USER MOD reduce.3.24.130724 H: found=0, std=0, add=1254, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1254 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: B 43 ASN : amide:sc= -0.249 K(o=-0.83,f=-1.8!) USER MOD Set 1.2: B 47 GLN : amide:sc= -0.582 X(o=-0.83,f=-0.58) USER MOD Set 2.1: A 35 MET CE :methyl 168:sc= -0.0763 (180deg=-0.509) USER MOD Set 2.2: B 7 TYR OH : rot -176:sc= 1.21 USER MOD Set 3.1: A 5 SER OG : rot -11:sc= 1.68 USER MOD Set 3.2: A 8 SER OG : rot 12:sc= 0.673 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -174:sc= 0 (180deg=-0.0233) USER MOD Single : A 6 LYS NZ :NH3+ 164:sc= -1.02! (180deg=-2.07!) USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 ASN : amide:sc= -0.0725 X(o=-0.072,f=-0.1) USER MOD Single : A 14 LYS NZ :NH3+ 161:sc= 1.19 (180deg=0.782) USER MOD Single : A 17 GLN : amide:sc= -0.8 K(o=-0.8,f=-0.0005) USER MOD Single : A 25 LYS NZ :NH3+ 172:sc= 1.27 (180deg=1.02) USER MOD Single : A 29 THR OG1 : rot 122:sc= 1.18 USER MOD Single : A 36 CYS SG : rot 82:sc= 0.869 USER MOD Single : A 39 ASN : amide:sc= 1.18 K(o=1.2,f=-0.018) USER MOD Single : A 42 THR OG1 : rot 82:sc= 1.24 USER MOD Single : A 43 ASN : amide:sc= -0.142 K(o=-0.14,f=-0.75) USER MOD Single : A 47 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 ASN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 61 THR OG1 : rot -3:sc= 0.693 USER MOD Single : A 62 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.00934) USER MOD Single : A 65 LYS NZ :NH3+ 143:sc= 1.23 (180deg=0.987) USER MOD Single : A 66 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 SER OG : rot -80:sc= 1.07 USER MOD Single : A 71 HIS : no HE2:sc= -3.08 K(o=-2.9,f=-3.9) USER MOD Single : A 72 HIS : no HD1:sc= 0 X(o=0,f=-0.0063) USER MOD Single : A 73 HIS : no HE2:sc= 1.22 K(o=1.2,f=-3.9!) USER MOD Single : A 74 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 75 HIS : no HD1:sc=-0.00177 X(o=-0.0018,f=-0.0073) USER MOD Single : A 76 HIS : no HD1:sc= 0 X(o=0,f=-0.016) USER MOD Single : B 1 MET CE :methyl 158:sc= -0.115 (180deg=-0.728) USER MOD Single : B 1 MET N :NH3+ 152:sc= 1.26 (180deg=0.342) USER MOD Single : B 5 SER OG : rot 52:sc= 0.0866 USER MOD Single : B 6 LYS NZ :NH3+ 164:sc= -0.048 (180deg=-0.308) USER MOD Single : B 8 SER OG : rot 180:sc= 0 USER MOD Single : B 9 ASN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : B 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 17 GLN : amide:sc= -1.47 K(o=-1.5,f=-0.15) USER MOD Single : B 25 LYS NZ :NH3+ -140:sc= 2.28 (180deg=0.208) USER MOD Single : B 29 THR OG1 : rot 180:sc= 0.124 USER MOD Single : B 35 MET CE :methyl 156:sc= -0.11 (180deg=-0.868) USER MOD Single : B 36 CYS SG : rot 77:sc= 0.0287 USER MOD Single : B 39 ASN : amide:sc= 0 X(o=0,f=0.048) USER MOD Single : B 42 THR OG1 : rot -33:sc= 0.0539 USER MOD Single : B 51 SER OG : rot -20:sc= 0.107 USER MOD Single : B 52 LYS NZ :NH3+ 162:sc= -0.0851 (180deg=-0.417) USER MOD Single : B 59 ASN : amide:sc= 1.18 K(o=1.2,f=-0.065) USER MOD Single : B 61 THR OG1 : rot -84:sc= 0.776 USER MOD Single : B 62 LYS NZ :NH3+ -169:sc= 0.827 (180deg=0.417) USER MOD Single : B 65 LYS NZ :NH3+ -124:sc= 1.28 (180deg=0.428) USER MOD Single : B 66 GLN : amide:sc= -1.54! C(o=-1.5!,f=-6.6!) USER MOD Single : B 67 SER OG : rot 60:sc= 1.24 USER MOD Single : B 71 HIS : no HD1:sc= -0.367 X(o=-0.37,f=-0.7) USER MOD Single : B 72 HIS : no HD1:sc= 0.171 K(o=0.17,f=-4.2!) USER MOD Single : B 73 HIS : no HE2:sc= 0.215 K(o=0.22,f=-0.77) USER MOD Single : B 74 HIS : no HD1:sc= 0 X(o=0,f=-0.013) USER MOD Single : B 75 HIS : no HD1:sc= 0 X(o=0,f=-0.057) USER MOD Single : B 76 HIS : no HD1:sc= 1.16 K(o=1.2,f=-4.7!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -17.313 -20.986 9.065 1.00 0.00 N ATOM 2 CA MET A 1 -17.338 -21.552 7.699 1.00 0.00 C ATOM 3 C MET A 1 -16.171 -21.015 6.883 1.00 0.00 C ATOM 4 O MET A 1 -15.947 -19.805 6.825 1.00 0.00 O ATOM 5 CB MET A 1 -18.665 -21.228 7.006 1.00 0.00 C ATOM 6 CG MET A 1 -19.853 -21.985 7.573 1.00 0.00 C ATOM 7 SD MET A 1 -19.703 -23.768 7.354 1.00 0.00 S ATOM 8 CE MET A 1 -21.205 -24.331 8.150 1.00 0.00 C ATOM 0 H1 MET A 1 -18.052 -21.437 9.641 1.00 0.00 H new ATOM 0 H2 MET A 1 -16.383 -21.161 9.496 1.00 0.00 H new ATOM 0 H3 MET A 1 -17.486 -19.961 9.019 1.00 0.00 H new ATOM 0 HA MET A 1 -17.243 -22.635 7.773 1.00 0.00 H new ATOM 0 HB2 MET A 1 -18.855 -20.158 7.088 1.00 0.00 H new ATOM 0 HB3 MET A 1 -18.575 -21.455 5.944 1.00 0.00 H new ATOM 0 HG2 MET A 1 -19.950 -21.759 8.635 1.00 0.00 H new ATOM 0 HG3 MET A 1 -20.766 -21.638 7.089 1.00 0.00 H new ATOM 0 HE1 MET A 1 -21.259 -25.418 8.098 1.00 0.00 H new ATOM 0 HE2 MET A 1 -21.203 -24.018 9.194 1.00 0.00 H new ATOM 0 HE3 MET A 1 -22.069 -23.900 7.644 1.00 0.00 H new ATOM 20 N PRO A 2 -15.398 -21.910 6.258 1.00 0.00 N ATOM 21 CA PRO A 2 -14.223 -21.535 5.473 1.00 0.00 C ATOM 22 C PRO A 2 -14.585 -20.817 4.175 1.00 0.00 C ATOM 23 O PRO A 2 -15.635 -21.081 3.582 1.00 0.00 O ATOM 24 CB PRO A 2 -13.541 -22.874 5.159 1.00 0.00 C ATOM 25 CG PRO A 2 -14.214 -23.886 6.024 1.00 0.00 C ATOM 26 CD PRO A 2 -15.599 -23.365 6.271 1.00 0.00 C ATOM 0 HA PRO A 2 -13.591 -20.837 6.022 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -13.647 -23.129 4.104 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -12.473 -22.828 5.370 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -14.245 -24.859 5.534 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -13.674 -24.018 6.962 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -16.297 -23.685 5.497 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -15.999 -23.711 7.224 1.00 0.00 H new ATOM 34 N ILE A 3 -13.707 -19.893 3.776 1.00 0.00 N ATOM 35 CA ILE A 3 -13.775 -19.174 2.494 1.00 0.00 C ATOM 36 C ILE A 3 -15.163 -18.604 2.195 1.00 0.00 C ATOM 37 O ILE A 3 -15.580 -18.553 1.039 1.00 0.00 O ATOM 38 CB ILE A 3 -13.284 -20.037 1.296 1.00 0.00 C ATOM 39 CG1 ILE A 3 -14.168 -21.273 1.070 1.00 0.00 C ATOM 40 CG2 ILE A 3 -11.835 -20.452 1.516 1.00 0.00 C ATOM 41 CD1 ILE A 3 -13.770 -22.099 -0.134 1.00 0.00 C ATOM 0 H ILE A 3 -12.909 -19.615 4.347 1.00 0.00 H new ATOM 0 HA ILE A 3 -13.091 -18.333 2.612 1.00 0.00 H new ATOM 0 HB ILE A 3 -13.355 -19.425 0.397 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -14.130 -21.902 1.959 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -15.203 -20.951 0.952 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -11.498 -21.056 0.674 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -11.210 -19.563 1.598 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -11.759 -21.035 2.434 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -14.440 -22.953 -0.227 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -13.836 -21.487 -1.033 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -12.746 -22.453 -0.010 1.00 0.00 H new ATOM 53 N VAL A 4 -15.852 -18.138 3.238 1.00 0.00 N ATOM 54 CA VAL A 4 -17.157 -17.493 3.076 1.00 0.00 C ATOM 55 C VAL A 4 -17.057 -16.274 2.158 1.00 0.00 C ATOM 56 O VAL A 4 -16.601 -15.207 2.569 1.00 0.00 O ATOM 57 CB VAL A 4 -17.772 -17.077 4.433 1.00 0.00 C ATOM 58 CG1 VAL A 4 -18.382 -18.281 5.130 1.00 0.00 C ATOM 59 CG2 VAL A 4 -16.732 -16.420 5.332 1.00 0.00 C ATOM 0 H VAL A 4 -15.529 -18.195 4.204 1.00 0.00 H new ATOM 0 HA VAL A 4 -17.816 -18.231 2.619 1.00 0.00 H new ATOM 0 HB VAL A 4 -18.557 -16.348 4.234 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -18.810 -17.971 6.083 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -19.164 -18.707 4.502 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -17.610 -19.030 5.306 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -17.194 -16.139 6.278 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -15.919 -17.121 5.520 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -16.338 -15.530 4.842 1.00 0.00 H new ATOM 69 N SER A 5 -17.442 -16.481 0.897 1.00 0.00 N ATOM 70 CA SER A 5 -17.349 -15.478 -0.175 1.00 0.00 C ATOM 71 C SER A 5 -15.907 -15.007 -0.404 1.00 0.00 C ATOM 72 O SER A 5 -15.659 -14.175 -1.280 1.00 0.00 O ATOM 73 CB SER A 5 -18.276 -14.270 0.086 1.00 0.00 C ATOM 74 OG SER A 5 -17.826 -13.463 1.167 1.00 0.00 O ATOM 0 H SER A 5 -17.836 -17.368 0.582 1.00 0.00 H new ATOM 0 HA SER A 5 -17.686 -15.973 -1.086 1.00 0.00 H new ATOM 0 HB2 SER A 5 -18.338 -13.662 -0.816 1.00 0.00 H new ATOM 0 HB3 SER A 5 -19.283 -14.628 0.299 1.00 0.00 H new ATOM 0 HG SER A 5 -17.115 -13.932 1.652 1.00 0.00 H new ATOM 80 N LYS A 6 -14.960 -15.583 0.352 1.00 0.00 N ATOM 81 CA LYS A 6 -13.562 -15.137 0.367 1.00 0.00 C ATOM 82 C LYS A 6 -13.457 -13.730 0.961 1.00 0.00 C ATOM 83 O LYS A 6 -12.888 -13.537 2.036 1.00 0.00 O ATOM 84 CB LYS A 6 -12.955 -15.189 -1.040 1.00 0.00 C ATOM 85 CG LYS A 6 -12.811 -16.603 -1.581 1.00 0.00 C ATOM 86 CD LYS A 6 -12.534 -16.621 -3.081 1.00 0.00 C ATOM 87 CE LYS A 6 -13.816 -16.493 -3.902 1.00 0.00 C ATOM 88 NZ LYS A 6 -14.468 -15.161 -3.758 1.00 0.00 N ATOM 0 H LYS A 6 -15.144 -16.373 0.971 1.00 0.00 H new ATOM 0 HA LYS A 6 -12.991 -15.817 0.999 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -13.580 -14.609 -1.719 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -11.975 -14.712 -1.023 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -12.000 -17.110 -1.057 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -13.723 -17.164 -1.375 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -11.858 -15.804 -3.335 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -12.026 -17.549 -3.345 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -13.587 -16.668 -4.953 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -14.517 -17.270 -3.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -15.161 -15.029 -4.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -14.952 -15.109 -2.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -13.747 -14.414 -3.812 1.00 0.00 H new ATOM 102 N TYR A 7 -14.020 -12.760 0.258 1.00 0.00 N ATOM 103 CA TYR A 7 -14.114 -11.398 0.747 1.00 0.00 C ATOM 104 C TYR A 7 -15.355 -10.733 0.162 1.00 0.00 C ATOM 105 O TYR A 7 -15.528 -10.682 -1.059 1.00 0.00 O ATOM 106 CB TYR A 7 -12.843 -10.589 0.413 1.00 0.00 C ATOM 107 CG TYR A 7 -12.508 -10.497 -1.064 1.00 0.00 C ATOM 108 CD1 TYR A 7 -11.771 -11.491 -1.695 1.00 0.00 C ATOM 109 CD2 TYR A 7 -12.918 -9.406 -1.826 1.00 0.00 C ATOM 110 CE1 TYR A 7 -11.457 -11.408 -3.037 1.00 0.00 C ATOM 111 CE2 TYR A 7 -12.609 -9.317 -3.170 1.00 0.00 C ATOM 112 CZ TYR A 7 -11.878 -10.318 -3.772 1.00 0.00 C ATOM 113 OH TYR A 7 -11.569 -10.230 -5.109 1.00 0.00 O ATOM 0 H TYR A 7 -14.424 -12.897 -0.668 1.00 0.00 H new ATOM 0 HA TYR A 7 -14.200 -11.423 1.833 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -12.960 -9.579 0.807 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -11.998 -11.038 0.934 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -11.437 -12.345 -1.125 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -13.487 -8.616 -1.359 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -10.885 -12.192 -3.510 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -12.939 -8.466 -3.747 1.00 0.00 H new ATOM 0 HH TYR A 7 -11.942 -9.402 -5.477 1.00 0.00 H new ATOM 123 N SER A 8 -16.242 -10.274 1.032 1.00 0.00 N ATOM 124 CA SER A 8 -17.423 -9.548 0.595 1.00 0.00 C ATOM 125 C SER A 8 -17.069 -8.087 0.336 1.00 0.00 C ATOM 126 O SER A 8 -16.056 -7.593 0.837 1.00 0.00 O ATOM 127 CB SER A 8 -18.522 -9.644 1.653 1.00 0.00 C ATOM 128 OG SER A 8 -18.916 -10.990 1.868 1.00 0.00 O ATOM 0 H SER A 8 -16.166 -10.391 2.042 1.00 0.00 H new ATOM 0 HA SER A 8 -17.789 -9.993 -0.330 1.00 0.00 H new ATOM 0 HB2 SER A 8 -18.167 -9.213 2.589 1.00 0.00 H new ATOM 0 HB3 SER A 8 -19.385 -9.056 1.339 1.00 0.00 H new ATOM 0 HG SER A 8 -18.277 -11.592 1.432 1.00 0.00 H new ATOM 134 N ASN A 9 -17.901 -7.396 -0.439 1.00 0.00 N ATOM 135 CA ASN A 9 -17.682 -5.978 -0.719 1.00 0.00 C ATOM 136 C ASN A 9 -17.651 -5.177 0.579 1.00 0.00 C ATOM 137 O ASN A 9 -16.894 -4.215 0.705 1.00 0.00 O ATOM 138 CB ASN A 9 -18.766 -5.426 -1.657 1.00 0.00 C ATOM 139 CG ASN A 9 -20.169 -5.533 -1.083 1.00 0.00 C ATOM 140 OD1 ASN A 9 -20.840 -6.547 -1.252 1.00 0.00 O ATOM 141 ND2 ASN A 9 -20.623 -4.488 -0.405 1.00 0.00 N ATOM 0 H ASN A 9 -18.730 -7.792 -0.883 1.00 0.00 H new ATOM 0 HA ASN A 9 -16.718 -5.879 -1.217 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -18.549 -4.380 -1.876 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -18.726 -5.965 -2.604 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -21.560 -4.509 -0.003 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -20.035 -3.663 -0.286 1.00 0.00 H new ATOM 148 N GLU A 10 -18.457 -5.603 1.548 1.00 0.00 N ATOM 149 CA GLU A 10 -18.520 -4.941 2.843 1.00 0.00 C ATOM 150 C GLU A 10 -17.189 -5.066 3.582 1.00 0.00 C ATOM 151 O GLU A 10 -16.812 -4.184 4.351 1.00 0.00 O ATOM 152 CB GLU A 10 -19.654 -5.535 3.684 1.00 0.00 C ATOM 153 CG GLU A 10 -19.492 -7.019 3.964 1.00 0.00 C ATOM 154 CD GLU A 10 -20.650 -7.595 4.744 1.00 0.00 C ATOM 155 OE1 GLU A 10 -20.755 -7.311 5.957 1.00 0.00 O ATOM 156 OE2 GLU A 10 -21.461 -8.336 4.150 1.00 0.00 O ATOM 0 H GLU A 10 -19.077 -6.408 1.458 1.00 0.00 H new ATOM 0 HA GLU A 10 -18.720 -3.882 2.679 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -19.711 -4.999 4.632 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -20.601 -5.372 3.169 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -19.394 -7.554 3.019 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -18.568 -7.181 4.520 1.00 0.00 H new ATOM 163 N ARG A 11 -16.472 -6.157 3.329 1.00 0.00 N ATOM 164 CA ARG A 11 -15.190 -6.380 3.976 1.00 0.00 C ATOM 165 C ARG A 11 -14.125 -5.515 3.327 1.00 0.00 C ATOM 166 O ARG A 11 -13.234 -5.015 4.001 1.00 0.00 O ATOM 167 CB ARG A 11 -14.775 -7.850 3.906 1.00 0.00 C ATOM 168 CG ARG A 11 -13.592 -8.180 4.806 1.00 0.00 C ATOM 169 CD ARG A 11 -13.240 -9.659 4.767 1.00 0.00 C ATOM 170 NE ARG A 11 -12.375 -10.036 5.883 1.00 0.00 N ATOM 171 CZ ARG A 11 -12.083 -11.289 6.219 1.00 0.00 C ATOM 172 NH1 ARG A 11 -12.498 -12.306 5.472 1.00 0.00 N ATOM 173 NH2 ARG A 11 -11.358 -11.521 7.301 1.00 0.00 N ATOM 0 H ARG A 11 -16.757 -6.894 2.684 1.00 0.00 H new ATOM 0 HA ARG A 11 -15.294 -6.108 5.026 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -15.623 -8.475 4.187 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -14.522 -8.101 2.876 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -12.727 -7.593 4.497 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -13.824 -7.890 5.831 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -14.154 -10.252 4.798 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -12.742 -9.890 3.826 1.00 0.00 H new ATOM 0 HE ARG A 11 -11.967 -9.287 6.442 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -13.047 -12.130 4.630 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -12.268 -13.263 5.740 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -11.028 -10.742 7.870 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -11.129 -12.479 7.566 1.00 0.00 H new ATOM 187 N VAL A 12 -14.233 -5.337 2.016 1.00 0.00 N ATOM 188 CA VAL A 12 -13.316 -4.469 1.290 1.00 0.00 C ATOM 189 C VAL A 12 -13.385 -3.059 1.859 1.00 0.00 C ATOM 190 O VAL A 12 -12.361 -2.446 2.163 1.00 0.00 O ATOM 191 CB VAL A 12 -13.639 -4.430 -0.220 1.00 0.00 C ATOM 192 CG1 VAL A 12 -12.650 -3.541 -0.962 1.00 0.00 C ATOM 193 CG2 VAL A 12 -13.636 -5.834 -0.804 1.00 0.00 C ATOM 0 H VAL A 12 -14.945 -5.781 1.436 1.00 0.00 H new ATOM 0 HA VAL A 12 -12.311 -4.873 1.410 1.00 0.00 H new ATOM 0 HB VAL A 12 -14.636 -4.007 -0.343 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -12.897 -3.529 -2.024 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -12.703 -2.527 -0.565 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -11.640 -3.930 -0.829 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -13.866 -5.786 -1.868 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -12.653 -6.284 -0.665 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -14.387 -6.440 -0.298 1.00 0.00 H new ATOM 203 N GLU A 13 -14.609 -2.567 2.030 1.00 0.00 N ATOM 204 CA GLU A 13 -14.835 -1.253 2.616 1.00 0.00 C ATOM 205 C GLU A 13 -14.330 -1.215 4.057 1.00 0.00 C ATOM 206 O GLU A 13 -13.795 -0.202 4.513 1.00 0.00 O ATOM 207 CB GLU A 13 -16.325 -0.896 2.565 1.00 0.00 C ATOM 208 CG GLU A 13 -16.903 -0.886 1.157 1.00 0.00 C ATOM 209 CD GLU A 13 -18.369 -0.500 1.122 1.00 0.00 C ATOM 210 OE1 GLU A 13 -19.234 -1.399 1.227 1.00 0.00 O ATOM 211 OE2 GLU A 13 -18.670 0.700 0.977 1.00 0.00 O ATOM 0 H GLU A 13 -15.462 -3.062 1.769 1.00 0.00 H new ATOM 0 HA GLU A 13 -14.279 -0.516 2.036 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -16.882 -1.610 3.172 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -16.470 0.086 3.015 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -16.334 -0.189 0.542 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -16.782 -1.874 0.713 1.00 0.00 H new ATOM 218 N LYS A 14 -14.486 -2.329 4.765 1.00 0.00 N ATOM 219 CA LYS A 14 -14.045 -2.416 6.150 1.00 0.00 C ATOM 220 C LYS A 14 -12.524 -2.394 6.261 1.00 0.00 C ATOM 221 O LYS A 14 -11.978 -1.647 7.060 1.00 0.00 O ATOM 222 CB LYS A 14 -14.596 -3.672 6.830 1.00 0.00 C ATOM 223 CG LYS A 14 -13.941 -3.937 8.174 1.00 0.00 C ATOM 224 CD LYS A 14 -14.594 -5.079 8.928 1.00 0.00 C ATOM 225 CE LYS A 14 -13.786 -5.433 10.167 1.00 0.00 C ATOM 226 NZ LYS A 14 -13.361 -4.220 10.918 1.00 0.00 N ATOM 0 H LYS A 14 -14.913 -3.181 4.403 1.00 0.00 H new ATOM 0 HA LYS A 14 -14.439 -1.537 6.661 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -15.672 -3.565 6.968 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -14.442 -4.532 6.178 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -12.886 -4.164 8.021 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -13.987 -3.033 8.781 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -15.608 -4.800 9.216 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -14.676 -5.951 8.279 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -14.382 -6.073 10.818 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -12.906 -6.006 9.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -13.106 -4.485 11.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -12.537 -3.792 10.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -14.142 -3.534 10.940 1.00 0.00 H new ATOM 240 N ILE A 15 -11.846 -3.206 5.454 1.00 0.00 N ATOM 241 CA ILE A 15 -10.388 -3.281 5.505 1.00 0.00 C ATOM 242 C ILE A 15 -9.769 -1.913 5.237 1.00 0.00 C ATOM 243 O ILE A 15 -8.785 -1.531 5.871 1.00 0.00 O ATOM 244 CB ILE A 15 -9.825 -4.319 4.504 1.00 0.00 C ATOM 245 CG1 ILE A 15 -10.378 -5.714 4.817 1.00 0.00 C ATOM 246 CG2 ILE A 15 -8.300 -4.337 4.554 1.00 0.00 C ATOM 247 CD1 ILE A 15 -9.960 -6.779 3.823 1.00 0.00 C ATOM 0 H ILE A 15 -12.279 -3.817 4.762 1.00 0.00 H new ATOM 0 HA ILE A 15 -10.120 -3.607 6.510 1.00 0.00 H new ATOM 0 HB ILE A 15 -10.138 -4.033 3.500 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -10.047 -6.010 5.812 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -11.467 -5.664 4.845 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -7.921 -5.072 3.844 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -7.916 -3.351 4.294 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -7.972 -4.601 5.559 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -10.391 -7.737 4.113 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -10.315 -6.508 2.829 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -8.873 -6.859 3.811 1.00 0.00 H new ATOM 259 N ILE A 16 -10.363 -1.166 4.314 1.00 0.00 N ATOM 260 CA ILE A 16 -9.913 0.191 4.041 1.00 0.00 C ATOM 261 C ILE A 16 -10.095 1.065 5.284 1.00 0.00 C ATOM 262 O ILE A 16 -9.219 1.854 5.629 1.00 0.00 O ATOM 263 CB ILE A 16 -10.665 0.813 2.843 1.00 0.00 C ATOM 264 CG1 ILE A 16 -10.443 -0.034 1.587 1.00 0.00 C ATOM 265 CG2 ILE A 16 -10.204 2.250 2.610 1.00 0.00 C ATOM 266 CD1 ILE A 16 -11.213 0.458 0.380 1.00 0.00 C ATOM 0 H ILE A 16 -11.152 -1.475 3.746 1.00 0.00 H new ATOM 0 HA ILE A 16 -8.855 0.143 3.781 1.00 0.00 H new ATOM 0 HB ILE A 16 -11.731 0.830 3.069 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -9.379 -0.044 1.349 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -10.733 -1.064 1.797 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -10.744 2.672 1.763 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -10.404 2.845 3.501 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -9.134 2.259 2.400 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -11.007 -0.190 -0.472 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -12.281 0.442 0.598 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -10.906 1.477 0.143 1.00 0.00 H new ATOM 278 N GLN A 17 -11.222 0.891 5.970 1.00 0.00 N ATOM 279 CA GLN A 17 -11.501 1.628 7.199 1.00 0.00 C ATOM 280 C GLN A 17 -10.529 1.224 8.309 1.00 0.00 C ATOM 281 O GLN A 17 -10.026 2.080 9.033 1.00 0.00 O ATOM 282 CB GLN A 17 -12.956 1.404 7.639 1.00 0.00 C ATOM 283 CG GLN A 17 -13.293 1.986 9.008 1.00 0.00 C ATOM 284 CD GLN A 17 -13.006 3.475 9.124 1.00 0.00 C ATOM 285 OE1 GLN A 17 -12.680 3.970 10.204 1.00 0.00 O ATOM 286 NE2 GLN A 17 -13.144 4.202 8.026 1.00 0.00 N ATOM 0 H GLN A 17 -11.960 0.243 5.694 1.00 0.00 H new ATOM 0 HA GLN A 17 -11.361 2.691 7.001 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -13.620 1.845 6.896 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -13.159 0.333 7.652 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -14.348 1.810 9.218 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -12.723 1.454 9.770 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -13.415 3.756 7.150 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -12.979 5.208 8.056 1.00 0.00 H new ATOM 295 N ASP A 18 -10.274 -0.074 8.435 1.00 0.00 N ATOM 296 CA ASP A 18 -9.288 -0.582 9.388 1.00 0.00 C ATOM 297 C ASP A 18 -7.937 0.104 9.169 1.00 0.00 C ATOM 298 O ASP A 18 -7.322 0.612 10.109 1.00 0.00 O ATOM 299 CB ASP A 18 -9.133 -2.104 9.246 1.00 0.00 C ATOM 300 CG ASP A 18 -10.136 -2.908 10.066 1.00 0.00 C ATOM 301 OD1 ASP A 18 -11.354 -2.803 9.814 1.00 0.00 O ATOM 302 OD2 ASP A 18 -9.700 -3.679 10.954 1.00 0.00 O ATOM 0 H ASP A 18 -10.738 -0.798 7.887 1.00 0.00 H new ATOM 0 HA ASP A 18 -9.639 -0.360 10.396 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -9.239 -2.373 8.195 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -8.124 -2.386 9.547 1.00 0.00 H new ATOM 307 N LEU A 19 -7.501 0.140 7.910 1.00 0.00 N ATOM 308 CA LEU A 19 -6.237 0.776 7.545 1.00 0.00 C ATOM 309 C LEU A 19 -6.282 2.281 7.809 1.00 0.00 C ATOM 310 O LEU A 19 -5.341 2.851 8.369 1.00 0.00 O ATOM 311 CB LEU A 19 -5.918 0.520 6.069 1.00 0.00 C ATOM 312 CG LEU A 19 -5.774 -0.952 5.673 1.00 0.00 C ATOM 313 CD1 LEU A 19 -5.554 -1.080 4.176 1.00 0.00 C ATOM 314 CD2 LEU A 19 -4.633 -1.607 6.437 1.00 0.00 C ATOM 0 H LEU A 19 -8.008 -0.266 7.123 1.00 0.00 H new ATOM 0 HA LEU A 19 -5.453 0.339 8.163 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -6.706 0.966 5.462 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -4.992 1.038 5.820 1.00 0.00 H new ATOM 0 HG LEU A 19 -6.699 -1.468 5.933 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -5.454 -2.133 3.912 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -6.405 -0.652 3.645 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -4.646 -0.547 3.895 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -4.549 -2.652 6.140 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -3.700 -1.090 6.212 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -4.831 -1.549 7.507 1.00 0.00 H new ATOM 326 N LEU A 20 -7.377 2.918 7.407 1.00 0.00 N ATOM 327 CA LEU A 20 -7.545 4.355 7.608 1.00 0.00 C ATOM 328 C LEU A 20 -7.534 4.699 9.090 1.00 0.00 C ATOM 329 O LEU A 20 -7.035 5.751 9.483 1.00 0.00 O ATOM 330 CB LEU A 20 -8.844 4.859 6.968 1.00 0.00 C ATOM 331 CG LEU A 20 -8.872 4.839 5.439 1.00 0.00 C ATOM 332 CD1 LEU A 20 -10.207 5.357 4.929 1.00 0.00 C ATOM 333 CD2 LEU A 20 -7.727 5.666 4.875 1.00 0.00 C ATOM 0 H LEU A 20 -8.162 2.463 6.940 1.00 0.00 H new ATOM 0 HA LEU A 20 -6.705 4.852 7.122 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -9.671 4.252 7.338 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -9.023 5.880 7.305 1.00 0.00 H new ATOM 0 HG LEU A 20 -8.749 3.810 5.103 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -10.213 5.337 3.839 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -11.011 4.726 5.308 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -10.356 6.380 5.274 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -7.762 5.641 3.786 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -7.820 6.697 5.217 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -6.778 5.254 5.217 1.00 0.00 H new ATOM 345 N ASP A 21 -8.074 3.802 9.910 1.00 0.00 N ATOM 346 CA ASP A 21 -8.080 4.000 11.351 1.00 0.00 C ATOM 347 C ASP A 21 -6.659 4.031 11.887 1.00 0.00 C ATOM 348 O ASP A 21 -6.334 4.840 12.746 1.00 0.00 O ATOM 349 CB ASP A 21 -8.871 2.907 12.064 1.00 0.00 C ATOM 350 CG ASP A 21 -8.984 3.168 13.552 1.00 0.00 C ATOM 351 OD1 ASP A 21 -8.101 2.724 14.312 1.00 0.00 O ATOM 352 OD2 ASP A 21 -9.962 3.823 13.972 1.00 0.00 O ATOM 0 H ASP A 21 -8.511 2.934 9.600 1.00 0.00 H new ATOM 0 HA ASP A 21 -8.564 4.957 11.547 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -9.869 2.840 11.631 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -8.387 1.944 11.900 1.00 0.00 H new ATOM 357 N VAL A 22 -5.812 3.146 11.370 1.00 0.00 N ATOM 358 CA VAL A 22 -4.400 3.126 11.746 1.00 0.00 C ATOM 359 C VAL A 22 -3.748 4.475 11.445 1.00 0.00 C ATOM 360 O VAL A 22 -2.958 4.998 12.232 1.00 0.00 O ATOM 361 CB VAL A 22 -3.627 2.023 10.994 1.00 0.00 C ATOM 362 CG1 VAL A 22 -2.168 2.000 11.424 1.00 0.00 C ATOM 363 CG2 VAL A 22 -4.273 0.663 11.213 1.00 0.00 C ATOM 0 H VAL A 22 -6.077 2.433 10.690 1.00 0.00 H new ATOM 0 HA VAL A 22 -4.356 2.920 12.815 1.00 0.00 H new ATOM 0 HB VAL A 22 -3.666 2.249 9.928 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -1.641 1.215 10.882 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -1.709 2.964 11.204 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -2.107 1.805 12.495 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -3.710 -0.098 10.673 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -4.273 0.427 12.277 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -5.299 0.684 10.846 1.00 0.00 H new ATOM 373 N LEU A 23 -4.117 5.043 10.309 1.00 0.00 N ATOM 374 CA LEU A 23 -3.559 6.302 9.859 1.00 0.00 C ATOM 375 C LEU A 23 -4.132 7.455 10.668 1.00 0.00 C ATOM 376 O LEU A 23 -3.425 8.411 10.985 1.00 0.00 O ATOM 377 CB LEU A 23 -3.854 6.511 8.372 1.00 0.00 C ATOM 378 CG LEU A 23 -3.341 5.409 7.438 1.00 0.00 C ATOM 379 CD1 LEU A 23 -3.728 5.712 6.000 1.00 0.00 C ATOM 380 CD2 LEU A 23 -1.831 5.256 7.561 1.00 0.00 C ATOM 0 H LEU A 23 -4.810 4.644 9.676 1.00 0.00 H new ATOM 0 HA LEU A 23 -2.479 6.273 10.005 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -4.933 6.601 8.242 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -3.416 7.460 8.062 1.00 0.00 H new ATOM 0 HG LEU A 23 -3.804 4.467 7.733 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -3.357 4.921 5.349 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -4.814 5.769 5.920 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -3.292 6.664 5.699 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -1.489 4.469 6.889 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -1.347 6.196 7.294 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -1.574 4.994 8.587 1.00 0.00 H new ATOM 392 N VAL A 24 -5.413 7.358 11.011 1.00 0.00 N ATOM 393 CA VAL A 24 -6.073 8.407 11.771 1.00 0.00 C ATOM 394 C VAL A 24 -5.676 8.325 13.246 1.00 0.00 C ATOM 395 O VAL A 24 -5.748 9.322 13.964 1.00 0.00 O ATOM 396 CB VAL A 24 -7.616 8.363 11.617 1.00 0.00 C ATOM 397 CG1 VAL A 24 -8.253 7.343 12.550 1.00 0.00 C ATOM 398 CG2 VAL A 24 -8.213 9.742 11.839 1.00 0.00 C ATOM 0 H VAL A 24 -6.010 6.566 10.774 1.00 0.00 H new ATOM 0 HA VAL A 24 -5.739 9.362 11.364 1.00 0.00 H new ATOM 0 HB VAL A 24 -7.834 8.047 10.597 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -9.334 7.346 12.409 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -7.860 6.351 12.327 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -8.022 7.601 13.583 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -9.296 9.692 11.727 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -7.968 10.087 12.843 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -7.804 10.438 11.106 1.00 0.00 H new ATOM 408 N LYS A 25 -5.258 7.132 13.689 1.00 0.00 N ATOM 409 CA LYS A 25 -4.663 6.978 15.015 1.00 0.00 C ATOM 410 C LYS A 25 -3.535 7.979 15.191 1.00 0.00 C ATOM 411 O LYS A 25 -3.447 8.668 16.204 1.00 0.00 O ATOM 412 CB LYS A 25 -4.072 5.575 15.228 1.00 0.00 C ATOM 413 CG LYS A 25 -5.074 4.454 15.460 1.00 0.00 C ATOM 414 CD LYS A 25 -4.347 3.179 15.876 1.00 0.00 C ATOM 415 CE LYS A 25 -5.291 2.004 16.086 1.00 0.00 C ATOM 416 NZ LYS A 25 -5.837 1.482 14.807 1.00 0.00 N ATOM 0 H LYS A 25 -5.322 6.268 13.151 1.00 0.00 H new ATOM 0 HA LYS A 25 -5.461 7.142 15.739 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -3.469 5.321 14.356 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -3.397 5.614 16.083 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -5.785 4.745 16.233 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -5.648 4.275 14.551 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -3.614 2.918 15.112 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -3.795 3.365 16.797 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -4.762 1.205 16.606 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -6.114 2.313 16.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -6.364 0.604 14.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -6.475 2.188 14.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -5.055 1.288 14.149 1.00 0.00 H new ATOM 430 N GLU A 26 -2.676 8.053 14.181 1.00 0.00 N ATOM 431 CA GLU A 26 -1.470 8.865 14.273 1.00 0.00 C ATOM 432 C GLU A 26 -1.641 10.220 13.593 1.00 0.00 C ATOM 433 O GLU A 26 -0.803 11.110 13.759 1.00 0.00 O ATOM 434 CB GLU A 26 -0.298 8.116 13.639 1.00 0.00 C ATOM 435 CG GLU A 26 -0.067 6.735 14.229 1.00 0.00 C ATOM 436 CD GLU A 26 0.292 6.778 15.699 1.00 0.00 C ATOM 437 OE1 GLU A 26 -0.624 6.797 16.542 1.00 0.00 O ATOM 438 OE2 GLU A 26 1.496 6.803 16.018 1.00 0.00 O ATOM 0 H GLU A 26 -2.792 7.563 13.294 1.00 0.00 H new ATOM 0 HA GLU A 26 -1.272 9.047 15.329 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -0.477 8.019 12.568 1.00 0.00 H new ATOM 0 HB3 GLU A 26 0.609 8.709 13.759 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -0.966 6.133 14.097 1.00 0.00 H new ATOM 0 HG3 GLU A 26 0.732 6.239 13.679 1.00 0.00 H new ATOM 445 N GLU A 27 -2.733 10.370 12.847 1.00 0.00 N ATOM 446 CA GLU A 27 -2.950 11.547 12.004 1.00 0.00 C ATOM 447 C GLU A 27 -1.744 11.762 11.097 1.00 0.00 C ATOM 448 O GLU A 27 -1.153 12.846 11.063 1.00 0.00 O ATOM 449 CB GLU A 27 -3.213 12.799 12.838 1.00 0.00 C ATOM 450 CG GLU A 27 -4.457 12.713 13.702 1.00 0.00 C ATOM 451 CD GLU A 27 -4.896 14.069 14.205 1.00 0.00 C ATOM 452 OE1 GLU A 27 -4.139 14.702 14.967 1.00 0.00 O ATOM 453 OE2 GLU A 27 -5.989 14.522 13.814 1.00 0.00 O ATOM 0 H GLU A 27 -3.488 9.686 12.808 1.00 0.00 H new ATOM 0 HA GLU A 27 -3.836 11.366 11.396 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -2.350 12.985 13.478 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -3.305 13.656 12.170 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -5.266 12.261 13.128 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -4.263 12.057 14.551 1.00 0.00 H new ATOM 460 N VAL A 28 -1.393 10.708 10.378 1.00 0.00 N ATOM 461 CA VAL A 28 -0.194 10.687 9.549 1.00 0.00 C ATOM 462 C VAL A 28 -0.237 11.743 8.447 1.00 0.00 C ATOM 463 O VAL A 28 -1.305 12.102 7.949 1.00 0.00 O ATOM 464 CB VAL A 28 0.010 9.296 8.909 1.00 0.00 C ATOM 465 CG1 VAL A 28 0.185 8.236 9.982 1.00 0.00 C ATOM 466 CG2 VAL A 28 -1.159 8.940 8.002 1.00 0.00 C ATOM 0 H VAL A 28 -1.930 9.841 10.351 1.00 0.00 H new ATOM 0 HA VAL A 28 0.643 10.913 10.210 1.00 0.00 H new ATOM 0 HB VAL A 28 0.916 9.332 8.303 1.00 0.00 H new ATOM 0 HG11 VAL A 28 0.327 7.263 9.512 1.00 0.00 H new ATOM 0 HG12 VAL A 28 1.056 8.476 10.592 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -0.703 8.208 10.614 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -0.992 7.956 7.563 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -2.080 8.926 8.584 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -1.243 9.682 7.208 1.00 0.00 H new ATOM 476 N THR A 29 0.934 12.245 8.085 1.00 0.00 N ATOM 477 CA THR A 29 1.061 13.168 6.975 1.00 0.00 C ATOM 478 C THR A 29 1.102 12.389 5.661 1.00 0.00 C ATOM 479 O THR A 29 1.299 11.173 5.678 1.00 0.00 O ATOM 480 CB THR A 29 2.337 14.026 7.118 1.00 0.00 C ATOM 481 OG1 THR A 29 3.482 13.183 7.282 1.00 0.00 O ATOM 482 CG2 THR A 29 2.226 14.968 8.305 1.00 0.00 C ATOM 0 H THR A 29 1.815 12.024 8.550 1.00 0.00 H new ATOM 0 HA THR A 29 0.198 13.834 6.977 1.00 0.00 H new ATOM 0 HB THR A 29 2.449 14.619 6.210 1.00 0.00 H new ATOM 0 HG1 THR A 29 4.129 13.368 6.570 1.00 0.00 H new ATOM 0 HG21 THR A 29 3.137 15.562 8.385 1.00 0.00 H new ATOM 0 HG22 THR A 29 1.372 15.631 8.165 1.00 0.00 H new ATOM 0 HG23 THR A 29 2.089 14.388 9.218 1.00 0.00 H new ATOM 490 N PRO A 30 0.905 13.060 4.512 1.00 0.00 N ATOM 491 CA PRO A 30 0.940 12.401 3.198 1.00 0.00 C ATOM 492 C PRO A 30 2.192 11.546 3.000 1.00 0.00 C ATOM 493 O PRO A 30 2.107 10.391 2.580 1.00 0.00 O ATOM 494 CB PRO A 30 0.940 13.573 2.219 1.00 0.00 C ATOM 495 CG PRO A 30 0.244 14.669 2.948 1.00 0.00 C ATOM 496 CD PRO A 30 0.616 14.503 4.395 1.00 0.00 C ATOM 0 HA PRO A 30 0.105 11.712 3.069 1.00 0.00 H new ATOM 0 HB2 PRO A 30 1.955 13.861 1.945 1.00 0.00 H new ATOM 0 HB3 PRO A 30 0.420 13.318 1.295 1.00 0.00 H new ATOM 0 HG2 PRO A 30 0.554 15.645 2.575 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -0.836 14.604 2.812 1.00 0.00 H new ATOM 0 HD2 PRO A 30 1.483 15.109 4.659 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -0.197 14.805 5.056 1.00 0.00 H new ATOM 504 N ASP A 31 3.346 12.117 3.328 1.00 0.00 N ATOM 505 CA ASP A 31 4.625 11.427 3.180 1.00 0.00 C ATOM 506 C ASP A 31 4.720 10.248 4.143 1.00 0.00 C ATOM 507 O ASP A 31 5.173 9.165 3.769 1.00 0.00 O ATOM 508 CB ASP A 31 5.791 12.400 3.415 1.00 0.00 C ATOM 509 CG ASP A 31 5.745 13.064 4.780 1.00 0.00 C ATOM 510 OD1 ASP A 31 4.789 13.832 5.036 1.00 0.00 O ATOM 511 OD2 ASP A 31 6.668 12.845 5.591 1.00 0.00 O ATOM 0 H ASP A 31 3.423 13.063 3.701 1.00 0.00 H new ATOM 0 HA ASP A 31 4.688 11.044 2.161 1.00 0.00 H new ATOM 0 HB2 ASP A 31 6.733 11.861 3.311 1.00 0.00 H new ATOM 0 HB3 ASP A 31 5.776 13.169 2.643 1.00 0.00 H new ATOM 516 N LEU A 32 4.265 10.457 5.372 1.00 0.00 N ATOM 517 CA LEU A 32 4.308 9.423 6.394 1.00 0.00 C ATOM 518 C LEU A 32 3.380 8.270 6.026 1.00 0.00 C ATOM 519 O LEU A 32 3.741 7.100 6.168 1.00 0.00 O ATOM 520 CB LEU A 32 3.919 10.012 7.755 1.00 0.00 C ATOM 521 CG LEU A 32 3.938 9.031 8.930 1.00 0.00 C ATOM 522 CD1 LEU A 32 5.311 8.399 9.076 1.00 0.00 C ATOM 523 CD2 LEU A 32 3.546 9.741 10.215 1.00 0.00 C ATOM 0 H LEU A 32 3.860 11.339 5.685 1.00 0.00 H new ATOM 0 HA LEU A 32 5.325 9.036 6.458 1.00 0.00 H new ATOM 0 HB2 LEU A 32 4.596 10.835 7.981 1.00 0.00 H new ATOM 0 HB3 LEU A 32 2.918 10.436 7.675 1.00 0.00 H new ATOM 0 HG LEU A 32 3.214 8.241 8.731 1.00 0.00 H new ATOM 0 HD11 LEU A 32 5.305 7.705 9.916 1.00 0.00 H new ATOM 0 HD12 LEU A 32 5.563 7.860 8.162 1.00 0.00 H new ATOM 0 HD13 LEU A 32 6.053 9.178 9.254 1.00 0.00 H new ATOM 0 HD21 LEU A 32 3.564 9.032 11.043 1.00 0.00 H new ATOM 0 HD22 LEU A 32 4.251 10.548 10.414 1.00 0.00 H new ATOM 0 HD23 LEU A 32 2.542 10.153 10.111 1.00 0.00 H new ATOM 535 N ALA A 33 2.193 8.612 5.536 1.00 0.00 N ATOM 536 CA ALA A 33 1.199 7.617 5.151 1.00 0.00 C ATOM 537 C ALA A 33 1.738 6.695 4.064 1.00 0.00 C ATOM 538 O ALA A 33 1.770 5.474 4.227 1.00 0.00 O ATOM 539 CB ALA A 33 -0.075 8.298 4.675 1.00 0.00 C ATOM 0 H ALA A 33 1.895 9.577 5.396 1.00 0.00 H new ATOM 0 HA ALA A 33 0.971 7.012 6.029 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -0.807 7.542 4.391 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -0.481 8.913 5.478 1.00 0.00 H new ATOM 0 HB3 ALA A 33 0.149 8.928 3.814 1.00 0.00 H new ATOM 545 N LEU A 34 2.186 7.296 2.969 1.00 0.00 N ATOM 546 CA LEU A 34 2.649 6.543 1.811 1.00 0.00 C ATOM 547 C LEU A 34 3.887 5.717 2.150 1.00 0.00 C ATOM 548 O LEU A 34 4.037 4.588 1.683 1.00 0.00 O ATOM 549 CB LEU A 34 2.950 7.497 0.656 1.00 0.00 C ATOM 550 CG LEU A 34 1.781 8.404 0.254 1.00 0.00 C ATOM 551 CD1 LEU A 34 2.202 9.372 -0.838 1.00 0.00 C ATOM 552 CD2 LEU A 34 0.592 7.574 -0.206 1.00 0.00 C ATOM 0 H LEU A 34 2.238 8.309 2.859 1.00 0.00 H new ATOM 0 HA LEU A 34 1.858 5.855 1.512 1.00 0.00 H new ATOM 0 HB2 LEU A 34 3.800 8.122 0.931 1.00 0.00 H new ATOM 0 HB3 LEU A 34 3.253 6.911 -0.212 1.00 0.00 H new ATOM 0 HG LEU A 34 1.483 8.981 1.130 1.00 0.00 H new ATOM 0 HD11 LEU A 34 1.357 10.006 -1.108 1.00 0.00 H new ATOM 0 HD12 LEU A 34 3.021 9.994 -0.477 1.00 0.00 H new ATOM 0 HD13 LEU A 34 2.530 8.812 -1.714 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -0.227 8.236 -0.487 1.00 0.00 H new ATOM 0 HD22 LEU A 34 0.881 6.970 -1.066 1.00 0.00 H new ATOM 0 HD23 LEU A 34 0.269 6.921 0.605 1.00 0.00 H new ATOM 564 N MET A 35 4.762 6.277 2.977 1.00 0.00 N ATOM 565 CA MET A 35 5.991 5.598 3.360 1.00 0.00 C ATOM 566 C MET A 35 5.689 4.337 4.167 1.00 0.00 C ATOM 567 O MET A 35 6.299 3.288 3.945 1.00 0.00 O ATOM 568 CB MET A 35 6.899 6.543 4.152 1.00 0.00 C ATOM 569 CG MET A 35 8.225 5.922 4.568 1.00 0.00 C ATOM 570 SD MET A 35 9.378 7.127 5.256 1.00 0.00 S ATOM 571 CE MET A 35 8.403 7.809 6.595 1.00 0.00 C ATOM 0 H MET A 35 4.642 7.200 3.395 1.00 0.00 H new ATOM 0 HA MET A 35 6.513 5.298 2.451 1.00 0.00 H new ATOM 0 HB2 MET A 35 7.098 7.429 3.550 1.00 0.00 H new ATOM 0 HB3 MET A 35 6.369 6.876 5.045 1.00 0.00 H new ATOM 0 HG2 MET A 35 8.039 5.141 5.306 1.00 0.00 H new ATOM 0 HG3 MET A 35 8.683 5.441 3.703 1.00 0.00 H new ATOM 0 HE1 MET A 35 9.043 8.408 7.243 1.00 0.00 H new ATOM 0 HE2 MET A 35 7.612 8.437 6.186 1.00 0.00 H new ATOM 0 HE3 MET A 35 7.960 6.998 7.172 1.00 0.00 H new ATOM 581 N CYS A 36 4.738 4.433 5.089 1.00 0.00 N ATOM 582 CA CYS A 36 4.344 3.282 5.893 1.00 0.00 C ATOM 583 C CYS A 36 3.664 2.231 5.022 1.00 0.00 C ATOM 584 O CYS A 36 3.951 1.040 5.132 1.00 0.00 O ATOM 585 CB CYS A 36 3.411 3.714 7.026 1.00 0.00 C ATOM 586 SG CYS A 36 4.125 4.952 8.133 1.00 0.00 S ATOM 0 H CYS A 36 4.228 5.291 5.298 1.00 0.00 H new ATOM 0 HA CYS A 36 5.242 2.845 6.330 1.00 0.00 H new ATOM 0 HB2 CYS A 36 2.493 4.113 6.595 1.00 0.00 H new ATOM 0 HB3 CYS A 36 3.134 2.836 7.610 1.00 0.00 H new ATOM 0 HG CYS A 36 4.004 6.132 7.601 1.00 0.00 H new ATOM 592 N LEU A 37 2.779 2.689 4.144 1.00 0.00 N ATOM 593 CA LEU A 37 2.056 1.798 3.247 1.00 0.00 C ATOM 594 C LEU A 37 3.015 1.049 2.327 1.00 0.00 C ATOM 595 O LEU A 37 2.885 -0.159 2.140 1.00 0.00 O ATOM 596 CB LEU A 37 1.036 2.583 2.421 1.00 0.00 C ATOM 597 CG LEU A 37 -0.115 3.201 3.224 1.00 0.00 C ATOM 598 CD1 LEU A 37 -1.001 4.051 2.323 1.00 0.00 C ATOM 599 CD2 LEU A 37 -0.937 2.115 3.905 1.00 0.00 C ATOM 0 H LEU A 37 2.545 3.676 4.035 1.00 0.00 H new ATOM 0 HA LEU A 37 1.527 1.065 3.856 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.557 3.380 1.891 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.616 1.919 1.665 1.00 0.00 H new ATOM 0 HG LEU A 37 0.312 3.844 3.994 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -1.812 4.481 2.911 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.409 4.852 1.881 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.418 3.429 1.531 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -1.749 2.573 4.470 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -1.352 1.446 3.151 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -0.299 1.547 4.582 1.00 0.00 H new ATOM 611 N GLY A 38 3.983 1.770 1.769 1.00 0.00 N ATOM 612 CA GLY A 38 4.956 1.161 0.875 1.00 0.00 C ATOM 613 C GLY A 38 5.689 -0.011 1.505 1.00 0.00 C ATOM 614 O GLY A 38 5.878 -1.049 0.867 1.00 0.00 O ATOM 0 H GLY A 38 4.112 2.770 1.920 1.00 0.00 H new ATOM 0 HA2 GLY A 38 4.449 0.822 -0.028 1.00 0.00 H new ATOM 0 HA3 GLY A 38 5.682 1.915 0.569 1.00 0.00 H new ATOM 618 N ASN A 39 6.093 0.149 2.761 1.00 0.00 N ATOM 619 CA ASN A 39 6.803 -0.910 3.473 1.00 0.00 C ATOM 620 C ASN A 39 5.880 -2.095 3.732 1.00 0.00 C ATOM 621 O ASN A 39 6.296 -3.249 3.633 1.00 0.00 O ATOM 622 CB ASN A 39 7.380 -0.393 4.793 1.00 0.00 C ATOM 623 CG ASN A 39 8.652 0.415 4.607 1.00 0.00 C ATOM 624 OD1 ASN A 39 9.752 -0.131 4.605 1.00 0.00 O ATOM 625 ND2 ASN A 39 8.513 1.723 4.455 1.00 0.00 N ATOM 0 H ASN A 39 5.942 0.998 3.306 1.00 0.00 H new ATOM 0 HA ASN A 39 7.629 -1.240 2.843 1.00 0.00 H new ATOM 0 HB2 ASN A 39 6.633 0.224 5.293 1.00 0.00 H new ATOM 0 HB3 ASN A 39 7.586 -1.238 5.449 1.00 0.00 H new ATOM 0 HD21 ASN A 39 9.336 2.312 4.331 1.00 0.00 H new ATOM 0 HD22 ASN A 39 7.583 2.141 4.462 1.00 0.00 H new ATOM 632 N ALA A 40 4.623 -1.801 4.051 1.00 0.00 N ATOM 633 CA ALA A 40 3.630 -2.840 4.290 1.00 0.00 C ATOM 634 C ALA A 40 3.409 -3.675 3.035 1.00 0.00 C ATOM 635 O ALA A 40 3.395 -4.905 3.094 1.00 0.00 O ATOM 636 CB ALA A 40 2.320 -2.225 4.761 1.00 0.00 C ATOM 0 H ALA A 40 4.269 -0.850 4.150 1.00 0.00 H new ATOM 0 HA ALA A 40 4.005 -3.498 5.074 1.00 0.00 H new ATOM 0 HB1 ALA A 40 1.589 -3.015 4.935 1.00 0.00 H new ATOM 0 HB2 ALA A 40 2.488 -1.676 5.687 1.00 0.00 H new ATOM 0 HB3 ALA A 40 1.943 -1.543 3.998 1.00 0.00 H new ATOM 642 N VAL A 41 3.255 -3.000 1.900 1.00 0.00 N ATOM 643 CA VAL A 41 3.056 -3.679 0.625 1.00 0.00 C ATOM 644 C VAL A 41 4.250 -4.571 0.299 1.00 0.00 C ATOM 645 O VAL A 41 4.088 -5.742 -0.047 1.00 0.00 O ATOM 646 CB VAL A 41 2.852 -2.677 -0.534 1.00 0.00 C ATOM 647 CG1 VAL A 41 2.596 -3.409 -1.842 1.00 0.00 C ATOM 648 CG2 VAL A 41 1.712 -1.720 -0.230 1.00 0.00 C ATOM 0 H VAL A 41 3.264 -1.982 1.838 1.00 0.00 H new ATOM 0 HA VAL A 41 2.155 -4.285 0.727 1.00 0.00 H new ATOM 0 HB VAL A 41 3.768 -2.095 -0.639 1.00 0.00 H new ATOM 0 HG11 VAL A 41 2.455 -2.684 -2.643 1.00 0.00 H new ATOM 0 HG12 VAL A 41 3.449 -4.047 -2.075 1.00 0.00 H new ATOM 0 HG13 VAL A 41 1.700 -4.022 -1.746 1.00 0.00 H new ATOM 0 HG21 VAL A 41 1.589 -1.025 -1.061 1.00 0.00 H new ATOM 0 HG22 VAL A 41 0.790 -2.285 -0.090 1.00 0.00 H new ATOM 0 HG23 VAL A 41 1.938 -1.162 0.679 1.00 0.00 H new ATOM 658 N THR A 42 5.446 -4.009 0.433 1.00 0.00 N ATOM 659 CA THR A 42 6.679 -4.729 0.131 1.00 0.00 C ATOM 660 C THR A 42 6.806 -5.990 0.989 1.00 0.00 C ATOM 661 O THR A 42 7.262 -7.033 0.516 1.00 0.00 O ATOM 662 CB THR A 42 7.911 -3.822 0.348 1.00 0.00 C ATOM 663 OG1 THR A 42 7.754 -2.607 -0.397 1.00 0.00 O ATOM 664 CG2 THR A 42 9.193 -4.519 -0.091 1.00 0.00 C ATOM 0 H THR A 42 5.589 -3.050 0.751 1.00 0.00 H new ATOM 0 HA THR A 42 6.638 -5.025 -0.917 1.00 0.00 H new ATOM 0 HB THR A 42 7.985 -3.601 1.413 1.00 0.00 H new ATOM 0 HG1 THR A 42 7.184 -1.987 0.105 1.00 0.00 H new ATOM 0 HG21 THR A 42 10.042 -3.856 0.074 1.00 0.00 H new ATOM 0 HG22 THR A 42 9.328 -5.432 0.489 1.00 0.00 H new ATOM 0 HG23 THR A 42 9.127 -4.768 -1.150 1.00 0.00 H new ATOM 672 N ASN A 43 6.374 -5.894 2.243 1.00 0.00 N ATOM 673 CA ASN A 43 6.430 -7.026 3.164 1.00 0.00 C ATOM 674 C ASN A 43 5.519 -8.152 2.685 1.00 0.00 C ATOM 675 O ASN A 43 5.864 -9.328 2.780 1.00 0.00 O ATOM 676 CB ASN A 43 6.012 -6.592 4.571 1.00 0.00 C ATOM 677 CG ASN A 43 6.230 -7.687 5.602 1.00 0.00 C ATOM 678 OD1 ASN A 43 7.158 -8.482 5.490 1.00 0.00 O ATOM 679 ND2 ASN A 43 5.374 -7.736 6.610 1.00 0.00 N ATOM 0 H ASN A 43 5.981 -5.043 2.646 1.00 0.00 H new ATOM 0 HA ASN A 43 7.458 -7.389 3.193 1.00 0.00 H new ATOM 0 HB2 ASN A 43 6.579 -5.707 4.859 1.00 0.00 H new ATOM 0 HB3 ASN A 43 4.960 -6.308 4.563 1.00 0.00 H new ATOM 0 HD21 ASN A 43 5.473 -8.453 7.329 1.00 0.00 H new ATOM 0 HD22 ASN A 43 4.615 -7.057 6.668 1.00 0.00 H new ATOM 686 N ILE A 44 4.356 -7.779 2.162 1.00 0.00 N ATOM 687 CA ILE A 44 3.387 -8.751 1.665 1.00 0.00 C ATOM 688 C ILE A 44 3.884 -9.404 0.375 1.00 0.00 C ATOM 689 O ILE A 44 3.817 -10.623 0.218 1.00 0.00 O ATOM 690 CB ILE A 44 2.007 -8.092 1.418 1.00 0.00 C ATOM 691 CG1 ILE A 44 1.471 -7.478 2.717 1.00 0.00 C ATOM 692 CG2 ILE A 44 1.010 -9.096 0.844 1.00 0.00 C ATOM 693 CD1 ILE A 44 1.321 -8.474 3.849 1.00 0.00 C ATOM 0 H ILE A 44 4.060 -6.807 2.071 1.00 0.00 H new ATOM 0 HA ILE A 44 3.274 -9.518 2.431 1.00 0.00 H new ATOM 0 HB ILE A 44 2.137 -7.297 0.684 1.00 0.00 H new ATOM 0 HG12 ILE A 44 2.142 -6.680 3.034 1.00 0.00 H new ATOM 0 HG13 ILE A 44 0.502 -7.020 2.518 1.00 0.00 H new ATOM 0 HG21 ILE A 44 0.051 -8.604 0.681 1.00 0.00 H new ATOM 0 HG22 ILE A 44 1.386 -9.481 -0.104 1.00 0.00 H new ATOM 0 HG23 ILE A 44 0.880 -9.921 1.544 1.00 0.00 H new ATOM 0 HD11 ILE A 44 0.937 -7.965 4.733 1.00 0.00 H new ATOM 0 HD12 ILE A 44 0.626 -9.260 3.553 1.00 0.00 H new ATOM 0 HD13 ILE A 44 2.292 -8.915 4.077 1.00 0.00 H new ATOM 705 N ILE A 45 4.404 -8.587 -0.534 1.00 0.00 N ATOM 706 CA ILE A 45 4.894 -9.075 -1.821 1.00 0.00 C ATOM 707 C ILE A 45 6.134 -9.954 -1.640 1.00 0.00 C ATOM 708 O ILE A 45 6.434 -10.817 -2.466 1.00 0.00 O ATOM 709 CB ILE A 45 5.211 -7.899 -2.775 1.00 0.00 C ATOM 710 CG1 ILE A 45 3.971 -7.020 -2.955 1.00 0.00 C ATOM 711 CG2 ILE A 45 5.691 -8.410 -4.127 1.00 0.00 C ATOM 712 CD1 ILE A 45 4.202 -5.812 -3.836 1.00 0.00 C ATOM 0 H ILE A 45 4.498 -7.580 -0.404 1.00 0.00 H new ATOM 0 HA ILE A 45 4.104 -9.680 -2.266 1.00 0.00 H new ATOM 0 HB ILE A 45 6.010 -7.304 -2.332 1.00 0.00 H new ATOM 0 HG12 ILE A 45 3.169 -7.622 -3.383 1.00 0.00 H new ATOM 0 HG13 ILE A 45 3.630 -6.684 -1.976 1.00 0.00 H new ATOM 0 HG21 ILE A 45 5.907 -7.564 -4.780 1.00 0.00 H new ATOM 0 HG22 ILE A 45 6.595 -9.004 -3.991 1.00 0.00 H new ATOM 0 HG23 ILE A 45 4.915 -9.028 -4.579 1.00 0.00 H new ATOM 0 HD11 ILE A 45 3.279 -5.238 -3.916 1.00 0.00 H new ATOM 0 HD12 ILE A 45 4.981 -5.187 -3.399 1.00 0.00 H new ATOM 0 HD13 ILE A 45 4.513 -6.139 -4.828 1.00 0.00 H new ATOM 724 N ALA A 46 6.842 -9.756 -0.538 1.00 0.00 N ATOM 725 CA ALA A 46 8.027 -10.553 -0.243 1.00 0.00 C ATOM 726 C ALA A 46 7.650 -11.973 0.176 1.00 0.00 C ATOM 727 O ALA A 46 8.510 -12.849 0.257 1.00 0.00 O ATOM 728 CB ALA A 46 8.860 -9.883 0.837 1.00 0.00 C ATOM 0 H ALA A 46 6.619 -9.053 0.166 1.00 0.00 H new ATOM 0 HA ALA A 46 8.622 -10.620 -1.154 1.00 0.00 H new ATOM 0 HB1 ALA A 46 9.741 -10.490 1.046 1.00 0.00 H new ATOM 0 HB2 ALA A 46 9.172 -8.896 0.496 1.00 0.00 H new ATOM 0 HB3 ALA A 46 8.265 -9.782 1.745 1.00 0.00 H new ATOM 734 N GLN A 47 6.365 -12.202 0.415 1.00 0.00 N ATOM 735 CA GLN A 47 5.879 -13.525 0.784 1.00 0.00 C ATOM 736 C GLN A 47 5.329 -14.254 -0.443 1.00 0.00 C ATOM 737 O GLN A 47 4.870 -15.393 -0.356 1.00 0.00 O ATOM 738 CB GLN A 47 4.793 -13.393 1.852 1.00 0.00 C ATOM 739 CG GLN A 47 5.251 -12.620 3.078 1.00 0.00 C ATOM 740 CD GLN A 47 4.132 -12.364 4.068 1.00 0.00 C ATOM 741 OE1 GLN A 47 3.199 -13.156 4.194 1.00 0.00 O ATOM 742 NE2 GLN A 47 4.215 -11.247 4.772 1.00 0.00 N ATOM 0 H GLN A 47 5.640 -11.487 0.360 1.00 0.00 H new ATOM 0 HA GLN A 47 6.708 -14.108 1.186 1.00 0.00 H new ATOM 0 HB2 GLN A 47 3.925 -12.895 1.419 1.00 0.00 H new ATOM 0 HB3 GLN A 47 4.470 -14.388 2.157 1.00 0.00 H new ATOM 0 HG2 GLN A 47 6.048 -13.175 3.574 1.00 0.00 H new ATOM 0 HG3 GLN A 47 5.675 -11.667 2.762 1.00 0.00 H new ATOM 0 HE21 GLN A 47 5.006 -10.617 4.637 1.00 0.00 H new ATOM 0 HE22 GLN A 47 3.488 -11.016 5.450 1.00 0.00 H new ATOM 751 N VAL A 48 5.392 -13.586 -1.586 1.00 0.00 N ATOM 752 CA VAL A 48 4.861 -14.129 -2.831 1.00 0.00 C ATOM 753 C VAL A 48 5.949 -14.863 -3.611 1.00 0.00 C ATOM 754 O VAL A 48 7.052 -14.351 -3.768 1.00 0.00 O ATOM 755 CB VAL A 48 4.290 -13.005 -3.723 1.00 0.00 C ATOM 756 CG1 VAL A 48 3.591 -13.578 -4.946 1.00 0.00 C ATOM 757 CG2 VAL A 48 3.338 -12.123 -2.933 1.00 0.00 C ATOM 0 H VAL A 48 5.809 -12.660 -1.678 1.00 0.00 H new ATOM 0 HA VAL A 48 4.066 -14.826 -2.567 1.00 0.00 H new ATOM 0 HB VAL A 48 5.125 -12.394 -4.065 1.00 0.00 H new ATOM 0 HG11 VAL A 48 3.199 -12.764 -5.556 1.00 0.00 H new ATOM 0 HG12 VAL A 48 4.302 -14.160 -5.532 1.00 0.00 H new ATOM 0 HG13 VAL A 48 2.770 -14.221 -4.628 1.00 0.00 H new ATOM 0 HG21 VAL A 48 2.947 -11.338 -3.580 1.00 0.00 H new ATOM 0 HG22 VAL A 48 2.512 -12.726 -2.555 1.00 0.00 H new ATOM 0 HG23 VAL A 48 3.870 -11.671 -2.096 1.00 0.00 H new ATOM 767 N PRO A 49 5.662 -16.079 -4.099 1.00 0.00 N ATOM 768 CA PRO A 49 6.593 -16.821 -4.952 1.00 0.00 C ATOM 769 C PRO A 49 6.883 -16.080 -6.256 1.00 0.00 C ATOM 770 O PRO A 49 5.959 -15.649 -6.937 1.00 0.00 O ATOM 771 CB PRO A 49 5.860 -18.137 -5.243 1.00 0.00 C ATOM 772 CG PRO A 49 4.815 -18.244 -4.185 1.00 0.00 C ATOM 773 CD PRO A 49 4.427 -16.835 -3.840 1.00 0.00 C ATOM 0 HA PRO A 49 7.560 -16.961 -4.469 1.00 0.00 H new ATOM 0 HB2 PRO A 49 5.414 -18.128 -6.238 1.00 0.00 H new ATOM 0 HB3 PRO A 49 6.544 -18.985 -5.208 1.00 0.00 H new ATOM 0 HG2 PRO A 49 3.954 -18.809 -4.543 1.00 0.00 H new ATOM 0 HG3 PRO A 49 5.199 -18.768 -3.310 1.00 0.00 H new ATOM 0 HD2 PRO A 49 3.601 -16.481 -4.457 1.00 0.00 H new ATOM 0 HD3 PRO A 49 4.110 -16.747 -2.801 1.00 0.00 H new ATOM 781 N GLU A 50 8.173 -15.925 -6.568 1.00 0.00 N ATOM 782 CA GLU A 50 8.665 -15.288 -7.811 1.00 0.00 C ATOM 783 C GLU A 50 7.766 -15.520 -9.022 1.00 0.00 C ATOM 784 O GLU A 50 7.492 -14.588 -9.778 1.00 0.00 O ATOM 785 CB GLU A 50 10.042 -15.843 -8.134 1.00 0.00 C ATOM 786 CG GLU A 50 10.992 -15.755 -6.971 1.00 0.00 C ATOM 787 CD GLU A 50 11.651 -14.404 -6.860 1.00 0.00 C ATOM 788 OE1 GLU A 50 12.373 -14.013 -7.796 1.00 0.00 O ATOM 789 OE2 GLU A 50 11.460 -13.736 -5.830 1.00 0.00 O ATOM 0 H GLU A 50 8.926 -16.242 -5.957 1.00 0.00 H new ATOM 0 HA GLU A 50 8.682 -14.215 -7.622 1.00 0.00 H new ATOM 0 HB2 GLU A 50 9.946 -16.884 -8.441 1.00 0.00 H new ATOM 0 HB3 GLU A 50 10.459 -15.298 -8.981 1.00 0.00 H new ATOM 0 HG2 GLU A 50 10.452 -15.968 -6.049 1.00 0.00 H new ATOM 0 HG3 GLU A 50 11.760 -16.522 -7.075 1.00 0.00 H new ATOM 796 N SER A 51 7.325 -16.764 -9.198 1.00 0.00 N ATOM 797 CA SER A 51 6.482 -17.155 -10.326 1.00 0.00 C ATOM 798 C SER A 51 5.270 -16.232 -10.479 1.00 0.00 C ATOM 799 O SER A 51 4.694 -16.116 -11.562 1.00 0.00 O ATOM 800 CB SER A 51 6.025 -18.607 -10.142 1.00 0.00 C ATOM 801 OG SER A 51 5.368 -19.099 -11.296 1.00 0.00 O ATOM 0 H SER A 51 7.543 -17.531 -8.561 1.00 0.00 H new ATOM 0 HA SER A 51 7.073 -17.067 -11.238 1.00 0.00 H new ATOM 0 HB2 SER A 51 6.888 -19.235 -9.919 1.00 0.00 H new ATOM 0 HB3 SER A 51 5.354 -18.672 -9.286 1.00 0.00 H new ATOM 0 HG SER A 51 5.092 -20.027 -11.145 1.00 0.00 H new ATOM 807 N LYS A 52 4.888 -15.577 -9.394 1.00 0.00 N ATOM 808 CA LYS A 52 3.800 -14.621 -9.425 1.00 0.00 C ATOM 809 C LYS A 52 4.162 -13.346 -8.661 1.00 0.00 C ATOM 810 O LYS A 52 3.346 -12.431 -8.562 1.00 0.00 O ATOM 811 CB LYS A 52 2.533 -15.256 -8.842 1.00 0.00 C ATOM 812 CG LYS A 52 2.729 -15.845 -7.452 1.00 0.00 C ATOM 813 CD LYS A 52 1.484 -16.566 -6.959 1.00 0.00 C ATOM 814 CE LYS A 52 0.295 -15.627 -6.831 1.00 0.00 C ATOM 815 NZ LYS A 52 -0.905 -16.324 -6.296 1.00 0.00 N ATOM 0 H LYS A 52 5.320 -15.693 -8.477 1.00 0.00 H new ATOM 0 HA LYS A 52 3.615 -14.344 -10.463 1.00 0.00 H new ATOM 0 HB2 LYS A 52 1.746 -14.503 -8.801 1.00 0.00 H new ATOM 0 HB3 LYS A 52 2.188 -16.041 -9.515 1.00 0.00 H new ATOM 0 HG2 LYS A 52 3.568 -16.540 -7.468 1.00 0.00 H new ATOM 0 HG3 LYS A 52 2.987 -15.049 -6.754 1.00 0.00 H new ATOM 0 HD2 LYS A 52 1.236 -17.373 -7.648 1.00 0.00 H new ATOM 0 HD3 LYS A 52 1.690 -17.024 -5.992 1.00 0.00 H new ATOM 0 HE2 LYS A 52 0.556 -14.797 -6.174 1.00 0.00 H new ATOM 0 HE3 LYS A 52 0.062 -15.200 -7.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -1.694 -15.650 -6.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -1.170 -17.100 -6.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -0.691 -16.710 -5.354 1.00 0.00 H new ATOM 829 N ARG A 53 5.389 -13.273 -8.130 1.00 0.00 N ATOM 830 CA ARG A 53 5.785 -12.123 -7.323 1.00 0.00 C ATOM 831 C ARG A 53 5.979 -10.885 -8.190 1.00 0.00 C ATOM 832 O ARG A 53 5.579 -9.783 -7.811 1.00 0.00 O ATOM 833 CB ARG A 53 7.076 -12.406 -6.554 1.00 0.00 C ATOM 834 CG ARG A 53 7.278 -11.462 -5.385 1.00 0.00 C ATOM 835 CD ARG A 53 8.745 -11.242 -5.061 1.00 0.00 C ATOM 836 NE ARG A 53 9.450 -12.462 -4.695 1.00 0.00 N ATOM 837 CZ ARG A 53 9.579 -12.923 -3.459 1.00 0.00 C ATOM 838 NH1 ARG A 53 8.879 -12.396 -2.475 1.00 0.00 N ATOM 839 NH2 ARG A 53 10.392 -13.943 -3.224 1.00 0.00 N ATOM 0 H ARG A 53 6.110 -13.985 -8.244 1.00 0.00 H new ATOM 0 HA ARG A 53 4.980 -11.939 -6.612 1.00 0.00 H new ATOM 0 HB2 ARG A 53 7.059 -13.433 -6.188 1.00 0.00 H new ATOM 0 HB3 ARG A 53 7.924 -12.324 -7.233 1.00 0.00 H new ATOM 0 HG2 ARG A 53 6.812 -10.503 -5.612 1.00 0.00 H new ATOM 0 HG3 ARG A 53 6.772 -11.863 -4.507 1.00 0.00 H new ATOM 0 HD2 ARG A 53 9.236 -10.794 -5.925 1.00 0.00 H new ATOM 0 HD3 ARG A 53 8.824 -10.527 -4.242 1.00 0.00 H new ATOM 0 HE ARG A 53 9.877 -13.003 -5.447 1.00 0.00 H new ATOM 0 HH11 ARG A 53 8.233 -11.629 -2.662 1.00 0.00 H new ATOM 0 HH12 ARG A 53 8.983 -12.755 -1.526 1.00 0.00 H new ATOM 0 HH21 ARG A 53 10.913 -14.367 -3.991 1.00 0.00 H new ATOM 0 HH22 ARG A 53 10.497 -14.304 -2.276 1.00 0.00 H new ATOM 853 N VAL A 54 6.585 -11.065 -9.354 1.00 0.00 N ATOM 854 CA VAL A 54 6.851 -9.949 -10.252 1.00 0.00 C ATOM 855 C VAL A 54 5.543 -9.448 -10.857 1.00 0.00 C ATOM 856 O VAL A 54 5.362 -8.250 -11.085 1.00 0.00 O ATOM 857 CB VAL A 54 7.835 -10.343 -11.378 1.00 0.00 C ATOM 858 CG1 VAL A 54 8.195 -9.137 -12.236 1.00 0.00 C ATOM 859 CG2 VAL A 54 9.088 -10.983 -10.796 1.00 0.00 C ATOM 0 H VAL A 54 6.902 -11.971 -9.699 1.00 0.00 H new ATOM 0 HA VAL A 54 7.314 -9.154 -9.668 1.00 0.00 H new ATOM 0 HB VAL A 54 7.341 -11.075 -12.017 1.00 0.00 H new ATOM 0 HG11 VAL A 54 8.888 -9.442 -13.020 1.00 0.00 H new ATOM 0 HG12 VAL A 54 7.291 -8.730 -12.689 1.00 0.00 H new ATOM 0 HG13 VAL A 54 8.664 -8.375 -11.614 1.00 0.00 H new ATOM 0 HG21 VAL A 54 9.768 -11.253 -11.604 1.00 0.00 H new ATOM 0 HG22 VAL A 54 9.581 -10.276 -10.128 1.00 0.00 H new ATOM 0 HG23 VAL A 54 8.814 -11.878 -10.238 1.00 0.00 H new ATOM 869 N ALA A 55 4.627 -10.378 -11.089 1.00 0.00 N ATOM 870 CA ALA A 55 3.320 -10.050 -11.632 1.00 0.00 C ATOM 871 C ALA A 55 2.523 -9.172 -10.670 1.00 0.00 C ATOM 872 O ALA A 55 2.011 -8.124 -11.058 1.00 0.00 O ATOM 873 CB ALA A 55 2.545 -11.320 -11.949 1.00 0.00 C ATOM 0 H ALA A 55 4.768 -11.372 -10.908 1.00 0.00 H new ATOM 0 HA ALA A 55 3.473 -9.488 -12.553 1.00 0.00 H new ATOM 0 HB1 ALA A 55 1.568 -11.058 -12.355 1.00 0.00 H new ATOM 0 HB2 ALA A 55 3.096 -11.909 -12.682 1.00 0.00 H new ATOM 0 HB3 ALA A 55 2.415 -11.904 -11.038 1.00 0.00 H new ATOM 879 N VAL A 56 2.439 -9.591 -9.410 1.00 0.00 N ATOM 880 CA VAL A 56 1.618 -8.887 -8.427 1.00 0.00 C ATOM 881 C VAL A 56 2.180 -7.503 -8.089 1.00 0.00 C ATOM 882 O VAL A 56 1.416 -6.555 -7.912 1.00 0.00 O ATOM 883 CB VAL A 56 1.433 -9.706 -7.124 1.00 0.00 C ATOM 884 CG1 VAL A 56 0.653 -10.984 -7.397 1.00 0.00 C ATOM 885 CG2 VAL A 56 2.769 -10.028 -6.475 1.00 0.00 C ATOM 0 H VAL A 56 2.926 -10.410 -9.046 1.00 0.00 H new ATOM 0 HA VAL A 56 0.642 -8.759 -8.896 1.00 0.00 H new ATOM 0 HB VAL A 56 0.862 -9.092 -6.428 1.00 0.00 H new ATOM 0 HG11 VAL A 56 0.535 -11.543 -6.469 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -0.329 -10.732 -7.797 1.00 0.00 H new ATOM 0 HG13 VAL A 56 1.194 -11.593 -8.121 1.00 0.00 H new ATOM 0 HG21 VAL A 56 2.602 -10.603 -5.564 1.00 0.00 H new ATOM 0 HG22 VAL A 56 3.378 -10.611 -7.166 1.00 0.00 H new ATOM 0 HG23 VAL A 56 3.287 -9.101 -6.229 1.00 0.00 H new ATOM 895 N VAL A 57 3.503 -7.375 -8.022 1.00 0.00 N ATOM 896 CA VAL A 57 4.108 -6.096 -7.661 1.00 0.00 C ATOM 897 C VAL A 57 3.939 -5.072 -8.782 1.00 0.00 C ATOM 898 O VAL A 57 3.661 -3.901 -8.523 1.00 0.00 O ATOM 899 CB VAL A 57 5.605 -6.231 -7.278 1.00 0.00 C ATOM 900 CG1 VAL A 57 6.437 -6.774 -8.429 1.00 0.00 C ATOM 901 CG2 VAL A 57 6.160 -4.897 -6.803 1.00 0.00 C ATOM 0 H VAL A 57 4.166 -8.127 -8.209 1.00 0.00 H new ATOM 0 HA VAL A 57 3.578 -5.743 -6.776 1.00 0.00 H new ATOM 0 HB VAL A 57 5.668 -6.949 -6.460 1.00 0.00 H new ATOM 0 HG11 VAL A 57 7.479 -6.853 -8.119 1.00 0.00 H new ATOM 0 HG12 VAL A 57 6.067 -7.759 -8.712 1.00 0.00 H new ATOM 0 HG13 VAL A 57 6.362 -6.099 -9.282 1.00 0.00 H new ATOM 0 HG21 VAL A 57 7.211 -5.013 -6.539 1.00 0.00 H new ATOM 0 HG22 VAL A 57 6.065 -4.159 -7.600 1.00 0.00 H new ATOM 0 HG23 VAL A 57 5.602 -4.561 -5.929 1.00 0.00 H new ATOM 911 N ASP A 58 4.074 -5.513 -10.028 1.00 0.00 N ATOM 912 CA ASP A 58 3.916 -4.608 -11.161 1.00 0.00 C ATOM 913 C ASP A 58 2.444 -4.283 -11.357 1.00 0.00 C ATOM 914 O ASP A 58 2.087 -3.156 -11.692 1.00 0.00 O ATOM 915 CB ASP A 58 4.497 -5.212 -12.441 1.00 0.00 C ATOM 916 CG ASP A 58 4.806 -4.158 -13.494 1.00 0.00 C ATOM 917 OD1 ASP A 58 3.872 -3.701 -14.195 1.00 0.00 O ATOM 918 OD2 ASP A 58 5.994 -3.786 -13.630 1.00 0.00 O ATOM 0 H ASP A 58 4.290 -6.478 -10.278 1.00 0.00 H new ATOM 0 HA ASP A 58 4.465 -3.692 -10.945 1.00 0.00 H new ATOM 0 HB2 ASP A 58 5.409 -5.758 -12.200 1.00 0.00 H new ATOM 0 HB3 ASP A 58 3.791 -5.935 -12.851 1.00 0.00 H new ATOM 923 N ASN A 59 1.594 -5.275 -11.121 1.00 0.00 N ATOM 924 CA ASN A 59 0.151 -5.087 -11.195 1.00 0.00 C ATOM 925 C ASN A 59 -0.299 -4.054 -10.172 1.00 0.00 C ATOM 926 O ASN A 59 -1.160 -3.220 -10.450 1.00 0.00 O ATOM 927 CB ASN A 59 -0.576 -6.410 -10.946 1.00 0.00 C ATOM 928 CG ASN A 59 -2.077 -6.281 -11.092 1.00 0.00 C ATOM 929 OD1 ASN A 59 -2.570 -5.484 -11.889 1.00 0.00 O ATOM 930 ND2 ASN A 59 -2.817 -7.067 -10.326 1.00 0.00 N ATOM 0 H ASN A 59 1.881 -6.222 -10.876 1.00 0.00 H new ATOM 0 HA ASN A 59 -0.097 -4.731 -12.195 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -0.209 -7.160 -11.646 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -0.341 -6.767 -9.944 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -3.834 -7.025 -10.384 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -2.370 -7.715 -9.677 1.00 0.00 H new ATOM 937 N PHE A 60 0.297 -4.111 -8.985 1.00 0.00 N ATOM 938 CA PHE A 60 0.017 -3.136 -7.939 1.00 0.00 C ATOM 939 C PHE A 60 0.348 -1.734 -8.426 1.00 0.00 C ATOM 940 O PHE A 60 -0.466 -0.818 -8.322 1.00 0.00 O ATOM 941 CB PHE A 60 0.833 -3.449 -6.683 1.00 0.00 C ATOM 942 CG PHE A 60 0.562 -2.524 -5.529 1.00 0.00 C ATOM 943 CD1 PHE A 60 -0.689 -2.477 -4.936 1.00 0.00 C ATOM 944 CD2 PHE A 60 1.564 -1.710 -5.035 1.00 0.00 C ATOM 945 CE1 PHE A 60 -0.931 -1.631 -3.870 1.00 0.00 C ATOM 946 CE2 PHE A 60 1.325 -0.864 -3.971 1.00 0.00 C ATOM 947 CZ PHE A 60 0.080 -0.824 -3.388 1.00 0.00 C ATOM 0 H PHE A 60 0.978 -4.824 -8.724 1.00 0.00 H new ATOM 0 HA PHE A 60 -1.044 -3.190 -7.695 1.00 0.00 H new ATOM 0 HB2 PHE A 60 0.623 -4.472 -6.372 1.00 0.00 H new ATOM 0 HB3 PHE A 60 1.893 -3.403 -6.931 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -1.482 -3.107 -5.310 1.00 0.00 H new ATOM 0 HD2 PHE A 60 2.545 -1.736 -5.487 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -1.910 -1.601 -3.415 1.00 0.00 H new ATOM 0 HE2 PHE A 60 2.117 -0.233 -3.596 1.00 0.00 H new ATOM 0 HZ PHE A 60 -0.106 -0.163 -2.555 1.00 0.00 H new ATOM 957 N THR A 61 1.544 -1.579 -8.977 1.00 0.00 N ATOM 958 CA THR A 61 1.990 -0.290 -9.470 1.00 0.00 C ATOM 959 C THR A 61 1.173 0.144 -10.688 1.00 0.00 C ATOM 960 O THR A 61 0.968 1.337 -10.926 1.00 0.00 O ATOM 961 CB THR A 61 3.498 -0.318 -9.804 1.00 0.00 C ATOM 962 OG1 THR A 61 3.798 -1.341 -10.761 1.00 0.00 O ATOM 963 CG2 THR A 61 4.311 -0.558 -8.541 1.00 0.00 C ATOM 0 H THR A 61 2.221 -2.333 -9.092 1.00 0.00 H new ATOM 0 HA THR A 61 1.832 0.443 -8.679 1.00 0.00 H new ATOM 0 HB THR A 61 3.761 0.649 -10.233 1.00 0.00 H new ATOM 0 HG1 THR A 61 2.983 -1.845 -10.967 1.00 0.00 H new ATOM 0 HG21 THR A 61 5.372 -0.576 -8.789 1.00 0.00 H new ATOM 0 HG22 THR A 61 4.119 0.243 -7.827 1.00 0.00 H new ATOM 0 HG23 THR A 61 4.025 -1.513 -8.101 1.00 0.00 H new ATOM 971 N LYS A 62 0.688 -0.839 -11.435 1.00 0.00 N ATOM 972 CA LYS A 62 -0.175 -0.597 -12.580 1.00 0.00 C ATOM 973 C LYS A 62 -1.514 -0.035 -12.107 1.00 0.00 C ATOM 974 O LYS A 62 -1.974 1.001 -12.588 1.00 0.00 O ATOM 975 CB LYS A 62 -0.402 -1.906 -13.339 1.00 0.00 C ATOM 976 CG LYS A 62 -0.963 -1.730 -14.738 1.00 0.00 C ATOM 977 CD LYS A 62 -1.377 -3.069 -15.330 1.00 0.00 C ATOM 978 CE LYS A 62 -1.609 -2.971 -16.828 1.00 0.00 C ATOM 979 NZ LYS A 62 -0.327 -2.943 -17.582 1.00 0.00 N ATOM 0 H LYS A 62 0.883 -1.825 -11.263 1.00 0.00 H new ATOM 0 HA LYS A 62 0.301 0.125 -13.243 1.00 0.00 H new ATOM 0 HB2 LYS A 62 0.545 -2.442 -13.405 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -1.084 -2.532 -12.763 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -1.822 -1.060 -14.708 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -0.215 -1.261 -15.377 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -0.604 -3.811 -15.129 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -2.288 -3.417 -14.842 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -2.208 -3.819 -17.160 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -2.181 -2.070 -17.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -0.524 -2.961 -18.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 0.196 -2.076 -17.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 0.245 -3.773 -17.325 1.00 0.00 H new ATOM 993 N ALA A 63 -2.122 -0.727 -11.146 1.00 0.00 N ATOM 994 CA ALA A 63 -3.401 -0.313 -10.583 1.00 0.00 C ATOM 995 C ALA A 63 -3.285 1.040 -9.890 1.00 0.00 C ATOM 996 O ALA A 63 -4.222 1.837 -9.909 1.00 0.00 O ATOM 997 CB ALA A 63 -3.913 -1.361 -9.607 1.00 0.00 C ATOM 0 H ALA A 63 -1.744 -1.583 -10.740 1.00 0.00 H new ATOM 0 HA ALA A 63 -4.113 -0.214 -11.402 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -4.869 -1.038 -9.195 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -4.044 -2.310 -10.128 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -3.193 -1.488 -8.798 1.00 0.00 H new ATOM 1003 N LEU A 64 -2.131 1.291 -9.277 1.00 0.00 N ATOM 1004 CA LEU A 64 -1.864 2.573 -8.633 1.00 0.00 C ATOM 1005 C LEU A 64 -1.985 3.722 -9.622 1.00 0.00 C ATOM 1006 O LEU A 64 -2.761 4.645 -9.415 1.00 0.00 O ATOM 1007 CB LEU A 64 -0.474 2.590 -7.992 1.00 0.00 C ATOM 1008 CG LEU A 64 -0.386 1.943 -6.613 1.00 0.00 C ATOM 1009 CD1 LEU A 64 1.060 1.885 -6.146 1.00 0.00 C ATOM 1010 CD2 LEU A 64 -1.233 2.718 -5.616 1.00 0.00 C ATOM 0 H LEU A 64 -1.364 0.621 -9.213 1.00 0.00 H new ATOM 0 HA LEU A 64 -2.613 2.703 -7.852 1.00 0.00 H new ATOM 0 HB2 LEU A 64 0.222 2.082 -8.659 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -0.141 3.625 -7.912 1.00 0.00 H new ATOM 0 HG LEU A 64 -0.768 0.924 -6.680 1.00 0.00 H new ATOM 0 HD11 LEU A 64 1.106 1.421 -5.161 1.00 0.00 H new ATOM 0 HD12 LEU A 64 1.647 1.297 -6.852 1.00 0.00 H new ATOM 0 HD13 LEU A 64 1.465 2.895 -6.090 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -1.163 2.247 -4.635 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -0.872 3.745 -5.552 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -2.272 2.719 -5.944 1.00 0.00 H new ATOM 1022 N LYS A 65 -1.234 3.652 -10.710 1.00 0.00 N ATOM 1023 CA LYS A 65 -1.251 4.721 -11.697 1.00 0.00 C ATOM 1024 C LYS A 65 -2.623 4.833 -12.363 1.00 0.00 C ATOM 1025 O LYS A 65 -3.032 5.911 -12.787 1.00 0.00 O ATOM 1026 CB LYS A 65 -0.150 4.506 -12.735 1.00 0.00 C ATOM 1027 CG LYS A 65 1.248 4.665 -12.158 1.00 0.00 C ATOM 1028 CD LYS A 65 2.324 4.483 -13.214 1.00 0.00 C ATOM 1029 CE LYS A 65 3.697 4.823 -12.655 1.00 0.00 C ATOM 1030 NZ LYS A 65 4.777 4.622 -13.653 1.00 0.00 N ATOM 0 H LYS A 65 -0.611 2.875 -10.931 1.00 0.00 H new ATOM 0 HA LYS A 65 -1.057 5.663 -11.184 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -0.250 3.508 -13.162 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -0.284 5.216 -13.551 1.00 0.00 H new ATOM 0 HG2 LYS A 65 1.344 5.653 -11.709 1.00 0.00 H new ATOM 0 HG3 LYS A 65 1.396 3.937 -11.361 1.00 0.00 H new ATOM 0 HD2 LYS A 65 2.317 3.453 -13.572 1.00 0.00 H new ATOM 0 HD3 LYS A 65 2.108 5.120 -14.072 1.00 0.00 H new ATOM 0 HE2 LYS A 65 3.704 5.860 -12.320 1.00 0.00 H new ATOM 0 HE3 LYS A 65 3.894 4.204 -11.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 5.496 5.365 -13.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 5.216 3.691 -13.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 4.377 4.669 -14.612 1.00 0.00 H new ATOM 1044 N GLN A 66 -3.344 3.724 -12.419 1.00 0.00 N ATOM 1045 CA GLN A 66 -4.685 3.715 -12.984 1.00 0.00 C ATOM 1046 C GLN A 66 -5.663 4.441 -12.059 1.00 0.00 C ATOM 1047 O GLN A 66 -6.525 5.194 -12.517 1.00 0.00 O ATOM 1048 CB GLN A 66 -5.141 2.271 -13.223 1.00 0.00 C ATOM 1049 CG GLN A 66 -6.481 2.148 -13.929 1.00 0.00 C ATOM 1050 CD GLN A 66 -6.831 0.709 -14.252 1.00 0.00 C ATOM 1051 OE1 GLN A 66 -6.473 0.194 -15.312 1.00 0.00 O ATOM 1052 NE2 GLN A 66 -7.538 0.050 -13.349 1.00 0.00 N ATOM 0 H GLN A 66 -3.023 2.817 -12.080 1.00 0.00 H new ATOM 0 HA GLN A 66 -4.667 4.241 -13.939 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -4.383 1.756 -13.814 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -5.200 1.757 -12.263 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -7.261 2.577 -13.300 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -6.458 2.730 -14.850 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -7.816 0.511 -12.483 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -7.805 -0.920 -13.519 1.00 0.00 H new ATOM 1061 N SER A 67 -5.508 4.232 -10.756 1.00 0.00 N ATOM 1062 CA SER A 67 -6.396 4.844 -9.777 1.00 0.00 C ATOM 1063 C SER A 67 -5.996 6.293 -9.495 1.00 0.00 C ATOM 1064 O SER A 67 -6.858 7.153 -9.312 1.00 0.00 O ATOM 1065 CB SER A 67 -6.411 4.019 -8.486 1.00 0.00 C ATOM 1066 OG SER A 67 -5.098 3.681 -8.078 1.00 0.00 O ATOM 0 H SER A 67 -4.777 3.645 -10.355 1.00 0.00 H new ATOM 0 HA SER A 67 -7.404 4.857 -10.192 1.00 0.00 H new ATOM 0 HB2 SER A 67 -6.906 4.584 -7.696 1.00 0.00 H new ATOM 0 HB3 SER A 67 -6.992 3.110 -8.639 1.00 0.00 H new ATOM 0 HG SER A 67 -4.778 2.919 -8.605 1.00 0.00 H new ATOM 1072 N VAL A 68 -4.693 6.566 -9.484 1.00 0.00 N ATOM 1073 CA VAL A 68 -4.190 7.924 -9.274 1.00 0.00 C ATOM 1074 C VAL A 68 -4.582 8.839 -10.440 1.00 0.00 C ATOM 1075 O VAL A 68 -4.753 10.050 -10.267 1.00 0.00 O ATOM 1076 CB VAL A 68 -2.652 7.937 -9.071 1.00 0.00 C ATOM 1077 CG1 VAL A 68 -2.108 9.358 -9.017 1.00 0.00 C ATOM 1078 CG2 VAL A 68 -2.282 7.184 -7.798 1.00 0.00 C ATOM 0 H VAL A 68 -3.965 5.865 -9.618 1.00 0.00 H new ATOM 0 HA VAL A 68 -4.652 8.304 -8.363 1.00 0.00 H new ATOM 0 HB VAL A 68 -2.199 7.438 -9.927 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -1.028 9.329 -8.874 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -2.337 9.871 -9.951 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -2.570 9.893 -8.187 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -1.200 7.200 -7.667 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -2.758 7.661 -6.942 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -2.623 6.151 -7.874 1.00 0.00 H new ATOM 1088 N LEU A 69 -4.743 8.258 -11.620 1.00 0.00 N ATOM 1089 CA LEU A 69 -5.227 9.006 -12.774 1.00 0.00 C ATOM 1090 C LEU A 69 -6.757 9.041 -12.792 1.00 0.00 C ATOM 1091 O LEU A 69 -7.367 9.655 -13.667 1.00 0.00 O ATOM 1092 CB LEU A 69 -4.686 8.406 -14.079 1.00 0.00 C ATOM 1093 CG LEU A 69 -3.348 8.982 -14.567 1.00 0.00 C ATOM 1094 CD1 LEU A 69 -2.251 8.814 -13.523 1.00 0.00 C ATOM 1095 CD2 LEU A 69 -2.938 8.326 -15.875 1.00 0.00 C ATOM 0 H LEU A 69 -4.547 7.274 -11.805 1.00 0.00 H new ATOM 0 HA LEU A 69 -4.861 10.029 -12.692 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -4.571 7.331 -13.944 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -5.431 8.551 -14.861 1.00 0.00 H new ATOM 0 HG LEU A 69 -3.486 10.050 -14.733 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -1.319 9.233 -13.903 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -2.536 9.334 -12.609 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -2.112 7.754 -13.309 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -1.988 8.743 -16.209 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -2.829 7.252 -15.725 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -3.702 8.511 -16.630 1.00 0.00 H new ATOM 1107 N GLU A 70 -7.370 8.367 -11.827 1.00 0.00 N ATOM 1108 CA GLU A 70 -8.816 8.400 -11.664 1.00 0.00 C ATOM 1109 C GLU A 70 -9.173 9.174 -10.381 1.00 0.00 C ATOM 1110 O GLU A 70 -8.845 10.356 -10.273 1.00 0.00 O ATOM 1111 CB GLU A 70 -9.376 6.963 -11.665 1.00 0.00 C ATOM 1112 CG GLU A 70 -10.895 6.861 -11.555 1.00 0.00 C ATOM 1113 CD GLU A 70 -11.629 7.809 -12.479 1.00 0.00 C ATOM 1114 OE1 GLU A 70 -11.906 7.431 -13.638 1.00 0.00 O ATOM 1115 OE2 GLU A 70 -11.939 8.936 -12.044 1.00 0.00 O ATOM 0 H GLU A 70 -6.884 7.788 -11.142 1.00 0.00 H new ATOM 0 HA GLU A 70 -9.279 8.925 -12.500 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -9.059 6.467 -12.582 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -8.929 6.415 -10.835 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -11.200 5.839 -11.778 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -11.192 7.065 -10.526 1.00 0.00 H new ATOM 1122 N HIS A 71 -9.813 8.494 -9.414 1.00 0.00 N ATOM 1123 CA HIS A 71 -10.286 9.096 -8.149 1.00 0.00 C ATOM 1124 C HIS A 71 -10.914 10.480 -8.349 1.00 0.00 C ATOM 1125 O HIS A 71 -10.837 11.335 -7.462 1.00 0.00 O ATOM 1126 CB HIS A 71 -9.161 9.166 -7.091 1.00 0.00 C ATOM 1127 CG HIS A 71 -8.009 10.073 -7.425 1.00 0.00 C ATOM 1128 ND1 HIS A 71 -8.069 11.448 -7.341 1.00 0.00 N ATOM 1129 CD2 HIS A 71 -6.760 9.787 -7.850 1.00 0.00 C ATOM 1130 CE1 HIS A 71 -6.911 11.961 -7.697 1.00 0.00 C ATOM 1131 NE2 HIS A 71 -6.094 10.977 -8.015 1.00 0.00 N ATOM 0 H HIS A 71 -10.020 7.498 -9.487 1.00 0.00 H new ATOM 0 HA HIS A 71 -11.068 8.433 -7.779 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -9.595 9.493 -6.146 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -8.773 8.160 -6.932 1.00 0.00 H new ATOM 0 HD1 HIS A 71 -8.885 11.985 -7.048 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -6.357 8.801 -8.028 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -6.670 13.013 -7.724 1.00 0.00 H new ATOM 1140 N HIS A 72 -11.570 10.687 -9.489 1.00 0.00 N ATOM 1141 CA HIS A 72 -12.129 11.997 -9.812 1.00 0.00 C ATOM 1142 C HIS A 72 -13.242 12.369 -8.839 1.00 0.00 C ATOM 1143 O HIS A 72 -13.454 13.543 -8.541 1.00 0.00 O ATOM 1144 CB HIS A 72 -12.648 12.028 -11.253 1.00 0.00 C ATOM 1145 CG HIS A 72 -13.037 13.399 -11.714 1.00 0.00 C ATOM 1146 ND1 HIS A 72 -14.265 13.696 -12.266 1.00 0.00 N ATOM 1147 CD2 HIS A 72 -12.346 14.563 -11.696 1.00 0.00 C ATOM 1148 CE1 HIS A 72 -14.312 14.980 -12.562 1.00 0.00 C ATOM 1149 NE2 HIS A 72 -13.162 15.528 -12.227 1.00 0.00 N ATOM 0 H HIS A 72 -11.726 9.971 -10.199 1.00 0.00 H new ATOM 0 HA HIS A 72 -11.331 12.733 -9.718 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -11.879 11.634 -11.917 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -13.510 11.366 -11.335 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -11.339 14.705 -11.331 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -15.152 15.495 -13.004 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -12.918 16.511 -12.344 1.00 0.00 H new ATOM 1158 N HIS A 73 -13.945 11.367 -8.343 1.00 0.00 N ATOM 1159 CA HIS A 73 -14.990 11.593 -7.363 1.00 0.00 C ATOM 1160 C HIS A 73 -14.811 10.667 -6.170 1.00 0.00 C ATOM 1161 O HIS A 73 -14.999 9.455 -6.278 1.00 0.00 O ATOM 1162 CB HIS A 73 -16.371 11.385 -7.985 1.00 0.00 C ATOM 1163 CG HIS A 73 -17.205 12.631 -8.018 1.00 0.00 C ATOM 1164 ND1 HIS A 73 -18.202 12.896 -7.102 1.00 0.00 N ATOM 1165 CD2 HIS A 73 -17.192 13.684 -8.870 1.00 0.00 C ATOM 1166 CE1 HIS A 73 -18.764 14.054 -7.392 1.00 0.00 C ATOM 1167 NE2 HIS A 73 -18.168 14.551 -8.454 1.00 0.00 N ATOM 0 H HIS A 73 -13.811 10.390 -8.603 1.00 0.00 H new ATOM 0 HA HIS A 73 -14.915 12.625 -7.021 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -16.250 11.011 -9.002 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -16.902 10.616 -7.423 1.00 0.00 H new ATOM 0 HD1 HIS A 73 -18.464 12.292 -6.323 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -16.536 13.815 -9.718 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -19.576 14.516 -6.849 1.00 0.00 H new ATOM 1176 N HIS A 74 -14.424 11.235 -5.039 1.00 0.00 N ATOM 1177 CA HIS A 74 -14.308 10.472 -3.805 1.00 0.00 C ATOM 1178 C HIS A 74 -15.658 10.453 -3.096 1.00 0.00 C ATOM 1179 O HIS A 74 -16.086 9.426 -2.576 1.00 0.00 O ATOM 1180 CB HIS A 74 -13.224 11.075 -2.899 1.00 0.00 C ATOM 1181 CG HIS A 74 -13.092 10.398 -1.565 1.00 0.00 C ATOM 1182 ND1 HIS A 74 -12.391 9.227 -1.375 1.00 0.00 N ATOM 1183 CD2 HIS A 74 -13.584 10.737 -0.350 1.00 0.00 C ATOM 1184 CE1 HIS A 74 -12.460 8.878 -0.103 1.00 0.00 C ATOM 1185 NE2 HIS A 74 -13.177 9.777 0.541 1.00 0.00 N ATOM 0 H HIS A 74 -14.185 12.222 -4.949 1.00 0.00 H new ATOM 0 HA HIS A 74 -14.015 9.449 -4.039 1.00 0.00 H new ATOM 0 HB2 HIS A 74 -12.265 11.026 -3.416 1.00 0.00 H new ATOM 0 HB3 HIS A 74 -13.446 12.130 -2.738 1.00 0.00 H new ATOM 0 HD2 HIS A 74 -14.186 11.604 -0.124 1.00 0.00 H new ATOM 0 HE1 HIS A 74 -12.005 8.002 0.336 1.00 0.00 H new ATOM 0 HE2 HIS A 74 -13.394 9.761 1.538 1.00 0.00 H new ATOM 1194 N HIS A 75 -16.323 11.598 -3.097 1.00 0.00 N ATOM 1195 CA HIS A 75 -17.653 11.712 -2.525 1.00 0.00 C ATOM 1196 C HIS A 75 -18.683 11.233 -3.541 1.00 0.00 C ATOM 1197 O HIS A 75 -18.709 11.708 -4.677 1.00 0.00 O ATOM 1198 CB HIS A 75 -17.937 13.170 -2.128 1.00 0.00 C ATOM 1199 CG HIS A 75 -19.199 13.365 -1.337 1.00 0.00 C ATOM 1200 ND1 HIS A 75 -19.205 13.569 0.025 1.00 0.00 N ATOM 1201 CD2 HIS A 75 -20.496 13.412 -1.725 1.00 0.00 C ATOM 1202 CE1 HIS A 75 -20.448 13.725 0.442 1.00 0.00 C ATOM 1203 NE2 HIS A 75 -21.249 13.638 -0.599 1.00 0.00 N ATOM 0 H HIS A 75 -15.959 12.466 -3.491 1.00 0.00 H new ATOM 0 HA HIS A 75 -17.715 11.093 -1.630 1.00 0.00 H new ATOM 0 HB2 HIS A 75 -17.096 13.545 -1.545 1.00 0.00 H new ATOM 0 HB3 HIS A 75 -17.993 13.775 -3.033 1.00 0.00 H new ATOM 0 HD2 HIS A 75 -20.868 13.294 -2.732 1.00 0.00 H new ATOM 0 HE1 HIS A 75 -20.755 13.895 1.463 1.00 0.00 H new ATOM 0 HE2 HIS A 75 -22.265 13.724 -0.573 1.00 0.00 H new ATOM 1212 N HIS A 76 -19.499 10.271 -3.149 1.00 0.00 N ATOM 1213 CA HIS A 76 -20.568 9.789 -4.009 1.00 0.00 C ATOM 1214 C HIS A 76 -21.913 10.005 -3.339 1.00 0.00 C ATOM 1215 O HIS A 76 -22.475 11.109 -3.481 1.00 0.00 O ATOM 1216 CB HIS A 76 -20.382 8.305 -4.348 1.00 0.00 C ATOM 1217 CG HIS A 76 -19.214 8.024 -5.238 1.00 0.00 C ATOM 1218 ND1 HIS A 76 -18.324 6.998 -5.012 1.00 0.00 N ATOM 1219 CD2 HIS A 76 -18.804 8.628 -6.377 1.00 0.00 C ATOM 1220 CE1 HIS A 76 -17.419 6.982 -5.969 1.00 0.00 C ATOM 1221 NE2 HIS A 76 -17.688 7.962 -6.808 1.00 0.00 N ATOM 1222 OXT HIS A 76 -22.392 9.077 -2.652 1.00 0.00 O ATOM 0 H HIS A 76 -19.443 9.808 -2.242 1.00 0.00 H new ATOM 0 HA HIS A 76 -20.534 10.355 -4.940 1.00 0.00 H new ATOM 0 HB2 HIS A 76 -20.262 7.744 -3.421 1.00 0.00 H new ATOM 0 HB3 HIS A 76 -21.288 7.937 -4.829 1.00 0.00 H new ATOM 0 HD2 HIS A 76 -19.270 9.476 -6.856 1.00 0.00 H new ATOM 0 HE1 HIS A 76 -16.598 6.286 -6.052 1.00 0.00 H new ATOM 0 HE2 HIS A 76 -17.151 8.188 -7.645 1.00 0.00 H new TER 1231 HIS A 76 ATOM 1232 N MET B 1 4.282 25.921 6.206 1.00 0.00 N ATOM 1233 CA MET B 1 5.603 25.910 6.876 1.00 0.00 C ATOM 1234 C MET B 1 5.767 24.641 7.704 1.00 0.00 C ATOM 1235 O MET B 1 4.882 24.287 8.482 1.00 0.00 O ATOM 1236 CB MET B 1 5.768 27.136 7.788 1.00 0.00 C ATOM 1237 CG MET B 1 5.720 28.474 7.060 1.00 0.00 C ATOM 1238 SD MET B 1 4.070 28.902 6.468 1.00 0.00 S ATOM 1239 CE MET B 1 3.185 29.078 8.016 1.00 0.00 C ATOM 0 H1 MET B 1 3.977 26.904 6.057 1.00 0.00 H new ATOM 0 H2 MET B 1 4.354 25.438 5.288 1.00 0.00 H new ATOM 0 H3 MET B 1 3.586 25.429 6.802 1.00 0.00 H new ATOM 0 HA MET B 1 6.369 25.941 6.101 1.00 0.00 H new ATOM 0 HB2 MET B 1 4.983 27.119 8.544 1.00 0.00 H new ATOM 0 HB3 MET B 1 6.719 27.057 8.314 1.00 0.00 H new ATOM 0 HG2 MET B 1 6.073 29.258 7.730 1.00 0.00 H new ATOM 0 HG3 MET B 1 6.406 28.445 6.214 1.00 0.00 H new ATOM 0 HE1 MET B 1 2.303 29.699 7.862 1.00 0.00 H new ATOM 0 HE2 MET B 1 2.879 28.095 8.374 1.00 0.00 H new ATOM 0 HE3 MET B 1 3.834 29.547 8.755 1.00 0.00 H new ATOM 1251 N PRO B 2 6.892 23.927 7.536 1.00 0.00 N ATOM 1252 CA PRO B 2 7.203 22.737 8.333 1.00 0.00 C ATOM 1253 C PRO B 2 7.523 23.106 9.779 1.00 0.00 C ATOM 1254 O PRO B 2 8.623 23.566 10.084 1.00 0.00 O ATOM 1255 CB PRO B 2 8.436 22.136 7.641 1.00 0.00 C ATOM 1256 CG PRO B 2 8.554 22.854 6.338 1.00 0.00 C ATOM 1257 CD PRO B 2 7.945 24.208 6.554 1.00 0.00 C ATOM 0 HA PRO B 2 6.364 22.042 8.382 1.00 0.00 H new ATOM 0 HB2 PRO B 2 9.332 22.273 8.247 1.00 0.00 H new ATOM 0 HB3 PRO B 2 8.316 21.063 7.488 1.00 0.00 H new ATOM 0 HG2 PRO B 2 9.597 22.940 6.033 1.00 0.00 H new ATOM 0 HG3 PRO B 2 8.034 22.314 5.547 1.00 0.00 H new ATOM 0 HD2 PRO B 2 8.673 24.925 6.933 1.00 0.00 H new ATOM 0 HD3 PRO B 2 7.540 24.623 5.631 1.00 0.00 H new ATOM 1265 N ILE B 3 6.545 22.926 10.658 1.00 0.00 N ATOM 1266 CA ILE B 3 6.680 23.328 12.053 1.00 0.00 C ATOM 1267 C ILE B 3 7.607 22.381 12.813 1.00 0.00 C ATOM 1268 O ILE B 3 8.779 22.683 13.029 1.00 0.00 O ATOM 1269 CB ILE B 3 5.307 23.371 12.760 1.00 0.00 C ATOM 1270 CG1 ILE B 3 4.309 24.185 11.930 1.00 0.00 C ATOM 1271 CG2 ILE B 3 5.445 23.964 14.157 1.00 0.00 C ATOM 1272 CD1 ILE B 3 2.889 24.138 12.458 1.00 0.00 C ATOM 0 H ILE B 3 5.646 22.502 10.428 1.00 0.00 H new ATOM 0 HA ILE B 3 7.112 24.329 12.055 1.00 0.00 H new ATOM 0 HB ILE B 3 4.933 22.352 12.854 1.00 0.00 H new ATOM 0 HG12 ILE B 3 4.640 25.223 11.897 1.00 0.00 H new ATOM 0 HG13 ILE B 3 4.317 23.815 10.905 1.00 0.00 H new ATOM 0 HG21 ILE B 3 4.468 23.987 14.641 1.00 0.00 H new ATOM 0 HG22 ILE B 3 6.128 23.352 14.746 1.00 0.00 H new ATOM 0 HG23 ILE B 3 5.838 24.978 14.085 1.00 0.00 H new ATOM 0 HD11 ILE B 3 2.243 24.738 11.817 1.00 0.00 H new ATOM 0 HD12 ILE B 3 2.537 23.106 12.464 1.00 0.00 H new ATOM 0 HD13 ILE B 3 2.865 24.536 13.472 1.00 0.00 H new ATOM 1284 N VAL B 4 7.071 21.231 13.212 1.00 0.00 N ATOM 1285 CA VAL B 4 7.838 20.240 13.962 1.00 0.00 C ATOM 1286 C VAL B 4 7.544 18.843 13.436 1.00 0.00 C ATOM 1287 O VAL B 4 7.815 17.841 14.101 1.00 0.00 O ATOM 1288 CB VAL B 4 7.512 20.281 15.475 1.00 0.00 C ATOM 1289 CG1 VAL B 4 7.969 21.590 16.098 1.00 0.00 C ATOM 1290 CG2 VAL B 4 6.022 20.069 15.713 1.00 0.00 C ATOM 0 H VAL B 4 6.105 20.961 13.028 1.00 0.00 H new ATOM 0 HA VAL B 4 8.892 20.482 13.828 1.00 0.00 H new ATOM 0 HB VAL B 4 8.057 19.468 15.955 1.00 0.00 H new ATOM 0 HG11 VAL B 4 7.727 21.591 17.161 1.00 0.00 H new ATOM 0 HG12 VAL B 4 9.046 21.697 15.971 1.00 0.00 H new ATOM 0 HG13 VAL B 4 7.462 22.422 15.610 1.00 0.00 H new ATOM 0 HG21 VAL B 4 5.816 20.102 16.783 1.00 0.00 H new ATOM 0 HG22 VAL B 4 5.458 20.855 15.211 1.00 0.00 H new ATOM 0 HG23 VAL B 4 5.725 19.098 15.316 1.00 0.00 H new ATOM 1300 N SER B 5 7.007 18.788 12.227 1.00 0.00 N ATOM 1301 CA SER B 5 6.577 17.534 11.633 1.00 0.00 C ATOM 1302 C SER B 5 7.763 16.729 11.109 1.00 0.00 C ATOM 1303 O SER B 5 8.079 16.759 9.919 1.00 0.00 O ATOM 1304 CB SER B 5 5.573 17.814 10.514 1.00 0.00 C ATOM 1305 OG SER B 5 6.036 18.862 9.676 1.00 0.00 O ATOM 0 H SER B 5 6.858 19.605 11.635 1.00 0.00 H new ATOM 0 HA SER B 5 6.095 16.933 12.404 1.00 0.00 H new ATOM 0 HB2 SER B 5 5.418 16.911 9.924 1.00 0.00 H new ATOM 0 HB3 SER B 5 4.608 18.084 10.943 1.00 0.00 H new ATOM 0 HG SER B 5 6.947 18.662 9.375 1.00 0.00 H new ATOM 1311 N LYS B 6 8.440 16.045 12.020 1.00 0.00 N ATOM 1312 CA LYS B 6 9.558 15.181 11.667 1.00 0.00 C ATOM 1313 C LYS B 6 9.298 13.765 12.155 1.00 0.00 C ATOM 1314 O LYS B 6 10.002 12.835 11.773 1.00 0.00 O ATOM 1315 CB LYS B 6 10.860 15.705 12.282 1.00 0.00 C ATOM 1316 CG LYS B 6 11.261 17.092 11.806 1.00 0.00 C ATOM 1317 CD LYS B 6 11.624 17.095 10.331 1.00 0.00 C ATOM 1318 CE LYS B 6 12.103 18.466 9.876 1.00 0.00 C ATOM 1319 NZ LYS B 6 13.321 18.903 10.610 1.00 0.00 N ATOM 0 H LYS B 6 8.232 16.072 13.018 1.00 0.00 H new ATOM 0 HA LYS B 6 9.658 15.177 10.582 1.00 0.00 H new ATOM 0 HB2 LYS B 6 10.755 15.722 13.367 1.00 0.00 H new ATOM 0 HB3 LYS B 6 11.665 15.007 12.050 1.00 0.00 H new ATOM 0 HG2 LYS B 6 10.441 17.788 11.981 1.00 0.00 H new ATOM 0 HG3 LYS B 6 12.110 17.446 12.391 1.00 0.00 H new ATOM 0 HD2 LYS B 6 12.404 16.356 10.146 1.00 0.00 H new ATOM 0 HD3 LYS B 6 10.757 16.798 9.741 1.00 0.00 H new ATOM 0 HE2 LYS B 6 12.314 18.440 8.807 1.00 0.00 H new ATOM 0 HE3 LYS B 6 11.308 19.196 10.026 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 13.768 19.692 10.101 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 13.057 19.213 11.567 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 13.990 18.110 10.675 1.00 0.00 H new ATOM 1333 N TYR B 7 8.265 13.631 12.996 1.00 0.00 N ATOM 1334 CA TYR B 7 7.913 12.374 13.664 1.00 0.00 C ATOM 1335 C TYR B 7 9.149 11.606 14.148 1.00 0.00 C ATOM 1336 O TYR B 7 10.126 12.208 14.602 1.00 0.00 O ATOM 1337 CB TYR B 7 6.988 11.483 12.801 1.00 0.00 C ATOM 1338 CG TYR B 7 7.302 11.410 11.314 1.00 0.00 C ATOM 1339 CD1 TYR B 7 8.275 10.551 10.821 1.00 0.00 C ATOM 1340 CD2 TYR B 7 6.592 12.184 10.403 1.00 0.00 C ATOM 1341 CE1 TYR B 7 8.537 10.471 9.463 1.00 0.00 C ATOM 1342 CE2 TYR B 7 6.841 12.104 9.045 1.00 0.00 C ATOM 1343 CZ TYR B 7 7.813 11.246 8.579 1.00 0.00 C ATOM 1344 OH TYR B 7 8.059 11.155 7.226 1.00 0.00 O ATOM 0 H TYR B 7 7.643 14.403 13.234 1.00 0.00 H new ATOM 0 HA TYR B 7 7.343 12.653 14.551 1.00 0.00 H new ATOM 0 HB2 TYR B 7 7.017 10.471 13.205 1.00 0.00 H new ATOM 0 HB3 TYR B 7 5.965 11.843 12.916 1.00 0.00 H new ATOM 0 HD1 TYR B 7 8.837 9.935 11.507 1.00 0.00 H new ATOM 0 HD2 TYR B 7 5.831 12.861 10.763 1.00 0.00 H new ATOM 0 HE1 TYR B 7 9.305 9.805 9.097 1.00 0.00 H new ATOM 0 HE2 TYR B 7 6.276 12.711 8.353 1.00 0.00 H new ATOM 0 HH TYR B 7 7.509 11.811 6.749 1.00 0.00 H new ATOM 1354 N SER B 8 9.086 10.286 14.085 1.00 0.00 N ATOM 1355 CA SER B 8 10.163 9.440 14.571 1.00 0.00 C ATOM 1356 C SER B 8 10.152 8.114 13.821 1.00 0.00 C ATOM 1357 O SER B 8 9.083 7.631 13.429 1.00 0.00 O ATOM 1358 CB SER B 8 9.996 9.208 16.081 1.00 0.00 C ATOM 1359 OG SER B 8 11.091 8.496 16.634 1.00 0.00 O ATOM 0 H SER B 8 8.293 9.774 13.699 1.00 0.00 H new ATOM 0 HA SER B 8 11.121 9.931 14.397 1.00 0.00 H new ATOM 0 HB2 SER B 8 9.896 10.169 16.586 1.00 0.00 H new ATOM 0 HB3 SER B 8 9.075 8.655 16.263 1.00 0.00 H new ATOM 0 HG SER B 8 10.948 8.370 17.595 1.00 0.00 H new ATOM 1365 N ASN B 9 11.329 7.531 13.616 1.00 0.00 N ATOM 1366 CA ASN B 9 11.439 6.244 12.934 1.00 0.00 C ATOM 1367 C ASN B 9 10.695 5.177 13.724 1.00 0.00 C ATOM 1368 O ASN B 9 10.076 4.279 13.149 1.00 0.00 O ATOM 1369 CB ASN B 9 12.906 5.847 12.764 1.00 0.00 C ATOM 1370 CG ASN B 9 13.079 4.575 11.953 1.00 0.00 C ATOM 1371 OD1 ASN B 9 13.108 3.474 12.498 1.00 0.00 O ATOM 1372 ND2 ASN B 9 13.208 4.721 10.642 1.00 0.00 N ATOM 0 H ASN B 9 12.221 7.928 13.912 1.00 0.00 H new ATOM 0 HA ASN B 9 10.992 6.334 11.944 1.00 0.00 H new ATOM 0 HB2 ASN B 9 13.444 6.660 12.276 1.00 0.00 H new ATOM 0 HB3 ASN B 9 13.357 5.711 13.747 1.00 0.00 H new ATOM 0 HD21 ASN B 9 13.337 3.902 10.048 1.00 0.00 H new ATOM 0 HD22 ASN B 9 13.178 5.652 10.227 1.00 0.00 H new ATOM 1379 N GLU B 10 10.745 5.308 15.049 1.00 0.00 N ATOM 1380 CA GLU B 10 10.001 4.439 15.951 1.00 0.00 C ATOM 1381 C GLU B 10 8.522 4.437 15.585 1.00 0.00 C ATOM 1382 O GLU B 10 7.899 3.380 15.451 1.00 0.00 O ATOM 1383 CB GLU B 10 10.162 4.929 17.392 1.00 0.00 C ATOM 1384 CG GLU B 10 9.286 4.195 18.391 1.00 0.00 C ATOM 1385 CD GLU B 10 9.154 4.943 19.697 1.00 0.00 C ATOM 1386 OE1 GLU B 10 8.272 5.823 19.792 1.00 0.00 O ATOM 1387 OE2 GLU B 10 9.929 4.663 20.633 1.00 0.00 O ATOM 0 H GLU B 10 11.302 6.019 15.524 1.00 0.00 H new ATOM 0 HA GLU B 10 10.394 3.426 15.860 1.00 0.00 H new ATOM 0 HB2 GLU B 10 11.205 4.819 17.689 1.00 0.00 H new ATOM 0 HB3 GLU B 10 9.929 5.993 17.432 1.00 0.00 H new ATOM 0 HG2 GLU B 10 8.296 4.043 17.960 1.00 0.00 H new ATOM 0 HG3 GLU B 10 9.705 3.207 18.582 1.00 0.00 H new ATOM 1394 N ARG B 11 7.974 5.635 15.411 1.00 0.00 N ATOM 1395 CA ARG B 11 6.561 5.791 15.118 1.00 0.00 C ATOM 1396 C ARG B 11 6.227 5.184 13.761 1.00 0.00 C ATOM 1397 O ARG B 11 5.225 4.490 13.621 1.00 0.00 O ATOM 1398 CB ARG B 11 6.161 7.271 15.161 1.00 0.00 C ATOM 1399 CG ARG B 11 4.659 7.482 15.187 1.00 0.00 C ATOM 1400 CD ARG B 11 4.289 8.926 15.487 1.00 0.00 C ATOM 1401 NE ARG B 11 2.871 9.047 15.813 1.00 0.00 N ATOM 1402 CZ ARG B 11 2.235 10.196 16.035 1.00 0.00 C ATOM 1403 NH1 ARG B 11 2.873 11.356 15.935 1.00 0.00 N ATOM 1404 NH2 ARG B 11 0.950 10.179 16.362 1.00 0.00 N ATOM 0 H ARG B 11 8.492 6.512 15.469 1.00 0.00 H new ATOM 0 HA ARG B 11 5.991 5.261 15.881 1.00 0.00 H new ATOM 0 HB2 ARG B 11 6.602 7.735 16.043 1.00 0.00 H new ATOM 0 HB3 ARG B 11 6.578 7.779 14.292 1.00 0.00 H new ATOM 0 HG2 ARG B 11 4.236 7.192 14.225 1.00 0.00 H new ATOM 0 HG3 ARG B 11 4.215 6.831 15.940 1.00 0.00 H new ATOM 0 HD2 ARG B 11 4.890 9.293 16.319 1.00 0.00 H new ATOM 0 HD3 ARG B 11 4.522 9.551 14.625 1.00 0.00 H new ATOM 0 HE ARG B 11 2.326 8.187 15.875 1.00 0.00 H new ATOM 0 HH11 ARG B 11 3.862 11.374 15.686 1.00 0.00 H new ATOM 0 HH12 ARG B 11 2.374 12.229 16.108 1.00 0.00 H new ATOM 0 HH21 ARG B 11 0.456 9.290 16.442 1.00 0.00 H new ATOM 0 HH22 ARG B 11 0.456 11.055 16.534 1.00 0.00 H new ATOM 1418 N VAL B 12 7.086 5.428 12.776 1.00 0.00 N ATOM 1419 CA VAL B 12 6.887 4.900 11.429 1.00 0.00 C ATOM 1420 C VAL B 12 6.802 3.376 11.440 1.00 0.00 C ATOM 1421 O VAL B 12 5.853 2.793 10.913 1.00 0.00 O ATOM 1422 CB VAL B 12 8.031 5.326 10.482 1.00 0.00 C ATOM 1423 CG1 VAL B 12 7.800 4.801 9.072 1.00 0.00 C ATOM 1424 CG2 VAL B 12 8.183 6.836 10.467 1.00 0.00 C ATOM 0 H VAL B 12 7.930 5.990 12.885 1.00 0.00 H new ATOM 0 HA VAL B 12 5.946 5.314 11.066 1.00 0.00 H new ATOM 0 HB VAL B 12 8.956 4.889 10.859 1.00 0.00 H new ATOM 0 HG11 VAL B 12 8.621 5.116 8.427 1.00 0.00 H new ATOM 0 HG12 VAL B 12 7.752 3.712 9.092 1.00 0.00 H new ATOM 0 HG13 VAL B 12 6.862 5.198 8.685 1.00 0.00 H new ATOM 0 HG21 VAL B 12 8.994 7.113 9.794 1.00 0.00 H new ATOM 0 HG22 VAL B 12 7.254 7.292 10.124 1.00 0.00 H new ATOM 0 HG23 VAL B 12 8.410 7.189 11.473 1.00 0.00 H new ATOM 1434 N GLU B 13 7.789 2.744 12.063 1.00 0.00 N ATOM 1435 CA GLU B 13 7.864 1.290 12.116 1.00 0.00 C ATOM 1436 C GLU B 13 6.651 0.715 12.850 1.00 0.00 C ATOM 1437 O GLU B 13 6.136 -0.346 12.490 1.00 0.00 O ATOM 1438 CB GLU B 13 9.171 0.872 12.798 1.00 0.00 C ATOM 1439 CG GLU B 13 9.474 -0.620 12.744 1.00 0.00 C ATOM 1440 CD GLU B 13 9.160 -1.333 14.045 1.00 0.00 C ATOM 1441 OE1 GLU B 13 9.773 -0.987 15.079 1.00 0.00 O ATOM 1442 OE2 GLU B 13 8.325 -2.258 14.038 1.00 0.00 O ATOM 0 H GLU B 13 8.554 3.220 12.542 1.00 0.00 H new ATOM 0 HA GLU B 13 7.854 0.891 11.102 1.00 0.00 H new ATOM 0 HB2 GLU B 13 9.995 1.412 12.333 1.00 0.00 H new ATOM 0 HB3 GLU B 13 9.135 1.183 13.842 1.00 0.00 H new ATOM 0 HG2 GLU B 13 8.897 -1.074 11.938 1.00 0.00 H new ATOM 0 HG3 GLU B 13 10.527 -0.763 12.502 1.00 0.00 H new ATOM 1449 N LYS B 14 6.181 1.441 13.856 1.00 0.00 N ATOM 1450 CA LYS B 14 5.025 1.018 14.634 1.00 0.00 C ATOM 1451 C LYS B 14 3.740 1.127 13.809 1.00 0.00 C ATOM 1452 O LYS B 14 2.863 0.270 13.906 1.00 0.00 O ATOM 1453 CB LYS B 14 4.921 1.858 15.909 1.00 0.00 C ATOM 1454 CG LYS B 14 3.800 1.432 16.844 1.00 0.00 C ATOM 1455 CD LYS B 14 3.892 2.149 18.183 1.00 0.00 C ATOM 1456 CE LYS B 14 5.191 1.815 18.901 1.00 0.00 C ATOM 1457 NZ LYS B 14 5.309 2.509 20.212 1.00 0.00 N ATOM 0 H LYS B 14 6.585 2.329 14.153 1.00 0.00 H new ATOM 0 HA LYS B 14 5.155 -0.028 14.910 1.00 0.00 H new ATOM 0 HB2 LYS B 14 5.868 1.803 16.446 1.00 0.00 H new ATOM 0 HB3 LYS B 14 4.772 2.902 15.632 1.00 0.00 H new ATOM 0 HG2 LYS B 14 2.837 1.645 16.381 1.00 0.00 H new ATOM 0 HG3 LYS B 14 3.846 0.355 17.002 1.00 0.00 H new ATOM 0 HD2 LYS B 14 3.827 3.226 18.027 1.00 0.00 H new ATOM 0 HD3 LYS B 14 3.045 1.866 18.808 1.00 0.00 H new ATOM 0 HE2 LYS B 14 5.250 0.738 19.057 1.00 0.00 H new ATOM 0 HE3 LYS B 14 6.034 2.093 18.269 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 6.210 2.250 20.662 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 5.280 3.538 20.064 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 4.520 2.225 20.827 1.00 0.00 H new ATOM 1471 N ILE B 15 3.641 2.174 12.991 1.00 0.00 N ATOM 1472 CA ILE B 15 2.475 2.360 12.125 1.00 0.00 C ATOM 1473 C ILE B 15 2.369 1.211 11.130 1.00 0.00 C ATOM 1474 O ILE B 15 1.296 0.640 10.930 1.00 0.00 O ATOM 1475 CB ILE B 15 2.534 3.699 11.355 1.00 0.00 C ATOM 1476 CG1 ILE B 15 2.557 4.871 12.336 1.00 0.00 C ATOM 1477 CG2 ILE B 15 1.347 3.822 10.403 1.00 0.00 C ATOM 1478 CD1 ILE B 15 2.735 6.217 11.671 1.00 0.00 C ATOM 0 H ILE B 15 4.349 2.903 12.909 1.00 0.00 H new ATOM 0 HA ILE B 15 1.595 2.377 12.769 1.00 0.00 H new ATOM 0 HB ILE B 15 3.450 3.721 10.764 1.00 0.00 H new ATOM 0 HG12 ILE B 15 1.627 4.876 12.904 1.00 0.00 H new ATOM 0 HG13 ILE B 15 3.366 4.719 13.051 1.00 0.00 H new ATOM 0 HG21 ILE B 15 1.405 4.771 9.870 1.00 0.00 H new ATOM 0 HG22 ILE B 15 1.369 3.001 9.686 1.00 0.00 H new ATOM 0 HG23 ILE B 15 0.418 3.782 10.972 1.00 0.00 H new ATOM 0 HD11 ILE B 15 2.742 7.000 12.430 1.00 0.00 H new ATOM 0 HD12 ILE B 15 3.679 6.232 11.126 1.00 0.00 H new ATOM 0 HD13 ILE B 15 1.913 6.391 10.977 1.00 0.00 H new ATOM 1490 N ILE B 16 3.501 0.868 10.524 1.00 0.00 N ATOM 1491 CA ILE B 16 3.571 -0.252 9.596 1.00 0.00 C ATOM 1492 C ILE B 16 3.109 -1.537 10.281 1.00 0.00 C ATOM 1493 O ILE B 16 2.414 -2.359 9.683 1.00 0.00 O ATOM 1494 CB ILE B 16 5.010 -0.447 9.067 1.00 0.00 C ATOM 1495 CG1 ILE B 16 5.520 0.854 8.444 1.00 0.00 C ATOM 1496 CG2 ILE B 16 5.056 -1.577 8.046 1.00 0.00 C ATOM 1497 CD1 ILE B 16 6.991 0.825 8.091 1.00 0.00 C ATOM 0 H ILE B 16 4.387 1.354 10.661 1.00 0.00 H new ATOM 0 HA ILE B 16 2.914 -0.028 8.755 1.00 0.00 H new ATOM 0 HB ILE B 16 5.656 -0.714 9.903 1.00 0.00 H new ATOM 0 HG12 ILE B 16 4.944 1.065 7.543 1.00 0.00 H new ATOM 0 HG13 ILE B 16 5.338 1.674 9.138 1.00 0.00 H new ATOM 0 HG21 ILE B 16 6.077 -1.700 7.685 1.00 0.00 H new ATOM 0 HG22 ILE B 16 4.723 -2.504 8.514 1.00 0.00 H new ATOM 0 HG23 ILE B 16 4.401 -1.337 7.208 1.00 0.00 H new ATOM 0 HD11 ILE B 16 7.279 1.781 7.654 1.00 0.00 H new ATOM 0 HD12 ILE B 16 7.578 0.646 8.992 1.00 0.00 H new ATOM 0 HD13 ILE B 16 7.177 0.027 7.372 1.00 0.00 H new ATOM 1509 N GLN B 17 3.474 -1.684 11.549 1.00 0.00 N ATOM 1510 CA GLN B 17 3.118 -2.869 12.314 1.00 0.00 C ATOM 1511 C GLN B 17 1.616 -2.930 12.564 1.00 0.00 C ATOM 1512 O GLN B 17 1.005 -3.988 12.436 1.00 0.00 O ATOM 1513 CB GLN B 17 3.870 -2.898 13.644 1.00 0.00 C ATOM 1514 CG GLN B 17 3.582 -4.139 14.474 1.00 0.00 C ATOM 1515 CD GLN B 17 3.893 -5.428 13.732 1.00 0.00 C ATOM 1516 OE1 GLN B 17 3.253 -6.456 13.954 1.00 0.00 O ATOM 1517 NE2 GLN B 17 4.875 -5.388 12.846 1.00 0.00 N ATOM 0 H GLN B 17 4.017 -0.995 12.069 1.00 0.00 H new ATOM 0 HA GLN B 17 3.405 -3.741 11.727 1.00 0.00 H new ATOM 0 HB2 GLN B 17 4.941 -2.841 13.449 1.00 0.00 H new ATOM 0 HB3 GLN B 17 3.604 -2.013 14.223 1.00 0.00 H new ATOM 0 HG2 GLN B 17 4.170 -4.102 15.391 1.00 0.00 H new ATOM 0 HG3 GLN B 17 2.532 -4.138 14.768 1.00 0.00 H new ATOM 0 HE21 GLN B 17 5.384 -4.518 12.688 1.00 0.00 H new ATOM 0 HE22 GLN B 17 5.123 -6.227 12.321 1.00 0.00 H new ATOM 1526 N ASP B 18 1.023 -1.792 12.909 1.00 0.00 N ATOM 1527 CA ASP B 18 -0.410 -1.730 13.184 1.00 0.00 C ATOM 1528 C ASP B 18 -1.194 -2.075 11.922 1.00 0.00 C ATOM 1529 O ASP B 18 -2.241 -2.723 11.980 1.00 0.00 O ATOM 1530 CB ASP B 18 -0.796 -0.339 13.700 1.00 0.00 C ATOM 1531 CG ASP B 18 -2.060 -0.353 14.543 1.00 0.00 C ATOM 1532 OD1 ASP B 18 -1.998 -0.851 15.690 1.00 0.00 O ATOM 1533 OD2 ASP B 18 -3.109 0.142 14.080 1.00 0.00 O ATOM 0 H ASP B 18 1.510 -0.901 13.005 1.00 0.00 H new ATOM 0 HA ASP B 18 -0.655 -2.458 13.958 1.00 0.00 H new ATOM 0 HB2 ASP B 18 0.025 0.065 14.292 1.00 0.00 H new ATOM 0 HB3 ASP B 18 -0.938 0.331 12.852 1.00 0.00 H new ATOM 1538 N LEU B 19 -0.655 -1.658 10.777 1.00 0.00 N ATOM 1539 CA LEU B 19 -1.217 -2.025 9.480 1.00 0.00 C ATOM 1540 C LEU B 19 -1.123 -3.534 9.268 1.00 0.00 C ATOM 1541 O LEU B 19 -2.073 -4.169 8.807 1.00 0.00 O ATOM 1542 CB LEU B 19 -0.472 -1.304 8.349 1.00 0.00 C ATOM 1543 CG LEU B 19 -0.609 0.221 8.331 1.00 0.00 C ATOM 1544 CD1 LEU B 19 0.344 0.831 7.314 1.00 0.00 C ATOM 1545 CD2 LEU B 19 -2.043 0.624 8.017 1.00 0.00 C ATOM 0 H LEU B 19 0.173 -1.064 10.723 1.00 0.00 H new ATOM 0 HA LEU B 19 -2.265 -1.725 9.466 1.00 0.00 H new ATOM 0 HB2 LEU B 19 0.587 -1.555 8.418 1.00 0.00 H new ATOM 0 HB3 LEU B 19 -0.830 -1.694 7.396 1.00 0.00 H new ATOM 0 HG LEU B 19 -0.350 0.599 9.320 1.00 0.00 H new ATOM 0 HD11 LEU B 19 0.232 1.915 7.315 1.00 0.00 H new ATOM 0 HD12 LEU B 19 1.370 0.571 7.575 1.00 0.00 H new ATOM 0 HD13 LEU B 19 0.113 0.444 6.321 1.00 0.00 H new ATOM 0 HD21 LEU B 19 -2.122 1.711 8.008 1.00 0.00 H new ATOM 0 HD22 LEU B 19 -2.326 0.232 7.040 1.00 0.00 H new ATOM 0 HD23 LEU B 19 -2.710 0.218 8.778 1.00 0.00 H new ATOM 1557 N LEU B 20 0.030 -4.101 9.613 1.00 0.00 N ATOM 1558 CA LEU B 20 0.254 -5.536 9.478 1.00 0.00 C ATOM 1559 C LEU B 20 -0.691 -6.316 10.382 1.00 0.00 C ATOM 1560 O LEU B 20 -1.256 -7.326 9.963 1.00 0.00 O ATOM 1561 CB LEU B 20 1.706 -5.897 9.804 1.00 0.00 C ATOM 1562 CG LEU B 20 2.756 -5.297 8.865 1.00 0.00 C ATOM 1563 CD1 LEU B 20 4.156 -5.669 9.326 1.00 0.00 C ATOM 1564 CD2 LEU B 20 2.522 -5.758 7.434 1.00 0.00 C ATOM 0 H LEU B 20 0.826 -3.586 9.989 1.00 0.00 H new ATOM 0 HA LEU B 20 0.053 -5.808 8.442 1.00 0.00 H new ATOM 0 HB2 LEU B 20 1.924 -5.572 10.821 1.00 0.00 H new ATOM 0 HB3 LEU B 20 1.806 -6.982 9.788 1.00 0.00 H new ATOM 0 HG LEU B 20 2.662 -4.211 8.893 1.00 0.00 H new ATOM 0 HD11 LEU B 20 4.890 -5.234 8.647 1.00 0.00 H new ATOM 0 HD12 LEU B 20 4.321 -5.286 10.333 1.00 0.00 H new ATOM 0 HD13 LEU B 20 4.262 -6.754 9.329 1.00 0.00 H new ATOM 0 HD21 LEU B 20 3.279 -5.321 6.783 1.00 0.00 H new ATOM 0 HD22 LEU B 20 2.587 -6.845 7.387 1.00 0.00 H new ATOM 0 HD23 LEU B 20 1.533 -5.439 7.106 1.00 0.00 H new ATOM 1576 N ASP B 21 -0.856 -5.843 11.617 1.00 0.00 N ATOM 1577 CA ASP B 21 -1.818 -6.433 12.551 1.00 0.00 C ATOM 1578 C ASP B 21 -3.188 -6.568 11.896 1.00 0.00 C ATOM 1579 O ASP B 21 -3.850 -7.599 12.017 1.00 0.00 O ATOM 1580 CB ASP B 21 -1.960 -5.583 13.821 1.00 0.00 C ATOM 1581 CG ASP B 21 -0.750 -5.646 14.734 1.00 0.00 C ATOM 1582 OD1 ASP B 21 -0.257 -6.762 15.003 1.00 0.00 O ATOM 1583 OD2 ASP B 21 -0.312 -4.580 15.221 1.00 0.00 O ATOM 0 H ASP B 21 -0.336 -5.052 11.996 1.00 0.00 H new ATOM 0 HA ASP B 21 -1.438 -7.418 12.823 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -2.136 -4.546 13.536 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -2.839 -5.915 14.374 1.00 0.00 H new ATOM 1588 N VAL B 22 -3.600 -5.515 11.195 1.00 0.00 N ATOM 1589 CA VAL B 22 -4.873 -5.508 10.484 1.00 0.00 C ATOM 1590 C VAL B 22 -4.891 -6.555 9.373 1.00 0.00 C ATOM 1591 O VAL B 22 -5.831 -7.343 9.269 1.00 0.00 O ATOM 1592 CB VAL B 22 -5.170 -4.122 9.873 1.00 0.00 C ATOM 1593 CG1 VAL B 22 -6.421 -4.165 9.004 1.00 0.00 C ATOM 1594 CG2 VAL B 22 -5.314 -3.078 10.967 1.00 0.00 C ATOM 0 H VAL B 22 -3.066 -4.651 11.105 1.00 0.00 H new ATOM 0 HA VAL B 22 -5.644 -5.747 11.217 1.00 0.00 H new ATOM 0 HB VAL B 22 -4.329 -3.844 9.238 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -6.608 -3.176 8.586 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -6.277 -4.880 8.194 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -7.274 -4.470 9.610 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -5.523 -2.107 10.518 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -6.134 -3.356 11.629 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -4.388 -3.021 11.540 1.00 0.00 H new ATOM 1604 N LEU B 23 -3.844 -6.562 8.558 1.00 0.00 N ATOM 1605 CA LEU B 23 -3.755 -7.471 7.419 1.00 0.00 C ATOM 1606 C LEU B 23 -3.794 -8.932 7.866 1.00 0.00 C ATOM 1607 O LEU B 23 -4.493 -9.755 7.269 1.00 0.00 O ATOM 1608 CB LEU B 23 -2.474 -7.203 6.626 1.00 0.00 C ATOM 1609 CG LEU B 23 -2.352 -5.796 6.034 1.00 0.00 C ATOM 1610 CD1 LEU B 23 -1.013 -5.622 5.337 1.00 0.00 C ATOM 1611 CD2 LEU B 23 -3.498 -5.516 5.073 1.00 0.00 C ATOM 0 H LEU B 23 -3.039 -5.945 8.665 1.00 0.00 H new ATOM 0 HA LEU B 23 -4.619 -7.289 6.781 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -1.619 -7.380 7.278 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -2.411 -7.927 5.814 1.00 0.00 H new ATOM 0 HG LEU B 23 -2.408 -5.076 6.851 1.00 0.00 H new ATOM 0 HD11 LEU B 23 -0.946 -4.616 4.923 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -0.207 -5.773 6.055 1.00 0.00 H new ATOM 0 HD13 LEU B 23 -0.924 -6.352 4.532 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -3.392 -4.511 4.664 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -3.478 -6.243 4.261 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -4.446 -5.593 5.605 1.00 0.00 H new ATOM 1623 N VAL B 24 -3.052 -9.245 8.922 1.00 0.00 N ATOM 1624 CA VAL B 24 -3.002 -10.605 9.442 1.00 0.00 C ATOM 1625 C VAL B 24 -4.315 -10.966 10.136 1.00 0.00 C ATOM 1626 O VAL B 24 -4.723 -12.127 10.147 1.00 0.00 O ATOM 1627 CB VAL B 24 -1.823 -10.795 10.422 1.00 0.00 C ATOM 1628 CG1 VAL B 24 -1.748 -12.237 10.899 1.00 0.00 C ATOM 1629 CG2 VAL B 24 -0.512 -10.383 9.770 1.00 0.00 C ATOM 0 H VAL B 24 -2.477 -8.576 9.434 1.00 0.00 H new ATOM 0 HA VAL B 24 -2.851 -11.272 8.593 1.00 0.00 H new ATOM 0 HB VAL B 24 -1.994 -10.155 11.287 1.00 0.00 H new ATOM 0 HG11 VAL B 24 -0.911 -12.349 11.588 1.00 0.00 H new ATOM 0 HG12 VAL B 24 -2.675 -12.500 11.408 1.00 0.00 H new ATOM 0 HG13 VAL B 24 -1.604 -12.896 10.043 1.00 0.00 H new ATOM 0 HG21 VAL B 24 0.306 -10.524 10.477 1.00 0.00 H new ATOM 0 HG22 VAL B 24 -0.337 -10.995 8.885 1.00 0.00 H new ATOM 0 HG23 VAL B 24 -0.564 -9.334 9.480 1.00 0.00 H new ATOM 1639 N LYS B 25 -4.982 -9.957 10.693 1.00 0.00 N ATOM 1640 CA LYS B 25 -6.275 -10.152 11.347 1.00 0.00 C ATOM 1641 C LYS B 25 -7.302 -10.678 10.351 1.00 0.00 C ATOM 1642 O LYS B 25 -8.120 -11.537 10.677 1.00 0.00 O ATOM 1643 CB LYS B 25 -6.765 -8.833 11.961 1.00 0.00 C ATOM 1644 CG LYS B 25 -8.061 -8.960 12.748 1.00 0.00 C ATOM 1645 CD LYS B 25 -8.411 -7.667 13.469 1.00 0.00 C ATOM 1646 CE LYS B 25 -9.507 -6.878 12.760 1.00 0.00 C ATOM 1647 NZ LYS B 25 -9.101 -6.387 11.414 1.00 0.00 N ATOM 0 H LYS B 25 -4.647 -8.993 10.705 1.00 0.00 H new ATOM 0 HA LYS B 25 -6.152 -10.887 12.142 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -5.990 -8.440 12.619 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -6.906 -8.103 11.164 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -8.872 -9.231 12.072 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -7.968 -9.768 13.474 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -8.733 -7.897 14.484 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -7.518 -7.048 13.551 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -10.391 -7.508 12.658 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -9.791 -6.027 13.379 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -9.466 -5.424 11.271 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -8.063 -6.378 11.346 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -9.490 -7.016 10.683 1.00 0.00 H new ATOM 1661 N GLU B 26 -7.234 -10.170 9.130 1.00 0.00 N ATOM 1662 CA GLU B 26 -8.184 -10.548 8.096 1.00 0.00 C ATOM 1663 C GLU B 26 -7.720 -11.785 7.337 1.00 0.00 C ATOM 1664 O GLU B 26 -8.529 -12.462 6.699 1.00 0.00 O ATOM 1665 CB GLU B 26 -8.385 -9.396 7.112 1.00 0.00 C ATOM 1666 CG GLU B 26 -8.882 -8.114 7.757 1.00 0.00 C ATOM 1667 CD GLU B 26 -10.158 -8.317 8.540 1.00 0.00 C ATOM 1668 OE1 GLU B 26 -11.191 -8.654 7.923 1.00 0.00 O ATOM 1669 OE2 GLU B 26 -10.132 -8.137 9.773 1.00 0.00 O ATOM 0 H GLU B 26 -6.530 -9.495 8.831 1.00 0.00 H new ATOM 0 HA GLU B 26 -9.129 -10.779 8.589 1.00 0.00 H new ATOM 0 HB2 GLU B 26 -7.441 -9.194 6.607 1.00 0.00 H new ATOM 0 HB3 GLU B 26 -9.097 -9.705 6.346 1.00 0.00 H new ATOM 0 HG2 GLU B 26 -8.111 -7.722 8.420 1.00 0.00 H new ATOM 0 HG3 GLU B 26 -9.049 -7.364 6.984 1.00 0.00 H new ATOM 1676 N GLU B 27 -6.422 -12.084 7.426 1.00 0.00 N ATOM 1677 CA GLU B 27 -5.811 -13.158 6.637 1.00 0.00 C ATOM 1678 C GLU B 27 -5.969 -12.853 5.149 1.00 0.00 C ATOM 1679 O GLU B 27 -6.258 -13.742 4.343 1.00 0.00 O ATOM 1680 CB GLU B 27 -6.439 -14.518 6.965 1.00 0.00 C ATOM 1681 CG GLU B 27 -6.315 -14.926 8.422 1.00 0.00 C ATOM 1682 CD GLU B 27 -6.988 -16.252 8.702 1.00 0.00 C ATOM 1683 OE1 GLU B 27 -8.232 -16.270 8.832 1.00 0.00 O ATOM 1684 OE2 GLU B 27 -6.283 -17.280 8.780 1.00 0.00 O ATOM 0 H GLU B 27 -5.770 -11.595 8.040 1.00 0.00 H new ATOM 0 HA GLU B 27 -4.752 -13.210 6.890 1.00 0.00 H new ATOM 0 HB2 GLU B 27 -7.495 -14.493 6.695 1.00 0.00 H new ATOM 0 HB3 GLU B 27 -5.970 -15.281 6.344 1.00 0.00 H new ATOM 0 HG2 GLU B 27 -5.261 -14.991 8.691 1.00 0.00 H new ATOM 0 HG3 GLU B 27 -6.758 -14.155 9.053 1.00 0.00 H new ATOM 1691 N VAL B 28 -5.757 -11.587 4.801 1.00 0.00 N ATOM 1692 CA VAL B 28 -5.995 -11.097 3.449 1.00 0.00 C ATOM 1693 C VAL B 28 -5.182 -11.842 2.395 1.00 0.00 C ATOM 1694 O VAL B 28 -4.052 -12.269 2.637 1.00 0.00 O ATOM 1695 CB VAL B 28 -5.691 -9.587 3.329 1.00 0.00 C ATOM 1696 CG1 VAL B 28 -6.665 -8.775 4.165 1.00 0.00 C ATOM 1697 CG2 VAL B 28 -4.256 -9.280 3.741 1.00 0.00 C ATOM 0 H VAL B 28 -5.416 -10.875 5.447 1.00 0.00 H new ATOM 0 HA VAL B 28 -7.053 -11.278 3.261 1.00 0.00 H new ATOM 0 HB VAL B 28 -5.811 -9.306 2.283 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -6.433 -7.715 4.066 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -7.682 -8.958 3.819 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -6.580 -9.069 5.211 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -4.071 -8.210 3.646 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -4.102 -9.585 4.776 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -3.568 -9.826 3.096 1.00 0.00 H new ATOM 1707 N THR B 29 -5.782 -11.999 1.230 1.00 0.00 N ATOM 1708 CA THR B 29 -5.102 -12.555 0.081 1.00 0.00 C ATOM 1709 C THR B 29 -4.253 -11.465 -0.570 1.00 0.00 C ATOM 1710 O THR B 29 -4.616 -10.293 -0.495 1.00 0.00 O ATOM 1711 CB THR B 29 -6.139 -13.091 -0.924 1.00 0.00 C ATOM 1712 OG1 THR B 29 -7.443 -13.057 -0.322 1.00 0.00 O ATOM 1713 CG2 THR B 29 -5.815 -14.517 -1.342 1.00 0.00 C ATOM 0 H THR B 29 -6.754 -11.744 1.056 1.00 0.00 H new ATOM 0 HA THR B 29 -4.458 -13.377 0.393 1.00 0.00 H new ATOM 0 HB THR B 29 -6.115 -12.460 -1.812 1.00 0.00 H new ATOM 0 HG1 THR B 29 -8.106 -13.396 -0.959 1.00 0.00 H new ATOM 0 HG21 THR B 29 -6.565 -14.867 -2.051 1.00 0.00 H new ATOM 0 HG22 THR B 29 -4.831 -14.544 -1.811 1.00 0.00 H new ATOM 0 HG23 THR B 29 -5.817 -15.163 -0.464 1.00 0.00 H new ATOM 1721 N PRO B 30 -3.110 -11.818 -1.191 1.00 0.00 N ATOM 1722 CA PRO B 30 -2.222 -10.841 -1.836 1.00 0.00 C ATOM 1723 C PRO B 30 -2.972 -9.846 -2.724 1.00 0.00 C ATOM 1724 O PRO B 30 -2.775 -8.636 -2.613 1.00 0.00 O ATOM 1725 CB PRO B 30 -1.294 -11.719 -2.677 1.00 0.00 C ATOM 1726 CG PRO B 30 -1.223 -13.003 -1.930 1.00 0.00 C ATOM 1727 CD PRO B 30 -2.577 -13.192 -1.294 1.00 0.00 C ATOM 0 HA PRO B 30 -1.706 -10.218 -1.105 1.00 0.00 H new ATOM 0 HB2 PRO B 30 -1.689 -11.865 -3.682 1.00 0.00 H new ATOM 0 HB3 PRO B 30 -0.308 -11.267 -2.784 1.00 0.00 H new ATOM 0 HG2 PRO B 30 -0.988 -13.831 -2.599 1.00 0.00 H new ATOM 0 HG3 PRO B 30 -0.438 -12.971 -1.174 1.00 0.00 H new ATOM 0 HD2 PRO B 30 -3.221 -13.827 -1.903 1.00 0.00 H new ATOM 0 HD3 PRO B 30 -2.497 -13.665 -0.315 1.00 0.00 H new ATOM 1735 N ASP B 31 -3.841 -10.364 -3.588 1.00 0.00 N ATOM 1736 CA ASP B 31 -4.628 -9.530 -4.501 1.00 0.00 C ATOM 1737 C ASP B 31 -5.508 -8.558 -3.718 1.00 0.00 C ATOM 1738 O ASP B 31 -5.590 -7.373 -4.041 1.00 0.00 O ATOM 1739 CB ASP B 31 -5.512 -10.407 -5.392 1.00 0.00 C ATOM 1740 CG ASP B 31 -4.735 -11.517 -6.072 1.00 0.00 C ATOM 1741 OD1 ASP B 31 -4.374 -12.495 -5.385 1.00 0.00 O ATOM 1742 OD2 ASP B 31 -4.487 -11.422 -7.294 1.00 0.00 O ATOM 0 H ASP B 31 -4.021 -11.364 -3.677 1.00 0.00 H new ATOM 0 HA ASP B 31 -3.936 -8.963 -5.123 1.00 0.00 H new ATOM 0 HB2 ASP B 31 -6.309 -10.843 -4.790 1.00 0.00 H new ATOM 0 HB3 ASP B 31 -5.988 -9.785 -6.150 1.00 0.00 H new ATOM 1747 N LEU B 32 -6.151 -9.077 -2.677 1.00 0.00 N ATOM 1748 CA LEU B 32 -7.026 -8.276 -1.828 1.00 0.00 C ATOM 1749 C LEU B 32 -6.225 -7.206 -1.094 1.00 0.00 C ATOM 1750 O LEU B 32 -6.639 -6.048 -1.020 1.00 0.00 O ATOM 1751 CB LEU B 32 -7.747 -9.180 -0.818 1.00 0.00 C ATOM 1752 CG LEU B 32 -8.656 -8.463 0.186 1.00 0.00 C ATOM 1753 CD1 LEU B 32 -9.811 -7.779 -0.525 1.00 0.00 C ATOM 1754 CD2 LEU B 32 -9.173 -9.447 1.220 1.00 0.00 C ATOM 0 H LEU B 32 -6.082 -10.056 -2.400 1.00 0.00 H new ATOM 0 HA LEU B 32 -7.767 -7.783 -2.458 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -8.346 -9.904 -1.370 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -6.997 -9.744 -0.263 1.00 0.00 H new ATOM 0 HG LEU B 32 -8.071 -7.697 0.695 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -10.443 -7.277 0.207 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -9.421 -7.046 -1.231 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -10.399 -8.523 -1.062 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -9.818 -8.926 1.928 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -9.741 -10.233 0.722 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -8.332 -9.890 1.753 1.00 0.00 H new ATOM 1766 N ALA B 33 -5.077 -7.604 -0.561 1.00 0.00 N ATOM 1767 CA ALA B 33 -4.197 -6.689 0.148 1.00 0.00 C ATOM 1768 C ALA B 33 -3.800 -5.521 -0.743 1.00 0.00 C ATOM 1769 O ALA B 33 -3.859 -4.365 -0.326 1.00 0.00 O ATOM 1770 CB ALA B 33 -2.962 -7.423 0.646 1.00 0.00 C ATOM 0 H ALA B 33 -4.733 -8.563 -0.608 1.00 0.00 H new ATOM 0 HA ALA B 33 -4.737 -6.292 1.008 1.00 0.00 H new ATOM 0 HB1 ALA B 33 -2.313 -6.725 1.175 1.00 0.00 H new ATOM 0 HB2 ALA B 33 -3.262 -8.223 1.323 1.00 0.00 H new ATOM 0 HB3 ALA B 33 -2.424 -7.848 -0.202 1.00 0.00 H new ATOM 1776 N LEU B 34 -3.426 -5.830 -1.979 1.00 0.00 N ATOM 1777 CA LEU B 34 -3.014 -4.809 -2.936 1.00 0.00 C ATOM 1778 C LEU B 34 -4.147 -3.820 -3.207 1.00 0.00 C ATOM 1779 O LEU B 34 -3.927 -2.610 -3.256 1.00 0.00 O ATOM 1780 CB LEU B 34 -2.561 -5.453 -4.253 1.00 0.00 C ATOM 1781 CG LEU B 34 -1.389 -6.435 -4.139 1.00 0.00 C ATOM 1782 CD1 LEU B 34 -1.029 -6.996 -5.508 1.00 0.00 C ATOM 1783 CD2 LEU B 34 -0.181 -5.763 -3.500 1.00 0.00 C ATOM 0 H LEU B 34 -3.399 -6.782 -2.343 1.00 0.00 H new ATOM 0 HA LEU B 34 -2.176 -4.266 -2.499 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -3.410 -5.977 -4.692 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -2.282 -4.661 -4.948 1.00 0.00 H new ATOM 0 HG LEU B 34 -1.696 -7.261 -3.498 1.00 0.00 H new ATOM 0 HD11 LEU B 34 -0.195 -7.691 -5.409 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -1.890 -7.519 -5.925 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -0.744 -6.180 -6.172 1.00 0.00 H new ATOM 0 HD21 LEU B 34 0.638 -6.478 -3.429 1.00 0.00 H new ATOM 0 HD22 LEU B 34 0.129 -4.915 -4.111 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -0.445 -5.414 -2.502 1.00 0.00 H new ATOM 1795 N MET B 35 -5.361 -4.343 -3.362 1.00 0.00 N ATOM 1796 CA MET B 35 -6.526 -3.512 -3.648 1.00 0.00 C ATOM 1797 C MET B 35 -6.833 -2.572 -2.486 1.00 0.00 C ATOM 1798 O MET B 35 -7.117 -1.395 -2.694 1.00 0.00 O ATOM 1799 CB MET B 35 -7.742 -4.390 -3.962 1.00 0.00 C ATOM 1800 CG MET B 35 -8.993 -3.597 -4.313 1.00 0.00 C ATOM 1801 SD MET B 35 -10.358 -4.641 -4.861 1.00 0.00 S ATOM 1802 CE MET B 35 -10.589 -5.685 -3.423 1.00 0.00 C ATOM 0 H MET B 35 -5.563 -5.340 -3.294 1.00 0.00 H new ATOM 0 HA MET B 35 -6.298 -2.901 -4.521 1.00 0.00 H new ATOM 0 HB2 MET B 35 -7.497 -5.052 -4.793 1.00 0.00 H new ATOM 0 HB3 MET B 35 -7.954 -5.024 -3.101 1.00 0.00 H new ATOM 0 HG2 MET B 35 -9.309 -3.023 -3.442 1.00 0.00 H new ATOM 0 HG3 MET B 35 -8.754 -2.880 -5.098 1.00 0.00 H new ATOM 0 HE1 MET B 35 -11.609 -6.069 -3.412 1.00 0.00 H new ATOM 0 HE2 MET B 35 -9.888 -6.519 -3.462 1.00 0.00 H new ATOM 0 HE3 MET B 35 -10.411 -5.103 -2.519 1.00 0.00 H new ATOM 1812 N CYS B 36 -6.764 -3.086 -1.266 1.00 0.00 N ATOM 1813 CA CYS B 36 -7.056 -2.280 -0.089 1.00 0.00 C ATOM 1814 C CYS B 36 -5.925 -1.293 0.206 1.00 0.00 C ATOM 1815 O CYS B 36 -6.176 -0.118 0.481 1.00 0.00 O ATOM 1816 CB CYS B 36 -7.310 -3.184 1.119 1.00 0.00 C ATOM 1817 SG CYS B 36 -8.745 -4.271 0.931 1.00 0.00 S ATOM 0 H CYS B 36 -6.510 -4.053 -1.066 1.00 0.00 H new ATOM 0 HA CYS B 36 -7.956 -1.699 -0.291 1.00 0.00 H new ATOM 0 HB2 CYS B 36 -6.425 -3.794 1.296 1.00 0.00 H new ATOM 0 HB3 CYS B 36 -7.451 -2.562 2.003 1.00 0.00 H new ATOM 0 HG CYS B 36 -8.436 -5.268 0.156 1.00 0.00 H new ATOM 1823 N LEU B 37 -4.681 -1.761 0.132 1.00 0.00 N ATOM 1824 CA LEU B 37 -3.528 -0.913 0.419 1.00 0.00 C ATOM 1825 C LEU B 37 -3.382 0.188 -0.628 1.00 0.00 C ATOM 1826 O LEU B 37 -3.197 1.353 -0.287 1.00 0.00 O ATOM 1827 CB LEU B 37 -2.243 -1.746 0.488 1.00 0.00 C ATOM 1828 CG LEU B 37 -2.153 -2.711 1.675 1.00 0.00 C ATOM 1829 CD1 LEU B 37 -0.912 -3.582 1.560 1.00 0.00 C ATOM 1830 CD2 LEU B 37 -2.142 -1.942 2.985 1.00 0.00 C ATOM 0 H LEU B 37 -4.447 -2.720 -0.124 1.00 0.00 H new ATOM 0 HA LEU B 37 -3.695 -0.446 1.390 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -2.151 -2.320 -0.434 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -1.391 -1.067 0.527 1.00 0.00 H new ATOM 0 HG LEU B 37 -3.031 -3.357 1.661 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -0.864 -4.261 2.411 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -0.957 -4.160 0.637 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -0.024 -2.950 1.549 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -2.078 -2.643 3.818 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -1.282 -1.273 3.007 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -3.058 -1.358 3.072 1.00 0.00 H new ATOM 1842 N GLY B 38 -3.487 -0.187 -1.900 1.00 0.00 N ATOM 1843 CA GLY B 38 -3.358 0.782 -2.975 1.00 0.00 C ATOM 1844 C GLY B 38 -4.461 1.817 -2.949 1.00 0.00 C ATOM 1845 O GLY B 38 -4.250 2.980 -3.297 1.00 0.00 O ATOM 0 H GLY B 38 -3.659 -1.145 -2.206 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -2.392 1.281 -2.897 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -3.372 0.263 -3.933 1.00 0.00 H new ATOM 1849 N ASN B 39 -5.635 1.392 -2.514 1.00 0.00 N ATOM 1850 CA ASN B 39 -6.786 2.275 -2.405 1.00 0.00 C ATOM 1851 C ASN B 39 -6.541 3.321 -1.322 1.00 0.00 C ATOM 1852 O ASN B 39 -6.958 4.474 -1.438 1.00 0.00 O ATOM 1853 CB ASN B 39 -8.024 1.447 -2.077 1.00 0.00 C ATOM 1854 CG ASN B 39 -9.323 2.092 -2.524 1.00 0.00 C ATOM 1855 OD1 ASN B 39 -9.484 3.309 -2.488 1.00 0.00 O ATOM 1856 ND2 ASN B 39 -10.254 1.263 -2.973 1.00 0.00 N ATOM 0 H ASN B 39 -5.818 0.430 -2.228 1.00 0.00 H new ATOM 0 HA ASN B 39 -6.942 2.792 -3.352 1.00 0.00 H new ATOM 0 HB2 ASN B 39 -7.932 0.469 -2.550 1.00 0.00 H new ATOM 0 HB3 ASN B 39 -8.063 1.278 -1.001 1.00 0.00 H new ATOM 0 HD21 ASN B 39 -11.146 1.630 -3.306 1.00 0.00 H new ATOM 0 HD22 ASN B 39 -10.079 0.258 -2.986 1.00 0.00 H new ATOM 1863 N ALA B 40 -5.839 2.917 -0.270 1.00 0.00 N ATOM 1864 CA ALA B 40 -5.463 3.839 0.791 1.00 0.00 C ATOM 1865 C ALA B 40 -4.387 4.802 0.293 1.00 0.00 C ATOM 1866 O ALA B 40 -4.321 5.955 0.719 1.00 0.00 O ATOM 1867 CB ALA B 40 -4.976 3.076 2.015 1.00 0.00 C ATOM 0 H ALA B 40 -5.520 1.958 -0.130 1.00 0.00 H new ATOM 0 HA ALA B 40 -6.341 4.417 1.079 1.00 0.00 H new ATOM 0 HB1 ALA B 40 -4.699 3.782 2.798 1.00 0.00 H new ATOM 0 HB2 ALA B 40 -5.771 2.425 2.378 1.00 0.00 H new ATOM 0 HB3 ALA B 40 -4.108 2.474 1.747 1.00 0.00 H new ATOM 1873 N VAL B 41 -3.564 4.325 -0.639 1.00 0.00 N ATOM 1874 CA VAL B 41 -2.509 5.137 -1.224 1.00 0.00 C ATOM 1875 C VAL B 41 -3.118 6.240 -2.078 1.00 0.00 C ATOM 1876 O VAL B 41 -2.780 7.418 -1.936 1.00 0.00 O ATOM 1877 CB VAL B 41 -1.551 4.283 -2.093 1.00 0.00 C ATOM 1878 CG1 VAL B 41 -0.514 5.150 -2.794 1.00 0.00 C ATOM 1879 CG2 VAL B 41 -0.863 3.223 -1.249 1.00 0.00 C ATOM 0 H VAL B 41 -3.612 3.374 -1.004 1.00 0.00 H new ATOM 0 HA VAL B 41 -1.933 5.573 -0.408 1.00 0.00 H new ATOM 0 HB VAL B 41 -2.152 3.790 -2.857 1.00 0.00 H new ATOM 0 HG11 VAL B 41 0.141 4.519 -3.395 1.00 0.00 H new ATOM 0 HG12 VAL B 41 -1.018 5.869 -3.440 1.00 0.00 H new ATOM 0 HG13 VAL B 41 0.078 5.683 -2.050 1.00 0.00 H new ATOM 0 HG21 VAL B 41 -0.195 2.634 -1.878 1.00 0.00 H new ATOM 0 HG22 VAL B 41 -0.287 3.704 -0.459 1.00 0.00 H new ATOM 0 HG23 VAL B 41 -1.613 2.569 -0.804 1.00 0.00 H new ATOM 1889 N THR B 42 -4.054 5.855 -2.936 1.00 0.00 N ATOM 1890 CA THR B 42 -4.666 6.790 -3.860 1.00 0.00 C ATOM 1891 C THR B 42 -5.597 7.753 -3.125 1.00 0.00 C ATOM 1892 O THR B 42 -5.929 8.820 -3.642 1.00 0.00 O ATOM 1893 CB THR B 42 -5.437 6.062 -4.985 1.00 0.00 C ATOM 1894 OG1 THR B 42 -5.869 7.009 -5.970 1.00 0.00 O ATOM 1895 CG2 THR B 42 -6.647 5.318 -4.442 1.00 0.00 C ATOM 0 H THR B 42 -4.404 4.900 -3.008 1.00 0.00 H new ATOM 0 HA THR B 42 -3.859 7.361 -4.319 1.00 0.00 H new ATOM 0 HB THR B 42 -4.760 5.335 -5.434 1.00 0.00 H new ATOM 0 HG1 THR B 42 -6.071 7.864 -5.536 1.00 0.00 H new ATOM 0 HG21 THR B 42 -7.165 4.818 -5.261 1.00 0.00 H new ATOM 0 HG22 THR B 42 -6.321 4.577 -3.713 1.00 0.00 H new ATOM 0 HG23 THR B 42 -7.324 6.025 -3.963 1.00 0.00 H new ATOM 1903 N ASN B 43 -6.009 7.374 -1.919 1.00 0.00 N ATOM 1904 CA ASN B 43 -6.834 8.238 -1.082 1.00 0.00 C ATOM 1905 C ASN B 43 -6.001 9.419 -0.596 1.00 0.00 C ATOM 1906 O ASN B 43 -6.446 10.564 -0.632 1.00 0.00 O ATOM 1907 CB ASN B 43 -7.396 7.445 0.112 1.00 0.00 C ATOM 1908 CG ASN B 43 -8.454 8.200 0.907 1.00 0.00 C ATOM 1909 OD1 ASN B 43 -8.437 9.425 0.999 1.00 0.00 O ATOM 1910 ND2 ASN B 43 -9.390 7.463 1.489 1.00 0.00 N ATOM 0 H ASN B 43 -5.784 6.472 -1.499 1.00 0.00 H new ATOM 0 HA ASN B 43 -7.674 8.612 -1.667 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -7.826 6.512 -0.253 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -6.575 7.179 0.778 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -10.127 7.911 2.034 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -9.374 6.448 1.392 1.00 0.00 H new ATOM 1917 N ILE B 44 -4.776 9.129 -0.170 1.00 0.00 N ATOM 1918 CA ILE B 44 -3.865 10.157 0.318 1.00 0.00 C ATOM 1919 C ILE B 44 -3.391 11.046 -0.832 1.00 0.00 C ATOM 1920 O ILE B 44 -3.327 12.270 -0.706 1.00 0.00 O ATOM 1921 CB ILE B 44 -2.640 9.526 1.027 1.00 0.00 C ATOM 1922 CG1 ILE B 44 -3.095 8.596 2.162 1.00 0.00 C ATOM 1923 CG2 ILE B 44 -1.705 10.603 1.563 1.00 0.00 C ATOM 1924 CD1 ILE B 44 -3.896 9.291 3.243 1.00 0.00 C ATOM 0 H ILE B 44 -4.390 8.185 -0.153 1.00 0.00 H new ATOM 0 HA ILE B 44 -4.410 10.766 1.040 1.00 0.00 H new ATOM 0 HB ILE B 44 -2.091 8.936 0.293 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -3.696 7.791 1.739 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -2.217 8.135 2.614 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -0.854 10.133 2.056 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -1.351 11.221 0.738 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -2.240 11.226 2.279 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -4.180 8.568 4.007 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -3.292 10.078 3.695 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -4.794 9.728 2.806 1.00 0.00 H new ATOM 1936 N ILE B 45 -3.085 10.421 -1.965 1.00 0.00 N ATOM 1937 CA ILE B 45 -2.603 11.143 -3.142 1.00 0.00 C ATOM 1938 C ILE B 45 -3.688 12.061 -3.719 1.00 0.00 C ATOM 1939 O ILE B 45 -3.390 13.078 -4.348 1.00 0.00 O ATOM 1940 CB ILE B 45 -2.108 10.155 -4.230 1.00 0.00 C ATOM 1941 CG1 ILE B 45 -0.956 9.306 -3.682 1.00 0.00 C ATOM 1942 CG2 ILE B 45 -1.662 10.895 -5.484 1.00 0.00 C ATOM 1943 CD1 ILE B 45 -0.411 8.296 -4.671 1.00 0.00 C ATOM 0 H ILE B 45 -3.162 9.412 -2.095 1.00 0.00 H new ATOM 0 HA ILE B 45 -1.766 11.764 -2.824 1.00 0.00 H new ATOM 0 HB ILE B 45 -2.939 9.503 -4.500 1.00 0.00 H new ATOM 0 HG12 ILE B 45 -0.147 9.967 -3.370 1.00 0.00 H new ATOM 0 HG13 ILE B 45 -1.298 8.779 -2.791 1.00 0.00 H new ATOM 0 HG21 ILE B 45 -1.320 10.176 -6.229 1.00 0.00 H new ATOM 0 HG22 ILE B 45 -2.499 11.465 -5.887 1.00 0.00 H new ATOM 0 HG23 ILE B 45 -0.847 11.574 -5.235 1.00 0.00 H new ATOM 0 HD11 ILE B 45 0.401 7.735 -4.208 1.00 0.00 H new ATOM 0 HD12 ILE B 45 -1.205 7.609 -4.965 1.00 0.00 H new ATOM 0 HD13 ILE B 45 -0.036 8.816 -5.553 1.00 0.00 H new ATOM 1955 N ALA B 46 -4.948 11.720 -3.479 1.00 0.00 N ATOM 1956 CA ALA B 46 -6.065 12.517 -3.978 1.00 0.00 C ATOM 1957 C ALA B 46 -6.197 13.826 -3.204 1.00 0.00 C ATOM 1958 O ALA B 46 -6.856 14.766 -3.657 1.00 0.00 O ATOM 1959 CB ALA B 46 -7.359 11.725 -3.886 1.00 0.00 C ATOM 0 H ALA B 46 -5.223 10.898 -2.942 1.00 0.00 H new ATOM 0 HA ALA B 46 -5.867 12.757 -5.022 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -8.184 12.331 -4.261 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -7.274 10.818 -4.484 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -7.549 11.458 -2.846 1.00 0.00 H new ATOM 1965 N GLN B 47 -5.562 13.885 -2.044 1.00 0.00 N ATOM 1966 CA GLN B 47 -5.683 15.038 -1.162 1.00 0.00 C ATOM 1967 C GLN B 47 -4.682 16.133 -1.530 1.00 0.00 C ATOM 1968 O GLN B 47 -4.904 17.311 -1.245 1.00 0.00 O ATOM 1969 CB GLN B 47 -5.493 14.594 0.289 1.00 0.00 C ATOM 1970 CG GLN B 47 -6.441 13.478 0.694 1.00 0.00 C ATOM 1971 CD GLN B 47 -6.137 12.903 2.061 1.00 0.00 C ATOM 1972 OE1 GLN B 47 -5.648 13.597 2.953 1.00 0.00 O ATOM 1973 NE2 GLN B 47 -6.428 11.624 2.233 1.00 0.00 N ATOM 0 H GLN B 47 -4.955 13.146 -1.689 1.00 0.00 H new ATOM 0 HA GLN B 47 -6.681 15.461 -1.281 1.00 0.00 H new ATOM 0 HB2 GLN B 47 -4.465 14.260 0.430 1.00 0.00 H new ATOM 0 HB3 GLN B 47 -5.643 15.449 0.948 1.00 0.00 H new ATOM 0 HG2 GLN B 47 -7.463 13.857 0.686 1.00 0.00 H new ATOM 0 HG3 GLN B 47 -6.391 12.681 -0.048 1.00 0.00 H new ATOM 0 HE21 GLN B 47 -6.832 11.085 1.467 1.00 0.00 H new ATOM 0 HE22 GLN B 47 -6.248 11.176 3.132 1.00 0.00 H new ATOM 1982 N VAL B 48 -3.589 15.739 -2.172 1.00 0.00 N ATOM 1983 CA VAL B 48 -2.566 16.684 -2.604 1.00 0.00 C ATOM 1984 C VAL B 48 -2.798 17.086 -4.063 1.00 0.00 C ATOM 1985 O VAL B 48 -3.536 16.409 -4.778 1.00 0.00 O ATOM 1986 CB VAL B 48 -1.143 16.093 -2.438 1.00 0.00 C ATOM 1987 CG1 VAL B 48 -0.859 15.799 -0.973 1.00 0.00 C ATOM 1988 CG2 VAL B 48 -0.961 14.835 -3.281 1.00 0.00 C ATOM 0 H VAL B 48 -3.388 14.767 -2.406 1.00 0.00 H new ATOM 0 HA VAL B 48 -2.641 17.568 -1.971 1.00 0.00 H new ATOM 0 HB VAL B 48 -0.429 16.836 -2.792 1.00 0.00 H new ATOM 0 HG11 VAL B 48 0.144 15.384 -0.873 1.00 0.00 H new ATOM 0 HG12 VAL B 48 -0.930 16.721 -0.396 1.00 0.00 H new ATOM 0 HG13 VAL B 48 -1.588 15.080 -0.598 1.00 0.00 H new ATOM 0 HG21 VAL B 48 0.048 14.446 -3.141 1.00 0.00 H new ATOM 0 HG22 VAL B 48 -1.686 14.082 -2.972 1.00 0.00 H new ATOM 0 HG23 VAL B 48 -1.114 15.077 -4.333 1.00 0.00 H new ATOM 1998 N PRO B 49 -2.203 18.205 -4.517 1.00 0.00 N ATOM 1999 CA PRO B 49 -2.334 18.670 -5.907 1.00 0.00 C ATOM 2000 C PRO B 49 -1.648 17.739 -6.912 1.00 0.00 C ATOM 2001 O PRO B 49 -0.685 17.042 -6.572 1.00 0.00 O ATOM 2002 CB PRO B 49 -1.651 20.042 -5.893 1.00 0.00 C ATOM 2003 CG PRO B 49 -0.716 19.995 -4.736 1.00 0.00 C ATOM 2004 CD PRO B 49 -1.378 19.121 -3.708 1.00 0.00 C ATOM 0 HA PRO B 49 -3.377 18.700 -6.223 1.00 0.00 H new ATOM 0 HB2 PRO B 49 -1.117 20.226 -6.825 1.00 0.00 H new ATOM 0 HB3 PRO B 49 -2.380 20.845 -5.779 1.00 0.00 H new ATOM 0 HG2 PRO B 49 0.251 19.587 -5.031 1.00 0.00 H new ATOM 0 HG3 PRO B 49 -0.533 20.994 -4.340 1.00 0.00 H new ATOM 0 HD2 PRO B 49 -0.645 18.579 -3.110 1.00 0.00 H new ATOM 0 HD3 PRO B 49 -1.986 19.704 -3.016 1.00 0.00 H new ATOM 2012 N GLU B 50 -2.146 17.745 -8.149 1.00 0.00 N ATOM 2013 CA GLU B 50 -1.635 16.876 -9.215 1.00 0.00 C ATOM 2014 C GLU B 50 -0.137 17.058 -9.435 1.00 0.00 C ATOM 2015 O GLU B 50 0.556 16.112 -9.815 1.00 0.00 O ATOM 2016 CB GLU B 50 -2.367 17.131 -10.536 1.00 0.00 C ATOM 2017 CG GLU B 50 -3.868 16.917 -10.469 1.00 0.00 C ATOM 2018 CD GLU B 50 -4.613 18.128 -9.947 1.00 0.00 C ATOM 2019 OE1 GLU B 50 -4.775 18.255 -8.717 1.00 0.00 O ATOM 2020 OE2 GLU B 50 -5.048 18.954 -10.773 1.00 0.00 O ATOM 0 H GLU B 50 -2.913 18.350 -8.442 1.00 0.00 H new ATOM 0 HA GLU B 50 -1.817 15.852 -8.888 1.00 0.00 H new ATOM 0 HB2 GLU B 50 -2.172 18.155 -10.855 1.00 0.00 H new ATOM 0 HB3 GLU B 50 -1.952 16.475 -11.301 1.00 0.00 H new ATOM 0 HG2 GLU B 50 -4.239 16.669 -11.463 1.00 0.00 H new ATOM 0 HG3 GLU B 50 -4.080 16.062 -9.827 1.00 0.00 H new ATOM 2027 N SER B 51 0.354 18.266 -9.181 1.00 0.00 N ATOM 2028 CA SER B 51 1.767 18.584 -9.357 1.00 0.00 C ATOM 2029 C SER B 51 2.655 17.708 -8.468 1.00 0.00 C ATOM 2030 O SER B 51 3.865 17.622 -8.680 1.00 0.00 O ATOM 2031 CB SER B 51 2.011 20.066 -9.052 1.00 0.00 C ATOM 2032 OG SER B 51 3.353 20.438 -9.323 1.00 0.00 O ATOM 0 H SER B 51 -0.211 19.048 -8.850 1.00 0.00 H new ATOM 0 HA SER B 51 2.032 18.380 -10.394 1.00 0.00 H new ATOM 0 HB2 SER B 51 1.335 20.678 -9.649 1.00 0.00 H new ATOM 0 HB3 SER B 51 1.781 20.266 -8.005 1.00 0.00 H new ATOM 0 HG SER B 51 3.917 19.637 -9.344 1.00 0.00 H new ATOM 2038 N LYS B 52 2.059 17.066 -7.471 1.00 0.00 N ATOM 2039 CA LYS B 52 2.804 16.150 -6.618 1.00 0.00 C ATOM 2040 C LYS B 52 2.340 14.711 -6.820 1.00 0.00 C ATOM 2041 O LYS B 52 3.085 13.773 -6.555 1.00 0.00 O ATOM 2042 CB LYS B 52 2.676 16.541 -5.143 1.00 0.00 C ATOM 2043 CG LYS B 52 3.154 17.957 -4.841 1.00 0.00 C ATOM 2044 CD LYS B 52 3.364 18.179 -3.349 1.00 0.00 C ATOM 2045 CE LYS B 52 4.532 17.357 -2.817 1.00 0.00 C ATOM 2046 NZ LYS B 52 5.808 17.696 -3.503 1.00 0.00 N ATOM 0 H LYS B 52 1.071 17.161 -7.235 1.00 0.00 H new ATOM 0 HA LYS B 52 3.853 16.219 -6.904 1.00 0.00 H new ATOM 0 HB2 LYS B 52 1.633 16.447 -4.840 1.00 0.00 H new ATOM 0 HB3 LYS B 52 3.248 15.837 -4.539 1.00 0.00 H new ATOM 0 HG2 LYS B 52 4.087 18.146 -5.371 1.00 0.00 H new ATOM 0 HG3 LYS B 52 2.424 18.674 -5.216 1.00 0.00 H new ATOM 0 HD2 LYS B 52 3.547 19.237 -3.161 1.00 0.00 H new ATOM 0 HD3 LYS B 52 2.455 17.912 -2.810 1.00 0.00 H new ATOM 0 HE2 LYS B 52 4.639 17.529 -1.746 1.00 0.00 H new ATOM 0 HE3 LYS B 52 4.319 16.296 -2.950 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 6.609 17.361 -2.931 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 5.833 17.238 -4.436 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 5.875 18.727 -3.622 1.00 0.00 H new ATOM 2060 N ARG B 53 1.119 14.547 -7.318 1.00 0.00 N ATOM 2061 CA ARG B 53 0.517 13.223 -7.478 1.00 0.00 C ATOM 2062 C ARG B 53 1.352 12.326 -8.390 1.00 0.00 C ATOM 2063 O ARG B 53 1.823 11.267 -7.971 1.00 0.00 O ATOM 2064 CB ARG B 53 -0.901 13.339 -8.043 1.00 0.00 C ATOM 2065 CG ARG B 53 -1.859 14.083 -7.132 1.00 0.00 C ATOM 2066 CD ARG B 53 -3.264 14.136 -7.714 1.00 0.00 C ATOM 2067 NE ARG B 53 -4.152 14.950 -6.890 1.00 0.00 N ATOM 2068 CZ ARG B 53 -5.368 15.353 -7.252 1.00 0.00 C ATOM 2069 NH1 ARG B 53 -5.880 14.988 -8.422 1.00 0.00 N ATOM 2070 NH2 ARG B 53 -6.070 16.128 -6.434 1.00 0.00 N ATOM 0 H ARG B 53 0.522 15.317 -7.620 1.00 0.00 H new ATOM 0 HA ARG B 53 0.480 12.768 -6.488 1.00 0.00 H new ATOM 0 HB2 ARG B 53 -0.859 13.848 -9.006 1.00 0.00 H new ATOM 0 HB3 ARG B 53 -1.292 12.339 -8.228 1.00 0.00 H new ATOM 0 HG2 ARG B 53 -1.887 13.595 -6.158 1.00 0.00 H new ATOM 0 HG3 ARG B 53 -1.494 15.097 -6.970 1.00 0.00 H new ATOM 0 HD2 ARG B 53 -3.226 14.545 -8.724 1.00 0.00 H new ATOM 0 HD3 ARG B 53 -3.664 13.125 -7.794 1.00 0.00 H new ATOM 0 HE ARG B 53 -3.816 15.231 -5.969 1.00 0.00 H new ATOM 0 HH11 ARG B 53 -5.341 14.394 -9.052 1.00 0.00 H new ATOM 0 HH12 ARG B 53 -6.813 15.302 -8.691 1.00 0.00 H new ATOM 0 HH21 ARG B 53 -5.677 16.410 -5.536 1.00 0.00 H new ATOM 0 HH22 ARG B 53 -7.003 16.441 -6.703 1.00 0.00 H new ATOM 2084 N VAL B 54 1.542 12.767 -9.630 1.00 0.00 N ATOM 2085 CA VAL B 54 2.233 11.963 -10.637 1.00 0.00 C ATOM 2086 C VAL B 54 3.682 11.699 -10.235 1.00 0.00 C ATOM 2087 O VAL B 54 4.217 10.608 -10.459 1.00 0.00 O ATOM 2088 CB VAL B 54 2.198 12.649 -12.024 1.00 0.00 C ATOM 2089 CG1 VAL B 54 2.847 11.771 -13.087 1.00 0.00 C ATOM 2090 CG2 VAL B 54 0.768 12.992 -12.411 1.00 0.00 C ATOM 0 H VAL B 54 1.227 13.678 -9.964 1.00 0.00 H new ATOM 0 HA VAL B 54 1.706 11.011 -10.702 1.00 0.00 H new ATOM 0 HB VAL B 54 2.771 13.574 -11.959 1.00 0.00 H new ATOM 0 HG11 VAL B 54 2.808 12.278 -14.051 1.00 0.00 H new ATOM 0 HG12 VAL B 54 3.886 11.582 -12.818 1.00 0.00 H new ATOM 0 HG13 VAL B 54 2.311 10.824 -13.153 1.00 0.00 H new ATOM 0 HG21 VAL B 54 0.761 13.474 -13.389 1.00 0.00 H new ATOM 0 HG22 VAL B 54 0.173 12.079 -12.452 1.00 0.00 H new ATOM 0 HG23 VAL B 54 0.343 13.669 -11.670 1.00 0.00 H new ATOM 2100 N ALA B 55 4.307 12.694 -9.618 1.00 0.00 N ATOM 2101 CA ALA B 55 5.694 12.574 -9.188 1.00 0.00 C ATOM 2102 C ALA B 55 5.840 11.494 -8.122 1.00 0.00 C ATOM 2103 O ALA B 55 6.634 10.558 -8.272 1.00 0.00 O ATOM 2104 CB ALA B 55 6.201 13.907 -8.663 1.00 0.00 C ATOM 0 H ALA B 55 3.875 13.593 -9.404 1.00 0.00 H new ATOM 0 HA ALA B 55 6.295 12.285 -10.050 1.00 0.00 H new ATOM 0 HB1 ALA B 55 7.238 13.802 -8.345 1.00 0.00 H new ATOM 0 HB2 ALA B 55 6.137 14.657 -9.452 1.00 0.00 H new ATOM 0 HB3 ALA B 55 5.592 14.220 -7.815 1.00 0.00 H new ATOM 2110 N VAL B 56 5.049 11.609 -7.062 1.00 0.00 N ATOM 2111 CA VAL B 56 5.142 10.691 -5.937 1.00 0.00 C ATOM 2112 C VAL B 56 4.777 9.266 -6.342 1.00 0.00 C ATOM 2113 O VAL B 56 5.504 8.328 -6.018 1.00 0.00 O ATOM 2114 CB VAL B 56 4.251 11.140 -4.758 1.00 0.00 C ATOM 2115 CG1 VAL B 56 4.287 10.122 -3.625 1.00 0.00 C ATOM 2116 CG2 VAL B 56 4.690 12.507 -4.251 1.00 0.00 C ATOM 0 H VAL B 56 4.335 12.331 -6.959 1.00 0.00 H new ATOM 0 HA VAL B 56 6.182 10.706 -5.612 1.00 0.00 H new ATOM 0 HB VAL B 56 3.225 11.211 -5.120 1.00 0.00 H new ATOM 0 HG11 VAL B 56 3.651 10.464 -2.808 1.00 0.00 H new ATOM 0 HG12 VAL B 56 3.925 9.160 -3.988 1.00 0.00 H new ATOM 0 HG13 VAL B 56 5.311 10.013 -3.266 1.00 0.00 H new ATOM 0 HG21 VAL B 56 4.052 12.809 -3.420 1.00 0.00 H new ATOM 0 HG22 VAL B 56 5.725 12.455 -3.913 1.00 0.00 H new ATOM 0 HG23 VAL B 56 4.607 13.237 -5.056 1.00 0.00 H new ATOM 2126 N VAL B 57 3.673 9.099 -7.070 1.00 0.00 N ATOM 2127 CA VAL B 57 3.198 7.762 -7.415 1.00 0.00 C ATOM 2128 C VAL B 57 4.194 7.018 -8.307 1.00 0.00 C ATOM 2129 O VAL B 57 4.370 5.809 -8.167 1.00 0.00 O ATOM 2130 CB VAL B 57 1.798 7.779 -8.086 1.00 0.00 C ATOM 2131 CG1 VAL B 57 1.822 8.514 -9.418 1.00 0.00 C ATOM 2132 CG2 VAL B 57 1.273 6.360 -8.269 1.00 0.00 C ATOM 0 H VAL B 57 3.098 9.862 -7.427 1.00 0.00 H new ATOM 0 HA VAL B 57 3.108 7.227 -6.469 1.00 0.00 H new ATOM 0 HB VAL B 57 1.123 8.320 -7.422 1.00 0.00 H new ATOM 0 HG11 VAL B 57 0.824 8.505 -9.857 1.00 0.00 H new ATOM 0 HG12 VAL B 57 2.139 9.545 -9.259 1.00 0.00 H new ATOM 0 HG13 VAL B 57 2.520 8.020 -10.094 1.00 0.00 H new ATOM 0 HG21 VAL B 57 0.291 6.393 -8.741 1.00 0.00 H new ATOM 0 HG22 VAL B 57 1.960 5.797 -8.900 1.00 0.00 H new ATOM 0 HG23 VAL B 57 1.192 5.874 -7.297 1.00 0.00 H new ATOM 2142 N ASP B 58 4.867 7.731 -9.207 1.00 0.00 N ATOM 2143 CA ASP B 58 5.832 7.087 -10.095 1.00 0.00 C ATOM 2144 C ASP B 58 7.061 6.648 -9.319 1.00 0.00 C ATOM 2145 O ASP B 58 7.605 5.575 -9.564 1.00 0.00 O ATOM 2146 CB ASP B 58 6.247 8.012 -11.229 1.00 0.00 C ATOM 2147 CG ASP B 58 7.140 7.322 -12.244 1.00 0.00 C ATOM 2148 OD1 ASP B 58 6.682 6.355 -12.887 1.00 0.00 O ATOM 2149 OD2 ASP B 58 8.302 7.749 -12.410 1.00 0.00 O ATOM 0 H ASP B 58 4.765 8.737 -9.340 1.00 0.00 H new ATOM 0 HA ASP B 58 5.346 6.211 -10.525 1.00 0.00 H new ATOM 0 HB2 ASP B 58 5.356 8.389 -11.731 1.00 0.00 H new ATOM 0 HB3 ASP B 58 6.770 8.875 -10.817 1.00 0.00 H new ATOM 2154 N ASN B 59 7.496 7.474 -8.378 1.00 0.00 N ATOM 2155 CA ASN B 59 8.629 7.114 -7.534 1.00 0.00 C ATOM 2156 C ASN B 59 8.242 5.989 -6.585 1.00 0.00 C ATOM 2157 O ASN B 59 9.018 5.063 -6.360 1.00 0.00 O ATOM 2158 CB ASN B 59 9.140 8.318 -6.739 1.00 0.00 C ATOM 2159 CG ASN B 59 9.975 9.267 -7.577 1.00 0.00 C ATOM 2160 OD1 ASN B 59 11.186 9.093 -7.711 1.00 0.00 O ATOM 2161 ND2 ASN B 59 9.338 10.275 -8.143 1.00 0.00 N ATOM 0 H ASN B 59 7.088 8.388 -8.180 1.00 0.00 H new ATOM 0 HA ASN B 59 9.434 6.774 -8.185 1.00 0.00 H new ATOM 0 HB2 ASN B 59 8.290 8.860 -6.324 1.00 0.00 H new ATOM 0 HB3 ASN B 59 9.735 7.965 -5.897 1.00 0.00 H new ATOM 0 HD21 ASN B 59 9.851 10.945 -8.716 1.00 0.00 H new ATOM 0 HD22 ASN B 59 8.333 10.384 -8.007 1.00 0.00 H new ATOM 2168 N PHE B 60 7.030 6.078 -6.045 1.00 0.00 N ATOM 2169 CA PHE B 60 6.486 5.047 -5.165 1.00 0.00 C ATOM 2170 C PHE B 60 6.479 3.702 -5.877 1.00 0.00 C ATOM 2171 O PHE B 60 7.028 2.721 -5.382 1.00 0.00 O ATOM 2172 CB PHE B 60 5.058 5.422 -4.759 1.00 0.00 C ATOM 2173 CG PHE B 60 4.459 4.543 -3.695 1.00 0.00 C ATOM 2174 CD1 PHE B 60 5.002 4.497 -2.422 1.00 0.00 C ATOM 2175 CD2 PHE B 60 3.341 3.771 -3.973 1.00 0.00 C ATOM 2176 CE1 PHE B 60 4.443 3.695 -1.446 1.00 0.00 C ATOM 2177 CE2 PHE B 60 2.778 2.969 -3.001 1.00 0.00 C ATOM 2178 CZ PHE B 60 3.329 2.931 -1.737 1.00 0.00 C ATOM 0 H PHE B 60 6.399 6.863 -6.204 1.00 0.00 H new ATOM 0 HA PHE B 60 7.110 4.973 -4.275 1.00 0.00 H new ATOM 0 HB2 PHE B 60 5.054 6.453 -4.405 1.00 0.00 H new ATOM 0 HB3 PHE B 60 4.421 5.386 -5.643 1.00 0.00 H new ATOM 0 HD1 PHE B 60 5.871 5.094 -2.190 1.00 0.00 H new ATOM 0 HD2 PHE B 60 2.906 3.798 -4.961 1.00 0.00 H new ATOM 0 HE1 PHE B 60 4.876 3.665 -0.457 1.00 0.00 H new ATOM 0 HE2 PHE B 60 1.907 2.372 -3.230 1.00 0.00 H new ATOM 0 HZ PHE B 60 2.890 2.304 -0.975 1.00 0.00 H new ATOM 2188 N THR B 61 5.869 3.681 -7.053 1.00 0.00 N ATOM 2189 CA THR B 61 5.762 2.467 -7.843 1.00 0.00 C ATOM 2190 C THR B 61 7.135 1.965 -8.293 1.00 0.00 C ATOM 2191 O THR B 61 7.427 0.765 -8.208 1.00 0.00 O ATOM 2192 CB THR B 61 4.853 2.685 -9.072 1.00 0.00 C ATOM 2193 OG1 THR B 61 5.260 3.850 -9.798 1.00 0.00 O ATOM 2194 CG2 THR B 61 3.399 2.830 -8.644 1.00 0.00 C ATOM 0 H THR B 61 5.438 4.499 -7.483 1.00 0.00 H new ATOM 0 HA THR B 61 5.314 1.707 -7.203 1.00 0.00 H new ATOM 0 HB THR B 61 4.946 1.813 -9.719 1.00 0.00 H new ATOM 0 HG1 THR B 61 4.856 4.646 -9.393 1.00 0.00 H new ATOM 0 HG21 THR B 61 2.774 2.983 -9.524 1.00 0.00 H new ATOM 0 HG22 THR B 61 3.080 1.926 -8.125 1.00 0.00 H new ATOM 0 HG23 THR B 61 3.300 3.685 -7.976 1.00 0.00 H new ATOM 2202 N LYS B 62 7.977 2.886 -8.761 1.00 0.00 N ATOM 2203 CA LYS B 62 9.325 2.538 -9.201 1.00 0.00 C ATOM 2204 C LYS B 62 10.117 1.888 -8.068 1.00 0.00 C ATOM 2205 O LYS B 62 10.651 0.790 -8.221 1.00 0.00 O ATOM 2206 CB LYS B 62 10.056 3.785 -9.695 1.00 0.00 C ATOM 2207 CG LYS B 62 11.076 3.503 -10.785 1.00 0.00 C ATOM 2208 CD LYS B 62 11.771 4.776 -11.243 1.00 0.00 C ATOM 2209 CE LYS B 62 10.777 5.873 -11.601 1.00 0.00 C ATOM 2210 NZ LYS B 62 9.794 5.443 -12.634 1.00 0.00 N ATOM 0 H LYS B 62 7.749 3.877 -8.845 1.00 0.00 H new ATOM 0 HA LYS B 62 9.241 1.823 -10.019 1.00 0.00 H new ATOM 0 HB2 LYS B 62 9.324 4.500 -10.071 1.00 0.00 H new ATOM 0 HB3 LYS B 62 10.560 4.258 -8.852 1.00 0.00 H new ATOM 0 HG2 LYS B 62 11.818 2.795 -10.416 1.00 0.00 H new ATOM 0 HG3 LYS B 62 10.581 3.032 -11.634 1.00 0.00 H new ATOM 0 HD2 LYS B 62 12.434 5.131 -10.454 1.00 0.00 H new ATOM 0 HD3 LYS B 62 12.396 4.556 -12.109 1.00 0.00 H new ATOM 0 HE2 LYS B 62 10.242 6.181 -10.702 1.00 0.00 H new ATOM 0 HE3 LYS B 62 11.320 6.746 -11.963 1.00 0.00 H new ATOM 0 HZ1 LYS B 62 9.265 6.271 -12.975 1.00 0.00 H new ATOM 0 HZ2 LYS B 62 10.297 5.001 -13.430 1.00 0.00 H new ATOM 0 HZ3 LYS B 62 9.132 4.756 -12.219 1.00 0.00 H new ATOM 2224 N ALA B 63 10.168 2.568 -6.925 1.00 0.00 N ATOM 2225 CA ALA B 63 10.925 2.085 -5.775 1.00 0.00 C ATOM 2226 C ALA B 63 10.358 0.772 -5.255 1.00 0.00 C ATOM 2227 O ALA B 63 11.109 -0.122 -4.870 1.00 0.00 O ATOM 2228 CB ALA B 63 10.937 3.129 -4.669 1.00 0.00 C ATOM 0 H ALA B 63 9.693 3.457 -6.771 1.00 0.00 H new ATOM 0 HA ALA B 63 11.950 1.906 -6.101 1.00 0.00 H new ATOM 0 HB1 ALA B 63 11.506 2.752 -3.819 1.00 0.00 H new ATOM 0 HB2 ALA B 63 11.399 4.045 -5.038 1.00 0.00 H new ATOM 0 HB3 ALA B 63 9.914 3.340 -4.356 1.00 0.00 H new ATOM 2234 N LEU B 64 9.032 0.665 -5.254 1.00 0.00 N ATOM 2235 CA LEU B 64 8.345 -0.550 -4.824 1.00 0.00 C ATOM 2236 C LEU B 64 8.904 -1.781 -5.524 1.00 0.00 C ATOM 2237 O LEU B 64 9.405 -2.700 -4.874 1.00 0.00 O ATOM 2238 CB LEU B 64 6.847 -0.444 -5.119 1.00 0.00 C ATOM 2239 CG LEU B 64 5.946 -0.252 -3.900 1.00 0.00 C ATOM 2240 CD1 LEU B 64 4.548 0.137 -4.339 1.00 0.00 C ATOM 2241 CD2 LEU B 64 5.896 -1.520 -3.063 1.00 0.00 C ATOM 0 H LEU B 64 8.406 1.414 -5.550 1.00 0.00 H new ATOM 0 HA LEU B 64 8.505 -0.655 -3.751 1.00 0.00 H new ATOM 0 HB2 LEU B 64 6.688 0.391 -5.801 1.00 0.00 H new ATOM 0 HB3 LEU B 64 6.533 -1.347 -5.642 1.00 0.00 H new ATOM 0 HG LEU B 64 6.362 0.549 -3.289 1.00 0.00 H new ATOM 0 HD11 LEU B 64 3.915 0.271 -3.462 1.00 0.00 H new ATOM 0 HD12 LEU B 64 4.590 1.069 -4.902 1.00 0.00 H new ATOM 0 HD13 LEU B 64 4.133 -0.649 -4.969 1.00 0.00 H new ATOM 0 HD21 LEU B 64 5.249 -1.361 -2.200 1.00 0.00 H new ATOM 0 HD22 LEU B 64 5.503 -2.339 -3.666 1.00 0.00 H new ATOM 0 HD23 LEU B 64 6.900 -1.771 -2.722 1.00 0.00 H new ATOM 2253 N LYS B 65 8.840 -1.778 -6.851 1.00 0.00 N ATOM 2254 CA LYS B 65 9.238 -2.942 -7.632 1.00 0.00 C ATOM 2255 C LYS B 65 10.731 -3.220 -7.502 1.00 0.00 C ATOM 2256 O LYS B 65 11.147 -4.377 -7.444 1.00 0.00 O ATOM 2257 CB LYS B 65 8.839 -2.756 -9.098 1.00 0.00 C ATOM 2258 CG LYS B 65 7.342 -2.570 -9.273 1.00 0.00 C ATOM 2259 CD LYS B 65 6.913 -2.612 -10.729 1.00 0.00 C ATOM 2260 CE LYS B 65 7.506 -1.469 -11.533 1.00 0.00 C ATOM 2261 NZ LYS B 65 6.934 -1.415 -12.903 1.00 0.00 N ATOM 0 H LYS B 65 8.517 -0.985 -7.406 1.00 0.00 H new ATOM 0 HA LYS B 65 8.713 -3.811 -7.236 1.00 0.00 H new ATOM 0 HB2 LYS B 65 9.360 -1.890 -9.506 1.00 0.00 H new ATOM 0 HB3 LYS B 65 9.164 -3.623 -9.673 1.00 0.00 H new ATOM 0 HG2 LYS B 65 6.816 -3.349 -8.721 1.00 0.00 H new ATOM 0 HG3 LYS B 65 7.045 -1.615 -8.838 1.00 0.00 H new ATOM 0 HD2 LYS B 65 7.219 -3.561 -11.169 1.00 0.00 H new ATOM 0 HD3 LYS B 65 5.825 -2.569 -10.787 1.00 0.00 H new ATOM 0 HE2 LYS B 65 7.317 -0.526 -11.021 1.00 0.00 H new ATOM 0 HE3 LYS B 65 8.588 -1.588 -11.593 1.00 0.00 H new ATOM 0 HZ1 LYS B 65 7.703 -1.459 -13.602 1.00 0.00 H new ATOM 0 HZ2 LYS B 65 6.292 -2.221 -13.043 1.00 0.00 H new ATOM 0 HZ3 LYS B 65 6.407 -0.527 -13.024 1.00 0.00 H new ATOM 2275 N GLN B 66 11.531 -2.164 -7.423 1.00 0.00 N ATOM 2276 CA GLN B 66 12.978 -2.318 -7.293 1.00 0.00 C ATOM 2277 C GLN B 66 13.350 -2.894 -5.927 1.00 0.00 C ATOM 2278 O GLN B 66 14.236 -3.740 -5.823 1.00 0.00 O ATOM 2279 CB GLN B 66 13.687 -0.978 -7.512 1.00 0.00 C ATOM 2280 CG GLN B 66 13.555 -0.431 -8.931 1.00 0.00 C ATOM 2281 CD GLN B 66 14.270 -1.282 -9.969 1.00 0.00 C ATOM 2282 OE1 GLN B 66 14.405 -2.495 -9.817 1.00 0.00 O ATOM 2283 NE2 GLN B 66 14.732 -0.650 -11.036 1.00 0.00 N ATOM 0 H GLN B 66 11.207 -1.197 -7.446 1.00 0.00 H new ATOM 0 HA GLN B 66 13.308 -3.018 -8.061 1.00 0.00 H new ATOM 0 HB2 GLN B 66 13.283 -0.246 -6.812 1.00 0.00 H new ATOM 0 HB3 GLN B 66 14.745 -1.095 -7.276 1.00 0.00 H new ATOM 0 HG2 GLN B 66 12.499 -0.364 -9.191 1.00 0.00 H new ATOM 0 HG3 GLN B 66 13.956 0.582 -8.962 1.00 0.00 H new ATOM 0 HE21 GLN B 66 14.602 0.357 -11.128 1.00 0.00 H new ATOM 0 HE22 GLN B 66 15.218 -1.170 -11.766 1.00 0.00 H new ATOM 2292 N SER B 67 12.655 -2.449 -4.886 1.00 0.00 N ATOM 2293 CA SER B 67 12.927 -2.913 -3.531 1.00 0.00 C ATOM 2294 C SER B 67 12.535 -4.381 -3.374 1.00 0.00 C ATOM 2295 O SER B 67 13.188 -5.137 -2.653 1.00 0.00 O ATOM 2296 CB SER B 67 12.176 -2.054 -2.514 1.00 0.00 C ATOM 2297 OG SER B 67 12.497 -0.682 -2.682 1.00 0.00 O ATOM 0 H SER B 67 11.899 -1.768 -4.955 1.00 0.00 H new ATOM 0 HA SER B 67 13.997 -2.821 -3.346 1.00 0.00 H new ATOM 0 HB2 SER B 67 11.102 -2.198 -2.631 1.00 0.00 H new ATOM 0 HB3 SER B 67 12.432 -2.371 -1.503 1.00 0.00 H new ATOM 0 HG SER B 67 12.248 -0.396 -3.586 1.00 0.00 H new ATOM 2303 N VAL B 68 11.469 -4.780 -4.061 1.00 0.00 N ATOM 2304 CA VAL B 68 11.034 -6.169 -4.052 1.00 0.00 C ATOM 2305 C VAL B 68 12.072 -7.058 -4.734 1.00 0.00 C ATOM 2306 O VAL B 68 12.395 -8.144 -4.247 1.00 0.00 O ATOM 2307 CB VAL B 68 9.662 -6.336 -4.744 1.00 0.00 C ATOM 2308 CG1 VAL B 68 9.283 -7.803 -4.851 1.00 0.00 C ATOM 2309 CG2 VAL B 68 8.589 -5.565 -3.990 1.00 0.00 C ATOM 0 H VAL B 68 10.892 -4.160 -4.630 1.00 0.00 H new ATOM 0 HA VAL B 68 10.929 -6.474 -3.011 1.00 0.00 H new ATOM 0 HB VAL B 68 9.740 -5.930 -5.753 1.00 0.00 H new ATOM 0 HG11 VAL B 68 8.314 -7.894 -5.341 1.00 0.00 H new ATOM 0 HG12 VAL B 68 10.036 -8.332 -5.435 1.00 0.00 H new ATOM 0 HG13 VAL B 68 9.227 -8.238 -3.853 1.00 0.00 H new ATOM 0 HG21 VAL B 68 7.629 -5.693 -4.491 1.00 0.00 H new ATOM 0 HG22 VAL B 68 8.519 -5.942 -2.970 1.00 0.00 H new ATOM 0 HG23 VAL B 68 8.849 -4.507 -3.969 1.00 0.00 H new ATOM 2319 N LEU B 69 12.613 -6.574 -5.845 1.00 0.00 N ATOM 2320 CA LEU B 69 13.628 -7.310 -6.589 1.00 0.00 C ATOM 2321 C LEU B 69 14.924 -7.408 -5.789 1.00 0.00 C ATOM 2322 O LEU B 69 15.631 -8.411 -5.861 1.00 0.00 O ATOM 2323 CB LEU B 69 13.892 -6.644 -7.942 1.00 0.00 C ATOM 2324 CG LEU B 69 12.704 -6.640 -8.905 1.00 0.00 C ATOM 2325 CD1 LEU B 69 13.056 -5.884 -10.176 1.00 0.00 C ATOM 2326 CD2 LEU B 69 12.280 -8.066 -9.233 1.00 0.00 C ATOM 0 H LEU B 69 12.365 -5.672 -6.252 1.00 0.00 H new ATOM 0 HA LEU B 69 13.253 -8.319 -6.763 1.00 0.00 H new ATOM 0 HB2 LEU B 69 14.202 -5.614 -7.768 1.00 0.00 H new ATOM 0 HB3 LEU B 69 14.728 -7.152 -8.423 1.00 0.00 H new ATOM 0 HG LEU B 69 11.868 -6.134 -8.422 1.00 0.00 H new ATOM 0 HD11 LEU B 69 12.201 -5.890 -10.852 1.00 0.00 H new ATOM 0 HD12 LEU B 69 13.315 -4.855 -9.927 1.00 0.00 H new ATOM 0 HD13 LEU B 69 13.905 -6.365 -10.662 1.00 0.00 H new ATOM 0 HD21 LEU B 69 11.433 -8.045 -9.919 1.00 0.00 H new ATOM 0 HD22 LEU B 69 13.112 -8.595 -9.699 1.00 0.00 H new ATOM 0 HD23 LEU B 69 11.991 -8.580 -8.316 1.00 0.00 H new ATOM 2338 N GLU B 70 15.227 -6.371 -5.019 1.00 0.00 N ATOM 2339 CA GLU B 70 16.434 -6.356 -4.199 1.00 0.00 C ATOM 2340 C GLU B 70 16.240 -7.183 -2.924 1.00 0.00 C ATOM 2341 O GLU B 70 17.201 -7.533 -2.241 1.00 0.00 O ATOM 2342 CB GLU B 70 16.834 -4.916 -3.861 1.00 0.00 C ATOM 2343 CG GLU B 70 18.124 -4.811 -3.062 1.00 0.00 C ATOM 2344 CD GLU B 70 18.652 -3.399 -2.978 1.00 0.00 C ATOM 2345 OE1 GLU B 70 17.961 -2.527 -2.419 1.00 0.00 O ATOM 2346 OE2 GLU B 70 19.774 -3.152 -3.472 1.00 0.00 O ATOM 0 H GLU B 70 14.655 -5.530 -4.944 1.00 0.00 H new ATOM 0 HA GLU B 70 17.242 -6.811 -4.772 1.00 0.00 H new ATOM 0 HB2 GLU B 70 16.944 -4.352 -4.787 1.00 0.00 H new ATOM 0 HB3 GLU B 70 16.028 -4.448 -3.296 1.00 0.00 H new ATOM 0 HG2 GLU B 70 17.953 -5.190 -2.054 1.00 0.00 H new ATOM 0 HG3 GLU B 70 18.881 -5.450 -3.518 1.00 0.00 H new ATOM 2353 N HIS B 71 14.992 -7.536 -2.629 1.00 0.00 N ATOM 2354 CA HIS B 71 14.684 -8.352 -1.457 1.00 0.00 C ATOM 2355 C HIS B 71 14.966 -9.828 -1.751 1.00 0.00 C ATOM 2356 O HIS B 71 14.598 -10.713 -0.980 1.00 0.00 O ATOM 2357 CB HIS B 71 13.217 -8.158 -1.041 1.00 0.00 C ATOM 2358 CG HIS B 71 12.914 -8.608 0.359 1.00 0.00 C ATOM 2359 ND1 HIS B 71 12.387 -9.846 0.664 1.00 0.00 N ATOM 2360 CD2 HIS B 71 13.063 -7.966 1.545 1.00 0.00 C ATOM 2361 CE1 HIS B 71 12.225 -9.944 1.971 1.00 0.00 C ATOM 2362 NE2 HIS B 71 12.627 -8.819 2.526 1.00 0.00 N ATOM 0 H HIS B 71 14.178 -7.271 -3.184 1.00 0.00 H new ATOM 0 HA HIS B 71 15.322 -8.034 -0.632 1.00 0.00 H new ATOM 0 HB2 HIS B 71 12.960 -7.103 -1.136 1.00 0.00 H new ATOM 0 HB3 HIS B 71 12.578 -8.706 -1.734 1.00 0.00 H new ATOM 0 HD2 HIS B 71 13.452 -6.969 1.689 1.00 0.00 H new ATOM 0 HE1 HIS B 71 11.830 -10.801 2.496 1.00 0.00 H new ATOM 0 HE2 HIS B 71 12.616 -8.615 3.525 1.00 0.00 H new ATOM 2371 N HIS B 72 15.636 -10.080 -2.871 1.00 0.00 N ATOM 2372 CA HIS B 72 16.005 -11.435 -3.263 1.00 0.00 C ATOM 2373 C HIS B 72 17.012 -12.042 -2.293 1.00 0.00 C ATOM 2374 O HIS B 72 17.023 -13.256 -2.076 1.00 0.00 O ATOM 2375 CB HIS B 72 16.592 -11.452 -4.679 1.00 0.00 C ATOM 2376 CG HIS B 72 15.569 -11.580 -5.765 1.00 0.00 C ATOM 2377 ND1 HIS B 72 15.790 -11.174 -7.061 1.00 0.00 N ATOM 2378 CD2 HIS B 72 14.324 -12.105 -5.747 1.00 0.00 C ATOM 2379 CE1 HIS B 72 14.727 -11.449 -7.792 1.00 0.00 C ATOM 2380 NE2 HIS B 72 13.821 -12.018 -7.020 1.00 0.00 N ATOM 0 H HIS B 72 15.936 -9.358 -3.527 1.00 0.00 H new ATOM 0 HA HIS B 72 15.095 -12.034 -3.242 1.00 0.00 H new ATOM 0 HB2 HIS B 72 17.160 -10.535 -4.836 1.00 0.00 H new ATOM 0 HB3 HIS B 72 17.296 -12.280 -4.759 1.00 0.00 H new ATOM 0 HD2 HIS B 72 13.817 -12.518 -4.887 1.00 0.00 H new ATOM 0 HE1 HIS B 72 14.617 -11.243 -8.846 1.00 0.00 H new ATOM 0 HE2 HIS B 72 12.901 -12.339 -7.320 1.00 0.00 H new ATOM 2389 N HIS B 73 17.861 -11.202 -1.715 1.00 0.00 N ATOM 2390 CA HIS B 73 18.905 -11.679 -0.823 1.00 0.00 C ATOM 2391 C HIS B 73 19.320 -10.582 0.147 1.00 0.00 C ATOM 2392 O HIS B 73 19.531 -9.440 -0.254 1.00 0.00 O ATOM 2393 CB HIS B 73 20.118 -12.138 -1.641 1.00 0.00 C ATOM 2394 CG HIS B 73 21.132 -12.906 -0.852 1.00 0.00 C ATOM 2395 ND1 HIS B 73 22.396 -12.435 -0.580 1.00 0.00 N ATOM 2396 CD2 HIS B 73 21.062 -14.134 -0.289 1.00 0.00 C ATOM 2397 CE1 HIS B 73 23.059 -13.338 0.112 1.00 0.00 C ATOM 2398 NE2 HIS B 73 22.274 -14.382 0.305 1.00 0.00 N ATOM 0 H HIS B 73 17.846 -10.191 -1.848 1.00 0.00 H new ATOM 0 HA HIS B 73 18.517 -12.521 -0.250 1.00 0.00 H new ATOM 0 HB2 HIS B 73 19.772 -12.758 -2.468 1.00 0.00 H new ATOM 0 HB3 HIS B 73 20.600 -11.263 -2.078 1.00 0.00 H new ATOM 0 HD1 HIS B 73 22.762 -11.528 -0.869 1.00 0.00 H new ATOM 0 HD2 HIS B 73 20.210 -14.797 -0.304 1.00 0.00 H new ATOM 0 HE1 HIS B 73 24.076 -13.241 0.463 1.00 0.00 H new ATOM 2407 N HIS B 74 19.410 -10.926 1.422 1.00 0.00 N ATOM 2408 CA HIS B 74 19.943 -10.009 2.418 1.00 0.00 C ATOM 2409 C HIS B 74 21.452 -9.940 2.284 1.00 0.00 C ATOM 2410 O HIS B 74 22.108 -10.976 2.173 1.00 0.00 O ATOM 2411 CB HIS B 74 19.562 -10.444 3.837 1.00 0.00 C ATOM 2412 CG HIS B 74 18.213 -9.967 4.277 1.00 0.00 C ATOM 2413 ND1 HIS B 74 17.123 -10.797 4.406 1.00 0.00 N ATOM 2414 CD2 HIS B 74 17.787 -8.732 4.632 1.00 0.00 C ATOM 2415 CE1 HIS B 74 16.086 -10.095 4.823 1.00 0.00 C ATOM 2416 NE2 HIS B 74 16.460 -8.839 4.967 1.00 0.00 N ATOM 0 H HIS B 74 19.121 -11.832 1.792 1.00 0.00 H new ATOM 0 HA HIS B 74 19.512 -9.023 2.244 1.00 0.00 H new ATOM 0 HB2 HIS B 74 19.587 -11.532 3.892 1.00 0.00 H new ATOM 0 HB3 HIS B 74 20.313 -10.072 4.534 1.00 0.00 H new ATOM 0 HD2 HIS B 74 18.381 -7.830 4.649 1.00 0.00 H new ATOM 0 HE1 HIS B 74 15.097 -10.484 5.014 1.00 0.00 H new ATOM 0 HE2 HIS B 74 15.862 -8.073 5.276 1.00 0.00 H new ATOM 2425 N HIS B 75 21.984 -8.716 2.285 1.00 0.00 N ATOM 2426 CA HIS B 75 23.412 -8.468 2.077 1.00 0.00 C ATOM 2427 C HIS B 75 23.795 -8.717 0.621 1.00 0.00 C ATOM 2428 O HIS B 75 23.636 -9.821 0.101 1.00 0.00 O ATOM 2429 CB HIS B 75 24.281 -9.328 3.014 1.00 0.00 C ATOM 2430 CG HIS B 75 25.757 -9.125 2.837 1.00 0.00 C ATOM 2431 ND1 HIS B 75 26.539 -9.915 2.021 1.00 0.00 N ATOM 2432 CD2 HIS B 75 26.596 -8.221 3.391 1.00 0.00 C ATOM 2433 CE1 HIS B 75 27.790 -9.505 2.082 1.00 0.00 C ATOM 2434 NE2 HIS B 75 27.854 -8.478 2.907 1.00 0.00 N ATOM 0 H HIS B 75 21.436 -7.868 2.430 1.00 0.00 H new ATOM 0 HA HIS B 75 23.600 -7.421 2.316 1.00 0.00 H new ATOM 0 HB2 HIS B 75 24.015 -9.103 4.047 1.00 0.00 H new ATOM 0 HB3 HIS B 75 24.047 -10.379 2.846 1.00 0.00 H new ATOM 0 HD2 HIS B 75 26.326 -7.440 4.087 1.00 0.00 H new ATOM 0 HE1 HIS B 75 28.622 -9.937 1.547 1.00 0.00 H new ATOM 0 HE2 HIS B 75 28.700 -7.960 3.146 1.00 0.00 H new ATOM 2443 N HIS B 76 24.290 -7.680 -0.036 1.00 0.00 N ATOM 2444 CA HIS B 76 24.750 -7.804 -1.410 1.00 0.00 C ATOM 2445 C HIS B 76 26.090 -8.519 -1.454 1.00 0.00 C ATOM 2446 O HIS B 76 27.110 -7.880 -1.140 1.00 0.00 O ATOM 2447 CB HIS B 76 24.863 -6.435 -2.084 1.00 0.00 C ATOM 2448 CG HIS B 76 23.589 -5.960 -2.714 1.00 0.00 C ATOM 2449 ND1 HIS B 76 23.196 -6.331 -3.978 1.00 0.00 N ATOM 2450 CD2 HIS B 76 22.627 -5.125 -2.253 1.00 0.00 C ATOM 2451 CE1 HIS B 76 22.052 -5.744 -4.273 1.00 0.00 C ATOM 2452 NE2 HIS B 76 21.682 -5.005 -3.244 1.00 0.00 N ATOM 2453 OXT HIS B 76 26.115 -9.719 -1.805 1.00 0.00 O ATOM 0 H HIS B 76 24.383 -6.744 0.359 1.00 0.00 H new ATOM 0 HA HIS B 76 24.013 -8.391 -1.958 1.00 0.00 H new ATOM 0 HB2 HIS B 76 25.186 -5.703 -1.344 1.00 0.00 H new ATOM 0 HB3 HIS B 76 25.639 -6.480 -2.848 1.00 0.00 H new ATOM 0 HD2 HIS B 76 22.606 -4.643 -1.287 1.00 0.00 H new ATOM 0 HE1 HIS B 76 21.509 -5.850 -5.201 1.00 0.00 H new ATOM 0 HE2 HIS B 76 20.835 -4.439 -3.193 1.00 0.00 H new TER 2462 HIS B 76