOM 1473 CG LEU A 96 2.055 3.860 -1.904 1.00 0.00 C ATOM 1474 CD1 LEU A 96 0.605 3.664 -2.319 1.00 0.00 C ATOM 1475 CD2 LEU A 96 2.901 4.276 -3.099 1.00 0.00 C ATOM 0 H LEU A 96 1.540 6.657 0.876 1.00 0.00 H new ATOM 0 HA LEU A 96 0.320 4.378 0.200 1.00 0.00 H new ATOM 0 HB2 LEU A 96 1.837 5.862 -1.184 1.00 0.00 H new ATOM 0 HB3 LEU A 96 3.206 5.002 -0.508 1.00 0.00 H new ATOM 0 HG LEU A 96 2.436 2.911 -1.527 1.00 0.00 H new ATOM 0 HD11 LEU A 96 0.552 2.921 -3.115 1.00 0.00 H new ATOM 0 HD12 LEU A 96 0.025 3.321 -1.463 1.00 0.00 H new ATOM 0 HD13 LEU A 96 0.198 4.610 -2.677 1.00 0.00 H new ATOM 0 HD21 LEU A 96 2.816 3.525 -3.884 1.00 0.00 H new ATOM 0 HD22 LEU A 96 2.550 5.236 -3.476 1.00 0.00 H new ATOM 0 HD23 LEU A 96 3.943 4.365 -2.793 1.00 0.00 H new ATOM 1487 N ASP A 97 2.961 3.640 2.009 1.00 0.00 N ATOM 1488 CA ASP A 97 3.610 2.572 2.761 1.00 0.00 C ATOM 1489 C ASP A 97 2.576 1.612 3.342 1.00 0.00 C ATOM 1490 O ASP A 97 2.648 0.402 3.128 1.00 0.00 O ATOM 1491 CB ASP A 97 4.467 3.158 3.884 1.00 0.00 C ATOM 1492 CG ASP A 97 5.341 2.114 4.550 1.00 0.00 C ATOM 1493 OD1 ASP A 97 6.242 1.575 3.873 1.00 0.00 O ATOM 1494 OD2 ASP A 97 5.124 1.834 5.748 1.00 0.00 O ATOM 0 H ASP A 97 3.361 4.566 2.160 1.00 0.00 H new ATOM 0 HA ASP A 97 4.252 2.017 2.077 1.00 0.00 H new ATOM 0 HB2 ASP A 97 5.097 3.951 3.481 1.00 0.00 H new ATOM 0 HB3 ASP A 97 3.818 3.615 4.631 1.00 0.00 H new ATOM 1499 N GLY A 98 1.615 2.160 4.080 1.00 0.00 N ATOM 1500 CA GLY A 98 0.582 1.338 4.682 1.00 0.00 C ATOM 1501 C GLY A 98 0.007 0.326 3.710 1.00 0.00 C ATOM 1502 O GLY A 98 -0.233 -0.826 4.072 1.00 0.00 O ATOM 0 H GLY A 98 1.534 3.159 4.271 1.00 0.00 H new ATOM 0 HA2 GLY A 98 0.995 0.815 5.545 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -0.219 1.979 5.051 1.00 0.00 H new ATOM 1506 N PHE A 99 -0.217 0.757 2.473 1.00 0.00 N ATOM 1507 CA PHE A 99 -0.770 -0.119 1.447 1.00 0.00 C ATOM 1508 C PHE A 99 0.222 -1.217 1.077 1.00 0.00 C ATOM 1509 O PHE A 99 -0.064 -2.405 1.231 1.00 0.00 O ATOM 1510 CB PHE A 99 -1.141 0.690 0.202 1.00 0.00 C ATOM 1511 CG PHE A 99 -1.572 -0.160 -0.958 1.00 0.00 C ATOM 1512 CD1 PHE A 99 -2.891 -0.566 -1.084 1.00 0.00 C ATOM 1513 CD2 PHE A 99 -0.659 -0.554 -1.923 1.00 0.00 C ATOM 1514 CE1 PHE A 99 -3.292 -1.348 -2.151 1.00 0.00 C ATOM 1515 CE2 PHE A 99 -1.054 -1.335 -2.992 1.00 0.00 C ATOM 1516 CZ PHE A 99 -2.372 -1.734 -3.106 1.00 0.00 C ATOM 0 H PHE A 99 -0.024 1.707 2.157 1.00 0.00 H new ATOM 0 HA PHE A 99 -1.669 -0.587 1.849 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -1.945 1.381 0.454 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -0.284 1.293 -0.098 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -3.614 -0.268 -0.340 1.00 0.00 H new ATOM 0 HD2 PHE A 99 0.373 -0.247 -1.839 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -4.323 -1.657 -2.238 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -0.333 -1.634 -3.738 1.00 0.00 H new ATOM 0 HZ PHE A 99 -2.682 -2.346 -3.940 1.00 0.00 H new ATOM 1526 N ILE A 100 1.389 -0.812 0.587 1.00 0.00 N ATOM 1527 CA ILE A 100 2.424 -1.761 0.195 1.00 0.00 C ATOM 1528 C ILE A 100 2.852 -2.626 1.375 1.00 0.00 C ATOM 1529 O ILE A 100 3.401 -3.713 1.196 1.00 0.00 O ATOM 1530 CB ILE A 100 3.660 -1.042 -0.375 1.00 0.00 C ATOM 1531 CG1 ILE A 100 3.241 -0.029 -1.443 1.00 0.00 C ATOM 1532 CG2 ILE A 100 4.642 -2.051 -0.951 1.00 0.00 C ATOM 1533 CD1 ILE A 100 4.405 0.713 -2.062 1.00 0.00 C ATOM 0 H ILE A 100 1.641 0.167 0.452 1.00 0.00 H new ATOM 0 HA ILE A 100 1.993 -2.395 -0.580 1.00 0.00 H new ATOM 0 HB ILE A 100 4.154 -0.505 0.435 1.00 0.00 H new ATOM 0 HG12 ILE A 100 2.692 -0.548 -2.229 1.00 0.00 H new ATOM 0 HG13 ILE A 100 2.556 0.693 -0.999 1.00 0.00 H new ATOM 0 HG21 ILE A 100 5.510 -1.527 -1.350 1.00 0.00 H new ATOM 0 HG22 ILE A 100 4.961 -2.737 -0.166 1.00 0.00 H new ATOM 0 HG23 ILE A 100 4.159 -2.613 -1.750 1.00 0.00 H new ATOM 0 HD11 ILE A 100 4.034 1.414 -2.810 1.00 0.00 H new ATOM 0 HD12 ILE A 100 4.941 1.260 -1.287 1.00 0.00 H new ATOM 0 HD13 ILE A 100 5.080 0.000 -2.536 1.00 0.00 H new ATOM 1545 N LYS A 101 2.595 -2.137 2.584 1.00 0.00 N ATOM 1546 CA LYS A 101 2.950 -2.866 3.796 1.00 0.00 C ATOM 1547 C LYS A 101 2.234 -4.212 3.851 1.00 0.00 C ATOM 1548 O LYS A 101 2.722 -5.162 4.464 1.00 0.00 O ATOM 1549 CB LYS A 101 2.599 -2.038 5.034 1.00 0.00 C ATOM 1550 CG LYS A 101 3.730 -1.142 5.508 1.00 0.00 C ATOM 1551 CD LYS A 101 4.836 -1.944 6.173 1.00 0.00 C ATOM 1552 CE LYS A 101 5.959 -1.044 6.664 1.00 0.00 C ATOM 1553 NZ LYS A 101 6.941 -0.743 5.586 1.00 0.00 N ATOM 0 H LYS A 101 2.142 -1.238 2.750 1.00 0.00 H new ATOM 0 HA LYS A 101 4.025 -3.047 3.780 1.00 0.00 H new ATOM 0 HB2 LYS A 101 1.727 -1.422 4.813 1.00 0.00 H new ATOM 0 HB3 LYS A 101 2.317 -2.712 5.843 1.00 0.00 H new ATOM 0 HG2 LYS A 101 4.138 -0.591 4.661 1.00 0.00 H new ATOM 0 HG3 LYS A 101 3.341 -0.405 6.210 1.00 0.00 H new ATOM 0 HD2 LYS A 101 4.425 -2.506 7.012 1.00 0.00 H new ATOM 0 HD3 LYS A 101 5.234 -2.672 5.466 1.00 0.00 H new ATOM 0 HE2 LYS A 101 5.538 -0.112 7.042 1.00 0.00 H new ATOM 0 HE3 LYS A 101 6.471 -1.524 7.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 7.867 -1.144 5.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 6.614 -1.162 4.692 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 7.029 0.287 5.474 1.00 0.00 H new ATOM 1567 N LYS A 102 1.075 -4.287 3.205 1.00 0.00 N ATOM 1568 CA LYS A 102 0.293 -5.517 3.178 1.00 0.00 C ATOM 1569 C LYS A 102 -0.201 -5.817 1.766 1.00 0.00 C ATOM 1570 O LYS A 102 0.012 -6.911 1.243 1.00 0.00 O ATOM 1571 CB LYS A 102 -0.897 -5.410 4.134 1.00 0.00 C ATOM 1572 CG LYS A 102 -1.807 -4.230 3.843 1.00 0.00 C ATOM 1573 CD LYS A 102 -2.689 -3.898 5.035 1.00 0.00 C ATOM 1574 CE LYS A 102 -1.908 -3.177 6.122 1.00 0.00 C ATOM 1575 NZ LYS A 102 -1.762 -1.724 5.830 1.00 0.00 N ATOM 0 H LYS A 102 0.657 -3.510 2.693 1.00 0.00 H new ATOM 0 HA LYS A 102 0.938 -6.335 3.500 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -1.480 -6.329 4.079 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -0.525 -5.328 5.155 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -1.204 -3.360 3.582 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -2.432 -4.456 2.979 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -3.522 -3.275 4.710 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -3.116 -4.816 5.440 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -2.414 -3.306 7.079 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -0.921 -3.629 6.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -1.253 -1.262 6.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -1.227 -1.599 4.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -2.703 -1.294 5.728 1.00 0.00 H new ATOM 1589 N PHE A 103 -0.860 -4.838 1.155 1.00 0.00 N ATOM 1590 CA PHE A 103 -1.383 -4.997 -0.197 1.00 0.00 C ATOM 1591 C PHE A 103 -0.297 -5.494 -1.146 1.00 0.00 C ATOM 1592 O PHE A 103 -0.586 -5.974 -2.242 1.00 0.00 O ATOM 1593 CB PHE A 103 -1.952 -3.671 -0.706 1.00 0.00 C ATOM 1594 CG PHE A 103 -3.212 -3.251 -0.003 1.00 0.00 C ATOM 1595 CD1 PHE A 103 -3.159 -2.675 1.256 1.00 0.00 C ATOM 1596 CD2 PHE A 103 -4.448 -3.431 -0.602 1.00 0.00 C ATOM 1597 CE1 PHE A 103 -4.316 -2.288 1.905 1.00 0.00 C ATOM 1598 CE2 PHE A 103 -5.609 -3.045 0.042 1.00 0.00 C ATOM 1599 CZ PHE A 103 -5.542 -2.472 1.297 1.00 0.00 C ATOM 0 H PHE A 103 -1.044 -3.927 1.574 1.00 0.00 H new ATOM 0 HA PHE A 103 -2.181 -5.739 -0.165 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -1.200 -2.891 -0.584 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -2.152 -3.757 -1.774 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -2.203 -2.527 1.736 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -4.505 -3.878 -1.583 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -4.261 -1.842 2.887 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -6.567 -3.191 -0.435 1.00 0.00 H new ATOM 0 HZ PHE A 103 -6.447 -2.168 1.802 1.00 0.00 H new ATOM 1609 N VAL A 104 0.956 -5.376 -0.716 1.00 0.00 N ATOM 1610 CA VAL A 104 2.087 -5.813 -1.526 1.00 0.00 C ATOM 1611 C VAL A 104 3.003 -6.739 -0.735 1.00 0.00 C ATOM 1612 O VAL A 104 3.346 -7.830 -1.193 1.00 0.00 O ATOM 1613 CB VAL A 104 2.906 -4.614 -2.040 1.00 0.00 C ATOM 1614 CG1 VAL A 104 4.227 -5.083 -2.630 1.00 0.00 C ATOM 1615 CG2 VAL A 104 2.106 -3.823 -3.064 1.00 0.00 C ATOM 0 H VAL A 104 1.213 -4.981 0.189 1.00 0.00 H new ATOM 0 HA VAL A 104 1.676 -6.354 -2.378 1.00 0.00 H new ATOM 0 HB VAL A 104 3.125 -3.958 -1.198 1.00 0.00 H new ATOM 0 HG11 VAL A 104 4.792 -4.222 -2.988 1.00 0.00 H new ATOM 0 HG12 VAL A 104 4.803 -5.602 -1.864 1.00 0.00 H new ATOM 0 HG13 VAL A 104 4.034 -5.761 -3.461 1.00 0.00 H new ATOM 0 HG21 VAL A 104 2.700 -2.980 -3.417 1.00 0.00 H new ATOM 0 HG22 VAL A 104 1.855 -4.468 -3.906 1.00 0.00 H new ATOM 0 HG23 VAL A 104 1.189 -3.454 -2.604 1.00 0.00 H new ATOM 1625 N LEU A 105 3.397 -6.298 0.454 1.00 0.00 N ATOM 1626 CA LEU A 105 4.274 -7.089 1.311 1.00 0.00 C ATOM 1627 C LEU A 105 3.499 -8.206 2.002 1.00 0.00 C ATOM 1628 O LEU A 105 2.327 -8.043 2.344 1.00 0.00 O ATOM 1629 CB LEU A 105 4.941 -6.193 2.357 1.00 0.00 C ATOM 1630 CG LEU A 105 5.926 -5.153 1.820 1.00 0.00 C ATOM 1631 CD1 LEU A 105 6.385 -4.227 2.935 1.00 0.00 C ATOM 1632 CD2 LEU A 105 7.118 -5.836 1.166 1.00 0.00 C ATOM 0 H LEU A 105 3.124 -5.397 0.847 1.00 0.00 H new ATOM 0 HA LEU A 105 5.043 -7.540 0.684 1.00 0.00 H new ATOM 0 HB2 LEU A 105 4.160 -5.672 2.911 1.00 0.00 H new ATOM 0 HB3 LEU A 105 5.467 -6.829 3.069 1.00 0.00 H new ATOM 0 HG LEU A 105 5.417 -4.554 1.065 1.00 0.00 H new ATOM 0 HD11 LEU A 105 7.085 -3.494 2.534 1.00 0.00 H new ATOM 0 HD12 LEU A 105 5.523 -3.712 3.358 1.00 0.00 H new ATOM 0 HD13 LEU A 105 6.877 -4.811 3.713 1.00 0.00 H new ATOM 0 HD21 LEU A 105 7.808 -5.081 0.790 1.00 0.00 H new ATOM 0 HD22 LEU A 105 7.628 -6.460 1.900 1.00 0.00 H new ATOM 0 HD23 LEU A 105 6.773 -6.457 0.339 1.00 0.00 H new ATOM 1644 N CYS A 106 4.161 -9.339 2.207 1.00 0.00 N ATOM 1645 CA CYS A 106 3.536 -10.484 2.859 1.00 0.00 C ATOM 1646 C CYS A 106 3.681 -10.392 4.375 1.00 0.00 C ATOM 1647 O CYS A 106 4.755 -10.106 4.905 1.00 0.00 O ATOM 1648 CB CYS A 106 4.158 -11.787 2.355 1.00 0.00 C ATOM 1649 SG CYS A 106 3.106 -13.255 2.595 1.00 0.00 S ATOM 0 H CYS A 106 5.131 -9.489 1.931 1.00 0.00 H new ATOM 0 HA CYS A 106 2.475 -10.476 2.611 1.00 0.00 H new ATOM 0 HB2 CYS A 106 4.382 -11.683 1.293 1.00 0.00 H new ATOM 0 HB3 CYS A 106 5.107 -11.946 2.867 1.00 0.00 H new ATOM 1654 N PRO A 107 2.574 -10.640 5.092 1.00 0.00 N ATOM 1655 CA PRO A 107 2.552 -10.593 6.557 1.00 0.00 C ATOM 1656 C PRO A 107 3.335 -11.740 7.186 1.00 0.00 C ATOM 1657 O PRO A 107 3.345 -11.901 8.406 1.00 0.00 O ATOM 1658 CB PRO A 107 1.064 -10.714 6.893 1.00 0.00 C ATOM 1659 CG PRO A 107 0.469 -11.426 5.728 1.00 0.00 C ATOM 1660 CD PRO A 107 1.260 -10.988 4.526 1.00 0.00 C ATOM 0 HA PRO A 107 3.018 -9.686 6.943 1.00 0.00 H new ATOM 0 HB2 PRO A 107 0.911 -11.271 7.817 1.00 0.00 H new ATOM 0 HB3 PRO A 107 0.609 -9.734 7.032 1.00 0.00 H new ATOM 0 HG2 PRO A 107 0.526 -12.506 5.860 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -0.585 -11.174 5.614 1.00 0.00 H new ATOM 0 HD2 PRO A 107 1.339 -11.784 3.785 1.00 0.00 H new ATOM 0 HD3 PRO A 107 0.798 -10.135 4.029 1.00 0.00 H new ATOM 1668 N GLU A 108 3.991 -12.534 6.345 1.00 0.00 N ATOM 1669 CA GLU A 108 4.777 -13.666 6.821 1.00 0.00 C ATOM 1670 C GLU A 108 6.208 -13.594 6.297 1.00 0.00 C ATOM 1671 O GLU A 108 7.168 -13.687 7.063 1.00 0.00 O ATOM 1672 CB GLU A 108 4.129 -14.983 6.388 1.00 0.00 C ATOM 1673 CG GLU A 108 2.932 -15.380 7.235 1.00 0.00 C ATOM 1674 CD GLU A 108 3.294 -15.594 8.692 1.00 0.00 C ATOM 1675 OE1 GLU A 108 3.413 -14.591 9.428 1.00 0.00 O ATOM 1676 OE2 GLU A 108 3.458 -16.764 9.097 1.00 0.00 O ATOM 0 H GLU A 108 3.994 -12.414 5.332 1.00 0.00 H new ATOM 0 HA GLU A 108 4.805 -13.624 7.910 1.00 0.00 H new ATOM 0 HB2 GLU A 108 3.815 -14.899 5.348 1.00 0.00 H new ATOM 0 HB3 GLU A 108 4.874 -15.777 6.433 1.00 0.00 H new ATOM 0 HG2 GLU A 108 2.168 -14.605 7.164 1.00 0.00 H new ATOM 0 HG3 GLU A 108 2.496 -16.295 6.835 1.00 0.00 H new ATOM 1683 N CYS A 109 6.343 -13.429 4.985 1.00 0.00 N ATOM 1684 CA CYS A 109 7.656 -13.346 4.356 1.00 0.00 C ATOM 1685 C CYS A 109 7.851 -11.991 3.681 1.00 0.00 C ATOM 1686 O CYS A 109 8.738 -11.825 2.845 1.00 0.00 O ATOM 1687 CB CYS A 109 7.825 -14.468 3.330 1.00 0.00 C ATOM 1688 SG CYS A 109 6.695 -14.349 1.905 1.00 0.00 S ATOM 0 H CYS A 109 5.559 -13.350 4.337 1.00 0.00 H new ATOM 0 HA CYS A 109 8.412 -13.457 5.134 1.00 0.00 H new ATOM 0 HB2 CYS A 109 8.853 -14.462 2.967 1.00 0.00 H new ATOM 0 HB3 CYS A 109 7.668 -15.426 3.826 1.00 0.00 H new ATOM 1693 N GLU A 110 7.015 -11.026 4.052 1.00 0.00 N ATOM 1694 CA GLU A 110 7.095 -9.686 3.482 1.00 0.00 C ATOM 1695 C GLU A 110 7.582 -9.738 2.037 1.00 0.00 C ATOM 1696 O GLU A 110 8.429 -8.945 1.627 1.00 0.00 O ATOM 1697 CB GLU A 110 8.031 -8.809 4.316 1.00 0.00 C ATOM 1698 CG GLU A 110 7.342 -8.120 5.482 1.00 0.00 C ATOM 1699 CD GLU A 110 8.324 -7.575 6.501 1.00 0.00 C ATOM 1700 OE1 GLU A 110 8.975 -6.550 6.208 1.00 0.00 O ATOM 1701 OE2 GLU A 110 8.442 -8.173 7.591 1.00 0.00 O ATOM 0 H GLU A 110 6.275 -11.147 4.744 1.00 0.00 H new ATOM 0 HA GLU A 110 6.095 -9.253 3.495 1.00 0.00 H new ATOM 0 HB2 GLU A 110 8.846 -9.423 4.698 1.00 0.00 H new ATOM 0 HB3 GLU A 110 8.478 -8.053 3.671 1.00 0.00 H new ATOM 0 HG2 GLU A 110 6.726 -7.304 5.104 1.00 0.00 H new ATOM 0 HG3 GLU A 110 6.671 -8.826 5.971 1.00 0.00 H new ATOM 1708 N ASN A 111 7.040 -10.678 1.270 1.00 0.00 N ATOM 1709 CA ASN A 111 7.419 -10.835 -0.130 1.00 0.00 C ATOM 1710 C ASN A 111 6.525 -9.991 -1.034 1.00 0.00 C ATOM 1711 O ASN A 111 5.319 -10.215 -1.139 1.00 0.00 O ATOM 1712 CB ASN A 111 7.336 -12.306 -0.541 1.00 0.00 C ATOM 1713 CG ASN A 111 7.844 -12.543 -1.950 1.00 0.00 C ATOM 1714 OD1 ASN A 111 7.203 -13.229 -2.746 1.00 0.00 O ATOM 1715 ND2 ASN A 111 9.003 -11.974 -2.264 1.00 0.00 N ATOM 0 H ASN A 111 6.337 -11.343 1.594 1.00 0.00 H new ATOM 0 HA ASN A 111 8.447 -10.491 -0.243 1.00 0.00 H new ATOM 0 HB2 ASN A 111 7.916 -12.909 0.158 1.00 0.00 H new ATOM 0 HB3 ASN A 111 6.302 -12.642 -0.469 1.00 0.00 H new ATOM 0 HD21 ASN A 111 9.396 -12.098 -3.197 1.00 0.00 H new ATOM 0 HD22 ASN A 111 9.500 -11.413 -1.572 1.00 0.00 H new ATOM 1722 N PRO A 112 7.128 -8.998 -1.703 1.00 0.00 N ATOM 1723 CA PRO A 112 6.406 -8.101 -2.610 1.00 0.00 C ATOM 1724 C PRO A 112 5.947 -8.809 -3.880 1.00 0.00 C ATOM 1725 O PRO A 112 5.347 -8.195 -4.762 1.00 0.00 O ATOM 1726 CB PRO A 112 7.441 -7.024 -2.943 1.00 0.00 C ATOM 1727 CG PRO A 112 8.759 -7.691 -2.747 1.00 0.00 C ATOM 1728 CD PRO A 112 8.562 -8.673 -1.625 1.00 0.00 C ATOM 0 HA PRO A 112 5.495 -7.710 -2.157 1.00 0.00 H new ATOM 0 HB2 PRO A 112 7.326 -6.668 -3.967 1.00 0.00 H new ATOM 0 HB3 PRO A 112 7.335 -6.158 -2.290 1.00 0.00 H new ATOM 0 HG2 PRO A 112 9.080 -8.197 -3.657 1.00 0.00 H new ATOM 0 HG3 PRO A 112 9.532 -6.964 -2.498 1.00 0.00 H new ATOM 0 HD2 PRO A 112 9.182 -9.560 -1.754 1.00 0.00 H new ATOM 0 HD3 PRO A 112 8.824 -8.238 -0.660 1.00 0.00 H new ATOM 1736 N GLU A 113 6.232 -10.105 -3.967 1.00 0.00 N ATOM 1737 CA GLU A 113 5.848 -10.895 -5.130 1.00 0.00 C ATOM 1738 C GLU A 113 4.566 -11.677 -4.858 1.00 0.00 C ATOM 1739 O GLU A 113 4.437 -12.837 -5.249 1.00 0.00 O ATOM 1740 CB GLU A 113 6.973 -11.858 -5.514 1.00 0.00 C ATOM 1741 CG GLU A 113 7.956 -11.277 -6.517 1.00 0.00 C ATOM 1742 CD GLU A 113 7.511 -11.478 -7.953 1.00 0.00 C ATOM 1743 OE1 GLU A 113 6.843 -12.496 -8.231 1.00 0.00 O ATOM 1744 OE2 GLU A 113 7.830 -10.616 -8.798 1.00 0.00 O ATOM 0 H GLU A 113 6.727 -10.629 -3.246 1.00 0.00 H new ATOM 0 HA GLU A 113 5.667 -10.210 -5.958 1.00 0.00 H new ATOM 0 HB2 GLU A 113 7.515 -12.148 -4.614 1.00 0.00 H new ATOM 0 HB3 GLU A 113 6.536 -12.766 -5.930 1.00 0.00 H new ATOM 0 HG2 GLU A 113 8.079 -10.211 -6.324 1.00 0.00 H new ATOM 0 HG3 GLU A 113 8.932 -11.741 -6.375 1.00 0.00 H new ATOM 1751 N THR A 114 3.619 -11.032 -4.183 1.00 0.00 N ATOM 1752 CA THR A 114 2.348 -11.666 -3.856 1.00 0.00 C ATOM 1753 C THR A 114 1.227 -11.140 -4.745 1.00 0.00 C ATOM 1754 O THR A 114 1.442 -10.255 -5.574 1.00 0.00 O ATOM 1755 CB THR A 114 1.968 -11.435 -2.381 1.00 0.00 C ATOM 1756 OG1 THR A 114 1.535 -10.084 -2.192 1.00 0.00 O ATOM 1757 CG2 THR A 114 3.148 -11.727 -1.466 1.00 0.00 C ATOM 0 H THR A 114 3.709 -10.071 -3.852 1.00 0.00 H new ATOM 0 HA THR A 114 2.474 -12.735 -4.028 1.00 0.00 H new ATOM 0 HB THR A 114 1.155 -12.115 -2.128 1.00 0.00 H new ATOM 0 HG1 THR A 114 2.288 -9.540 -1.881 1.00 0.00 H new ATOM 0 HG21 THR A 114 2.856 -11.557 -0.430 1.00 0.00 H new ATOM 0 HG22 THR A 114 3.457 -12.765 -1.590 1.00 0.00 H new ATOM 0 HG23 THR A 114 3.978 -11.069 -1.722 1.00 0.00 H new ATOM 1765 N ASP A 115 0.031 -11.690 -4.568 1.00 0.00 N ATOM 1766 CA ASP A 115 -1.126 -11.275 -5.354 1.00 0.00 C ATOM 1767 C ASP A 115 -2.380 -11.219 -4.487 1.00 0.00 C ATOM 1768 O ASP A 115 -2.488 -11.928 -3.486 1.00 0.00 O ATOM 1769 CB ASP A 115 -1.343 -12.233 -6.526 1.00 0.00 C ATOM 1770 CG ASP A 115 -0.168 -12.252 -7.483 1.00 0.00 C ATOM 1771 OD1 ASP A 115 0.922 -12.706 -7.076 1.00 0.00 O ATOM 1772 OD2 ASP A 115 -0.337 -11.813 -8.640 1.00 0.00 O ATOM 0 H ASP A 115 -0.163 -12.424 -3.887 1.00 0.00 H new ATOM 0 HA ASP A 115 -0.931 -10.276 -5.743 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -1.512 -13.239 -6.143 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -2.244 -11.943 -7.067 1.00 0.00 H new ATOM 1777 N LEU A 116 -3.325 -10.372 -4.878 1.00 0.00 N ATOM 1778 CA LEU A 116 -4.573 -10.222 -4.137 1.00 0.00 C ATOM 1779 C LEU A 116 -5.724 -10.909 -4.863 1.00 0.00 C ATOM 1780 O LEU A 116 -5.755 -10.958 -6.093 1.00 0.00 O ATOM 1781 CB LEU A 116 -4.894 -8.740 -3.935 1.00 0.00 C ATOM 1782 CG LEU A 116 -3.810 -7.904 -3.253 1.00 0.00 C ATOM 1783 CD1 LEU A 116 -4.101 -6.420 -3.412 1.00 0.00 C ATOM 1784 CD2 LEU A 116 -3.700 -8.274 -1.781 1.00 0.00 C ATOM 0 H LEU A 116 -3.251 -9.778 -5.704 1.00 0.00 H new ATOM 0 HA LEU A 116 -4.448 -10.696 -3.164 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -5.106 -8.299 -4.909 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -5.808 -8.664 -3.345 1.00 0.00 H new ATOM 0 HG LEU A 116 -2.855 -8.119 -3.734 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -3.319 -5.841 -2.920 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -4.129 -6.166 -4.472 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -5.064 -6.187 -2.958 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -2.924 -7.670 -1.311 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -4.654 -8.088 -1.287 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -3.443 -9.329 -1.689 1.00 0.00 H new ATOM 1796 N HIS A 117 -6.671 -11.438 -4.094 1.00 0.00 N ATOM 1797 CA HIS A 117 -7.826 -12.121 -4.665 1.00 0.00 C ATOM 1798 C HIS A 117 -9.126 -11.472 -4.198 1.00 0.00 C ATOM 1799 O HIS A 117 -9.317 -11.228 -3.007 1.00 0.00 O ATOM 1800 CB HIS A 117 -7.814 -13.600 -4.278 1.00 0.00 C ATOM 1801 CG HIS A 117 -6.794 -14.405 -5.023 1.00 0.00 C ATOM 1802 ND1 HIS A 117 -6.829 -14.584 -6.390 1.00 0.00 N ATOM 1803 CD2 HIS A 117 -5.706 -15.081 -4.585 1.00 0.00 C ATOM 1804 CE1 HIS A 117 -5.807 -15.335 -6.760 1.00 0.00 C ATOM 1805 NE2 HIS A 117 -5.110 -15.650 -5.683 1.00 0.00 N ATOM 0 H HIS A 117 -6.661 -11.407 -3.075 1.00 0.00 H new ATOM 0 HA HIS A 117 -7.767 -12.037 -5.750 1.00 0.00 H new ATOM 0 HB2 HIS A 117 -7.622 -13.686 -3.208 1.00 0.00 H new ATOM 0 HB3 HIS A 117 -8.802 -14.023 -4.460 1.00 0.00 H new ATOM 0 HD1 HIS A 117 -7.534 -14.197 -7.017 1.00 0.00 H new ATOM 0 HD2 HIS A 117 -5.369 -15.158 -3.562 1.00 0.00 H new ATOM 0 HE1 HIS A 117 -5.580 -15.640 -7.771 1.00 0.00 H new ATOM 1813 N VAL A 118 -10.016 -11.193 -5.145 1.00 0.00 N ATOM 1814 CA VAL A 118 -11.298 -10.573 -4.831 1.00 0.00 C ATOM 1815 C VAL A 118 -12.455 -11.518 -5.136 1.00 0.00 C ATOM 1816 O VAL A 118 -12.499 -12.139 -6.196 1.00 0.00 O ATOM 1817 CB VAL A 118 -11.496 -9.265 -5.620 1.00 0.00 C ATOM 1818 CG1 VAL A 118 -11.612 -9.551 -7.109 1.00 0.00 C ATOM 1819 CG2 VAL A 118 -12.722 -8.520 -5.115 1.00 0.00 C ATOM 0 H VAL A 118 -9.873 -11.387 -6.136 1.00 0.00 H new ATOM 0 HA VAL A 118 -11.289 -10.348 -3.765 1.00 0.00 H new ATOM 0 HB VAL A 118 -10.623 -8.631 -5.464 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -11.751 -8.615 -7.650 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -10.702 -10.039 -7.458 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -12.466 -10.204 -7.289 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -12.847 -7.598 -5.683 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -13.605 -9.146 -5.240 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -12.593 -8.281 -4.059 1.00 0.00 H new ATOM 1829 N ASN A 119 -13.391 -11.620 -4.197 1.00 0.00 N ATOM 1830 CA ASN A 119 -14.550 -12.489 -4.365 1.00 0.00 C ATOM 1831 C ASN A 119 -15.843 -11.680 -4.351 1.00 0.00 C ATOM 1832 O ASN A 119 -16.288 -11.192 -3.312 1.00 0.00 O ATOM 1833 CB ASN A 119 -14.584 -13.547 -3.260 1.00 0.00 C ATOM 1834 CG ASN A 119 -13.478 -14.573 -3.407 1.00 0.00 C ATOM 1835 OD1 ASN A 119 -12.863 -14.692 -4.467 1.00 0.00 O ATOM 1836 ND2 ASN A 119 -13.219 -15.321 -2.340 1.00 0.00 N ATOM 0 H ASN A 119 -13.369 -11.112 -3.313 1.00 0.00 H new ATOM 0 HA ASN A 119 -14.464 -12.986 -5.332 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -14.495 -13.058 -2.290 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -15.549 -14.053 -3.275 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -12.485 -16.028 -2.379 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -13.754 -15.188 -1.482 1.00 0.00 H new ATOM 1843 N PRO A 120 -16.463 -11.535 -5.532 1.00 0.00 N ATOM 1844 CA PRO A 120 -17.715 -10.787 -5.682 1.00 0.00 C ATOM 1845 C PRO A 120 -18.898 -11.502 -5.038 1.00 0.00 C ATOM 1846 O PRO A 120 -20.009 -10.974 -4.999 1.00 0.00 O ATOM 1847 CB PRO A 120 -17.900 -10.707 -7.199 1.00 0.00 C ATOM 1848 CG PRO A 120 -17.158 -11.883 -7.734 1.00 0.00 C ATOM 1849 CD PRO A 120 -15.990 -12.091 -6.811 1.00 0.00 C ATOM 0 HA PRO A 120 -17.670 -9.814 -5.192 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -18.955 -10.747 -7.472 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -17.503 -9.774 -7.598 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -17.795 -12.767 -7.762 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -16.821 -11.701 -8.754 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -15.733 -13.146 -6.720 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -15.099 -11.575 -7.168 1.00 0.00 H new ATOM 1857 N LYS A 121 -18.652 -12.706 -4.533 1.00 0.00 N ATOM 1858 CA LYS A 121 -19.696 -13.493 -3.888 1.00 0.00 C ATOM 1859 C LYS A 121 -19.565 -13.432 -2.370 1.00 0.00 C ATOM 1860 O LYS A 121 -20.538 -13.172 -1.661 1.00 0.00 O ATOM 1861 CB LYS A 121 -19.630 -14.948 -4.358 1.00 0.00 C ATOM 1862 CG LYS A 121 -20.386 -15.205 -5.650 1.00 0.00 C ATOM 1863 CD LYS A 121 -21.834 -15.581 -5.383 1.00 0.00 C ATOM 1864 CE LYS A 121 -22.491 -16.182 -6.616 1.00 0.00 C ATOM 1865 NZ LYS A 121 -23.822 -16.772 -6.304 1.00 0.00 N ATOM 0 H LYS A 121 -17.738 -13.158 -4.558 1.00 0.00 H new ATOM 0 HA LYS A 121 -20.660 -13.070 -4.169 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -18.586 -15.229 -4.496 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -20.033 -15.592 -3.577 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -20.350 -14.314 -6.277 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -19.898 -16.006 -6.205 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -21.880 -16.295 -4.561 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -22.388 -14.697 -5.069 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -22.605 -15.412 -7.379 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -21.842 -16.951 -7.035 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -24.237 -17.171 -7.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -23.711 -17.525 -5.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -24.450 -16.033 -5.928 1.00 0.00 H new ATOM 1879 N LYS A 122 -18.355 -13.671 -1.875 1.00 0.00 N ATOM 1880 CA LYS A 122 -18.094 -13.641 -0.441 1.00 0.00 C ATOM 1881 C LYS A 122 -17.793 -12.221 0.027 1.00 0.00 C ATOM 1882 O LYS A 122 -17.766 -11.946 1.227 1.00 0.00 O ATOM 1883 CB LYS A 122 -16.922 -14.562 -0.095 1.00 0.00 C ATOM 1884 CG LYS A 122 -17.341 -15.990 0.213 1.00 0.00 C ATOM 1885 CD LYS A 122 -18.144 -16.070 1.500 1.00 0.00 C ATOM 1886 CE LYS A 122 -18.385 -17.513 1.917 1.00 0.00 C ATOM 1887 NZ LYS A 122 -19.616 -18.073 1.294 1.00 0.00 N ATOM 0 H LYS A 122 -17.539 -13.888 -2.447 1.00 0.00 H new ATOM 0 HA LYS A 122 -18.988 -13.993 0.073 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -16.219 -14.570 -0.928 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -16.392 -14.154 0.766 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -17.935 -16.382 -0.613 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -16.455 -16.620 0.296 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -17.614 -15.544 2.294 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -19.100 -15.564 1.366 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -17.526 -18.121 1.634 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -18.470 -17.568 3.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -19.745 -19.058 1.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -20.440 -17.508 1.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -19.525 -18.045 0.258 1.00 0.00 H new ATOM 1901 N GLN A 123 -17.570 -11.323 -0.927 1.00 0.00 N ATOM 1902 CA GLN A 123 -17.272 -9.931 -0.610 1.00 0.00 C ATOM 1903 C GLN A 123 -16.137 -9.834 0.404 1.00 0.00 C ATOM 1904 O GLN A 123 -16.272 -9.188 1.444 1.00 0.00 O ATOM 1905 CB GLN A 123 -18.519 -9.231 -0.066 1.00 0.00 C ATOM 1906 CG GLN A 123 -19.437 -8.693 -1.152 1.00 0.00 C ATOM 1907 CD GLN A 123 -20.451 -9.718 -1.620 1.00 0.00 C ATOM 1908 OE1 GLN A 123 -21.590 -9.741 -1.153 1.00 0.00 O ATOM 1909 NE2 GLN A 123 -20.042 -10.574 -2.550 1.00 0.00 N ATOM 0 H GLN A 123 -17.590 -11.534 -1.925 1.00 0.00 H new ATOM 0 HA GLN A 123 -16.957 -9.435 -1.528 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -19.077 -9.932 0.556 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -18.211 -8.408 0.579 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -19.961 -7.814 -0.777 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -18.837 -8.367 -2.001 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -19.089 -10.519 -2.910 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -20.681 -11.286 -2.904 1.00 0.00 H new ATOM 1918 N THR A 124 -15.017 -10.480 0.095 1.00 0.00 N ATOM 1919 CA THR A 124 -13.859 -10.468 0.979 1.00 0.00 C ATOM 1920 C THR A 124 -12.560 -10.439 0.183 1.00 0.00 C ATOM 1921 O THR A 124 -12.447 -11.079 -0.863 1.00 0.00 O ATOM 1922 CB THR A 124 -13.850 -11.696 1.910 1.00 0.00 C ATOM 1923 OG1 THR A 124 -14.065 -12.889 1.148 1.00 0.00 O ATOM 1924 CG2 THR A 124 -14.924 -11.571 2.980 1.00 0.00 C ATOM 0 H THR A 124 -14.888 -11.018 -0.762 1.00 0.00 H new ATOM 0 HA THR A 124 -13.932 -9.564 1.583 1.00 0.00 H new ATOM 0 HB THR A 124 -12.877 -11.748 2.399 1.00 0.00 H new ATOM 0 HG1 THR A 124 -14.056 -13.665 1.746 1.00 0.00 H new ATOM 0 HG21 THR A 124 -14.899 -12.449 3.625 1.00 0.00 H new ATOM 0 HG22 THR A 124 -14.741 -10.677 3.576 1.00 0.00 H new ATOM 0 HG23 THR A 124 -15.903 -11.497 2.506 1.00 0.00 H new ATOM 1932 N ILE A 125 -11.581 -9.693 0.684 1.00 0.00 N ATOM 1933 CA ILE A 125 -10.288 -9.583 0.020 1.00 0.00 C ATOM 1934 C ILE A 125 -9.264 -10.520 0.650 1.00 0.00 C ATOM 1935 O ILE A 125 -8.883 -10.351 1.808 1.00 0.00 O ATOM 1936 CB ILE A 125 -9.749 -8.141 0.072 1.00 0.00 C ATOM 1937 CG1 ILE A 125 -10.781 -7.167 -0.501 1.00 0.00 C ATOM 1938 CG2 ILE A 125 -8.436 -8.038 -0.688 1.00 0.00 C ATOM 1939 CD1 ILE A 125 -10.420 -5.713 -0.291 1.00 0.00 C ATOM 0 H ILE A 125 -11.659 -9.156 1.548 1.00 0.00 H new ATOM 0 HA ILE A 125 -10.443 -9.867 -1.021 1.00 0.00 H new ATOM 0 HB ILE A 125 -9.565 -7.875 1.113 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -10.893 -7.355 -1.569 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -11.749 -7.363 -0.040 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -8.068 -7.013 -0.642 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -7.702 -8.707 -0.239 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -8.595 -8.320 -1.729 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -11.195 -5.080 -0.722 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -10.337 -5.509 0.777 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -9.467 -5.501 -0.776 1.00 0.00 H new ATOM 1951 N GLY A 126 -8.819 -11.507 -0.121 1.00 0.00 N ATOM 1952 CA GLY A 126 -7.841 -12.456 0.379 1.00 0.00 C ATOM 1953 C GLY A 126 -6.565 -12.458 -0.439 1.00 0.00 C ATOM 1954 O GLY A 126 -6.607 -12.428 -1.668 1.00 0.00 O ATOM 0 H GLY A 126 -9.118 -11.667 -1.083 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -7.604 -12.217 1.416 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -8.274 -13.456 0.374 1.00 0.00 H new ATOM 1958 N ASN A 127 -5.426 -12.491 0.245 1.00 0.00 N ATOM 1959 CA ASN A 127 -4.131 -12.494 -0.426 1.00 0.00 C ATOM 1960 C ASN A 127 -3.534 -13.898 -0.450 1.00 0.00 C ATOM 1961 O ASN A 127 -3.656 -14.652 0.515 1.00 0.00 O ATOM 1962 CB ASN A 127 -3.169 -11.531 0.273 1.00 0.00 C ATOM 1963 CG ASN A 127 -3.293 -11.584 1.783 1.00 0.00 C ATOM 1964 OD1 ASN A 127 -3.990 -12.439 2.330 1.00 0.00 O ATOM 1965 ND2 ASN A 127 -2.615 -10.668 2.465 1.00 0.00 N ATOM 0 H ASN A 127 -5.373 -12.516 1.263 1.00 0.00 H new ATOM 0 HA ASN A 127 -4.282 -12.165 -1.454 1.00 0.00 H new ATOM 0 HB2 ASN A 127 -2.145 -11.773 -0.013 1.00 0.00 H new ATOM 0 HB3 ASN A 127 -3.364 -10.515 -0.069 1.00 0.00 H new ATOM 0 HD21 ASN A 127 -2.659 -10.654 3.484 1.00 0.00 H new ATOM 0 HD22 ASN A 127 -2.050 -9.978 1.970 1.00 0.00 H new ATOM 1972 N SER A 128 -2.889 -14.241 -1.560 1.00 0.00 N ATOM 1973 CA SER A 128 -2.276 -15.555 -1.712 1.00 0.00 C ATOM 1974 C SER A 128 -0.803 -15.427 -2.088 1.00 0.00 C ATOM 1975 O SER A 128 -0.467 -14.989 -3.189 1.00 0.00 O ATOM 1976 CB SER A 128 -3.017 -16.368 -2.776 1.00 0.00 C ATOM 1977 OG SER A 128 -2.959 -15.727 -4.039 1.00 0.00 O ATOM 0 H SER A 128 -2.777 -13.627 -2.367 1.00 0.00 H new ATOM 0 HA SER A 128 -2.346 -16.073 -0.756 1.00 0.00 H new ATOM 0 HB2 SER A 128 -2.578 -17.363 -2.849 1.00 0.00 H new ATOM 0 HB3 SER A 128 -4.057 -16.500 -2.479 1.00 0.00 H new ATOM 0 HG SER A 128 -3.652 -16.096 -4.625 1.00 0.00 H new ATOM 1983 N CYS A 129 0.073 -15.813 -1.166 1.00 0.00 N ATOM 1984 CA CYS A 129 1.510 -15.742 -1.399 1.00 0.00 C ATOM 1985 C CYS A 129 2.053 -17.089 -1.869 1.00 0.00 C ATOM 1986 O CYS A 129 1.453 -18.134 -1.619 1.00 0.00 O ATOM 1987 CB CYS A 129 2.233 -15.306 -0.123 1.00 0.00 C ATOM 1988 SG CYS A 129 4.049 -15.417 -0.222 1.00 0.00 S ATOM 0 H CYS A 129 -0.188 -16.178 -0.250 1.00 0.00 H new ATOM 0 HA CYS A 129 1.690 -15.005 -2.182 1.00 0.00 H new ATOM 0 HB2 CYS A 129 1.955 -14.277 0.106 1.00 0.00 H new ATOM 0 HB3 CYS A 129 1.887 -15.922 0.707 1.00 0.00 H new ATOM 1993 N LYS A 130 3.192 -17.056 -2.552 1.00 0.00 N ATOM 1994 CA LYS A 130 3.818 -18.272 -3.056 1.00 0.00 C ATOM 1995 C LYS A 130 5.174 -18.501 -2.396 1.00 0.00 C ATOM 1996 O LYS A 130 5.578 -19.640 -2.166 1.00 0.00 O ATOM 1997 CB LYS A 130 3.986 -18.191 -4.575 1.00 0.00 C ATOM 1998 CG LYS A 130 2.736 -18.574 -5.347 1.00 0.00 C ATOM 1999 CD LYS A 130 3.078 -19.202 -6.688 1.00 0.00 C ATOM 2000 CE LYS A 130 3.188 -20.716 -6.582 1.00 0.00 C ATOM 2001 NZ LYS A 130 4.574 -21.149 -6.251 1.00 0.00 N ATOM 0 H LYS A 130 3.701 -16.199 -2.769 1.00 0.00 H new ATOM 0 HA LYS A 130 3.169 -19.113 -2.812 1.00 0.00 H new ATOM 0 HB2 LYS A 130 4.273 -17.175 -4.847 1.00 0.00 H new ATOM 0 HB3 LYS A 130 4.804 -18.845 -4.877 1.00 0.00 H new ATOM 0 HG2 LYS A 130 2.143 -19.274 -4.757 1.00 0.00 H new ATOM 0 HG3 LYS A 130 2.120 -17.689 -5.505 1.00 0.00 H new ATOM 0 HD2 LYS A 130 2.312 -18.942 -7.419 1.00 0.00 H new ATOM 0 HD3 LYS A 130 4.020 -18.792 -7.053 1.00 0.00 H new ATOM 0 HE2 LYS A 130 2.502 -21.077 -5.816 1.00 0.00 H new ATOM 0 HE3 LYS A 130 2.881 -21.169 -7.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 4.677 -22.164 -6.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 5.253 -20.612 -6.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 4.761 -20.974 -5.243 1.00 0.00 H new ATOM 2015 N ALA A 131 5.870 -17.411 -2.091 1.00 0.00 N ATOM 2016 CA ALA A 131 7.178 -17.493 -1.453 1.00 0.00 C ATOM 2017 C ALA A 131 7.129 -18.379 -0.213 1.00 0.00 C ATOM 2018 O ALA A 131 7.903 -19.328 -0.084 1.00 0.00 O ATOM 2019 CB ALA A 131 7.677 -16.102 -1.092 1.00 0.00 C ATOM 0 H ALA A 131 5.550 -16.460 -2.276 1.00 0.00 H new ATOM 0 HA ALA A 131 7.873 -17.943 -2.161 1.00 0.00 H new ATOM 0 HB1 ALA A 131 8.655 -16.178 -0.616 1.00 0.00 H new ATOM 0 HB2 ALA A 131 7.759 -15.499 -1.996 1.00 0.00 H new ATOM 0 HB3 ALA A 131 6.975 -15.631 -0.404 1.00 0.00 H new ATOM 2025 N CYS A 132 6.215 -18.062 0.699 1.00 0.00 N ATOM 2026 CA CYS A 132 6.066 -18.828 1.930 1.00 0.00 C ATOM 2027 C CYS A 132 4.818 -19.706 1.877 1.00 0.00 C ATOM 2028 O CYS A 132 4.733 -20.723 2.563 1.00 0.00 O ATOM 2029 CB CYS A 132 5.990 -17.888 3.134 1.00 0.00 C ATOM 2030 SG CYS A 132 4.446 -16.926 3.231 1.00 0.00 S ATOM 0 H CYS A 132 5.567 -17.280 0.608 1.00 0.00 H new ATOM 0 HA CYS A 132 6.939 -19.473 2.035 1.00 0.00 H new ATOM 0 HB2 CYS A 132 6.098 -18.474 4.046 1.00 0.00 H new ATOM 0 HB3 CYS A 132 6.833 -17.198 3.097 1.00 0.00 H new ATOM 2035 N GLY A 133 3.853 -19.303 1.056 1.00 0.00 N ATOM 2036 CA GLY A 133 2.623 -20.063 0.928 1.00 0.00 C ATOM 2037 C GLY A 133 1.577 -19.648 1.943 1.00 0.00 C ATOM 2038 O GLY A 133 0.914 -20.494 2.544 1.00 0.00 O ATOM 0 H GLY A 133 3.901 -18.464 0.478 1.00 0.00 H new ATOM 0 HA2 GLY A 133 2.222 -19.932 -0.077 1.00 0.00 H new ATOM 0 HA3 GLY A 133 2.841 -21.124 1.049 1.00 0.00 H new ATOM 2042 N TYR A 134 1.428 -18.342 2.137 1.00 0.00 N ATOM 2043 CA TYR A 134 0.457 -17.817 3.089 1.00 0.00 C ATOM 2044 C TYR A 134 -0.857 -17.472 2.394 1.00 0.00 C ATOM 2045 O TYR A 134 -0.881 -16.700 1.436 1.00 0.00 O ATOM 2046 CB TYR A 134 1.018 -16.577 3.789 1.00 0.00 C ATOM 2047 CG TYR A 134 -0.046 -15.701 4.412 1.00 0.00 C ATOM 2048 CD1 TYR A 134 -0.756 -14.785 3.646 1.00 0.00 C ATOM 2049 CD2 TYR A 134 -0.340 -15.789 5.767 1.00 0.00 C ATOM 2050 CE1 TYR A 134 -1.728 -13.982 4.211 1.00 0.00 C ATOM 2051 CE2 TYR A 134 -1.311 -14.991 6.341 1.00 0.00 C ATOM 2052 CZ TYR A 134 -2.001 -14.089 5.559 1.00 0.00 C ATOM 2053 OH TYR A 134 -2.969 -13.292 6.125 1.00 0.00 O ATOM 0 H TYR A 134 1.967 -17.628 1.648 1.00 0.00 H new ATOM 0 HA TYR A 134 0.261 -18.589 3.833 1.00 0.00 H new ATOM 0 HB2 TYR A 134 1.717 -16.892 4.564 1.00 0.00 H new ATOM 0 HB3 TYR A 134 1.585 -15.988 3.068 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -0.544 -14.699 2.590 1.00 0.00 H new ATOM 0 HD2 TYR A 134 0.200 -16.493 6.382 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -2.271 -13.275 3.601 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -1.528 -15.073 7.396 1.00 0.00 H new ATOM 0 HH TYR A 134 -3.039 -13.492 7.082 1.00 0.00 H new ATOM 2063 N ARG A 135 -1.948 -18.050 2.886 1.00 0.00 N ATOM 2064 CA ARG A 135 -3.266 -17.805 2.313 1.00 0.00 C ATOM 2065 C ARG A 135 -4.287 -17.506 3.407 1.00 0.00 C ATOM 2066 O ARG A 135 -4.629 -18.376 4.206 1.00 0.00 O ATOM 2067 CB ARG A 135 -3.721 -19.013 1.492 1.00 0.00 C ATOM 2068 CG ARG A 135 -3.321 -18.941 0.028 1.00 0.00 C ATOM 2069 CD ARG A 135 -1.891 -19.414 -0.183 1.00 0.00 C ATOM 2070 NE ARG A 135 -1.816 -20.859 -0.380 1.00 0.00 N ATOM 2071 CZ ARG A 135 -2.292 -21.480 -1.453 1.00 0.00 C ATOM 2072 NH1 ARG A 135 -2.873 -20.786 -2.422 1.00 0.00 N ATOM 2073 NH2 ARG A 135 -2.186 -22.799 -1.559 1.00 0.00 N ATOM 0 H ARG A 135 -1.945 -18.691 3.680 1.00 0.00 H new ATOM 0 HA ARG A 135 -3.195 -16.936 1.659 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -3.301 -19.918 1.930 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -4.805 -19.100 1.560 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -3.999 -19.553 -0.566 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -3.423 -17.916 -0.328 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -1.466 -18.907 -1.049 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -1.286 -19.134 0.679 1.00 0.00 H new ATOM 0 HE ARG A 135 -1.374 -21.422 0.346 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -2.955 -19.772 -2.344 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -3.238 -21.266 -3.245 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -1.739 -23.336 -0.816 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -2.552 -23.275 -2.383 1.00 0.00 H new ATOM 2087 N GLY A 136 -4.770 -16.267 3.435 1.00 0.00 N ATOM 2088 CA GLY A 136 -5.746 -15.874 4.435 1.00 0.00 C ATOM 2089 C GLY A 136 -6.646 -14.752 3.957 1.00 0.00 C ATOM 2090 O GLY A 136 -6.712 -14.467 2.762 1.00 0.00 O ATOM 0 H GLY A 136 -4.503 -15.529 2.783 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -6.356 -16.737 4.701 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -5.227 -15.559 5.340 1.00 0.00 H new ATOM 2094 N MET A 137 -7.342 -14.115 4.893 1.00 0.00 N ATOM 2095 CA MET A 137 -8.243 -13.018 4.560 1.00 0.00 C ATOM 2096 C MET A 137 -7.708 -11.693 5.094 1.00 0.00 C ATOM 2097 O MET A 137 -7.489 -11.540 6.296 1.00 0.00 O ATOM 2098 CB MET A 137 -9.638 -13.285 5.129 1.00 0.00 C ATOM 2099 CG MET A 137 -9.661 -13.418 6.643 1.00 0.00 C ATOM 2100 SD MET A 137 -11.087 -14.347 7.237 1.00 0.00 S ATOM 2101 CE MET A 137 -10.290 -15.816 7.880 1.00 0.00 C ATOM 0 H MET A 137 -7.299 -14.339 5.887 1.00 0.00 H new ATOM 0 HA MET A 137 -8.308 -12.951 3.474 1.00 0.00 H new ATOM 0 HB2 MET A 137 -10.303 -12.474 4.833 1.00 0.00 H new ATOM 0 HB3 MET A 137 -10.033 -14.199 4.686 1.00 0.00 H new ATOM 0 HG2 MET A 137 -8.747 -13.911 6.974 1.00 0.00 H new ATOM 0 HG3 MET A 137 -9.667 -12.424 7.091 1.00 0.00 H new ATOM 0 HE1 MET A 137 -11.044 -16.491 8.284 1.00 0.00 H new ATOM 0 HE2 MET A 137 -9.747 -16.316 7.078 1.00 0.00 H new ATOM 0 HE3 MET A 137 -9.593 -15.536 8.670 1.00 0.00 H new ATOM 2111 N LEU A 138 -7.499 -10.739 4.194 1.00 0.00 N ATOM 2112 CA LEU A 138 -6.988 -9.426 4.575 1.00 0.00 C ATOM 2113 C LEU A 138 -7.997 -8.681 5.443 1.00 0.00 C ATOM 2114 O LEU A 138 -9.204 -8.763 5.219 1.00 0.00 O ATOM 2115 CB LEU A 138 -6.664 -8.602 3.328 1.00 0.00 C ATOM 2116 CG LEU A 138 -5.233 -8.717 2.801 1.00 0.00 C ATOM 2117 CD1 LEU A 138 -5.071 -7.915 1.519 1.00 0.00 C ATOM 2118 CD2 LEU A 138 -4.238 -8.251 3.853 1.00 0.00 C ATOM 0 H LEU A 138 -7.675 -10.849 3.195 1.00 0.00 H new ATOM 0 HA LEU A 138 -6.076 -9.572 5.154 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -7.348 -8.899 2.533 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -6.866 -7.554 3.547 1.00 0.00 H new ATOM 0 HG LEU A 138 -5.031 -9.765 2.578 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -4.047 -8.008 1.158 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -5.758 -8.295 0.763 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -5.292 -6.866 1.716 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -3.225 -8.340 3.460 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -4.438 -7.210 4.108 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -4.337 -8.868 4.746 1.00 0.00 H new ATOM 2130 N ASP A 139 -7.493 -7.953 6.434 1.00 0.00 N ATOM 2131 CA ASP A 139 -8.349 -7.190 7.334 1.00 0.00 C ATOM 2132 C ASP A 139 -8.584 -5.781 6.797 1.00 0.00 C ATOM 2133 O ASP A 139 -8.630 -4.814 7.559 1.00 0.00 O ATOM 2134 CB ASP A 139 -7.726 -7.120 8.729 1.00 0.00 C ATOM 2135 CG ASP A 139 -8.023 -8.354 9.559 1.00 0.00 C ATOM 2136 OD1 ASP A 139 -9.134 -8.435 10.123 1.00 0.00 O ATOM 2137 OD2 ASP A 139 -7.145 -9.238 9.644 1.00 0.00 O ATOM 0 H ASP A 139 -6.496 -7.876 6.634 1.00 0.00 H new ATOM 0 HA ASP A 139 -9.310 -7.700 7.399 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -6.647 -7.000 8.636 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -8.102 -6.238 9.248 1.00 0.00 H new ATOM 2142 N THR A 140 -8.731 -5.672 5.481 1.00 0.00 N ATOM 2143 CA THR A 140 -8.958 -4.382 4.841 1.00 0.00 C ATOM 2144 C THR A 140 -10.267 -3.758 5.312 1.00 0.00 C ATOM 2145 O THR A 140 -11.319 -4.397 5.278 1.00 0.00 O ATOM 2146 CB THR A 140 -8.988 -4.513 3.307 1.00 0.00 C ATOM 2147 OG1 THR A 140 -7.790 -5.147 2.846 1.00 0.00 O ATOM 2148 CG2 THR A 140 -9.131 -3.148 2.650 1.00 0.00 C ATOM 0 H THR A 140 -8.697 -6.462 4.837 1.00 0.00 H new ATOM 0 HA THR A 140 -8.127 -3.737 5.127 1.00 0.00 H new ATOM 0 HB THR A 140 -9.849 -5.122 3.033 1.00 0.00 H new ATOM 0 HG1 THR A 140 -7.818 -5.228 1.870 1.00 0.00 H new ATOM 0 HG21 THR A 140 -9.150 -3.266 1.567 1.00 0.00 H new ATOM 0 HG22 THR A 140 -10.059 -2.681 2.980 1.00 0.00 H new ATOM 0 HG23 THR A 140 -8.287 -2.518 2.932 1.00 0.00 H new ATOM 2156 N HIS A 141 -10.195 -2.505 5.752 1.00 0.00 N ATOM 2157 CA HIS A 141 -11.376 -1.794 6.229 1.00 0.00 C ATOM 2158 C HIS A 141 -12.535 -1.945 5.247 1.00 0.00 C ATOM 2159 O HIS A 141 -12.387 -2.551 4.185 1.00 0.00 O ATOM 2160 CB HIS A 141 -11.057 -0.313 6.435 1.00 0.00 C ATOM 2161 CG HIS A 141 -10.499 0.355 5.216 1.00 0.00 C ATOM 2162 ND1 HIS A 141 -9.954 1.621 5.234 1.00 0.00 N ATOM 2163 CD2 HIS A 141 -10.403 -0.076 3.936 1.00 0.00 C ATOM 2164 CE1 HIS A 141 -9.548 1.941 4.018 1.00 0.00 C ATOM 2165 NE2 HIS A 141 -9.808 0.928 3.212 1.00 0.00 N ATOM 0 H HIS A 141 -9.332 -1.962 5.788 1.00 0.00 H new ATOM 0 HA HIS A 141 -11.672 -2.231 7.183 1.00 0.00 H new ATOM 0 HB2 HIS A 141 -11.965 0.207 6.740 1.00 0.00 H new ATOM 0 HB3 HIS A 141 -10.343 -0.214 7.252 1.00 0.00 H new ATOM 0 HD1 HIS A 141 -9.876 2.218 6.058 1.00 0.00 H new ATOM 0 HD2 HIS A 141 -10.733 -1.031 3.555 1.00 0.00 H new ATOM 0 HE1 HIS A 141 -9.083 2.873 3.732 1.00 0.00 H new ATOM 2173 N HIS A 142 -13.687 -1.391 5.610 1.00 0.00 N ATOM 2174 CA HIS A 142 -14.871 -1.464 4.762 1.00 0.00 C ATOM 2175 C HIS A 142 -15.053 -0.172 3.970 1.00 0.00 C ATOM 2176 O HIS A 142 -16.132 0.098 3.442 1.00 0.00 O ATOM 2177 CB HIS A 142 -16.115 -1.737 5.608 1.00 0.00 C ATOM 2178 CG HIS A 142 -16.177 -3.132 6.149 1.00 0.00 C ATOM 2179 ND1 HIS A 142 -15.768 -3.463 7.424 1.00 0.00 N ATOM 2180 CD2 HIS A 142 -16.605 -4.283 5.582 1.00 0.00 C ATOM 2181 CE1 HIS A 142 -15.940 -4.759 7.616 1.00 0.00 C ATOM 2182 NE2 HIS A 142 -16.448 -5.280 6.514 1.00 0.00 N ATOM 0 H HIS A 142 -13.826 -0.887 6.486 1.00 0.00 H new ATOM 0 HA HIS A 142 -14.733 -2.285 4.058 1.00 0.00 H new ATOM 0 HB2 HIS A 142 -16.141 -1.032 6.439 1.00 0.00 H new ATOM 0 HB3 HIS A 142 -17.003 -1.550 5.004 1.00 0.00 H new ATOM 0 HD2 HIS A 142 -16.997 -4.397 4.582 1.00 0.00 H new ATOM 0 HE1 HIS A 142 -15.705 -5.300 8.521 1.00 0.00 H new ATOM 0 HE2 HIS A 142 -16.685 -6.263 6.377 1.00 0.00 H new ATOM 2190 N LYS A 143 -13.992 0.623 3.893 1.00 0.00 N ATOM 2191 CA LYS A 143 -14.033 1.887 3.166 1.00 0.00 C ATOM 2192 C LYS A 143 -13.552 1.704 1.730 1.00 0.00 C ATOM 2193 O LYS A 143 -14.146 2.239 0.793 1.00 0.00 O ATOM 2194 CB LYS A 143 -13.171 2.934 3.875 1.00 0.00 C ATOM 2195 CG LYS A 143 -13.772 3.437 5.176 1.00 0.00 C ATOM 2196 CD LYS A 143 -14.814 4.515 4.929 1.00 0.00 C ATOM 2197 CE LYS A 143 -15.750 4.668 6.118 1.00 0.00 C ATOM 2198 NZ LYS A 143 -15.184 5.573 7.156 1.00 0.00 N ATOM 0 H LYS A 143 -13.092 0.415 4.325 1.00 0.00 H new ATOM 0 HA LYS A 143 -15.067 2.232 3.143 1.00 0.00 H new ATOM 0 HB2 LYS A 143 -12.189 2.506 4.079 1.00 0.00 H new ATOM 0 HB3 LYS A 143 -13.017 3.780 3.205 1.00 0.00 H new ATOM 0 HG2 LYS A 143 -14.228 2.605 5.713 1.00 0.00 H new ATOM 0 HG3 LYS A 143 -12.982 3.833 5.814 1.00 0.00 H new ATOM 0 HD2 LYS A 143 -14.317 5.465 4.731 1.00 0.00 H new ATOM 0 HD3 LYS A 143 -15.392 4.267 4.039 1.00 0.00 H new ATOM 0 HE2 LYS A 143 -16.708 5.060 5.778 1.00 0.00 H new ATOM 0 HE3 LYS A 143 -15.944 3.689 6.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 -15.852 5.651 7.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 -14.282 5.186 7.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 -15.023 6.515 6.745 1.00 0.00 H new ATOM 2212 N LEU A 144 -12.474 0.945 1.564 1.00 0.00 N ATOM 2213 CA LEU A 144 -11.914 0.690 0.241 1.00 0.00 C ATOM 2214 C LEU A 144 -12.529 -0.560 -0.379 1.00 0.00 C ATOM 2215 O LEU A 144 -12.940 -0.551 -1.539 1.00 0.00 O ATOM 2216 CB LEU A 144 -10.395 0.535 0.330 1.00 0.00 C ATOM 2217 CG LEU A 144 -9.654 0.412 -1.001 1.00 0.00 C ATOM 2218 CD1 LEU A 144 -9.603 1.757 -1.710 1.00 0.00 C ATOM 2219 CD2 LEU A 144 -8.249 -0.131 -0.782 1.00 0.00 C ATOM 0 H LEU A 144 -11.970 0.496 2.329 1.00 0.00 H new ATOM 0 HA LEU A 144 -12.149 1.542 -0.397 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -9.993 1.393 0.869 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -10.175 -0.349 0.929 1.00 0.00 H new ATOM 0 HG LEU A 144 -10.198 -0.289 -1.634 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -9.072 1.650 -2.656 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -10.618 2.106 -1.901 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -9.083 2.480 -1.082 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -7.737 -0.212 -1.741 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -7.695 0.545 -0.130 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -8.308 -1.116 -0.318 1.00 0.00 H new ATOM 2231 N CYS A 145 -12.590 -1.633 0.403 1.00 0.00 N ATOM 2232 CA CYS A 145 -13.157 -2.891 -0.069 1.00 0.00 C ATOM 2233 C CYS A 145 -14.359 -2.641 -0.974 1.00 0.00 C ATOM 2234 O CYS A 145 -14.547 -3.326 -1.979 1.00 0.00 O ATOM 2235 CB CYS A 145 -13.568 -3.765 1.116 1.00 0.00 C ATOM 2236 SG CYS A 145 -15.234 -3.433 1.736 1.00 0.00 S ATOM 0 H CYS A 145 -12.254 -1.657 1.366 1.00 0.00 H new ATOM 0 HA CYS A 145 -12.393 -3.411 -0.647 1.00 0.00 H new ATOM 0 HB2 CYS A 145 -13.504 -4.812 0.821 1.00 0.00 H new ATOM 0 HB3 CYS A 145 -12.854 -3.618 1.927 1.00 0.00 H new ATOM 0 HG CYS A 145 -15.490 -4.223 2.736 1.00 0.00 H new ATOM 2242 N THR A 146 -15.173 -1.655 -0.609 1.00 0.00 N ATOM 2243 CA THR A 146 -16.359 -1.316 -1.385 1.00 0.00 C ATOM 2244 C THR A 146 -16.007 -1.071 -2.848 1.00 0.00 C ATOM 2245 O THR A 146 -16.580 -1.687 -3.746 1.00 0.00 O ATOM 2246 CB THR A 146 -17.060 -0.066 -0.821 1.00 0.00 C ATOM 2247 OG1 THR A 146 -17.409 -0.277 0.552 1.00 0.00 O ATOM 2248 CG2 THR A 146 -18.312 0.260 -1.623 1.00 0.00 C ATOM 0 H THR A 146 -15.032 -1.077 0.220 1.00 0.00 H new ATOM 0 HA THR A 146 -17.037 -2.167 -1.315 1.00 0.00 H new ATOM 0 HB THR A 146 -16.370 0.775 -0.895 1.00 0.00 H new ATOM 0 HG1 THR A 146 -16.682 0.041 1.127 1.00 0.00 H new ATOM 0 HG21 THR A 146 -18.790 1.146 -1.206 1.00 0.00 H new ATOM 0 HG22 THR A 146 -18.040 0.449 -2.662 1.00 0.00 H new ATOM 0 HG23 THR A 146 -19.003 -0.581 -1.576 1.00 0.00 H new ATOM 2256 N PHE A 147 -15.060 -0.167 -3.081 1.00 0.00 N ATOM 2257 CA PHE A 147 -14.632 0.159 -4.436 1.00 0.00 C ATOM 2258 C PHE A 147 -14.021 -1.059 -5.121 1.00 0.00 C ATOM 2259 O PHE A 147 -14.335 -1.359 -6.274 1.00 0.00 O ATOM 2260 CB PHE A 147 -13.619 1.306 -4.411 1.00 0.00 C ATOM 2261 CG PHE A 147 -12.817 1.425 -5.675 1.00 0.00 C ATOM 2262 CD1 PHE A 147 -11.631 0.726 -5.827 1.00 0.00 C ATOM 2263 CD2 PHE A 147 -13.250 2.236 -6.712 1.00 0.00 C ATOM 2264 CE1 PHE A 147 -10.890 0.833 -6.989 1.00 0.00 C ATOM 2265 CE2 PHE A 147 -12.514 2.347 -7.877 1.00 0.00 C ATOM 2266 CZ PHE A 147 -11.333 1.646 -8.015 1.00 0.00 C ATOM 0 H PHE A 147 -14.575 0.352 -2.349 1.00 0.00 H new ATOM 0 HA PHE A 147 -15.509 0.470 -5.003 1.00 0.00 H new ATOM 0 HB2 PHE A 147 -14.147 2.243 -4.236 1.00 0.00 H new ATOM 0 HB3 PHE A 147 -12.939 1.162 -3.571 1.00 0.00 H new ATOM 0 HD1 PHE A 147 -11.281 0.090 -5.028 1.00 0.00 H new ATOM 0 HD2 PHE A 147 -14.173 2.788 -6.609 1.00 0.00 H new ATOM 0 HE1 PHE A 147 -9.967 0.282 -7.095 1.00 0.00 H new ATOM 0 HE2 PHE A 147 -12.863 2.982 -8.678 1.00 0.00 H new ATOM 0 HZ PHE A 147 -10.756 1.733 -8.924 1.00 0.00 H new ATOM 2276 N ILE A 148 -13.146 -1.757 -4.405 1.00 0.00 N ATOM 2277 CA ILE A 148 -12.491 -2.943 -4.944 1.00 0.00 C ATOM 2278 C ILE A 148 -13.515 -3.958 -5.441 1.00 0.00 C ATOM 2279 O ILE A 148 -13.447 -4.416 -6.582 1.00 0.00 O ATOM 2280 CB ILE A 148 -11.588 -3.614 -3.892 1.00 0.00 C ATOM 2281 CG1 ILE A 148 -10.516 -2.634 -3.409 1.00 0.00 C ATOM 2282 CG2 ILE A 148 -10.947 -4.868 -4.467 1.00 0.00 C ATOM 2283 CD1 ILE A 148 -9.928 -2.997 -2.063 1.00 0.00 C ATOM 0 H ILE A 148 -12.874 -1.522 -3.450 1.00 0.00 H new ATOM 0 HA ILE A 148 -11.876 -2.612 -5.781 1.00 0.00 H new ATOM 0 HB ILE A 148 -12.201 -3.902 -3.038 1.00 0.00 H new ATOM 0 HG12 ILE A 148 -9.715 -2.592 -4.147 1.00 0.00 H new ATOM 0 HG13 ILE A 148 -10.948 -1.635 -3.350 1.00 0.00 H new ATOM 0 HG21 ILE A 148 -10.312 -5.331 -3.712 1.00 0.00 H new ATOM 0 HG22 ILE A 148 -11.725 -5.570 -4.766 1.00 0.00 H new ATOM 0 HG23 ILE A 148 -10.344 -4.603 -5.335 1.00 0.00 H new ATOM 0 HD11 ILE A 148 -9.176 -2.259 -1.784 1.00 0.00 H new ATOM 0 HD12 ILE A 148 -10.718 -3.011 -1.313 1.00 0.00 H new ATOM 0 HD13 ILE A 148 -9.466 -3.982 -2.122 1.00 0.00 H new ATOM 2295 N LEU A 149 -14.463 -4.304 -4.578 1.00 0.00 N ATOM 2296 CA LEU A 149 -15.504 -5.265 -4.929 1.00 0.00 C ATOM 2297 C LEU A 149 -16.258 -4.818 -6.177 1.00 0.00 C ATOM 2298 O LEU A 149 -16.375 -5.568 -7.146 1.00 0.00 O ATOM 2299 CB LEU A 149 -16.480 -5.438 -3.764 1.00 0.00 C ATOM 2300 CG LEU A 149 -16.009 -6.338 -2.621 1.00 0.00 C ATOM 2301 CD1 LEU A 149 -16.929 -6.201 -1.419 1.00 0.00 C ATOM 2302 CD2 LEU A 149 -15.939 -7.788 -3.079 1.00 0.00 C ATOM 0 H LEU A 149 -14.533 -3.934 -3.630 1.00 0.00 H new ATOM 0 HA LEU A 149 -15.026 -6.222 -5.139 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -16.704 -4.453 -3.355 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -17.414 -5.841 -4.156 1.00 0.00 H new ATOM 0 HG LEU A 149 -15.009 -6.022 -2.324 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -16.578 -6.849 -0.616 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -16.929 -5.166 -1.077 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -17.942 -6.489 -1.701 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -15.602 -8.415 -2.253 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -16.927 -8.115 -3.403 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -15.238 -7.874 -3.909 1.00 0.00 H new ATOM 2314 N LYS A 150 -16.766 -3.591 -6.148 1.00 0.00 N ATOM 2315 CA LYS A 150 -17.506 -3.041 -7.277 1.00 0.00 C ATOM 2316 C LYS A 150 -16.836 -3.410 -8.598 1.00 0.00 C ATOM 2317 O LYS A 150 -17.466 -3.987 -9.483 1.00 0.00 O ATOM 2318 CB LYS A 150 -17.610 -1.519 -7.154 1.00 0.00 C ATOM 2319 CG LYS A 150 -18.755 -1.058 -6.269 1.00 0.00 C ATOM 2320 CD LYS A 150 -20.104 -1.337 -6.911 1.00 0.00 C ATOM 2321 CE LYS A 150 -21.250 -0.897 -6.013 1.00 0.00 C ATOM 2322 NZ LYS A 150 -21.536 0.558 -6.152 1.00 0.00 N ATOM 0 H LYS A 150 -16.678 -2.958 -5.353 1.00 0.00 H new ATOM 0 HA LYS A 150 -18.508 -3.469 -7.265 1.00 0.00 H new ATOM 0 HB2 LYS A 150 -16.673 -1.130 -6.754 1.00 0.00 H new ATOM 0 HB3 LYS A 150 -17.735 -1.090 -8.148 1.00 0.00 H new ATOM 0 HG2 LYS A 150 -18.698 -1.565 -5.306 1.00 0.00 H new ATOM 0 HG3 LYS A 150 -18.658 0.010 -6.074 1.00 0.00 H new ATOM 0 HD2 LYS A 150 -20.168 -0.816 -7.866 1.00 0.00 H new ATOM 0 HD3 LYS A 150 -20.194 -2.403 -7.122 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -22.145 -1.468 -6.260 1.00 0.00 H new ATOM 0 HE3 LYS A 150 -21.005 -1.121 -4.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -22.323 0.819 -5.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -20.690 1.104 -5.892 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -21.795 0.768 -7.137 1.00 0.00 H new ATOM 2336 N ASN A 151 -15.557 -3.073 -8.721 1.00 0.00 N ATOM 2337 CA ASN A 151 -14.802 -3.370 -9.933 1.00 0.00 C ATOM 2338 C ASN A 151 -13.502 -4.096 -9.600 1.00 0.00 C ATOM 2339 O ASN A 151 -12.561 -3.518 -9.056 1.00 0.00 O ATOM 2340 CB ASN A 151 -14.498 -2.080 -10.698 1.00 0.00 C ATOM 2341 CG ASN A 151 -13.787 -1.053 -9.839 1.00 0.00 C ATOM 2342 OD1 ASN A 151 -12.591 -0.812 -10.002 1.00 0.00 O ATOM 2343 ND2 ASN A 151 -14.523 -0.441 -8.918 1.00 0.00 N ATOM 0 H ASN A 151 -15.021 -2.594 -7.997 1.00 0.00 H new ATOM 0 HA ASN A 151 -15.410 -4.022 -10.560 1.00 0.00 H new ATOM 0 HB2 ASN A 151 -13.882 -2.312 -11.567 1.00 0.00 H new ATOM 0 HB3 ASN A 151 -15.429 -1.655 -11.072 1.00 0.00 H new ATOM 0 HD21 ASN A 151 -14.100 0.261 -8.310 1.00 0.00 H new ATOM 0 HD22 ASN A 151 -15.511 -0.673 -8.818 1.00 0.00 H new ATOM 2350 N PRO A 152 -13.446 -5.393 -9.935 1.00 0.00 N ATOM 2351 CA PRO A 152 -12.266 -6.226 -9.682 1.00 0.00 C ATOM 2352 C PRO A 152 -11.087 -5.845 -10.571 1.00 0.00 C ATOM 2353 O PRO A 152 -11.217 -5.070 -11.518 1.00 0.00 O ATOM 2354 CB PRO A 152 -12.751 -7.639 -10.015 1.00 0.00 C ATOM 2355 CG PRO A 152 -13.868 -7.439 -10.981 1.00 0.00 C ATOM 2356 CD PRO A 152 -14.530 -6.147 -10.587 1.00 0.00 C ATOM 0 HA PRO A 152 -11.900 -6.116 -8.661 1.00 0.00 H new ATOM 0 HB2 PRO A 152 -11.953 -8.239 -10.452 1.00 0.00 H new ATOM 0 HB3 PRO A 152 -13.090 -8.162 -9.121 1.00 0.00 H new ATOM 0 HG2 PRO A 152 -13.495 -7.390 -12.004 1.00 0.00 H new ATOM 0 HG3 PRO A 152 -14.574 -8.268 -10.938 1.00 0.00 H new ATOM 0 HD2 PRO A 152 -14.923 -5.616 -11.454 1.00 0.00 H new ATOM 0 HD3 PRO A 152 -15.367 -6.315 -9.909 1.00 0.00 H new ATOM 2364 N PRO A 153 -9.907 -6.402 -10.260 1.00 0.00 N ATOM 2365 CA PRO A 153 -8.681 -6.136 -11.020 1.00 0.00 C ATOM 2366 C PRO A 153 -8.717 -6.753 -12.413 1.00 0.00 C ATOM 2367 O PRO A 153 -9.627 -7.514 -12.741 1.00 0.00 O ATOM 2368 CB PRO A 153 -7.589 -6.793 -10.172 1.00 0.00 C ATOM 2369 CG PRO A 153 -8.293 -7.860 -9.407 1.00 0.00 C ATOM 2370 CD PRO A 153 -9.678 -7.336 -9.145 1.00 0.00 C ATOM 0 HA PRO A 153 -8.528 -5.070 -11.186 1.00 0.00 H new ATOM 0 HB2 PRO A 153 -6.799 -7.210 -10.797 1.00 0.00 H new ATOM 0 HB3 PRO A 153 -7.119 -6.071 -9.504 1.00 0.00 H new ATOM 0 HG2 PRO A 153 -8.328 -8.789 -9.976 1.00 0.00 H new ATOM 0 HG3 PRO A 153 -7.775 -8.077 -8.473 1.00 0.00 H new ATOM 0 HD2 PRO A 153 -10.416 -8.138 -9.135 1.00 0.00 H new ATOM 0 HD3 PRO A 153 -9.741 -6.833 -8.180 1.00 0.00 H new ATOM 2378 N GLU A 154 -7.721 -6.421 -13.229 1.00 0.00 N ATOM 2379 CA GLU A 154 -7.641 -6.944 -14.588 1.00 0.00 C ATOM 2380 C GLU A 154 -6.242 -7.476 -14.884 1.00 0.00 C ATOM 2381 O GLU A 154 -5.246 -6.783 -14.680 1.00 0.00 O ATOM 2382 CB GLU A 154 -8.009 -5.856 -15.599 1.00 0.00 C ATOM 2383 CG GLU A 154 -7.749 -6.254 -17.042 1.00 0.00 C ATOM 2384 CD GLU A 154 -8.079 -5.144 -18.022 1.00 0.00 C ATOM 2385 OE1 GLU A 154 -9.281 -4.863 -18.215 1.00 0.00 O ATOM 2386 OE2 GLU A 154 -7.138 -4.558 -18.595 1.00 0.00 O ATOM 0 H GLU A 154 -6.959 -5.793 -12.973 1.00 0.00 H new ATOM 0 HA GLU A 154 -8.350 -7.767 -14.676 1.00 0.00 H new ATOM 0 HB2 GLU A 154 -9.064 -5.607 -15.484 1.00 0.00 H new ATOM 0 HB3 GLU A 154 -7.441 -4.954 -15.372 1.00 0.00 H new ATOM 0 HG2 GLU A 154 -6.702 -6.534 -17.155 1.00 0.00 H new ATOM 0 HG3 GLU A 154 -8.342 -7.136 -17.284 1.00 0.00 H new ATOM 2393 N ASN A 155 -6.175 -8.713 -15.366 1.00 0.00 N ATOM 2394 CA ASN A 155 -4.899 -9.340 -15.689 1.00 0.00 C ATOM 2395 C ASN A 155 -4.720 -9.462 -17.199 1.00 0.00 C ATOM 2396 O ASN A 155 -4.961 -10.520 -17.780 1.00 0.00 O ATOM 2397 CB ASN A 155 -4.807 -10.723 -15.040 1.00 0.00 C ATOM 2398 CG ASN A 155 -6.037 -11.569 -15.307 1.00 0.00 C ATOM 2399 OD1 ASN A 155 -6.847 -11.250 -16.177 1.00 0.00 O ATOM 2400 ND2 ASN A 155 -6.181 -12.655 -14.556 1.00 0.00 N ATOM 0 H ASN A 155 -6.990 -9.301 -15.541 1.00 0.00 H new ATOM 0 HA ASN A 155 -4.103 -8.708 -15.296 1.00 0.00 H new ATOM 0 HB2 ASN A 155 -3.925 -11.240 -15.417 1.00 0.00 H new ATOM 0 HB3 ASN A 155 -4.674 -10.609 -13.964 1.00 0.00 H new ATOM 0 HD21 ASN A 155 -6.989 -13.264 -14.689 1.00 0.00 H new ATOM 0 HD22 ASN A 155 -5.484 -12.880 -13.846 1.00 0.00 H new ATOM 2407 N SER A 156 -4.295 -8.372 -17.829 1.00 0.00 N ATOM 2408 CA SER A 156 -4.086 -8.355 -19.272 1.00 0.00 C ATOM 2409 C SER A 156 -3.246 -9.550 -19.714 1.00 0.00 C ATOM 2410 O SER A 156 -3.561 -10.213 -20.702 1.00 0.00 O ATOM 2411 CB SER A 156 -3.403 -7.053 -19.695 1.00 0.00 C ATOM 2412 OG SER A 156 -2.926 -7.136 -21.027 1.00 0.00 O ATOM 0 H SER A 156 -4.089 -7.489 -17.363 1.00 0.00 H new ATOM 0 HA SER A 156 -5.061 -8.419 -19.756 1.00 0.00 H new ATOM 0 HB2 SER A 156 -4.107 -6.225 -19.608 1.00 0.00 H new ATOM 0 HB3 SER A 156 -2.574 -6.838 -19.021 1.00 0.00 H new ATOM 0 HG SER A 156 -2.495 -6.291 -21.273 1.00 0.00 H new ATOM 2418 N ASP A 157 -2.176 -9.818 -18.974 1.00 0.00 N ATOM 2419 CA ASP A 157 -1.290 -10.933 -19.287 1.00 0.00 C ATOM 2420 C ASP A 157 -0.492 -11.355 -18.057 1.00 0.00 C ATOM 2421 O ASP A 157 -0.134 -10.500 -17.248 1.00 0.00 O ATOM 2422 CB ASP A 157 -0.337 -10.552 -20.421 1.00 0.00 C ATOM 2423 CG ASP A 157 0.590 -9.414 -20.042 1.00 0.00 C ATOM 2424 OD1 ASP A 157 0.098 -8.405 -19.495 1.00 0.00 O ATOM 2425 OD2 ASP A 157 1.808 -9.533 -20.291 1.00 0.00 O ATOM 0 H ASP A 157 -1.901 -9.278 -18.153 1.00 0.00 H new ATOM 0 HA ASP A 157 -1.905 -11.775 -19.606 1.00 0.00 H new ATOM 0 HB2 ASP A 157 0.257 -11.422 -20.700 1.00 0.00 H new ATOM 0 HB3 ASP A 157 -0.917 -10.267 -21.299 1.00 0.00 H new TER 2430 ASP A 157 HETATM 2431 ZN ZN A 301 4.621 -15.029 2.068 1.00 0.00 ZN