USER MOD reduce.3.24.130724 H: found=0, std=0, add=1072, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1072 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 85 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 89 GLN : amide:sc= 0.038 X(o=0.038,f=-0.46) USER MOD Set 2.1: A 78 MET CE :methyl 160:sc= -0.0203 (180deg=-0.825) USER MOD Set 2.2: A 88 GLN : amide:sc= -1.6 K(o=-1.6,f=-5.5!) USER MOD Set 3.1: A 53 ASN : amide:sc= -0.198 K(o=-0.33,f=-3.2!) USER MOD Set 3.2: A 57 THR OG1 : rot 180:sc= -0.136 USER MOD Set 4.1: A 7 ASN : amide:sc= -2.22! C(o=-1.3!,f=-3!) USER MOD Set 4.2: A 9 SER OG : rot -174:sc= 0.94 USER MOD Set 5.1: A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.2: A 11 ASN : amide:sc= -0.198 K(o=-0.2,f=-2.6!) USER MOD Set 6.1: A 1 SER N :NH3+ 161:sc= 1.37 (180deg=0) USER MOD Set 6.2: A 130 ASN : amide:sc= 2.21 K(o=3.6,f=-10!) USER MOD Single : A 1 SER OG : rot 180:sc= 0.00108 USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 10 ASN :FLIP amide:sc= 0 F(o=-0.73,f=0) USER MOD Single : A 14 LYS NZ :NH3+ 153:sc= -0.941 (180deg=-2.02!) USER MOD Single : A 16 MET CE :methyl -163:sc= -0.0458 (180deg=-0.399) USER MOD Single : A 18 GLN : amide:sc= -1.09 K(o=-1.1,f=-4.9!) USER MOD Single : A 20 LYS NZ :NH3+ -147:sc= 1.26 (180deg=1.1) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 180:sc= -0.695 USER MOD Single : A 35 ASN : amide:sc= 0.897 K(o=0.9,f=-3.4!) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 TYR OH : rot -169:sc= 1.24 USER MOD Single : A 43 MET CE :methyl -139:sc= -2.16 (180deg=-4.01!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 140:sc= 1.23 (180deg=-0.371!) USER MOD Single : A 67 ASN :FLIP amide:sc= -1.49 F(o=-4.7!,f=-1.5) USER MOD Single : A 69 HIS : no HE2:sc= -0.858 K(o=-0.86,f=-2.3) USER MOD Single : A 70 HIS : no HD1:sc= -0.238 X(o=-0.24,f=-0.24) USER MOD Single : A 72 ASN : amide:sc= 0.471 X(o=0.47,f=0.023) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 HIS : no HD1:sc= -0.371 X(o=-0.37,f=-0.22) USER MOD Single : A 86 MET CE :methyl 167:sc= -0.229 (180deg=-0.577) USER MOD Single : A 95 HIS : no HD1:sc= -0.0857 X(o=-0.086,f=-0.059) USER MOD Single : A 99 LYS NZ :NH3+ -169:sc= -0.0157 (180deg=-0.152) USER MOD Single : A 100 SER OG : rot 79:sc= 0.788 USER MOD Single : A 104 ASN : amide:sc= -0.0471 K(o=-0.047,f=-1.8!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 MET CE :methyl -162:sc= -0.161 (180deg=-0.666) USER MOD Single : A 110 LYS NZ :NH3+ -161:sc= 1.26 (180deg=0.731) USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 MET CE :methyl -132:sc= -0.959 (180deg=-4.99!) USER MOD Single : A 119 LYS NZ :NH3+ 167:sc= 0.139 (180deg=0.0108) USER MOD Single : A 120 LYS NZ :NH3+ -176:sc= 1.2 (180deg=1.16) USER MOD Single : A 123 HIS : no HD1:sc= -0.288 X(o=-0.29,f=0) USER MOD Single : A 124 LYS NZ :NH3+ 159:sc= 0.94 (180deg=0.646) USER MOD Single : A 126 ASN :FLIP amide:sc= 0 F(o=-1.5,f=0) USER MOD Single : A 131 MET CE :methyl -166:sc= -0.0607 (180deg=-0.447) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -9.043 -17.739 0.508 1.00 0.00 N ATOM 2 CA SER A 1 -8.425 -16.904 1.558 1.00 0.00 C ATOM 3 C SER A 1 -8.391 -15.442 1.115 1.00 0.00 C ATOM 4 O SER A 1 -7.513 -15.039 0.354 1.00 0.00 O ATOM 5 CB SER A 1 -7.008 -17.398 1.839 1.00 0.00 C ATOM 6 OG SER A 1 -6.974 -18.813 1.942 1.00 0.00 O ATOM 0 H1 SER A 1 -8.781 -18.734 0.657 1.00 0.00 H new ATOM 0 H2 SER A 1 -10.078 -17.643 0.552 1.00 0.00 H new ATOM 0 H3 SER A 1 -8.706 -17.429 -0.426 1.00 0.00 H new ATOM 0 HA SER A 1 -9.018 -16.980 2.469 1.00 0.00 H new ATOM 0 HB2 SER A 1 -6.340 -17.072 1.042 1.00 0.00 H new ATOM 0 HB3 SER A 1 -6.641 -16.953 2.764 1.00 0.00 H new ATOM 0 HG SER A 1 -6.056 -19.106 2.120 1.00 0.00 H new ATOM 14 N PRO A 2 -9.360 -14.634 1.565 1.00 0.00 N ATOM 15 CA PRO A 2 -9.464 -13.235 1.175 1.00 0.00 C ATOM 16 C PRO A 2 -8.681 -12.294 2.090 1.00 0.00 C ATOM 17 O PRO A 2 -8.781 -11.079 1.953 1.00 0.00 O ATOM 18 CB PRO A 2 -10.963 -12.979 1.291 1.00 0.00 C ATOM 19 CG PRO A 2 -11.412 -13.853 2.418 1.00 0.00 C ATOM 20 CD PRO A 2 -10.452 -15.022 2.479 1.00 0.00 C ATOM 0 HA PRO A 2 -9.045 -13.049 0.186 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -11.170 -11.929 1.497 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -11.480 -13.230 0.365 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -11.409 -13.302 3.358 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -12.432 -14.200 2.255 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -10.085 -15.185 3.492 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -10.930 -15.948 2.160 1.00 0.00 H new ATOM 28 N GLU A 3 -7.919 -12.862 3.025 1.00 0.00 N ATOM 29 CA GLU A 3 -7.147 -12.072 3.993 1.00 0.00 C ATOM 30 C GLU A 3 -6.284 -11.011 3.308 1.00 0.00 C ATOM 31 O GLU A 3 -6.590 -9.823 3.360 1.00 0.00 O ATOM 32 CB GLU A 3 -6.228 -12.983 4.819 1.00 0.00 C ATOM 33 CG GLU A 3 -6.931 -13.825 5.871 1.00 0.00 C ATOM 34 CD GLU A 3 -8.058 -14.660 5.312 1.00 0.00 C ATOM 35 OE1 GLU A 3 -7.841 -15.371 4.312 1.00 0.00 O ATOM 36 OE2 GLU A 3 -9.169 -14.603 5.874 1.00 0.00 O ATOM 0 H GLU A 3 -7.818 -13.871 3.135 1.00 0.00 H new ATOM 0 HA GLU A 3 -7.871 -11.575 4.639 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -5.696 -13.649 4.139 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -5.478 -12.365 5.312 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -6.203 -14.482 6.347 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -7.324 -13.169 6.648 1.00 0.00 H new ATOM 43 N ILE A 4 -5.200 -11.446 2.679 1.00 0.00 N ATOM 44 CA ILE A 4 -4.340 -10.539 1.944 1.00 0.00 C ATOM 45 C ILE A 4 -4.758 -10.422 0.467 1.00 0.00 C ATOM 46 O ILE A 4 -4.392 -9.470 -0.222 1.00 0.00 O ATOM 47 CB ILE A 4 -2.860 -10.979 2.092 1.00 0.00 C ATOM 48 CG1 ILE A 4 -2.414 -10.803 3.547 1.00 0.00 C ATOM 49 CG2 ILE A 4 -1.940 -10.216 1.150 1.00 0.00 C ATOM 50 CD1 ILE A 4 -2.629 -9.403 4.086 1.00 0.00 C ATOM 0 H ILE A 4 -4.899 -12.420 2.665 1.00 0.00 H new ATOM 0 HA ILE A 4 -4.447 -9.542 2.371 1.00 0.00 H new ATOM 0 HB ILE A 4 -2.792 -12.031 1.817 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -2.958 -11.511 4.172 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -1.356 -11.055 3.626 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -0.914 -10.557 1.288 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -2.246 -10.394 0.119 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -2.000 -9.150 1.367 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -2.290 -9.355 5.121 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -2.063 -8.691 3.485 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -3.689 -9.154 4.040 1.00 0.00 H new ATOM 62 N MET A 5 -5.570 -11.369 0.002 1.00 0.00 N ATOM 63 CA MET A 5 -6.012 -11.393 -1.385 1.00 0.00 C ATOM 64 C MET A 5 -6.973 -10.239 -1.652 1.00 0.00 C ATOM 65 O MET A 5 -6.993 -9.657 -2.737 1.00 0.00 O ATOM 66 CB MET A 5 -6.685 -12.735 -1.675 1.00 0.00 C ATOM 67 CG MET A 5 -7.263 -12.854 -3.077 1.00 0.00 C ATOM 68 SD MET A 5 -5.995 -12.799 -4.358 1.00 0.00 S ATOM 69 CE MET A 5 -6.998 -12.942 -5.834 1.00 0.00 C ATOM 0 H MET A 5 -5.935 -12.132 0.571 1.00 0.00 H new ATOM 0 HA MET A 5 -5.152 -11.276 -2.044 1.00 0.00 H new ATOM 0 HB2 MET A 5 -5.958 -13.533 -1.525 1.00 0.00 H new ATOM 0 HB3 MET A 5 -7.484 -12.892 -0.950 1.00 0.00 H new ATOM 0 HG2 MET A 5 -7.817 -13.789 -3.159 1.00 0.00 H new ATOM 0 HG3 MET A 5 -7.976 -12.046 -3.242 1.00 0.00 H new ATOM 0 HE1 MET A 5 -6.355 -12.923 -6.714 1.00 0.00 H new ATOM 0 HE2 MET A 5 -7.551 -13.881 -5.809 1.00 0.00 H new ATOM 0 HE3 MET A 5 -7.699 -12.109 -5.879 1.00 0.00 H new ATOM 79 N LYS A 6 -7.768 -9.915 -0.645 1.00 0.00 N ATOM 80 CA LYS A 6 -8.655 -8.772 -0.708 1.00 0.00 C ATOM 81 C LYS A 6 -8.016 -7.617 0.050 1.00 0.00 C ATOM 82 O LYS A 6 -7.971 -7.622 1.279 1.00 0.00 O ATOM 83 CB LYS A 6 -10.021 -9.128 -0.114 1.00 0.00 C ATOM 84 CG LYS A 6 -11.033 -7.997 -0.149 1.00 0.00 C ATOM 85 CD LYS A 6 -12.330 -8.417 0.518 1.00 0.00 C ATOM 86 CE LYS A 6 -13.337 -7.284 0.557 1.00 0.00 C ATOM 87 NZ LYS A 6 -14.565 -7.669 1.299 1.00 0.00 N ATOM 0 H LYS A 6 -7.815 -10.435 0.232 1.00 0.00 H new ATOM 0 HA LYS A 6 -8.812 -8.478 -1.746 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -10.429 -9.981 -0.656 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -9.883 -9.444 0.920 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -10.625 -7.122 0.356 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -11.227 -7.707 -1.182 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -12.757 -9.264 -0.019 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -12.123 -8.755 1.534 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -12.885 -6.411 1.028 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -13.601 -6.996 -0.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -15.231 -6.871 1.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -15.009 -8.487 0.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -14.315 -7.920 2.277 1.00 0.00 H new ATOM 101 N ASN A 7 -7.503 -6.646 -0.693 1.00 0.00 N ATOM 102 CA ASN A 7 -6.768 -5.535 -0.104 1.00 0.00 C ATOM 103 C ASN A 7 -7.657 -4.737 0.843 1.00 0.00 C ATOM 104 O ASN A 7 -8.607 -4.082 0.414 1.00 0.00 O ATOM 105 CB ASN A 7 -6.232 -4.613 -1.200 1.00 0.00 C ATOM 106 CG ASN A 7 -5.390 -3.480 -0.647 1.00 0.00 C ATOM 107 OD1 ASN A 7 -5.481 -2.347 -1.110 1.00 0.00 O ATOM 108 ND2 ASN A 7 -4.542 -3.779 0.327 1.00 0.00 N ATOM 0 H ASN A 7 -7.583 -6.605 -1.709 1.00 0.00 H new ATOM 0 HA ASN A 7 -5.933 -5.947 0.462 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -5.635 -5.196 -1.901 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -7.069 -4.198 -1.762 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -3.937 -3.056 0.717 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -4.494 -4.732 0.687 1.00 0.00 H new ATOM 115 N LEU A 8 -7.340 -4.796 2.131 1.00 0.00 N ATOM 116 CA LEU A 8 -8.128 -4.102 3.142 1.00 0.00 C ATOM 117 C LEU A 8 -8.061 -2.587 2.959 1.00 0.00 C ATOM 118 O LEU A 8 -8.962 -1.873 3.391 1.00 0.00 O ATOM 119 CB LEU A 8 -7.699 -4.497 4.568 1.00 0.00 C ATOM 120 CG LEU A 8 -6.293 -4.070 5.023 1.00 0.00 C ATOM 121 CD1 LEU A 8 -6.172 -4.229 6.532 1.00 0.00 C ATOM 122 CD2 LEU A 8 -5.215 -4.888 4.323 1.00 0.00 C ATOM 0 H LEU A 8 -6.544 -5.317 2.499 1.00 0.00 H new ATOM 0 HA LEU A 8 -9.164 -4.413 3.007 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -8.422 -4.077 5.267 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -7.767 -5.582 4.653 1.00 0.00 H new ATOM 0 HG LEU A 8 -6.148 -3.024 4.754 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -5.175 -3.926 6.851 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -6.916 -3.604 7.025 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -6.338 -5.272 6.802 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -4.232 -4.563 4.665 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -5.350 -5.944 4.557 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -5.290 -4.743 3.245 1.00 0.00 H new ATOM 134 N SER A 9 -7.009 -2.100 2.303 1.00 0.00 N ATOM 135 CA SER A 9 -6.906 -0.680 1.988 1.00 0.00 C ATOM 136 C SER A 9 -8.034 -0.276 1.041 1.00 0.00 C ATOM 137 O SER A 9 -8.639 0.787 1.190 1.00 0.00 O ATOM 138 CB SER A 9 -5.549 -0.375 1.347 1.00 0.00 C ATOM 139 OG SER A 9 -4.484 -0.909 2.120 1.00 0.00 O ATOM 0 H SER A 9 -6.222 -2.665 1.982 1.00 0.00 H new ATOM 0 HA SER A 9 -6.992 -0.107 2.911 1.00 0.00 H new ATOM 0 HB2 SER A 9 -5.517 -0.793 0.341 1.00 0.00 H new ATOM 0 HB3 SER A 9 -5.425 0.703 1.248 1.00 0.00 H new ATOM 0 HG SER A 9 -3.628 -0.618 1.743 1.00 0.00 H new ATOM 145 N ASN A 10 -8.321 -1.154 0.081 1.00 0.00 N ATOM 146 CA ASN A 10 -9.408 -0.947 -0.869 1.00 0.00 C ATOM 147 C ASN A 10 -10.756 -1.222 -0.203 1.00 0.00 C ATOM 148 O ASN A 10 -11.768 -0.620 -0.553 1.00 0.00 O ATOM 149 CB ASN A 10 -9.217 -1.858 -2.090 1.00 0.00 C ATOM 150 CG ASN A 10 -10.288 -1.684 -3.158 1.00 0.00 C ATOM 151 OD1 ASN A 10 -10.801 -0.473 -3.310 1.00 0.00 O flip ATOM 152 ND2 ASN A 10 -10.637 -2.637 -3.856 1.00 0.00 N flip ATOM 0 H ASN A 10 -7.808 -2.024 -0.058 1.00 0.00 H new ATOM 0 HA ASN A 10 -9.394 0.091 -1.200 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -8.241 -1.659 -2.532 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -9.211 -2.897 -1.760 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -10.219 -3.556 -3.710 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -11.344 -2.507 -4.580 1.00 0.00 H new ATOM 159 N ASN A 11 -10.750 -2.128 0.770 1.00 0.00 N ATOM 160 CA ASN A 11 -11.962 -2.470 1.510 1.00 0.00 C ATOM 161 C ASN A 11 -12.406 -1.285 2.358 1.00 0.00 C ATOM 162 O ASN A 11 -13.567 -0.883 2.318 1.00 0.00 O ATOM 163 CB ASN A 11 -11.720 -3.699 2.395 1.00 0.00 C ATOM 164 CG ASN A 11 -12.955 -4.121 3.171 1.00 0.00 C ATOM 165 OD1 ASN A 11 -13.787 -4.877 2.673 1.00 0.00 O ATOM 166 ND2 ASN A 11 -13.073 -3.653 4.405 1.00 0.00 N ATOM 0 H ASN A 11 -9.919 -2.640 1.065 1.00 0.00 H new ATOM 0 HA ASN A 11 -12.752 -2.709 0.798 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -11.387 -4.529 1.772 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -10.913 -3.483 3.095 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -13.875 -3.918 4.976 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -12.362 -3.028 4.783 1.00 0.00 H new ATOM 173 N PHE A 12 -11.481 -0.752 3.151 1.00 0.00 N ATOM 174 CA PHE A 12 -11.712 0.508 3.858 1.00 0.00 C ATOM 175 C PHE A 12 -12.076 1.644 2.888 1.00 0.00 C ATOM 176 O PHE A 12 -13.255 1.975 2.751 1.00 0.00 O ATOM 177 CB PHE A 12 -10.496 0.901 4.703 1.00 0.00 C ATOM 178 CG PHE A 12 -10.353 0.094 5.966 1.00 0.00 C ATOM 179 CD1 PHE A 12 -11.287 0.212 6.985 1.00 0.00 C ATOM 180 CD2 PHE A 12 -9.291 -0.779 6.136 1.00 0.00 C ATOM 181 CE1 PHE A 12 -11.163 -0.525 8.146 1.00 0.00 C ATOM 182 CE2 PHE A 12 -9.162 -1.519 7.297 1.00 0.00 C ATOM 183 CZ PHE A 12 -10.099 -1.392 8.302 1.00 0.00 C ATOM 0 H PHE A 12 -10.566 -1.170 3.321 1.00 0.00 H new ATOM 0 HA PHE A 12 -12.559 0.349 4.525 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -9.594 0.784 4.103 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -10.571 1.957 4.963 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -12.121 0.888 6.869 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -8.555 -0.883 5.352 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -11.897 -0.424 8.931 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -8.329 -2.196 7.417 1.00 0.00 H new ATOM 0 HZ PHE A 12 -10.001 -1.970 9.209 1.00 0.00 H new ATOM 193 N GLY A 13 -11.073 2.239 2.215 1.00 0.00 N ATOM 194 CA GLY A 13 -11.335 3.334 1.294 1.00 0.00 C ATOM 195 C GLY A 13 -12.184 4.441 1.900 1.00 0.00 C ATOM 196 O GLY A 13 -13.058 4.985 1.232 1.00 0.00 O ATOM 0 H GLY A 13 -10.091 1.977 2.297 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -10.386 3.754 0.961 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -11.838 2.943 0.410 1.00 0.00 H new ATOM 200 N LYS A 14 -11.930 4.770 3.165 1.00 0.00 N ATOM 201 CA LYS A 14 -12.721 5.771 3.874 1.00 0.00 C ATOM 202 C LYS A 14 -12.601 7.147 3.225 1.00 0.00 C ATOM 203 O LYS A 14 -13.593 7.857 3.074 1.00 0.00 O ATOM 204 CB LYS A 14 -12.282 5.848 5.338 1.00 0.00 C ATOM 205 CG LYS A 14 -12.382 4.520 6.075 1.00 0.00 C ATOM 206 CD LYS A 14 -13.821 4.040 6.210 1.00 0.00 C ATOM 207 CE LYS A 14 -14.522 4.641 7.424 1.00 0.00 C ATOM 208 NZ LYS A 14 -14.742 6.106 7.306 1.00 0.00 N ATOM 0 H LYS A 14 -11.181 4.356 3.720 1.00 0.00 H new ATOM 0 HA LYS A 14 -13.766 5.465 3.821 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -11.252 6.201 5.382 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -12.895 6.587 5.854 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -11.799 3.768 5.544 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -11.941 4.623 7.067 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -14.374 4.301 5.308 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -13.833 2.953 6.288 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -15.483 4.146 7.563 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -13.928 4.440 8.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -15.570 6.380 7.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -13.902 6.612 7.653 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -14.908 6.353 6.310 1.00 0.00 H new ATOM 222 N ALA A 15 -11.388 7.517 2.834 1.00 0.00 N ATOM 223 CA ALA A 15 -11.151 8.825 2.246 1.00 0.00 C ATOM 224 C ALA A 15 -10.085 8.761 1.158 1.00 0.00 C ATOM 225 O ALA A 15 -8.892 8.641 1.443 1.00 0.00 O ATOM 226 CB ALA A 15 -10.757 9.817 3.325 1.00 0.00 C ATOM 0 H ALA A 15 -10.557 6.931 2.914 1.00 0.00 H new ATOM 0 HA ALA A 15 -12.077 9.160 1.779 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -10.582 10.794 2.875 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -11.559 9.894 4.059 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -9.847 9.476 3.818 1.00 0.00 H new ATOM 232 N MET A 16 -10.523 8.834 -0.088 1.00 0.00 N ATOM 233 CA MET A 16 -9.619 8.774 -1.231 1.00 0.00 C ATOM 234 C MET A 16 -8.870 10.095 -1.399 1.00 0.00 C ATOM 235 O MET A 16 -7.658 10.119 -1.641 1.00 0.00 O ATOM 236 CB MET A 16 -10.413 8.457 -2.501 1.00 0.00 C ATOM 237 CG MET A 16 -9.570 8.428 -3.765 1.00 0.00 C ATOM 238 SD MET A 16 -10.549 8.170 -5.259 1.00 0.00 S ATOM 239 CE MET A 16 -11.211 6.534 -4.955 1.00 0.00 C ATOM 0 H MET A 16 -11.507 8.936 -0.338 1.00 0.00 H new ATOM 0 HA MET A 16 -8.887 7.985 -1.055 1.00 0.00 H new ATOM 0 HB2 MET A 16 -10.902 7.490 -2.380 1.00 0.00 H new ATOM 0 HB3 MET A 16 -11.202 9.200 -2.619 1.00 0.00 H new ATOM 0 HG2 MET A 16 -9.024 9.367 -3.853 1.00 0.00 H new ATOM 0 HG3 MET A 16 -8.828 7.634 -3.682 1.00 0.00 H new ATOM 0 HE1 MET A 16 -11.579 6.111 -5.890 1.00 0.00 H new ATOM 0 HE2 MET A 16 -10.427 5.894 -4.551 1.00 0.00 H new ATOM 0 HE3 MET A 16 -12.030 6.600 -4.239 1.00 0.00 H new ATOM 249 N ASP A 17 -9.599 11.191 -1.232 1.00 0.00 N ATOM 250 CA ASP A 17 -9.059 12.531 -1.446 1.00 0.00 C ATOM 251 C ASP A 17 -7.935 12.846 -0.469 1.00 0.00 C ATOM 252 O ASP A 17 -7.067 13.678 -0.746 1.00 0.00 O ATOM 253 CB ASP A 17 -10.172 13.575 -1.329 1.00 0.00 C ATOM 254 CG ASP A 17 -9.727 14.952 -1.776 1.00 0.00 C ATOM 255 OD1 ASP A 17 -9.204 15.718 -0.944 1.00 0.00 O ATOM 256 OD2 ASP A 17 -9.893 15.272 -2.969 1.00 0.00 O ATOM 0 H ASP A 17 -10.578 11.178 -0.945 1.00 0.00 H new ATOM 0 HA ASP A 17 -8.642 12.564 -2.452 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -11.025 13.260 -1.930 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -10.511 13.625 -0.294 1.00 0.00 H new ATOM 261 N GLN A 18 -7.916 12.151 0.654 1.00 0.00 N ATOM 262 CA GLN A 18 -6.943 12.457 1.691 1.00 0.00 C ATOM 263 C GLN A 18 -5.650 11.689 1.466 1.00 0.00 C ATOM 264 O GLN A 18 -4.584 12.131 1.881 1.00 0.00 O ATOM 265 CB GLN A 18 -7.512 12.202 3.089 1.00 0.00 C ATOM 266 CG GLN A 18 -8.089 13.455 3.753 1.00 0.00 C ATOM 267 CD GLN A 18 -7.033 14.491 4.104 1.00 0.00 C ATOM 268 OE1 GLN A 18 -6.008 14.610 3.436 1.00 0.00 O ATOM 269 NE2 GLN A 18 -7.283 15.250 5.158 1.00 0.00 N ATOM 0 H GLN A 18 -8.551 11.383 0.871 1.00 0.00 H new ATOM 0 HA GLN A 18 -6.713 13.521 1.628 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -8.293 11.444 3.022 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -6.725 11.794 3.724 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -8.823 13.906 3.085 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -8.619 13.165 4.660 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -8.146 15.120 5.687 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -6.613 15.965 5.442 1.00 0.00 H new ATOM 278 N CYS A 19 -5.730 10.552 0.780 1.00 0.00 N ATOM 279 CA CYS A 19 -4.520 9.863 0.348 1.00 0.00 C ATOM 280 C CYS A 19 -3.863 10.648 -0.784 1.00 0.00 C ATOM 281 O CYS A 19 -2.640 10.701 -0.889 1.00 0.00 O ATOM 282 CB CYS A 19 -4.808 8.418 -0.081 1.00 0.00 C ATOM 283 SG CYS A 19 -4.907 7.237 1.309 1.00 0.00 S ATOM 0 H CYS A 19 -6.603 10.096 0.516 1.00 0.00 H new ATOM 0 HA CYS A 19 -3.835 9.810 1.194 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -5.748 8.394 -0.633 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -4.027 8.091 -0.767 1.00 0.00 H new ATOM 288 N LYS A 20 -4.689 11.282 -1.611 1.00 0.00 N ATOM 289 CA LYS A 20 -4.204 12.157 -2.673 1.00 0.00 C ATOM 290 C LYS A 20 -3.366 13.296 -2.100 1.00 0.00 C ATOM 291 O LYS A 20 -2.214 13.480 -2.484 1.00 0.00 O ATOM 292 CB LYS A 20 -5.396 12.715 -3.458 1.00 0.00 C ATOM 293 CG LYS A 20 -5.088 13.931 -4.325 1.00 0.00 C ATOM 294 CD LYS A 20 -4.185 13.608 -5.507 1.00 0.00 C ATOM 295 CE LYS A 20 -4.009 14.833 -6.395 1.00 0.00 C ATOM 296 NZ LYS A 20 -3.207 14.541 -7.612 1.00 0.00 N ATOM 0 H LYS A 20 -5.705 11.205 -1.565 1.00 0.00 H new ATOM 0 HA LYS A 20 -3.568 11.578 -3.343 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -5.793 11.925 -4.095 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -6.183 12.981 -2.753 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -6.023 14.353 -4.694 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -4.613 14.697 -3.711 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -3.213 13.269 -5.148 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -4.613 12.790 -6.086 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -4.989 15.208 -6.690 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -3.523 15.625 -5.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -2.654 15.382 -7.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -2.562 13.748 -7.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -3.843 14.289 -8.395 1.00 0.00 H new ATOM 310 N ASP A 21 -3.948 14.039 -1.171 1.00 0.00 N ATOM 311 CA ASP A 21 -3.293 15.229 -0.622 1.00 0.00 C ATOM 312 C ASP A 21 -2.108 14.869 0.277 1.00 0.00 C ATOM 313 O ASP A 21 -1.036 15.465 0.163 1.00 0.00 O ATOM 314 CB ASP A 21 -4.298 16.090 0.151 1.00 0.00 C ATOM 315 CG ASP A 21 -3.700 17.410 0.600 1.00 0.00 C ATOM 316 OD1 ASP A 21 -3.442 18.273 -0.262 1.00 0.00 O ATOM 317 OD2 ASP A 21 -3.498 17.598 1.816 1.00 0.00 O ATOM 0 H ASP A 21 -4.869 13.845 -0.779 1.00 0.00 H new ATOM 0 HA ASP A 21 -2.906 15.801 -1.466 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -5.167 16.283 -0.478 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -4.651 15.538 1.022 1.00 0.00 H new ATOM 322 N GLU A 22 -2.293 13.881 1.146 1.00 0.00 N ATOM 323 CA GLU A 22 -1.263 13.496 2.113 1.00 0.00 C ATOM 324 C GLU A 22 -0.013 12.946 1.422 1.00 0.00 C ATOM 325 O GLU A 22 1.109 13.233 1.837 1.00 0.00 O ATOM 326 CB GLU A 22 -1.845 12.475 3.093 1.00 0.00 C ATOM 327 CG GLU A 22 -0.851 11.868 4.072 1.00 0.00 C ATOM 328 CD GLU A 22 -0.138 12.893 4.927 1.00 0.00 C ATOM 329 OE1 GLU A 22 -0.810 13.749 5.530 1.00 0.00 O ATOM 330 OE2 GLU A 22 1.102 12.809 5.031 1.00 0.00 O ATOM 0 H GLU A 22 -3.149 13.329 1.203 1.00 0.00 H new ATOM 0 HA GLU A 22 -0.952 14.385 2.662 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -2.641 12.956 3.661 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -2.304 11.669 2.521 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -1.376 11.167 4.722 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -0.111 11.293 3.515 1.00 0.00 H new ATOM 337 N LEU A 23 -0.198 12.166 0.364 1.00 0.00 N ATOM 338 CA LEU A 23 0.939 11.624 -0.379 1.00 0.00 C ATOM 339 C LEU A 23 1.463 12.646 -1.365 1.00 0.00 C ATOM 340 O LEU A 23 2.601 12.549 -1.822 1.00 0.00 O ATOM 341 CB LEU A 23 0.561 10.365 -1.161 1.00 0.00 C ATOM 342 CG LEU A 23 0.517 9.057 -0.374 1.00 0.00 C ATOM 343 CD1 LEU A 23 1.889 8.704 0.175 1.00 0.00 C ATOM 344 CD2 LEU A 23 -0.497 9.152 0.745 1.00 0.00 C ATOM 0 H LEU A 23 -1.112 11.895 0.002 1.00 0.00 H new ATOM 0 HA LEU A 23 1.702 11.373 0.358 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -0.419 10.525 -1.611 1.00 0.00 H new ATOM 0 HB3 LEU A 23 1.271 10.246 -1.979 1.00 0.00 H new ATOM 0 HG LEU A 23 0.214 8.260 -1.053 1.00 0.00 H new ATOM 0 HD11 LEU A 23 1.829 7.768 0.731 1.00 0.00 H new ATOM 0 HD12 LEU A 23 2.593 8.591 -0.650 1.00 0.00 H new ATOM 0 HD13 LEU A 23 2.231 9.499 0.838 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -0.518 8.213 1.298 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -0.221 9.963 1.418 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -1.484 9.348 0.326 1.00 0.00 H new ATOM 356 N SER A 24 0.617 13.620 -1.681 1.00 0.00 N ATOM 357 CA SER A 24 0.867 14.531 -2.786 1.00 0.00 C ATOM 358 C SER A 24 0.925 13.709 -4.068 1.00 0.00 C ATOM 359 O SER A 24 1.816 13.875 -4.904 1.00 0.00 O ATOM 360 CB SER A 24 2.169 15.303 -2.566 1.00 0.00 C ATOM 361 OG SER A 24 2.151 15.977 -1.318 1.00 0.00 O ATOM 0 H SER A 24 -0.254 13.798 -1.181 1.00 0.00 H new ATOM 0 HA SER A 24 0.067 15.268 -2.856 1.00 0.00 H new ATOM 0 HB2 SER A 24 3.015 14.616 -2.601 1.00 0.00 H new ATOM 0 HB3 SER A 24 2.310 16.024 -3.371 1.00 0.00 H new ATOM 0 HG SER A 24 2.993 16.463 -1.196 1.00 0.00 H new ATOM 367 N LEU A 25 -0.064 12.826 -4.204 1.00 0.00 N ATOM 368 CA LEU A 25 -0.076 11.814 -5.246 1.00 0.00 C ATOM 369 C LEU A 25 -0.116 12.450 -6.624 1.00 0.00 C ATOM 370 O LEU A 25 -1.040 13.199 -6.931 1.00 0.00 O ATOM 371 CB LEU A 25 -1.292 10.903 -5.063 1.00 0.00 C ATOM 372 CG LEU A 25 -1.132 9.761 -4.053 1.00 0.00 C ATOM 373 CD1 LEU A 25 -2.461 9.068 -3.854 1.00 0.00 C ATOM 374 CD2 LEU A 25 -0.084 8.770 -4.522 1.00 0.00 C ATOM 0 H LEU A 25 -0.878 12.797 -3.591 1.00 0.00 H new ATOM 0 HA LEU A 25 0.840 11.228 -5.166 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -2.138 11.517 -4.755 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -1.547 10.472 -6.031 1.00 0.00 H new ATOM 0 HG LEU A 25 -0.800 10.178 -3.102 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -2.344 8.257 -3.136 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -3.192 9.784 -3.477 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -2.806 8.663 -4.805 1.00 0.00 H new ATOM 0 HD21 LEU A 25 0.012 7.969 -3.790 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -0.384 8.350 -5.482 1.00 0.00 H new ATOM 0 HD23 LEU A 25 0.874 9.278 -4.632 1.00 0.00 H new ATOM 386 N PRO A 26 0.878 12.160 -7.475 1.00 0.00 N ATOM 387 CA PRO A 26 0.895 12.658 -8.847 1.00 0.00 C ATOM 388 C PRO A 26 -0.309 12.138 -9.615 1.00 0.00 C ATOM 389 O PRO A 26 -0.802 11.040 -9.332 1.00 0.00 O ATOM 390 CB PRO A 26 2.191 12.092 -9.441 1.00 0.00 C ATOM 391 CG PRO A 26 3.014 11.674 -8.272 1.00 0.00 C ATOM 392 CD PRO A 26 2.042 11.310 -7.186 1.00 0.00 C ATOM 0 HA PRO A 26 0.853 13.746 -8.896 1.00 0.00 H new ATOM 0 HB2 PRO A 26 1.985 11.247 -10.099 1.00 0.00 H new ATOM 0 HB3 PRO A 26 2.710 12.842 -10.038 1.00 0.00 H new ATOM 0 HG2 PRO A 26 3.650 10.826 -8.526 1.00 0.00 H new ATOM 0 HG3 PRO A 26 3.673 12.481 -7.951 1.00 0.00 H new ATOM 0 HD2 PRO A 26 1.784 10.251 -7.215 1.00 0.00 H new ATOM 0 HD3 PRO A 26 2.451 11.511 -6.196 1.00 0.00 H new ATOM 400 N ASP A 27 -0.786 12.913 -10.581 1.00 0.00 N ATOM 401 CA ASP A 27 -1.990 12.550 -11.322 1.00 0.00 C ATOM 402 C ASP A 27 -1.809 11.213 -12.038 1.00 0.00 C ATOM 403 O ASP A 27 -2.732 10.395 -12.090 1.00 0.00 O ATOM 404 CB ASP A 27 -2.356 13.646 -12.331 1.00 0.00 C ATOM 405 CG ASP A 27 -1.332 13.806 -13.440 1.00 0.00 C ATOM 406 OD1 ASP A 27 -0.161 14.121 -13.139 1.00 0.00 O ATOM 407 OD2 ASP A 27 -1.695 13.623 -14.622 1.00 0.00 O ATOM 0 H ASP A 27 -0.360 13.794 -10.870 1.00 0.00 H new ATOM 0 HA ASP A 27 -2.806 12.448 -10.606 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -3.326 13.415 -12.772 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -2.462 14.594 -11.804 1.00 0.00 H new ATOM 412 N SER A 28 -0.595 10.965 -12.508 1.00 0.00 N ATOM 413 CA SER A 28 -0.283 9.727 -13.199 1.00 0.00 C ATOM 414 C SER A 28 -0.313 8.552 -12.229 1.00 0.00 C ATOM 415 O SER A 28 -0.805 7.473 -12.557 1.00 0.00 O ATOM 416 CB SER A 28 1.094 9.830 -13.856 1.00 0.00 C ATOM 417 OG SER A 28 1.177 10.977 -14.685 1.00 0.00 O ATOM 0 H SER A 28 0.191 11.609 -12.422 1.00 0.00 H new ATOM 0 HA SER A 28 -1.035 9.559 -13.970 1.00 0.00 H new ATOM 0 HB2 SER A 28 1.865 9.876 -13.087 1.00 0.00 H new ATOM 0 HB3 SER A 28 1.287 8.935 -14.447 1.00 0.00 H new ATOM 0 HG SER A 28 2.067 11.022 -15.093 1.00 0.00 H new ATOM 423 N VAL A 29 0.193 8.778 -11.021 1.00 0.00 N ATOM 424 CA VAL A 29 0.277 7.722 -10.034 1.00 0.00 C ATOM 425 C VAL A 29 -1.083 7.395 -9.444 1.00 0.00 C ATOM 426 O VAL A 29 -1.488 6.242 -9.464 1.00 0.00 O ATOM 427 CB VAL A 29 1.249 8.067 -8.900 1.00 0.00 C ATOM 428 CG1 VAL A 29 1.281 6.935 -7.883 1.00 0.00 C ATOM 429 CG2 VAL A 29 2.635 8.343 -9.461 1.00 0.00 C ATOM 0 H VAL A 29 0.548 9.681 -10.708 1.00 0.00 H new ATOM 0 HA VAL A 29 0.656 6.847 -10.563 1.00 0.00 H new ATOM 0 HB VAL A 29 0.907 8.970 -8.395 1.00 0.00 H new ATOM 0 HG11 VAL A 29 1.974 7.187 -7.080 1.00 0.00 H new ATOM 0 HG12 VAL A 29 0.283 6.789 -7.469 1.00 0.00 H new ATOM 0 HG13 VAL A 29 1.609 6.017 -8.371 1.00 0.00 H new ATOM 0 HG21 VAL A 29 3.316 8.587 -8.645 1.00 0.00 H new ATOM 0 HG22 VAL A 29 2.998 7.459 -9.985 1.00 0.00 H new ATOM 0 HG23 VAL A 29 2.586 9.182 -10.156 1.00 0.00 H new ATOM 439 N VAL A 30 -1.798 8.402 -8.939 1.00 0.00 N ATOM 440 CA VAL A 30 -3.077 8.156 -8.293 1.00 0.00 C ATOM 441 C VAL A 30 -4.034 7.442 -9.261 1.00 0.00 C ATOM 442 O VAL A 30 -4.765 6.521 -8.876 1.00 0.00 O ATOM 443 CB VAL A 30 -3.693 9.454 -7.750 1.00 0.00 C ATOM 444 CG1 VAL A 30 -4.194 10.337 -8.857 1.00 0.00 C ATOM 445 CG2 VAL A 30 -4.801 9.156 -6.756 1.00 0.00 C ATOM 0 H VAL A 30 -1.514 9.381 -8.966 1.00 0.00 H new ATOM 0 HA VAL A 30 -2.906 7.503 -7.437 1.00 0.00 H new ATOM 0 HB VAL A 30 -2.903 9.995 -7.230 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -4.622 11.245 -8.433 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -3.366 10.600 -9.516 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -4.957 9.808 -9.427 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -5.220 10.092 -6.387 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -5.583 8.576 -7.246 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -4.396 8.585 -5.920 1.00 0.00 H new ATOM 455 N ALA A 31 -3.958 7.821 -10.537 1.00 0.00 N ATOM 456 CA ALA A 31 -4.763 7.193 -11.573 1.00 0.00 C ATOM 457 C ALA A 31 -4.375 5.731 -11.763 1.00 0.00 C ATOM 458 O ALA A 31 -5.228 4.844 -11.733 1.00 0.00 O ATOM 459 CB ALA A 31 -4.588 7.938 -12.879 1.00 0.00 C ATOM 0 H ALA A 31 -3.344 8.562 -10.874 1.00 0.00 H new ATOM 0 HA ALA A 31 -5.807 7.233 -11.262 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -5.193 7.464 -13.652 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -4.906 8.973 -12.753 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -3.539 7.914 -13.174 1.00 0.00 H new ATOM 465 N ASP A 32 -3.080 5.485 -11.943 1.00 0.00 N ATOM 466 CA ASP A 32 -2.590 4.135 -12.209 1.00 0.00 C ATOM 467 C ASP A 32 -2.681 3.273 -10.958 1.00 0.00 C ATOM 468 O ASP A 32 -2.715 2.048 -11.034 1.00 0.00 O ATOM 469 CB ASP A 32 -1.155 4.168 -12.727 1.00 0.00 C ATOM 470 CG ASP A 32 -0.708 2.820 -13.255 1.00 0.00 C ATOM 471 OD1 ASP A 32 -1.397 2.269 -14.144 1.00 0.00 O ATOM 472 OD2 ASP A 32 0.349 2.323 -12.813 1.00 0.00 O ATOM 0 H ASP A 32 -2.353 6.200 -11.910 1.00 0.00 H new ATOM 0 HA ASP A 32 -3.222 3.695 -12.980 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -1.073 4.912 -13.519 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -0.488 4.482 -11.924 1.00 0.00 H new ATOM 477 N LEU A 33 -2.695 3.921 -9.805 1.00 0.00 N ATOM 478 CA LEU A 33 -3.008 3.233 -8.552 1.00 0.00 C ATOM 479 C LEU A 33 -4.361 2.544 -8.673 1.00 0.00 C ATOM 480 O LEU A 33 -4.502 1.359 -8.374 1.00 0.00 O ATOM 481 CB LEU A 33 -3.052 4.185 -7.341 1.00 0.00 C ATOM 482 CG LEU A 33 -1.709 4.730 -6.842 1.00 0.00 C ATOM 483 CD1 LEU A 33 -1.795 5.059 -5.362 1.00 0.00 C ATOM 484 CD2 LEU A 33 -0.586 3.740 -7.112 1.00 0.00 C ATOM 0 H LEU A 33 -2.495 4.916 -9.705 1.00 0.00 H new ATOM 0 HA LEU A 33 -2.209 2.511 -8.382 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -3.688 5.032 -7.598 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -3.535 3.662 -6.515 1.00 0.00 H new ATOM 0 HG LEU A 33 -1.483 5.646 -7.389 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -0.835 5.445 -5.019 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -2.567 5.811 -5.201 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -2.044 4.157 -4.803 1.00 0.00 H new ATOM 0 HD21 LEU A 33 0.356 4.150 -6.749 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -0.796 2.802 -6.597 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -0.512 3.557 -8.184 1.00 0.00 H new ATOM 496 N TYR A 34 -5.355 3.308 -9.113 1.00 0.00 N ATOM 497 CA TYR A 34 -6.713 2.784 -9.290 1.00 0.00 C ATOM 498 C TYR A 34 -6.874 1.935 -10.566 1.00 0.00 C ATOM 499 O TYR A 34 -7.999 1.615 -10.946 1.00 0.00 O ATOM 500 CB TYR A 34 -7.723 3.933 -9.281 1.00 0.00 C ATOM 501 CG TYR A 34 -7.540 4.856 -8.100 1.00 0.00 C ATOM 502 CD1 TYR A 34 -7.145 4.354 -6.866 1.00 0.00 C ATOM 503 CD2 TYR A 34 -7.717 6.226 -8.227 1.00 0.00 C ATOM 504 CE1 TYR A 34 -6.943 5.189 -5.788 1.00 0.00 C ATOM 505 CE2 TYR A 34 -7.508 7.071 -7.154 1.00 0.00 C ATOM 506 CZ TYR A 34 -7.119 6.546 -5.937 1.00 0.00 C ATOM 507 OH TYR A 34 -6.885 7.380 -4.870 1.00 0.00 O ATOM 0 H TYR A 34 -5.250 4.293 -9.355 1.00 0.00 H new ATOM 0 HA TYR A 34 -6.906 2.117 -8.450 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -7.625 4.505 -10.204 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -8.733 3.524 -9.265 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -6.994 3.291 -6.749 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -8.022 6.638 -9.178 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -6.648 4.781 -4.832 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -7.648 8.136 -7.266 1.00 0.00 H new ATOM 0 HH TYR A 34 -7.053 8.308 -5.137 1.00 0.00 H new ATOM 517 N ASN A 35 -5.766 1.589 -11.232 1.00 0.00 N ATOM 518 CA ASN A 35 -5.813 0.814 -12.474 1.00 0.00 C ATOM 519 C ASN A 35 -6.536 -0.513 -12.239 1.00 0.00 C ATOM 520 O ASN A 35 -6.224 -1.236 -11.293 1.00 0.00 O ATOM 521 CB ASN A 35 -4.390 0.555 -12.978 1.00 0.00 C ATOM 522 CG ASN A 35 -4.342 0.111 -14.425 1.00 0.00 C ATOM 523 OD1 ASN A 35 -5.266 -0.521 -14.927 1.00 0.00 O ATOM 524 ND2 ASN A 35 -3.257 0.451 -15.109 1.00 0.00 N ATOM 0 H ASN A 35 -4.824 1.835 -10.929 1.00 0.00 H new ATOM 0 HA ASN A 35 -6.360 1.382 -13.227 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -3.800 1.464 -12.864 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -3.924 -0.208 -12.355 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -3.169 0.186 -16.090 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -2.511 0.977 -14.654 1.00 0.00 H new ATOM 531 N PHE A 36 -7.496 -0.826 -13.103 1.00 0.00 N ATOM 532 CA PHE A 36 -8.374 -1.969 -12.884 1.00 0.00 C ATOM 533 C PHE A 36 -7.654 -3.301 -13.105 1.00 0.00 C ATOM 534 O PHE A 36 -7.908 -4.273 -12.390 1.00 0.00 O ATOM 535 CB PHE A 36 -9.591 -1.869 -13.806 1.00 0.00 C ATOM 536 CG PHE A 36 -10.619 -2.941 -13.576 1.00 0.00 C ATOM 537 CD1 PHE A 36 -11.491 -2.860 -12.503 1.00 0.00 C ATOM 538 CD2 PHE A 36 -10.709 -4.029 -14.429 1.00 0.00 C ATOM 539 CE1 PHE A 36 -12.436 -3.844 -12.286 1.00 0.00 C ATOM 540 CE2 PHE A 36 -11.650 -5.017 -14.216 1.00 0.00 C ATOM 541 CZ PHE A 36 -12.515 -4.925 -13.143 1.00 0.00 C ATOM 0 H PHE A 36 -7.685 -0.305 -13.959 1.00 0.00 H new ATOM 0 HA PHE A 36 -8.696 -1.945 -11.843 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -10.060 -0.894 -13.669 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -9.255 -1.918 -14.842 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -11.432 -2.018 -11.829 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -10.036 -4.105 -15.270 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -13.112 -3.768 -11.447 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -11.710 -5.861 -14.888 1.00 0.00 H new ATOM 0 HZ PHE A 36 -13.252 -5.697 -12.974 1.00 0.00 H new ATOM 551 N TRP A 37 -6.764 -3.359 -14.087 1.00 0.00 N ATOM 552 CA TRP A 37 -6.024 -4.586 -14.338 1.00 0.00 C ATOM 553 C TRP A 37 -4.706 -4.577 -13.575 1.00 0.00 C ATOM 554 O TRP A 37 -3.960 -3.597 -13.606 1.00 0.00 O ATOM 555 CB TRP A 37 -5.806 -4.834 -15.842 1.00 0.00 C ATOM 556 CG TRP A 37 -5.008 -3.783 -16.557 1.00 0.00 C ATOM 557 CD1 TRP A 37 -3.664 -3.800 -16.799 1.00 0.00 C ATOM 558 CD2 TRP A 37 -5.506 -2.580 -17.150 1.00 0.00 C ATOM 559 NE1 TRP A 37 -3.295 -2.675 -17.495 1.00 0.00 N ATOM 560 CE2 TRP A 37 -4.406 -1.910 -17.720 1.00 0.00 C ATOM 561 CE3 TRP A 37 -6.774 -1.998 -17.248 1.00 0.00 C ATOM 562 CZ2 TRP A 37 -4.537 -0.694 -18.381 1.00 0.00 C ATOM 563 CZ3 TRP A 37 -6.901 -0.790 -17.904 1.00 0.00 C ATOM 564 CH2 TRP A 37 -5.789 -0.150 -18.462 1.00 0.00 C ATOM 0 H TRP A 37 -6.540 -2.585 -14.712 1.00 0.00 H new ATOM 0 HA TRP A 37 -6.626 -5.418 -13.972 1.00 0.00 H new ATOM 0 HB2 TRP A 37 -5.305 -5.794 -15.966 1.00 0.00 H new ATOM 0 HB3 TRP A 37 -6.780 -4.918 -16.324 1.00 0.00 H new ATOM 0 HD1 TRP A 37 -2.989 -4.584 -16.488 1.00 0.00 H new ATOM 0 HE1 TRP A 37 -2.347 -2.447 -17.795 1.00 0.00 H new ATOM 0 HE3 TRP A 37 -7.637 -2.484 -16.819 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 -3.682 -0.197 -18.815 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 -7.875 -0.331 -17.988 1.00 0.00 H new ATOM 0 HH2 TRP A 37 -5.922 0.795 -18.968 1.00 0.00 H new ATOM 575 N LYS A 38 -4.428 -5.669 -12.883 1.00 0.00 N ATOM 576 CA LYS A 38 -3.221 -5.773 -12.079 1.00 0.00 C ATOM 577 C LYS A 38 -2.070 -6.330 -12.910 1.00 0.00 C ATOM 578 O LYS A 38 -1.687 -7.493 -12.782 1.00 0.00 O ATOM 579 CB LYS A 38 -3.485 -6.618 -10.825 1.00 0.00 C ATOM 580 CG LYS A 38 -4.284 -7.886 -11.087 1.00 0.00 C ATOM 581 CD LYS A 38 -5.373 -8.087 -10.040 1.00 0.00 C ATOM 582 CE LYS A 38 -6.375 -6.939 -10.053 1.00 0.00 C ATOM 583 NZ LYS A 38 -7.487 -7.150 -9.089 1.00 0.00 N ATOM 0 H LYS A 38 -5.023 -6.498 -12.862 1.00 0.00 H new ATOM 0 HA LYS A 38 -2.929 -4.777 -11.747 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -2.530 -6.890 -10.375 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -4.019 -6.009 -10.096 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -4.736 -7.834 -12.078 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -3.614 -8.746 -11.086 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -5.892 -9.027 -10.228 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -4.920 -8.165 -9.052 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -5.861 -6.008 -9.813 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -6.784 -6.828 -11.057 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -8.143 -6.344 -9.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -7.996 -8.024 -9.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -7.102 -7.230 -8.126 1.00 0.00 H new ATOM 597 N ASP A 39 -1.564 -5.477 -13.796 1.00 0.00 N ATOM 598 CA ASP A 39 -0.454 -5.812 -14.706 1.00 0.00 C ATOM 599 C ASP A 39 0.712 -6.605 -14.066 1.00 0.00 C ATOM 600 O ASP A 39 1.316 -7.430 -14.750 1.00 0.00 O ATOM 601 CB ASP A 39 0.093 -4.526 -15.328 1.00 0.00 C ATOM 602 CG ASP A 39 1.234 -4.775 -16.296 1.00 0.00 C ATOM 603 OD1 ASP A 39 1.012 -5.435 -17.332 1.00 0.00 O ATOM 604 OD2 ASP A 39 2.355 -4.299 -16.037 1.00 0.00 O ATOM 0 H ASP A 39 -1.910 -4.524 -13.910 1.00 0.00 H new ATOM 0 HA ASP A 39 -0.883 -6.479 -15.454 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -0.713 -4.010 -15.850 1.00 0.00 H new ATOM 0 HB3 ASP A 39 0.435 -3.862 -14.534 1.00 0.00 H new ATOM 609 N ASP A 40 1.030 -6.376 -12.776 1.00 0.00 N ATOM 610 CA ASP A 40 2.179 -7.021 -12.130 1.00 0.00 C ATOM 611 C ASP A 40 3.476 -6.503 -12.749 1.00 0.00 C ATOM 612 O ASP A 40 4.338 -7.261 -13.197 1.00 0.00 O ATOM 613 CB ASP A 40 2.090 -8.559 -12.209 1.00 0.00 C ATOM 614 CG ASP A 40 3.217 -9.266 -11.470 1.00 0.00 C ATOM 615 OD1 ASP A 40 3.557 -8.856 -10.339 1.00 0.00 O ATOM 616 OD2 ASP A 40 3.776 -10.241 -12.019 1.00 0.00 O ATOM 0 H ASP A 40 0.505 -5.749 -12.166 1.00 0.00 H new ATOM 0 HA ASP A 40 2.169 -6.763 -11.071 1.00 0.00 H new ATOM 0 HB2 ASP A 40 1.135 -8.882 -11.796 1.00 0.00 H new ATOM 0 HB3 ASP A 40 2.104 -8.864 -13.256 1.00 0.00 H new ATOM 621 N TYR A 41 3.580 -5.186 -12.799 1.00 0.00 N ATOM 622 CA TYR A 41 4.791 -4.520 -13.245 1.00 0.00 C ATOM 623 C TYR A 41 5.699 -4.231 -12.057 1.00 0.00 C ATOM 624 O TYR A 41 5.349 -4.526 -10.909 1.00 0.00 O ATOM 625 CB TYR A 41 4.473 -3.225 -14.019 1.00 0.00 C ATOM 626 CG TYR A 41 3.766 -2.122 -13.240 1.00 0.00 C ATOM 627 CD1 TYR A 41 3.354 -2.290 -11.923 1.00 0.00 C ATOM 628 CD2 TYR A 41 3.509 -0.898 -13.848 1.00 0.00 C ATOM 629 CE1 TYR A 41 2.712 -1.278 -11.237 1.00 0.00 C ATOM 630 CE2 TYR A 41 2.867 0.119 -13.169 1.00 0.00 C ATOM 631 CZ TYR A 41 2.469 -0.076 -11.864 1.00 0.00 C ATOM 632 OH TYR A 41 1.830 0.936 -11.184 1.00 0.00 O ATOM 0 H TYR A 41 2.829 -4.550 -12.532 1.00 0.00 H new ATOM 0 HA TYR A 41 5.311 -5.189 -13.931 1.00 0.00 H new ATOM 0 HB2 TYR A 41 5.408 -2.822 -14.408 1.00 0.00 H new ATOM 0 HB3 TYR A 41 3.856 -3.485 -14.879 1.00 0.00 H new ATOM 0 HD1 TYR A 41 3.540 -3.231 -11.426 1.00 0.00 H new ATOM 0 HD2 TYR A 41 3.817 -0.740 -14.871 1.00 0.00 H new ATOM 0 HE1 TYR A 41 2.402 -1.428 -10.213 1.00 0.00 H new ATOM 0 HE2 TYR A 41 2.678 1.063 -13.659 1.00 0.00 H new ATOM 0 HH TYR A 41 1.587 1.649 -11.811 1.00 0.00 H new ATOM 642 N VAL A 42 6.859 -3.661 -12.322 1.00 0.00 N ATOM 643 CA VAL A 42 7.770 -3.302 -11.262 1.00 0.00 C ATOM 644 C VAL A 42 7.353 -1.952 -10.705 1.00 0.00 C ATOM 645 O VAL A 42 7.311 -0.961 -11.432 1.00 0.00 O ATOM 646 CB VAL A 42 9.231 -3.233 -11.756 1.00 0.00 C ATOM 647 CG1 VAL A 42 10.185 -3.015 -10.590 1.00 0.00 C ATOM 648 CG2 VAL A 42 9.600 -4.494 -12.527 1.00 0.00 C ATOM 0 H VAL A 42 7.189 -3.439 -13.261 1.00 0.00 H new ATOM 0 HA VAL A 42 7.725 -4.070 -10.490 1.00 0.00 H new ATOM 0 HB VAL A 42 9.321 -2.383 -12.432 1.00 0.00 H new ATOM 0 HG11 VAL A 42 11.209 -2.970 -10.961 1.00 0.00 H new ATOM 0 HG12 VAL A 42 9.939 -2.079 -10.089 1.00 0.00 H new ATOM 0 HG13 VAL A 42 10.091 -3.840 -9.884 1.00 0.00 H new ATOM 0 HG21 VAL A 42 10.634 -4.424 -12.866 1.00 0.00 H new ATOM 0 HG22 VAL A 42 9.489 -5.363 -11.878 1.00 0.00 H new ATOM 0 HG23 VAL A 42 8.942 -4.599 -13.390 1.00 0.00 H new ATOM 658 N MET A 43 6.993 -1.934 -9.432 1.00 0.00 N ATOM 659 CA MET A 43 6.556 -0.713 -8.771 1.00 0.00 C ATOM 660 C MET A 43 7.722 0.264 -8.645 1.00 0.00 C ATOM 661 O MET A 43 8.504 0.200 -7.700 1.00 0.00 O ATOM 662 CB MET A 43 5.957 -1.063 -7.406 1.00 0.00 C ATOM 663 CG MET A 43 5.411 0.123 -6.630 1.00 0.00 C ATOM 664 SD MET A 43 4.185 -0.371 -5.401 1.00 0.00 S ATOM 665 CE MET A 43 5.115 -1.552 -4.427 1.00 0.00 C ATOM 0 H MET A 43 6.995 -2.758 -8.831 1.00 0.00 H new ATOM 0 HA MET A 43 5.785 -0.224 -9.366 1.00 0.00 H new ATOM 0 HB2 MET A 43 5.154 -1.786 -7.551 1.00 0.00 H new ATOM 0 HB3 MET A 43 6.722 -1.553 -6.804 1.00 0.00 H new ATOM 0 HG2 MET A 43 6.233 0.639 -6.134 1.00 0.00 H new ATOM 0 HG3 MET A 43 4.961 0.833 -7.324 1.00 0.00 H new ATOM 0 HE1 MET A 43 4.479 -2.402 -4.181 1.00 0.00 H new ATOM 0 HE2 MET A 43 5.977 -1.897 -4.999 1.00 0.00 H new ATOM 0 HE3 MET A 43 5.456 -1.077 -3.507 1.00 0.00 H new ATOM 675 N THR A 44 7.843 1.144 -9.631 1.00 0.00 N ATOM 676 CA THR A 44 8.975 2.054 -9.718 1.00 0.00 C ATOM 677 C THR A 44 8.647 3.417 -9.109 1.00 0.00 C ATOM 678 O THR A 44 9.521 4.274 -8.970 1.00 0.00 O ATOM 679 CB THR A 44 9.406 2.247 -11.186 1.00 0.00 C ATOM 680 OG1 THR A 44 8.341 2.859 -11.928 1.00 0.00 O ATOM 681 CG2 THR A 44 9.764 0.916 -11.836 1.00 0.00 C ATOM 0 H THR A 44 7.165 1.246 -10.386 1.00 0.00 H new ATOM 0 HA THR A 44 9.792 1.606 -9.152 1.00 0.00 H new ATOM 0 HB THR A 44 10.288 2.888 -11.195 1.00 0.00 H new ATOM 0 HG1 THR A 44 8.620 2.981 -12.860 1.00 0.00 H new ATOM 0 HG21 THR A 44 10.064 1.085 -12.870 1.00 0.00 H new ATOM 0 HG22 THR A 44 10.587 0.454 -11.291 1.00 0.00 H new ATOM 0 HG23 THR A 44 8.898 0.255 -11.813 1.00 0.00 H new ATOM 689 N ASP A 45 7.380 3.623 -8.776 1.00 0.00 N ATOM 690 CA ASP A 45 6.945 4.877 -8.172 1.00 0.00 C ATOM 691 C ASP A 45 6.865 4.768 -6.659 1.00 0.00 C ATOM 692 O ASP A 45 6.287 3.822 -6.114 1.00 0.00 O ATOM 693 CB ASP A 45 5.597 5.314 -8.720 1.00 0.00 C ATOM 694 CG ASP A 45 5.022 6.435 -7.897 1.00 0.00 C ATOM 695 OD1 ASP A 45 5.632 7.520 -7.846 1.00 0.00 O ATOM 696 OD2 ASP A 45 3.997 6.212 -7.254 1.00 0.00 O ATOM 0 H ASP A 45 6.635 2.939 -8.913 1.00 0.00 H new ATOM 0 HA ASP A 45 7.692 5.627 -8.430 1.00 0.00 H new ATOM 0 HB2 ASP A 45 5.708 5.637 -9.755 1.00 0.00 H new ATOM 0 HB3 ASP A 45 4.909 4.469 -8.722 1.00 0.00 H new ATOM 701 N ARG A 46 7.396 5.781 -5.990 1.00 0.00 N ATOM 702 CA ARG A 46 7.496 5.760 -4.535 1.00 0.00 C ATOM 703 C ARG A 46 6.123 6.043 -3.936 1.00 0.00 C ATOM 704 O ARG A 46 5.839 5.673 -2.792 1.00 0.00 O ATOM 705 CB ARG A 46 8.545 6.771 -3.988 1.00 0.00 C ATOM 706 CG ARG A 46 9.971 6.595 -4.518 1.00 0.00 C ATOM 707 CD ARG A 46 10.065 6.907 -5.998 1.00 0.00 C ATOM 708 NE ARG A 46 11.424 6.791 -6.513 1.00 0.00 N ATOM 709 CZ ARG A 46 11.753 7.027 -7.781 1.00 0.00 C ATOM 710 NH1 ARG A 46 10.823 7.409 -8.649 1.00 0.00 N ATOM 711 NH2 ARG A 46 13.011 6.889 -8.173 1.00 0.00 N ATOM 0 H ARG A 46 7.764 6.626 -6.428 1.00 0.00 H new ATOM 0 HA ARG A 46 7.840 4.769 -4.240 1.00 0.00 H new ATOM 0 HB2 ARG A 46 8.210 7.780 -4.227 1.00 0.00 H new ATOM 0 HB3 ARG A 46 8.568 6.691 -2.901 1.00 0.00 H new ATOM 0 HG2 ARG A 46 10.647 7.248 -3.966 1.00 0.00 H new ATOM 0 HG3 ARG A 46 10.301 5.571 -4.341 1.00 0.00 H new ATOM 0 HD2 ARG A 46 9.413 6.230 -6.550 1.00 0.00 H new ATOM 0 HD3 ARG A 46 9.699 7.918 -6.176 1.00 0.00 H new ATOM 0 HE ARG A 46 12.163 6.514 -5.867 1.00 0.00 H new ATOM 0 HH11 ARG A 46 9.856 7.522 -8.344 1.00 0.00 H new ATOM 0 HH12 ARG A 46 11.076 7.590 -9.621 1.00 0.00 H new ATOM 0 HH21 ARG A 46 13.725 6.602 -7.504 1.00 0.00 H new ATOM 0 HH22 ARG A 46 13.265 7.069 -9.144 1.00 0.00 H new ATOM 725 N LEU A 47 5.250 6.663 -4.731 1.00 0.00 N ATOM 726 CA LEU A 47 3.942 7.043 -4.243 1.00 0.00 C ATOM 727 C LEU A 47 3.014 5.843 -4.242 1.00 0.00 C ATOM 728 O LEU A 47 1.972 5.859 -3.590 1.00 0.00 O ATOM 729 CB LEU A 47 3.331 8.187 -5.072 1.00 0.00 C ATOM 730 CG LEU A 47 3.873 9.584 -4.778 1.00 0.00 C ATOM 731 CD1 LEU A 47 3.765 9.872 -3.296 1.00 0.00 C ATOM 732 CD2 LEU A 47 5.309 9.731 -5.261 1.00 0.00 C ATOM 0 H LEU A 47 5.431 6.907 -5.705 1.00 0.00 H new ATOM 0 HA LEU A 47 4.064 7.405 -3.222 1.00 0.00 H new ATOM 0 HB2 LEU A 47 3.491 7.971 -6.128 1.00 0.00 H new ATOM 0 HB3 LEU A 47 2.253 8.194 -4.908 1.00 0.00 H new ATOM 0 HG LEU A 47 3.273 10.313 -5.323 1.00 0.00 H new ATOM 0 HD11 LEU A 47 4.153 10.870 -3.090 1.00 0.00 H new ATOM 0 HD12 LEU A 47 2.720 9.818 -2.990 1.00 0.00 H new ATOM 0 HD13 LEU A 47 4.344 9.136 -2.739 1.00 0.00 H new ATOM 0 HD21 LEU A 47 5.667 10.736 -5.038 1.00 0.00 H new ATOM 0 HD22 LEU A 47 5.940 9.000 -4.755 1.00 0.00 H new ATOM 0 HD23 LEU A 47 5.350 9.562 -6.337 1.00 0.00 H new ATOM 744 N ALA A 48 3.412 4.791 -4.945 1.00 0.00 N ATOM 745 CA ALA A 48 2.572 3.626 -5.081 1.00 0.00 C ATOM 746 C ALA A 48 2.754 2.737 -3.866 1.00 0.00 C ATOM 747 O ALA A 48 1.812 2.485 -3.112 1.00 0.00 O ATOM 748 CB ALA A 48 2.919 2.891 -6.363 1.00 0.00 C ATOM 0 H ALA A 48 4.309 4.728 -5.426 1.00 0.00 H new ATOM 0 HA ALA A 48 1.524 3.922 -5.138 1.00 0.00 H new ATOM 0 HB1 ALA A 48 2.282 2.012 -6.462 1.00 0.00 H new ATOM 0 HB2 ALA A 48 2.761 3.552 -7.215 1.00 0.00 H new ATOM 0 HB3 ALA A 48 3.964 2.581 -6.333 1.00 0.00 H new ATOM 754 N GLY A 49 3.984 2.268 -3.697 1.00 0.00 N ATOM 755 CA GLY A 49 4.384 1.612 -2.461 1.00 0.00 C ATOM 756 C GLY A 49 3.881 2.299 -1.189 1.00 0.00 C ATOM 757 O GLY A 49 3.349 1.628 -0.308 1.00 0.00 O ATOM 0 H GLY A 49 4.720 2.330 -4.400 1.00 0.00 H new ATOM 0 HA2 GLY A 49 4.018 0.585 -2.474 1.00 0.00 H new ATOM 0 HA3 GLY A 49 5.472 1.562 -2.426 1.00 0.00 H new ATOM 761 N CYS A 50 4.041 3.623 -1.070 1.00 0.00 N ATOM 762 CA CYS A 50 3.581 4.322 0.126 1.00 0.00 C ATOM 763 C CYS A 50 2.052 4.311 0.240 1.00 0.00 C ATOM 764 O CYS A 50 1.497 4.012 1.305 1.00 0.00 O ATOM 765 CB CYS A 50 4.102 5.764 0.133 1.00 0.00 C ATOM 766 SG CYS A 50 5.791 5.966 0.806 1.00 0.00 S ATOM 0 H CYS A 50 4.477 4.218 -1.775 1.00 0.00 H new ATOM 0 HA CYS A 50 3.981 3.792 0.990 1.00 0.00 H new ATOM 0 HB2 CYS A 50 4.084 6.147 -0.887 1.00 0.00 H new ATOM 0 HB3 CYS A 50 3.418 6.380 0.716 1.00 0.00 H new ATOM 771 N ALA A 51 1.362 4.577 -0.863 1.00 0.00 N ATOM 772 CA ALA A 51 -0.093 4.688 -0.833 1.00 0.00 C ATOM 773 C ALA A 51 -0.760 3.323 -0.791 1.00 0.00 C ATOM 774 O ALA A 51 -1.985 3.231 -0.712 1.00 0.00 O ATOM 775 CB ALA A 51 -0.602 5.493 -2.016 1.00 0.00 C ATOM 0 H ALA A 51 1.781 4.719 -1.782 1.00 0.00 H new ATOM 0 HA ALA A 51 -0.358 5.215 0.083 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -1.689 5.560 -1.970 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -0.175 6.495 -1.985 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -0.308 5.002 -2.944 1.00 0.00 H new ATOM 781 N ILE A 52 0.044 2.266 -0.838 1.00 0.00 N ATOM 782 CA ILE A 52 -0.469 0.917 -0.658 1.00 0.00 C ATOM 783 C ILE A 52 -1.169 0.818 0.703 1.00 0.00 C ATOM 784 O ILE A 52 -2.116 0.045 0.880 1.00 0.00 O ATOM 785 CB ILE A 52 0.663 -0.145 -0.788 1.00 0.00 C ATOM 786 CG1 ILE A 52 0.173 -1.374 -1.571 1.00 0.00 C ATOM 787 CG2 ILE A 52 1.208 -0.570 0.574 1.00 0.00 C ATOM 788 CD1 ILE A 52 -0.936 -2.153 -0.893 1.00 0.00 C ATOM 0 H ILE A 52 1.050 2.319 -0.999 1.00 0.00 H new ATOM 0 HA ILE A 52 -1.191 0.707 -1.447 1.00 0.00 H new ATOM 0 HB ILE A 52 1.478 0.324 -1.339 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -0.176 -1.049 -2.551 1.00 0.00 H new ATOM 0 HG13 ILE A 52 1.018 -2.042 -1.739 1.00 0.00 H new ATOM 0 HG21 ILE A 52 1.995 -1.311 0.436 1.00 0.00 H new ATOM 0 HG22 ILE A 52 1.615 0.299 1.090 1.00 0.00 H new ATOM 0 HG23 ILE A 52 0.403 -1.002 1.169 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -1.218 -3.002 -1.516 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -0.588 -2.514 0.075 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -1.801 -1.505 -0.749 1.00 0.00 H new ATOM 800 N ASN A 53 -0.713 1.619 1.667 1.00 0.00 N ATOM 801 CA ASN A 53 -1.375 1.669 2.958 1.00 0.00 C ATOM 802 C ASN A 53 -1.300 3.072 3.548 1.00 0.00 C ATOM 803 O ASN A 53 -0.563 3.329 4.498 1.00 0.00 O ATOM 804 CB ASN A 53 -0.783 0.641 3.924 1.00 0.00 C ATOM 805 CG ASN A 53 -1.731 0.305 5.064 1.00 0.00 C ATOM 806 OD1 ASN A 53 -2.530 1.137 5.500 1.00 0.00 O ATOM 807 ND2 ASN A 53 -1.659 -0.924 5.551 1.00 0.00 N ATOM 0 H ASN A 53 0.099 2.230 1.576 1.00 0.00 H new ATOM 0 HA ASN A 53 -2.424 1.417 2.806 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -0.540 -0.270 3.377 1.00 0.00 H new ATOM 0 HB3 ASN A 53 0.151 1.026 4.333 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -2.277 -1.208 6.311 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -0.986 -1.587 5.166 1.00 0.00 H new ATOM 814 N CYS A 54 -2.041 3.985 2.949 1.00 0.00 N ATOM 815 CA CYS A 54 -2.162 5.339 3.469 1.00 0.00 C ATOM 816 C CYS A 54 -3.442 5.472 4.268 1.00 0.00 C ATOM 817 O CYS A 54 -3.446 6.056 5.335 1.00 0.00 O ATOM 818 CB CYS A 54 -2.153 6.351 2.316 1.00 0.00 C ATOM 819 SG CYS A 54 -3.348 5.971 0.985 1.00 0.00 S ATOM 0 H CYS A 54 -2.573 3.814 2.096 1.00 0.00 H new ATOM 0 HA CYS A 54 -1.313 5.544 4.122 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -2.371 7.342 2.714 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -1.151 6.392 1.890 1.00 0.00 H new ATOM 824 N LEU A 55 -4.518 4.894 3.758 1.00 0.00 N ATOM 825 CA LEU A 55 -5.827 5.020 4.384 1.00 0.00 C ATOM 826 C LEU A 55 -5.787 4.555 5.840 1.00 0.00 C ATOM 827 O LEU A 55 -5.911 5.357 6.767 1.00 0.00 O ATOM 828 CB LEU A 55 -6.857 4.207 3.582 1.00 0.00 C ATOM 829 CG LEU A 55 -8.332 4.590 3.783 1.00 0.00 C ATOM 830 CD1 LEU A 55 -8.834 4.200 5.165 1.00 0.00 C ATOM 831 CD2 LEU A 55 -8.523 6.080 3.552 1.00 0.00 C ATOM 0 H LEU A 55 -4.511 4.330 2.908 1.00 0.00 H new ATOM 0 HA LEU A 55 -6.119 6.070 4.383 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -6.620 4.304 2.523 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -6.738 3.155 3.840 1.00 0.00 H new ATOM 0 HG LEU A 55 -8.921 4.035 3.052 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -9.880 4.488 5.267 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -8.740 3.122 5.295 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -8.242 4.710 5.925 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -9.572 6.339 3.697 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -7.910 6.639 4.259 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -8.225 6.332 2.534 1.00 0.00 H new ATOM 843 N ALA A 56 -5.550 3.271 6.039 1.00 0.00 N ATOM 844 CA ALA A 56 -5.706 2.678 7.355 1.00 0.00 C ATOM 845 C ALA A 56 -4.472 2.901 8.220 1.00 0.00 C ATOM 846 O ALA A 56 -4.527 2.764 9.443 1.00 0.00 O ATOM 847 CB ALA A 56 -6.005 1.198 7.209 1.00 0.00 C ATOM 0 H ALA A 56 -5.251 2.622 5.311 1.00 0.00 H new ATOM 0 HA ALA A 56 -6.541 3.166 7.859 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -6.122 0.751 8.196 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -6.925 1.067 6.640 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -5.182 0.711 6.686 1.00 0.00 H new ATOM 853 N THR A 57 -3.366 3.267 7.591 1.00 0.00 N ATOM 854 CA THR A 57 -2.170 3.619 8.334 1.00 0.00 C ATOM 855 C THR A 57 -2.218 5.083 8.779 1.00 0.00 C ATOM 856 O THR A 57 -1.833 5.412 9.902 1.00 0.00 O ATOM 857 CB THR A 57 -0.883 3.329 7.529 1.00 0.00 C ATOM 858 OG1 THR A 57 -0.717 1.914 7.393 1.00 0.00 O ATOM 859 CG2 THR A 57 0.335 3.921 8.213 1.00 0.00 C ATOM 0 H THR A 57 -3.273 3.327 6.577 1.00 0.00 H new ATOM 0 HA THR A 57 -2.143 2.989 9.223 1.00 0.00 H new ATOM 0 HB THR A 57 -0.979 3.790 6.546 1.00 0.00 H new ATOM 0 HG1 THR A 57 0.098 1.728 6.881 1.00 0.00 H new ATOM 0 HG21 THR A 57 1.226 3.701 7.624 1.00 0.00 H new ATOM 0 HG22 THR A 57 0.215 5.001 8.300 1.00 0.00 H new ATOM 0 HG23 THR A 57 0.441 3.487 9.207 1.00 0.00 H new ATOM 867 N LYS A 58 -2.712 5.964 7.917 1.00 0.00 N ATOM 868 CA LYS A 58 -2.816 7.370 8.270 1.00 0.00 C ATOM 869 C LYS A 58 -4.062 7.648 9.101 1.00 0.00 C ATOM 870 O LYS A 58 -4.287 8.786 9.515 1.00 0.00 O ATOM 871 CB LYS A 58 -2.783 8.261 7.021 1.00 0.00 C ATOM 872 CG LYS A 58 -1.407 8.347 6.372 1.00 0.00 C ATOM 873 CD LYS A 58 -0.697 9.639 6.749 1.00 0.00 C ATOM 874 CE LYS A 58 0.797 9.574 6.484 1.00 0.00 C ATOM 875 NZ LYS A 58 1.479 10.850 6.847 1.00 0.00 N ATOM 0 H LYS A 58 -3.042 5.732 6.980 1.00 0.00 H new ATOM 0 HA LYS A 58 -1.948 7.615 8.882 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -3.497 7.877 6.292 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -3.112 9.264 7.291 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -0.803 7.494 6.681 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -1.509 8.289 5.288 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -1.128 10.466 6.185 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -0.868 9.850 7.805 1.00 0.00 H new ATOM 0 HE2 LYS A 58 1.232 8.754 7.055 1.00 0.00 H new ATOM 0 HE3 LYS A 58 0.970 9.356 5.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 2.390 10.639 7.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 1.643 11.413 5.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 0.880 11.389 7.505 1.00 0.00 H new ATOM 889 N LEU A 59 -4.882 6.626 9.338 1.00 0.00 N ATOM 890 CA LEU A 59 -5.918 6.741 10.347 1.00 0.00 C ATOM 891 C LEU A 59 -5.276 6.895 11.720 1.00 0.00 C ATOM 892 O LEU A 59 -5.355 7.970 12.320 1.00 0.00 O ATOM 893 CB LEU A 59 -6.850 5.535 10.331 1.00 0.00 C ATOM 894 CG LEU A 59 -7.774 5.448 9.117 1.00 0.00 C ATOM 895 CD1 LEU A 59 -8.945 4.548 9.433 1.00 0.00 C ATOM 896 CD2 LEU A 59 -8.265 6.830 8.702 1.00 0.00 C ATOM 0 H LEU A 59 -4.847 5.729 8.854 1.00 0.00 H new ATOM 0 HA LEU A 59 -6.519 7.623 10.123 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -6.247 4.628 10.375 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -7.461 5.555 11.233 1.00 0.00 H new ATOM 0 HG LEU A 59 -7.212 5.029 8.283 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -9.602 4.488 8.565 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -8.581 3.551 9.682 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -9.498 4.954 10.280 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -8.920 6.738 7.836 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -8.815 7.284 9.527 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -7.411 7.458 8.446 1.00 0.00 H new ATOM 908 N ASP A 60 -4.611 5.838 12.199 1.00 0.00 N ATOM 909 CA ASP A 60 -3.897 5.894 13.478 1.00 0.00 C ATOM 910 C ASP A 60 -3.202 4.564 13.776 1.00 0.00 C ATOM 911 O ASP A 60 -3.856 3.611 14.198 1.00 0.00 O ATOM 912 CB ASP A 60 -4.866 6.238 14.616 1.00 0.00 C ATOM 913 CG ASP A 60 -4.149 6.671 15.875 1.00 0.00 C ATOM 914 OD1 ASP A 60 -3.799 7.865 15.984 1.00 0.00 O ATOM 915 OD2 ASP A 60 -3.949 5.828 16.771 1.00 0.00 O ATOM 0 H ASP A 60 -4.553 4.938 11.723 1.00 0.00 H new ATOM 0 HA ASP A 60 -3.139 6.674 13.405 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -5.536 7.034 14.291 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -5.487 5.369 14.836 1.00 0.00 H new ATOM 920 N VAL A 61 -1.887 4.489 13.548 1.00 0.00 N ATOM 921 CA VAL A 61 -1.118 3.264 13.831 1.00 0.00 C ATOM 922 C VAL A 61 0.326 3.596 14.230 1.00 0.00 C ATOM 923 O VAL A 61 1.287 3.018 13.708 1.00 0.00 O ATOM 924 CB VAL A 61 -1.091 2.281 12.621 1.00 0.00 C ATOM 925 CG1 VAL A 61 -2.471 1.736 12.303 1.00 0.00 C ATOM 926 CG2 VAL A 61 -0.488 2.925 11.391 1.00 0.00 C ATOM 0 H VAL A 61 -1.331 5.256 13.170 1.00 0.00 H new ATOM 0 HA VAL A 61 -1.629 2.775 14.660 1.00 0.00 H new ATOM 0 HB VAL A 61 -0.457 1.445 12.916 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -2.407 1.056 11.454 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -2.859 1.200 13.169 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -3.140 2.561 12.057 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -0.487 2.209 10.569 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -1.078 3.798 11.111 1.00 0.00 H new ATOM 0 HG23 VAL A 61 0.535 3.233 11.606 1.00 0.00 H new ATOM 936 N VAL A 62 0.489 4.507 15.178 1.00 0.00 N ATOM 937 CA VAL A 62 1.820 4.942 15.577 1.00 0.00 C ATOM 938 C VAL A 62 2.264 4.236 16.870 1.00 0.00 C ATOM 939 O VAL A 62 1.582 4.290 17.892 1.00 0.00 O ATOM 940 CB VAL A 62 1.908 6.491 15.716 1.00 0.00 C ATOM 941 CG1 VAL A 62 1.346 7.175 14.478 1.00 0.00 C ATOM 942 CG2 VAL A 62 1.203 7.004 16.964 1.00 0.00 C ATOM 0 H VAL A 62 -0.276 4.956 15.682 1.00 0.00 H new ATOM 0 HA VAL A 62 2.509 4.655 14.783 1.00 0.00 H new ATOM 0 HB VAL A 62 2.965 6.738 15.815 1.00 0.00 H new ATOM 0 HG11 VAL A 62 1.417 8.256 14.596 1.00 0.00 H new ATOM 0 HG12 VAL A 62 1.916 6.867 13.602 1.00 0.00 H new ATOM 0 HG13 VAL A 62 0.301 6.892 14.349 1.00 0.00 H new ATOM 0 HG21 VAL A 62 1.294 8.089 17.013 1.00 0.00 H new ATOM 0 HG22 VAL A 62 0.149 6.730 16.925 1.00 0.00 H new ATOM 0 HG23 VAL A 62 1.661 6.561 17.849 1.00 0.00 H new ATOM 952 N ASP A 63 3.379 3.506 16.792 1.00 0.00 N ATOM 953 CA ASP A 63 3.927 2.807 17.954 1.00 0.00 C ATOM 954 C ASP A 63 4.620 3.759 18.935 1.00 0.00 C ATOM 955 O ASP A 63 4.246 3.818 20.104 1.00 0.00 O ATOM 956 CB ASP A 63 4.926 1.732 17.512 1.00 0.00 C ATOM 957 CG ASP A 63 4.987 0.567 18.476 1.00 0.00 C ATOM 958 OD1 ASP A 63 4.195 -0.382 18.319 1.00 0.00 O ATOM 959 OD2 ASP A 63 5.839 0.590 19.385 1.00 0.00 O ATOM 0 H ASP A 63 3.919 3.384 15.936 1.00 0.00 H new ATOM 0 HA ASP A 63 3.083 2.347 18.467 1.00 0.00 H new ATOM 0 HB2 ASP A 63 4.648 1.367 16.523 1.00 0.00 H new ATOM 0 HB3 ASP A 63 5.917 2.177 17.421 1.00 0.00 H new ATOM 964 N PRO A 64 5.642 4.521 18.483 1.00 0.00 N ATOM 965 CA PRO A 64 6.528 5.268 19.361 1.00 0.00 C ATOM 966 C PRO A 64 6.149 6.744 19.479 1.00 0.00 C ATOM 967 O PRO A 64 4.972 7.096 19.528 1.00 0.00 O ATOM 968 CB PRO A 64 7.878 5.110 18.639 1.00 0.00 C ATOM 969 CG PRO A 64 7.548 4.713 17.224 1.00 0.00 C ATOM 970 CD PRO A 64 6.049 4.751 17.101 1.00 0.00 C ATOM 0 HA PRO A 64 6.508 4.907 20.389 1.00 0.00 H new ATOM 0 HB2 PRO A 64 8.444 6.041 18.661 1.00 0.00 H new ATOM 0 HB3 PRO A 64 8.493 4.352 19.124 1.00 0.00 H new ATOM 0 HG2 PRO A 64 8.012 5.396 16.513 1.00 0.00 H new ATOM 0 HG3 PRO A 64 7.929 3.716 17.003 1.00 0.00 H new ATOM 0 HD2 PRO A 64 5.692 5.708 16.721 1.00 0.00 H new ATOM 0 HD3 PRO A 64 5.672 3.981 16.428 1.00 0.00 H new ATOM 978 N ASP A 65 7.170 7.600 19.493 1.00 0.00 N ATOM 979 CA ASP A 65 6.999 9.044 19.677 1.00 0.00 C ATOM 980 C ASP A 65 6.400 9.718 18.442 1.00 0.00 C ATOM 981 O ASP A 65 6.373 10.943 18.349 1.00 0.00 O ATOM 982 CB ASP A 65 8.353 9.693 19.996 1.00 0.00 C ATOM 983 CG ASP A 65 8.893 9.292 21.355 1.00 0.00 C ATOM 984 OD1 ASP A 65 9.437 8.173 21.480 1.00 0.00 O ATOM 985 OD2 ASP A 65 8.777 10.096 22.308 1.00 0.00 O ATOM 0 H ASP A 65 8.142 7.313 19.377 1.00 0.00 H new ATOM 0 HA ASP A 65 6.305 9.183 20.506 1.00 0.00 H new ATOM 0 HB2 ASP A 65 9.074 9.414 19.227 1.00 0.00 H new ATOM 0 HB3 ASP A 65 8.249 10.777 19.957 1.00 0.00 H new ATOM 990 N GLY A 66 5.922 8.922 17.501 1.00 0.00 N ATOM 991 CA GLY A 66 5.379 9.460 16.273 1.00 0.00 C ATOM 992 C GLY A 66 5.994 8.795 15.063 1.00 0.00 C ATOM 993 O GLY A 66 5.347 8.015 14.361 1.00 0.00 O ATOM 0 H GLY A 66 5.900 7.904 17.567 1.00 0.00 H new ATOM 0 HA2 GLY A 66 4.298 9.319 16.258 1.00 0.00 H new ATOM 0 HA3 GLY A 66 5.561 10.534 16.232 1.00 0.00 H new ATOM 997 N ASN A 67 7.262 9.098 14.847 1.00 0.00 N ATOM 998 CA ASN A 67 8.033 8.548 13.743 1.00 0.00 C ATOM 999 C ASN A 67 8.423 7.096 14.003 1.00 0.00 C ATOM 1000 O ASN A 67 8.506 6.669 15.152 1.00 0.00 O ATOM 1001 CB ASN A 67 9.300 9.387 13.540 1.00 0.00 C ATOM 1002 CG ASN A 67 10.082 9.569 14.835 1.00 0.00 C ATOM 1003 OD1 ASN A 67 10.991 8.650 15.124 1.00 0.00 O flip ATOM 1004 ND2 ASN A 67 9.864 10.529 15.574 1.00 0.00 N flip ATOM 0 H ASN A 67 7.792 9.739 15.438 1.00 0.00 H new ATOM 0 HA ASN A 67 7.413 8.578 12.847 1.00 0.00 H new ATOM 0 HB2 ASN A 67 9.937 8.907 12.797 1.00 0.00 H new ATOM 0 HB3 ASN A 67 9.027 10.364 13.142 1.00 0.00 H new ATOM 0 HD21 ASN A 67 9.156 11.218 15.320 1.00 0.00 H new ATOM 0 HD22 ASN A 67 10.391 10.636 16.441 1.00 0.00 H new ATOM 1011 N LEU A 68 8.642 6.348 12.920 1.00 0.00 N ATOM 1012 CA LEU A 68 9.175 4.982 12.989 1.00 0.00 C ATOM 1013 C LEU A 68 8.170 4.016 13.601 1.00 0.00 C ATOM 1014 O LEU A 68 8.539 3.051 14.273 1.00 0.00 O ATOM 1015 CB LEU A 68 10.498 4.941 13.770 1.00 0.00 C ATOM 1016 CG LEU A 68 11.750 5.327 12.972 1.00 0.00 C ATOM 1017 CD1 LEU A 68 11.970 4.350 11.829 1.00 0.00 C ATOM 1018 CD2 LEU A 68 11.637 6.745 12.434 1.00 0.00 C ATOM 0 H LEU A 68 8.456 6.670 11.970 1.00 0.00 H new ATOM 0 HA LEU A 68 9.368 4.662 11.965 1.00 0.00 H new ATOM 0 HB2 LEU A 68 10.414 5.610 14.627 1.00 0.00 H new ATOM 0 HB3 LEU A 68 10.636 3.934 14.164 1.00 0.00 H new ATOM 0 HG LEU A 68 12.607 5.284 13.645 1.00 0.00 H new ATOM 0 HD11 LEU A 68 12.862 4.637 11.272 1.00 0.00 H new ATOM 0 HD12 LEU A 68 12.100 3.345 12.230 1.00 0.00 H new ATOM 0 HD13 LEU A 68 11.106 4.367 11.165 1.00 0.00 H new ATOM 0 HD21 LEU A 68 12.537 6.994 11.872 1.00 0.00 H new ATOM 0 HD22 LEU A 68 10.769 6.817 11.779 1.00 0.00 H new ATOM 0 HD23 LEU A 68 11.524 7.441 13.265 1.00 0.00 H new ATOM 1030 N HIS A 69 6.900 4.263 13.341 1.00 0.00 N ATOM 1031 CA HIS A 69 5.833 3.409 13.840 1.00 0.00 C ATOM 1032 C HIS A 69 5.671 2.144 12.994 1.00 0.00 C ATOM 1033 O HIS A 69 4.686 1.983 12.278 1.00 0.00 O ATOM 1034 CB HIS A 69 4.507 4.184 13.924 1.00 0.00 C ATOM 1035 CG HIS A 69 4.055 4.843 12.647 1.00 0.00 C ATOM 1036 ND1 HIS A 69 3.011 4.364 11.885 1.00 0.00 N ATOM 1037 CD2 HIS A 69 4.486 5.966 12.021 1.00 0.00 C ATOM 1038 CE1 HIS A 69 2.822 5.160 10.849 1.00 0.00 C ATOM 1039 NE2 HIS A 69 3.704 6.138 10.907 1.00 0.00 N ATOM 0 H HIS A 69 6.578 5.054 12.783 1.00 0.00 H new ATOM 0 HA HIS A 69 6.113 3.093 14.845 1.00 0.00 H new ATOM 0 HB2 HIS A 69 3.727 3.498 14.254 1.00 0.00 H new ATOM 0 HB3 HIS A 69 4.603 4.951 14.693 1.00 0.00 H new ATOM 0 HD1 HIS A 69 2.469 3.525 12.090 1.00 0.00 H new ATOM 0 HD2 HIS A 69 5.295 6.606 12.340 1.00 0.00 H new ATOM 0 HE1 HIS A 69 2.071 5.032 10.083 1.00 0.00 H new ATOM 1048 N HIS A 70 6.646 1.249 13.081 1.00 0.00 N ATOM 1049 CA HIS A 70 6.572 -0.023 12.372 1.00 0.00 C ATOM 1050 C HIS A 70 5.809 -1.065 13.184 1.00 0.00 C ATOM 1051 O HIS A 70 5.090 -1.884 12.622 1.00 0.00 O ATOM 1052 CB HIS A 70 7.968 -0.550 11.973 1.00 0.00 C ATOM 1053 CG HIS A 70 9.072 -0.289 12.962 1.00 0.00 C ATOM 1054 ND1 HIS A 70 9.989 0.728 12.796 1.00 0.00 N ATOM 1055 CD2 HIS A 70 9.420 -0.914 14.115 1.00 0.00 C ATOM 1056 CE1 HIS A 70 10.844 0.719 13.800 1.00 0.00 C ATOM 1057 NE2 HIS A 70 10.522 -0.265 14.613 1.00 0.00 N ATOM 0 H HIS A 70 7.494 1.378 13.633 1.00 0.00 H new ATOM 0 HA HIS A 70 6.021 0.161 11.450 1.00 0.00 H new ATOM 0 HB2 HIS A 70 7.897 -1.626 11.811 1.00 0.00 H new ATOM 0 HB3 HIS A 70 8.246 -0.102 11.019 1.00 0.00 H new ATOM 0 HD2 HIS A 70 8.922 -1.764 14.558 1.00 0.00 H new ATOM 0 HE1 HIS A 70 11.669 1.403 13.933 1.00 0.00 H new ATOM 0 HE2 HIS A 70 11.012 -0.506 15.474 1.00 0.00 H new ATOM 1066 N GLY A 71 5.928 -0.995 14.505 1.00 0.00 N ATOM 1067 CA GLY A 71 5.289 -1.982 15.364 1.00 0.00 C ATOM 1068 C GLY A 71 3.782 -1.935 15.272 1.00 0.00 C ATOM 1069 O GLY A 71 3.145 -2.895 14.837 1.00 0.00 O ATOM 0 H GLY A 71 6.454 -0.274 14.999 1.00 0.00 H new ATOM 0 HA2 GLY A 71 5.636 -2.978 15.089 1.00 0.00 H new ATOM 0 HA3 GLY A 71 5.593 -1.812 16.397 1.00 0.00 H new ATOM 1073 N ASN A 72 3.220 -0.805 15.668 1.00 0.00 N ATOM 1074 CA ASN A 72 1.772 -0.611 15.667 1.00 0.00 C ATOM 1075 C ASN A 72 1.175 -0.824 14.266 1.00 0.00 C ATOM 1076 O ASN A 72 0.039 -1.276 14.138 1.00 0.00 O ATOM 1077 CB ASN A 72 1.433 0.794 16.194 1.00 0.00 C ATOM 1078 CG ASN A 72 0.076 0.877 16.874 1.00 0.00 C ATOM 1079 OD1 ASN A 72 -0.827 0.090 16.603 1.00 0.00 O ATOM 1080 ND2 ASN A 72 -0.075 1.850 17.760 1.00 0.00 N ATOM 0 H ASN A 72 3.748 0.003 15.998 1.00 0.00 H new ATOM 0 HA ASN A 72 1.328 -1.357 16.326 1.00 0.00 H new ATOM 0 HB2 ASN A 72 2.204 1.104 16.900 1.00 0.00 H new ATOM 0 HB3 ASN A 72 1.458 1.500 15.364 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -0.965 1.965 18.244 1.00 0.00 H new ATOM 0 HD22 ASN A 72 0.699 2.484 17.958 1.00 0.00 H new ATOM 1087 N ALA A 73 1.944 -0.528 13.212 1.00 0.00 N ATOM 1088 CA ALA A 73 1.452 -0.682 11.847 1.00 0.00 C ATOM 1089 C ALA A 73 1.378 -2.156 11.444 1.00 0.00 C ATOM 1090 O ALA A 73 0.454 -2.582 10.739 1.00 0.00 O ATOM 1091 CB ALA A 73 2.335 0.088 10.879 1.00 0.00 C ATOM 0 H ALA A 73 2.902 -0.183 13.281 1.00 0.00 H new ATOM 0 HA ALA A 73 0.442 -0.274 11.806 1.00 0.00 H new ATOM 0 HB1 ALA A 73 1.957 -0.036 9.864 1.00 0.00 H new ATOM 0 HB2 ALA A 73 2.328 1.146 11.143 1.00 0.00 H new ATOM 0 HB3 ALA A 73 3.355 -0.293 10.935 1.00 0.00 H new ATOM 1097 N LYS A 74 2.338 -2.949 11.907 1.00 0.00 N ATOM 1098 CA LYS A 74 2.360 -4.362 11.563 1.00 0.00 C ATOM 1099 C LYS A 74 1.386 -5.118 12.444 1.00 0.00 C ATOM 1100 O LYS A 74 0.740 -6.065 11.998 1.00 0.00 O ATOM 1101 CB LYS A 74 3.762 -4.963 11.682 1.00 0.00 C ATOM 1102 CG LYS A 74 4.806 -4.272 10.814 1.00 0.00 C ATOM 1103 CD LYS A 74 4.254 -3.838 9.461 1.00 0.00 C ATOM 1104 CE LYS A 74 3.846 -5.018 8.596 1.00 0.00 C ATOM 1105 NZ LYS A 74 3.228 -4.564 7.321 1.00 0.00 N ATOM 0 H LYS A 74 3.099 -2.642 12.512 1.00 0.00 H new ATOM 0 HA LYS A 74 2.059 -4.455 10.520 1.00 0.00 H new ATOM 0 HB2 LYS A 74 4.080 -4.915 12.723 1.00 0.00 H new ATOM 0 HB3 LYS A 74 3.719 -6.018 11.411 1.00 0.00 H new ATOM 0 HG2 LYS A 74 5.191 -3.399 11.341 1.00 0.00 H new ATOM 0 HG3 LYS A 74 5.648 -4.947 10.659 1.00 0.00 H new ATOM 0 HD2 LYS A 74 3.392 -3.189 9.615 1.00 0.00 H new ATOM 0 HD3 LYS A 74 5.007 -3.250 8.936 1.00 0.00 H new ATOM 0 HE2 LYS A 74 4.720 -5.633 8.381 1.00 0.00 H new ATOM 0 HE3 LYS A 74 3.141 -5.645 9.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 2.960 -5.392 6.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 2.381 -3.997 7.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 3.911 -3.986 6.791 1.00 0.00 H new ATOM 1119 N ASP A 75 1.268 -4.678 13.693 1.00 0.00 N ATOM 1120 CA ASP A 75 0.257 -5.212 14.595 1.00 0.00 C ATOM 1121 C ASP A 75 -1.127 -4.919 14.034 1.00 0.00 C ATOM 1122 O ASP A 75 -2.026 -5.756 14.102 1.00 0.00 O ATOM 1123 CB ASP A 75 0.396 -4.600 15.992 1.00 0.00 C ATOM 1124 CG ASP A 75 -0.568 -5.208 16.993 1.00 0.00 C ATOM 1125 OD1 ASP A 75 -1.699 -4.694 17.131 1.00 0.00 O ATOM 1126 OD2 ASP A 75 -0.188 -6.196 17.660 1.00 0.00 O ATOM 0 H ASP A 75 1.859 -3.954 14.102 1.00 0.00 H new ATOM 0 HA ASP A 75 0.397 -6.290 14.680 1.00 0.00 H new ATOM 0 HB2 ASP A 75 1.417 -4.739 16.346 1.00 0.00 H new ATOM 0 HB3 ASP A 75 0.223 -3.525 15.933 1.00 0.00 H new ATOM 1131 N PHE A 76 -1.276 -3.728 13.458 1.00 0.00 N ATOM 1132 CA PHE A 76 -2.514 -3.339 12.800 1.00 0.00 C ATOM 1133 C PHE A 76 -2.892 -4.341 11.715 1.00 0.00 C ATOM 1134 O PHE A 76 -4.049 -4.741 11.609 1.00 0.00 O ATOM 1135 CB PHE A 76 -2.385 -1.941 12.185 1.00 0.00 C ATOM 1136 CG PHE A 76 -3.539 -1.586 11.296 1.00 0.00 C ATOM 1137 CD1 PHE A 76 -4.805 -1.413 11.822 1.00 0.00 C ATOM 1138 CD2 PHE A 76 -3.358 -1.440 9.933 1.00 0.00 C ATOM 1139 CE1 PHE A 76 -5.873 -1.102 11.007 1.00 0.00 C ATOM 1140 CE2 PHE A 76 -4.419 -1.127 9.112 1.00 0.00 C ATOM 1141 CZ PHE A 76 -5.680 -0.959 9.651 1.00 0.00 C ATOM 0 H PHE A 76 -0.548 -3.014 13.436 1.00 0.00 H new ATOM 0 HA PHE A 76 -3.300 -3.325 13.555 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -2.308 -1.204 12.984 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -1.460 -1.886 11.611 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -4.960 -1.523 12.885 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -2.374 -1.573 9.507 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -6.858 -0.971 11.431 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -4.265 -1.013 8.049 1.00 0.00 H new ATOM 0 HZ PHE A 76 -6.514 -0.716 9.009 1.00 0.00 H new ATOM 1151 N ALA A 77 -1.911 -4.764 10.929 1.00 0.00 N ATOM 1152 CA ALA A 77 -2.171 -5.714 9.854 1.00 0.00 C ATOM 1153 C ALA A 77 -2.492 -7.099 10.407 1.00 0.00 C ATOM 1154 O ALA A 77 -3.288 -7.841 9.833 1.00 0.00 O ATOM 1155 CB ALA A 77 -0.975 -5.805 8.921 1.00 0.00 C ATOM 0 H ALA A 77 -0.938 -4.469 11.013 1.00 0.00 H new ATOM 0 HA ALA A 77 -3.036 -5.352 9.298 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -1.188 -6.519 8.125 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -0.777 -4.825 8.486 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -0.101 -6.136 9.481 1.00 0.00 H new ATOM 1161 N MET A 78 -1.860 -7.442 11.518 1.00 0.00 N ATOM 1162 CA MET A 78 -2.060 -8.746 12.139 1.00 0.00 C ATOM 1163 C MET A 78 -3.406 -8.831 12.848 1.00 0.00 C ATOM 1164 O MET A 78 -4.036 -9.888 12.874 1.00 0.00 O ATOM 1165 CB MET A 78 -0.931 -9.049 13.127 1.00 0.00 C ATOM 1166 CG MET A 78 0.426 -9.211 12.468 1.00 0.00 C ATOM 1167 SD MET A 78 1.760 -9.466 13.656 1.00 0.00 S ATOM 1168 CE MET A 78 3.167 -9.557 12.551 1.00 0.00 C ATOM 0 H MET A 78 -1.203 -6.836 12.010 1.00 0.00 H new ATOM 0 HA MET A 78 -2.050 -9.490 11.343 1.00 0.00 H new ATOM 0 HB2 MET A 78 -0.876 -8.244 13.860 1.00 0.00 H new ATOM 0 HB3 MET A 78 -1.172 -9.961 13.672 1.00 0.00 H new ATOM 0 HG2 MET A 78 0.392 -10.057 11.781 1.00 0.00 H new ATOM 0 HG3 MET A 78 0.642 -8.325 11.872 1.00 0.00 H new ATOM 0 HE1 MET A 78 4.082 -9.357 13.109 1.00 0.00 H new ATOM 0 HE2 MET A 78 3.220 -10.553 12.111 1.00 0.00 H new ATOM 0 HE3 MET A 78 3.056 -8.816 11.759 1.00 0.00 H new ATOM 1178 N LYS A 79 -3.850 -7.728 13.431 1.00 0.00 N ATOM 1179 CA LYS A 79 -5.120 -7.724 14.130 1.00 0.00 C ATOM 1180 C LYS A 79 -6.258 -7.320 13.200 1.00 0.00 C ATOM 1181 O LYS A 79 -7.427 -7.440 13.563 1.00 0.00 O ATOM 1182 CB LYS A 79 -5.064 -6.809 15.361 1.00 0.00 C ATOM 1183 CG LYS A 79 -4.074 -7.260 16.433 1.00 0.00 C ATOM 1184 CD LYS A 79 -4.589 -8.441 17.258 1.00 0.00 C ATOM 1185 CE LYS A 79 -4.676 -9.724 16.445 1.00 0.00 C ATOM 1186 NZ LYS A 79 -5.218 -10.857 17.237 1.00 0.00 N ATOM 0 H LYS A 79 -3.355 -6.836 13.433 1.00 0.00 H new ATOM 0 HA LYS A 79 -5.316 -8.740 14.473 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -4.800 -5.802 15.039 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -6.059 -6.752 15.802 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -3.133 -7.538 15.958 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -3.861 -6.424 17.099 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -3.930 -8.599 18.111 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -5.574 -8.200 17.657 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -5.309 -9.557 15.573 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -3.685 -9.984 16.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -5.259 -11.709 16.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -4.601 -11.035 18.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -6.175 -10.622 17.570 1.00 0.00 H new ATOM 1200 N HIS A 80 -5.921 -6.842 12.000 1.00 0.00 N ATOM 1201 CA HIS A 80 -6.936 -6.452 11.029 1.00 0.00 C ATOM 1202 C HIS A 80 -6.476 -6.808 9.619 1.00 0.00 C ATOM 1203 O HIS A 80 -5.741 -6.049 8.995 1.00 0.00 O ATOM 1204 CB HIS A 80 -7.223 -4.942 11.099 1.00 0.00 C ATOM 1205 CG HIS A 80 -7.410 -4.408 12.488 1.00 0.00 C ATOM 1206 ND1 HIS A 80 -8.618 -4.407 13.148 1.00 0.00 N ATOM 1207 CD2 HIS A 80 -6.518 -3.860 13.346 1.00 0.00 C ATOM 1208 CE1 HIS A 80 -8.459 -3.884 14.349 1.00 0.00 C ATOM 1209 NE2 HIS A 80 -7.193 -3.544 14.492 1.00 0.00 N ATOM 0 H HIS A 80 -4.960 -6.718 11.682 1.00 0.00 H new ATOM 0 HA HIS A 80 -7.851 -6.994 11.269 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -6.400 -4.406 10.625 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -8.120 -4.728 10.517 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -5.466 -3.701 13.159 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -9.235 -3.756 15.090 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -6.784 -3.115 15.322 1.00 0.00 H new ATOM 1218 N GLY A 81 -6.869 -7.979 9.138 1.00 0.00 N ATOM 1219 CA GLY A 81 -6.578 -8.350 7.766 1.00 0.00 C ATOM 1220 C GLY A 81 -5.929 -9.710 7.659 1.00 0.00 C ATOM 1221 O GLY A 81 -6.581 -10.693 7.298 1.00 0.00 O ATOM 0 H GLY A 81 -7.384 -8.679 9.672 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -7.502 -8.346 7.188 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -5.921 -7.602 7.322 1.00 0.00 H new ATOM 1225 N ALA A 82 -4.652 -9.774 8.002 1.00 0.00 N ATOM 1226 CA ALA A 82 -3.896 -11.011 7.894 1.00 0.00 C ATOM 1227 C ALA A 82 -3.818 -11.712 9.237 1.00 0.00 C ATOM 1228 O ALA A 82 -3.869 -11.067 10.282 1.00 0.00 O ATOM 1229 CB ALA A 82 -2.488 -10.735 7.384 1.00 0.00 C ATOM 0 H ALA A 82 -4.117 -8.982 8.358 1.00 0.00 H new ATOM 0 HA ALA A 82 -4.413 -11.658 7.185 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -1.938 -11.673 7.310 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -2.542 -10.267 6.401 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -1.975 -10.067 8.076 1.00 0.00 H new ATOM 1235 N ASP A 83 -3.707 -13.029 9.214 1.00 0.00 N ATOM 1236 CA ASP A 83 -3.408 -13.767 10.429 1.00 0.00 C ATOM 1237 C ASP A 83 -1.918 -13.926 10.535 1.00 0.00 C ATOM 1238 O ASP A 83 -1.187 -13.585 9.595 1.00 0.00 O ATOM 1239 CB ASP A 83 -4.083 -15.129 10.468 1.00 0.00 C ATOM 1240 CG ASP A 83 -3.348 -16.179 9.671 1.00 0.00 C ATOM 1241 OD1 ASP A 83 -3.528 -16.228 8.440 1.00 0.00 O ATOM 1242 OD2 ASP A 83 -2.595 -16.969 10.283 1.00 0.00 O ATOM 0 H ASP A 83 -3.818 -13.604 8.379 1.00 0.00 H new ATOM 0 HA ASP A 83 -3.799 -13.203 11.275 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -4.163 -15.458 11.504 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -5.099 -15.035 10.084 1.00 0.00 H new ATOM 1247 N GLU A 84 -1.460 -14.450 11.656 1.00 0.00 N ATOM 1248 CA GLU A 84 -0.070 -14.463 11.936 1.00 0.00 C ATOM 1249 C GLU A 84 0.724 -15.190 10.864 1.00 0.00 C ATOM 1250 O GLU A 84 1.804 -14.751 10.506 1.00 0.00 O ATOM 1251 CB GLU A 84 0.221 -15.086 13.298 1.00 0.00 C ATOM 1252 CG GLU A 84 0.280 -14.095 14.444 1.00 0.00 C ATOM 1253 CD GLU A 84 0.961 -14.691 15.655 1.00 0.00 C ATOM 1254 OE1 GLU A 84 2.145 -15.073 15.541 1.00 0.00 O ATOM 1255 OE2 GLU A 84 0.324 -14.787 16.722 1.00 0.00 O ATOM 0 H GLU A 84 -2.046 -14.869 12.378 1.00 0.00 H new ATOM 0 HA GLU A 84 0.247 -13.420 11.948 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -0.547 -15.828 13.515 1.00 0.00 H new ATOM 0 HB3 GLU A 84 1.171 -15.617 13.245 1.00 0.00 H new ATOM 0 HG2 GLU A 84 0.817 -13.201 14.126 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -0.730 -13.783 14.710 1.00 0.00 H new ATOM 1262 N THR A 85 0.188 -16.280 10.326 1.00 0.00 N ATOM 1263 CA THR A 85 0.950 -17.072 9.376 1.00 0.00 C ATOM 1264 C THR A 85 1.279 -16.244 8.127 1.00 0.00 C ATOM 1265 O THR A 85 2.384 -16.330 7.599 1.00 0.00 O ATOM 1266 CB THR A 85 0.241 -18.395 8.987 1.00 0.00 C ATOM 1267 OG1 THR A 85 1.163 -19.258 8.309 1.00 0.00 O ATOM 1268 CG2 THR A 85 -0.962 -18.152 8.098 1.00 0.00 C ATOM 0 H THR A 85 -0.750 -16.627 10.527 1.00 0.00 H new ATOM 0 HA THR A 85 1.879 -17.352 9.873 1.00 0.00 H new ATOM 0 HB THR A 85 -0.108 -18.863 9.907 1.00 0.00 H new ATOM 0 HG1 THR A 85 0.711 -20.093 8.066 1.00 0.00 H new ATOM 0 HG21 THR A 85 -1.429 -19.105 7.849 1.00 0.00 H new ATOM 0 HG22 THR A 85 -1.680 -17.522 8.622 1.00 0.00 H new ATOM 0 HG23 THR A 85 -0.643 -17.654 7.182 1.00 0.00 H new ATOM 1276 N MET A 86 0.359 -15.370 7.703 1.00 0.00 N ATOM 1277 CA MET A 86 0.562 -14.612 6.482 1.00 0.00 C ATOM 1278 C MET A 86 1.416 -13.408 6.792 1.00 0.00 C ATOM 1279 O MET A 86 2.305 -13.045 6.026 1.00 0.00 O ATOM 1280 CB MET A 86 -0.771 -14.187 5.868 1.00 0.00 C ATOM 1281 CG MET A 86 -1.751 -15.332 5.733 1.00 0.00 C ATOM 1282 SD MET A 86 -3.252 -14.874 4.845 1.00 0.00 S ATOM 1283 CE MET A 86 -2.593 -14.571 3.206 1.00 0.00 C ATOM 0 H MET A 86 -0.519 -15.178 8.186 1.00 0.00 H new ATOM 0 HA MET A 86 1.068 -15.241 5.750 1.00 0.00 H new ATOM 0 HB2 MET A 86 -1.216 -13.406 6.484 1.00 0.00 H new ATOM 0 HB3 MET A 86 -0.590 -13.753 4.885 1.00 0.00 H new ATOM 0 HG2 MET A 86 -1.266 -16.159 5.214 1.00 0.00 H new ATOM 0 HG3 MET A 86 -2.019 -15.693 6.726 1.00 0.00 H new ATOM 0 HE1 MET A 86 -3.413 -14.505 2.491 1.00 0.00 H new ATOM 0 HE2 MET A 86 -2.034 -13.635 3.206 1.00 0.00 H new ATOM 0 HE3 MET A 86 -1.930 -15.389 2.923 1.00 0.00 H new ATOM 1293 N ALA A 87 1.159 -12.812 7.944 1.00 0.00 N ATOM 1294 CA ALA A 87 1.970 -11.719 8.426 1.00 0.00 C ATOM 1295 C ALA A 87 3.411 -12.184 8.585 1.00 0.00 C ATOM 1296 O ALA A 87 4.347 -11.437 8.320 1.00 0.00 O ATOM 1297 CB ALA A 87 1.413 -11.214 9.743 1.00 0.00 C ATOM 0 H ALA A 87 0.390 -13.072 8.562 1.00 0.00 H new ATOM 0 HA ALA A 87 1.950 -10.899 7.708 1.00 0.00 H new ATOM 0 HB1 ALA A 87 2.027 -10.389 10.105 1.00 0.00 H new ATOM 0 HB2 ALA A 87 0.390 -10.868 9.597 1.00 0.00 H new ATOM 0 HB3 ALA A 87 1.422 -12.021 10.475 1.00 0.00 H new ATOM 1303 N GLN A 88 3.566 -13.447 8.970 1.00 0.00 N ATOM 1304 CA GLN A 88 4.880 -14.044 9.189 1.00 0.00 C ATOM 1305 C GLN A 88 5.567 -14.380 7.871 1.00 0.00 C ATOM 1306 O GLN A 88 6.791 -14.466 7.804 1.00 0.00 O ATOM 1307 CB GLN A 88 4.766 -15.289 10.067 1.00 0.00 C ATOM 1308 CG GLN A 88 5.139 -15.052 11.528 1.00 0.00 C ATOM 1309 CD GLN A 88 4.519 -13.794 12.119 1.00 0.00 C ATOM 1310 OE1 GLN A 88 5.110 -12.716 12.075 1.00 0.00 O ATOM 1311 NE2 GLN A 88 3.325 -13.913 12.676 1.00 0.00 N ATOM 0 H GLN A 88 2.787 -14.084 9.139 1.00 0.00 H new ATOM 0 HA GLN A 88 5.496 -13.308 9.706 1.00 0.00 H new ATOM 0 HB2 GLN A 88 3.743 -15.663 10.019 1.00 0.00 H new ATOM 0 HB3 GLN A 88 5.410 -16.069 9.660 1.00 0.00 H new ATOM 0 HG2 GLN A 88 4.826 -15.913 12.118 1.00 0.00 H new ATOM 0 HG3 GLN A 88 6.224 -14.986 11.611 1.00 0.00 H new ATOM 0 HE21 GLN A 88 2.860 -14.821 12.697 1.00 0.00 H new ATOM 0 HE22 GLN A 88 2.869 -13.097 13.084 1.00 0.00 H new ATOM 1320 N GLN A 89 4.780 -14.559 6.822 1.00 0.00 N ATOM 1321 CA GLN A 89 5.348 -14.760 5.490 1.00 0.00 C ATOM 1322 C GLN A 89 5.801 -13.414 4.927 1.00 0.00 C ATOM 1323 O GLN A 89 6.704 -13.351 4.095 1.00 0.00 O ATOM 1324 CB GLN A 89 4.361 -15.431 4.509 1.00 0.00 C ATOM 1325 CG GLN A 89 3.670 -16.678 5.043 1.00 0.00 C ATOM 1326 CD GLN A 89 4.627 -17.742 5.542 1.00 0.00 C ATOM 1327 OE1 GLN A 89 5.748 -17.887 5.049 1.00 0.00 O ATOM 1328 NE2 GLN A 89 4.184 -18.494 6.533 1.00 0.00 N ATOM 0 H GLN A 89 3.761 -14.570 6.860 1.00 0.00 H new ATOM 0 HA GLN A 89 6.195 -15.437 5.597 1.00 0.00 H new ATOM 0 HB2 GLN A 89 3.599 -14.703 4.230 1.00 0.00 H new ATOM 0 HB3 GLN A 89 4.900 -15.694 3.599 1.00 0.00 H new ATOM 0 HG2 GLN A 89 3.003 -16.392 5.856 1.00 0.00 H new ATOM 0 HG3 GLN A 89 3.048 -17.103 4.255 1.00 0.00 H new ATOM 0 HE21 GLN A 89 3.249 -18.340 6.912 1.00 0.00 H new ATOM 0 HE22 GLN A 89 4.776 -19.229 6.920 1.00 0.00 H new ATOM 1337 N LEU A 90 5.188 -12.333 5.407 1.00 0.00 N ATOM 1338 CA LEU A 90 5.544 -10.998 4.952 1.00 0.00 C ATOM 1339 C LEU A 90 6.726 -10.463 5.749 1.00 0.00 C ATOM 1340 O LEU A 90 7.683 -9.943 5.176 1.00 0.00 O ATOM 1341 CB LEU A 90 4.353 -10.036 5.064 1.00 0.00 C ATOM 1342 CG LEU A 90 3.421 -9.978 3.846 1.00 0.00 C ATOM 1343 CD1 LEU A 90 2.756 -11.319 3.593 1.00 0.00 C ATOM 1344 CD2 LEU A 90 2.370 -8.899 4.039 1.00 0.00 C ATOM 0 H LEU A 90 4.447 -12.359 6.107 1.00 0.00 H new ATOM 0 HA LEU A 90 5.826 -11.068 3.901 1.00 0.00 H new ATOM 0 HB2 LEU A 90 3.763 -10.319 5.936 1.00 0.00 H new ATOM 0 HB3 LEU A 90 4.737 -9.033 5.251 1.00 0.00 H new ATOM 0 HG LEU A 90 4.026 -9.734 2.973 1.00 0.00 H new ATOM 0 HD11 LEU A 90 2.103 -11.243 2.724 1.00 0.00 H new ATOM 0 HD12 LEU A 90 3.520 -12.075 3.408 1.00 0.00 H new ATOM 0 HD13 LEU A 90 2.167 -11.604 4.465 1.00 0.00 H new ATOM 0 HD21 LEU A 90 1.716 -8.869 3.168 1.00 0.00 H new ATOM 0 HD22 LEU A 90 1.780 -9.121 4.928 1.00 0.00 H new ATOM 0 HD23 LEU A 90 2.859 -7.932 4.159 1.00 0.00 H new ATOM 1356 N VAL A 91 6.667 -10.613 7.072 1.00 0.00 N ATOM 1357 CA VAL A 91 7.717 -10.101 7.949 1.00 0.00 C ATOM 1358 C VAL A 91 9.078 -10.694 7.612 1.00 0.00 C ATOM 1359 O VAL A 91 10.101 -10.021 7.743 1.00 0.00 O ATOM 1360 CB VAL A 91 7.423 -10.343 9.449 1.00 0.00 C ATOM 1361 CG1 VAL A 91 6.340 -9.398 9.945 1.00 0.00 C ATOM 1362 CG2 VAL A 91 7.010 -11.779 9.730 1.00 0.00 C ATOM 0 H VAL A 91 5.904 -11.084 7.558 1.00 0.00 H new ATOM 0 HA VAL A 91 7.735 -9.026 7.772 1.00 0.00 H new ATOM 0 HB VAL A 91 8.352 -10.148 9.985 1.00 0.00 H new ATOM 0 HG11 VAL A 91 6.149 -9.586 11.002 1.00 0.00 H new ATOM 0 HG12 VAL A 91 6.668 -8.367 9.813 1.00 0.00 H new ATOM 0 HG13 VAL A 91 5.425 -9.563 9.376 1.00 0.00 H new ATOM 0 HG21 VAL A 91 6.814 -11.899 10.796 1.00 0.00 H new ATOM 0 HG22 VAL A 91 6.107 -12.015 9.166 1.00 0.00 H new ATOM 0 HG23 VAL A 91 7.812 -12.454 9.430 1.00 0.00 H new ATOM 1372 N ASP A 92 9.089 -11.937 7.148 1.00 0.00 N ATOM 1373 CA ASP A 92 10.339 -12.619 6.859 1.00 0.00 C ATOM 1374 C ASP A 92 11.024 -11.975 5.663 1.00 0.00 C ATOM 1375 O ASP A 92 12.225 -11.709 5.689 1.00 0.00 O ATOM 1376 CB ASP A 92 10.110 -14.113 6.612 1.00 0.00 C ATOM 1377 CG ASP A 92 11.385 -14.822 6.198 1.00 0.00 C ATOM 1378 OD1 ASP A 92 12.157 -15.233 7.092 1.00 0.00 O ATOM 1379 OD2 ASP A 92 11.633 -14.961 4.982 1.00 0.00 O ATOM 0 H ASP A 92 8.251 -12.489 6.965 1.00 0.00 H new ATOM 0 HA ASP A 92 10.989 -12.523 7.729 1.00 0.00 H new ATOM 0 HB2 ASP A 92 9.716 -14.574 7.518 1.00 0.00 H new ATOM 0 HB3 ASP A 92 9.356 -14.241 5.836 1.00 0.00 H new ATOM 1384 N ILE A 93 10.243 -11.693 4.628 1.00 0.00 N ATOM 1385 CA ILE A 93 10.766 -11.035 3.445 1.00 0.00 C ATOM 1386 C ILE A 93 11.144 -9.600 3.765 1.00 0.00 C ATOM 1387 O ILE A 93 12.192 -9.121 3.341 1.00 0.00 O ATOM 1388 CB ILE A 93 9.755 -11.063 2.267 1.00 0.00 C ATOM 1389 CG1 ILE A 93 9.885 -12.353 1.452 1.00 0.00 C ATOM 1390 CG2 ILE A 93 9.953 -9.864 1.353 1.00 0.00 C ATOM 1391 CD1 ILE A 93 9.705 -13.626 2.250 1.00 0.00 C ATOM 0 H ILE A 93 9.247 -11.911 4.587 1.00 0.00 H new ATOM 0 HA ILE A 93 11.653 -11.586 3.134 1.00 0.00 H new ATOM 0 HB ILE A 93 8.755 -11.022 2.699 1.00 0.00 H new ATOM 0 HG12 ILE A 93 9.147 -12.336 0.650 1.00 0.00 H new ATOM 0 HG13 ILE A 93 10.868 -12.372 0.981 1.00 0.00 H new ATOM 0 HG21 ILE A 93 9.233 -9.907 0.536 1.00 0.00 H new ATOM 0 HG22 ILE A 93 9.804 -8.945 1.920 1.00 0.00 H new ATOM 0 HG23 ILE A 93 10.964 -9.879 0.947 1.00 0.00 H new ATOM 0 HD11 ILE A 93 9.814 -14.487 1.591 1.00 0.00 H new ATOM 0 HD12 ILE A 93 10.459 -13.673 3.036 1.00 0.00 H new ATOM 0 HD13 ILE A 93 8.712 -13.636 2.699 1.00 0.00 H new ATOM 1403 N ILE A 94 10.301 -8.921 4.533 1.00 0.00 N ATOM 1404 CA ILE A 94 10.558 -7.531 4.873 1.00 0.00 C ATOM 1405 C ILE A 94 11.911 -7.403 5.551 1.00 0.00 C ATOM 1406 O ILE A 94 12.746 -6.601 5.146 1.00 0.00 O ATOM 1407 CB ILE A 94 9.471 -6.955 5.805 1.00 0.00 C ATOM 1408 CG1 ILE A 94 8.121 -6.935 5.090 1.00 0.00 C ATOM 1409 CG2 ILE A 94 9.849 -5.555 6.277 1.00 0.00 C ATOM 1410 CD1 ILE A 94 6.998 -6.387 5.938 1.00 0.00 C ATOM 0 H ILE A 94 9.443 -9.307 4.928 1.00 0.00 H new ATOM 0 HA ILE A 94 10.547 -6.963 3.943 1.00 0.00 H new ATOM 0 HB ILE A 94 9.392 -7.597 6.682 1.00 0.00 H new ATOM 0 HG12 ILE A 94 8.208 -6.335 4.184 1.00 0.00 H new ATOM 0 HG13 ILE A 94 7.869 -7.949 4.778 1.00 0.00 H new ATOM 0 HG21 ILE A 94 9.068 -5.169 6.933 1.00 0.00 H new ATOM 0 HG22 ILE A 94 10.792 -5.597 6.822 1.00 0.00 H new ATOM 0 HG23 ILE A 94 9.957 -4.897 5.415 1.00 0.00 H new ATOM 0 HD11 ILE A 94 6.070 -6.403 5.367 1.00 0.00 H new ATOM 0 HD12 ILE A 94 6.884 -7.000 6.832 1.00 0.00 H new ATOM 0 HD13 ILE A 94 7.228 -5.362 6.228 1.00 0.00 H new ATOM 1422 N HIS A 95 12.141 -8.245 6.545 1.00 0.00 N ATOM 1423 CA HIS A 95 13.370 -8.171 7.327 1.00 0.00 C ATOM 1424 C HIS A 95 14.569 -8.668 6.523 1.00 0.00 C ATOM 1425 O HIS A 95 15.655 -8.094 6.595 1.00 0.00 O ATOM 1426 CB HIS A 95 13.245 -8.988 8.619 1.00 0.00 C ATOM 1427 CG HIS A 95 12.103 -8.584 9.505 1.00 0.00 C ATOM 1428 ND1 HIS A 95 11.627 -9.382 10.522 1.00 0.00 N ATOM 1429 CD2 HIS A 95 11.334 -7.469 9.518 1.00 0.00 C ATOM 1430 CE1 HIS A 95 10.618 -8.780 11.120 1.00 0.00 C ATOM 1431 NE2 HIS A 95 10.420 -7.618 10.530 1.00 0.00 N ATOM 0 H HIS A 95 11.499 -8.984 6.830 1.00 0.00 H new ATOM 0 HA HIS A 95 13.530 -7.123 7.581 1.00 0.00 H new ATOM 0 HB2 HIS A 95 13.131 -10.040 8.358 1.00 0.00 H new ATOM 0 HB3 HIS A 95 14.174 -8.898 9.182 1.00 0.00 H new ATOM 0 HD2 HIS A 95 11.424 -6.621 8.855 1.00 0.00 H new ATOM 0 HE1 HIS A 95 10.051 -9.172 11.951 1.00 0.00 H new ATOM 0 HE2 HIS A 95 9.703 -6.939 10.785 1.00 0.00 H new ATOM 1440 N GLY A 96 14.349 -9.688 5.702 1.00 0.00 N ATOM 1441 CA GLY A 96 15.451 -10.338 5.029 1.00 0.00 C ATOM 1442 C GLY A 96 15.840 -9.624 3.763 1.00 0.00 C ATOM 1443 O GLY A 96 17.023 -9.375 3.517 1.00 0.00 O ATOM 0 H GLY A 96 13.428 -10.074 5.492 1.00 0.00 H new ATOM 0 HA2 GLY A 96 16.310 -10.381 5.699 1.00 0.00 H new ATOM 0 HA3 GLY A 96 15.177 -11.367 4.795 1.00 0.00 H new ATOM 1447 N CYS A 97 14.846 -9.270 2.969 1.00 0.00 N ATOM 1448 CA CYS A 97 15.091 -8.596 1.720 1.00 0.00 C ATOM 1449 C CYS A 97 15.569 -7.167 1.958 1.00 0.00 C ATOM 1450 O CYS A 97 16.453 -6.704 1.257 1.00 0.00 O ATOM 1451 CB CYS A 97 13.849 -8.621 0.827 1.00 0.00 C ATOM 1452 SG CYS A 97 13.263 -10.302 0.411 1.00 0.00 S ATOM 0 H CYS A 97 13.861 -9.441 3.173 1.00 0.00 H new ATOM 0 HA CYS A 97 15.884 -9.133 1.199 1.00 0.00 H new ATOM 0 HB2 CYS A 97 13.045 -8.081 1.326 1.00 0.00 H new ATOM 0 HB3 CYS A 97 14.068 -8.085 -0.097 1.00 0.00 H new ATOM 1457 N GLU A 98 14.993 -6.461 2.943 1.00 0.00 N ATOM 1458 CA GLU A 98 15.484 -5.122 3.288 1.00 0.00 C ATOM 1459 C GLU A 98 16.922 -5.196 3.799 1.00 0.00 C ATOM 1460 O GLU A 98 17.745 -4.341 3.474 1.00 0.00 O ATOM 1461 CB GLU A 98 14.578 -4.472 4.343 1.00 0.00 C ATOM 1462 CG GLU A 98 14.426 -2.958 4.211 1.00 0.00 C ATOM 1463 CD GLU A 98 15.591 -2.171 4.782 1.00 0.00 C ATOM 1464 OE1 GLU A 98 15.842 -2.273 6.002 1.00 0.00 O ATOM 1465 OE2 GLU A 98 16.240 -1.420 4.025 1.00 0.00 O ATOM 0 H GLU A 98 14.205 -6.787 3.502 1.00 0.00 H new ATOM 0 HA GLU A 98 15.465 -4.507 2.388 1.00 0.00 H new ATOM 0 HB2 GLU A 98 13.590 -4.929 4.284 1.00 0.00 H new ATOM 0 HB3 GLU A 98 14.976 -4.698 5.332 1.00 0.00 H new ATOM 0 HG2 GLU A 98 14.311 -2.705 3.157 1.00 0.00 H new ATOM 0 HG3 GLU A 98 13.510 -2.649 4.715 1.00 0.00 H new ATOM 1472 N LYS A 99 17.238 -6.233 4.568 1.00 0.00 N ATOM 1473 CA LYS A 99 18.587 -6.403 5.080 1.00 0.00 C ATOM 1474 C LYS A 99 19.566 -6.724 3.947 1.00 0.00 C ATOM 1475 O LYS A 99 20.710 -6.274 3.956 1.00 0.00 O ATOM 1476 CB LYS A 99 18.610 -7.510 6.132 1.00 0.00 C ATOM 1477 CG LYS A 99 19.961 -7.694 6.791 1.00 0.00 C ATOM 1478 CD LYS A 99 20.383 -6.453 7.561 1.00 0.00 C ATOM 1479 CE LYS A 99 21.725 -6.650 8.251 1.00 0.00 C ATOM 1480 NZ LYS A 99 21.660 -7.698 9.304 1.00 0.00 N ATOM 0 H LYS A 99 16.581 -6.962 4.847 1.00 0.00 H new ATOM 0 HA LYS A 99 18.901 -5.467 5.542 1.00 0.00 H new ATOM 0 HB2 LYS A 99 17.869 -7.286 6.899 1.00 0.00 H new ATOM 0 HB3 LYS A 99 18.312 -8.449 5.665 1.00 0.00 H new ATOM 0 HG2 LYS A 99 19.923 -8.547 7.468 1.00 0.00 H new ATOM 0 HG3 LYS A 99 20.709 -7.923 6.032 1.00 0.00 H new ATOM 0 HD2 LYS A 99 20.445 -5.605 6.879 1.00 0.00 H new ATOM 0 HD3 LYS A 99 19.624 -6.210 8.304 1.00 0.00 H new ATOM 0 HE2 LYS A 99 22.476 -6.925 7.511 1.00 0.00 H new ATOM 0 HE3 LYS A 99 22.046 -5.708 8.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 22.531 -7.674 9.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 20.840 -7.522 9.919 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 21.564 -8.633 8.858 1.00 0.00 H new ATOM 1494 N SER A 100 19.106 -7.487 2.964 1.00 0.00 N ATOM 1495 CA SER A 100 19.960 -7.900 1.855 1.00 0.00 C ATOM 1496 C SER A 100 19.780 -6.983 0.645 1.00 0.00 C ATOM 1497 O SER A 100 20.313 -7.248 -0.434 1.00 0.00 O ATOM 1498 CB SER A 100 19.634 -9.341 1.466 1.00 0.00 C ATOM 1499 OG SER A 100 19.604 -10.180 2.610 1.00 0.00 O ATOM 0 H SER A 100 18.148 -7.833 2.911 1.00 0.00 H new ATOM 0 HA SER A 100 20.998 -7.832 2.179 1.00 0.00 H new ATOM 0 HB2 SER A 100 18.670 -9.376 0.959 1.00 0.00 H new ATOM 0 HB3 SER A 100 20.379 -9.709 0.760 1.00 0.00 H new ATOM 0 HG SER A 100 18.752 -10.062 3.080 1.00 0.00 H new ATOM 1505 N ALA A 101 19.035 -5.904 0.835 1.00 0.00 N ATOM 1506 CA ALA A 101 18.724 -4.991 -0.254 1.00 0.00 C ATOM 1507 C ALA A 101 19.937 -4.163 -0.636 1.00 0.00 C ATOM 1508 O ALA A 101 20.742 -3.794 0.226 1.00 0.00 O ATOM 1509 CB ALA A 101 17.569 -4.074 0.128 1.00 0.00 C ATOM 0 H ALA A 101 18.634 -5.639 1.735 1.00 0.00 H new ATOM 0 HA ALA A 101 18.430 -5.590 -1.116 1.00 0.00 H new ATOM 0 HB1 ALA A 101 17.352 -3.399 -0.700 1.00 0.00 H new ATOM 0 HB2 ALA A 101 16.686 -4.674 0.349 1.00 0.00 H new ATOM 0 HB3 ALA A 101 17.842 -3.493 1.009 1.00 0.00 H new ATOM 1515 N PRO A 102 20.089 -3.863 -1.932 1.00 0.00 N ATOM 1516 CA PRO A 102 21.143 -2.975 -2.409 1.00 0.00 C ATOM 1517 C PRO A 102 20.980 -1.593 -1.796 1.00 0.00 C ATOM 1518 O PRO A 102 19.855 -1.164 -1.532 1.00 0.00 O ATOM 1519 CB PRO A 102 20.928 -2.927 -3.927 1.00 0.00 C ATOM 1520 CG PRO A 102 20.102 -4.126 -4.240 1.00 0.00 C ATOM 1521 CD PRO A 102 19.243 -4.352 -3.032 1.00 0.00 C ATOM 0 HA PRO A 102 22.143 -3.316 -2.142 1.00 0.00 H new ATOM 0 HB2 PRO A 102 20.420 -2.010 -4.224 1.00 0.00 H new ATOM 0 HB3 PRO A 102 21.878 -2.953 -4.461 1.00 0.00 H new ATOM 0 HG2 PRO A 102 19.493 -3.961 -5.129 1.00 0.00 H new ATOM 0 HG3 PRO A 102 20.731 -4.993 -4.441 1.00 0.00 H new ATOM 0 HD2 PRO A 102 18.304 -3.802 -3.095 1.00 0.00 H new ATOM 0 HD3 PRO A 102 18.988 -5.405 -2.909 1.00 0.00 H new ATOM 1529 N PRO A 103 22.092 -0.897 -1.525 1.00 0.00 N ATOM 1530 CA PRO A 103 22.073 0.412 -0.863 1.00 0.00 C ATOM 1531 C PRO A 103 21.228 1.449 -1.601 1.00 0.00 C ATOM 1532 O PRO A 103 21.707 2.144 -2.500 1.00 0.00 O ATOM 1533 CB PRO A 103 23.542 0.833 -0.841 1.00 0.00 C ATOM 1534 CG PRO A 103 24.307 -0.437 -0.974 1.00 0.00 C ATOM 1535 CD PRO A 103 23.463 -1.336 -1.830 1.00 0.00 C ATOM 0 HA PRO A 103 21.620 0.345 0.126 1.00 0.00 H new ATOM 0 HB2 PRO A 103 23.769 1.518 -1.658 1.00 0.00 H new ATOM 0 HB3 PRO A 103 23.791 1.349 0.086 1.00 0.00 H new ATOM 0 HG2 PRO A 103 25.280 -0.261 -1.433 1.00 0.00 H new ATOM 0 HG3 PRO A 103 24.491 -0.886 0.002 1.00 0.00 H new ATOM 0 HD2 PRO A 103 23.697 -1.221 -2.888 1.00 0.00 H new ATOM 0 HD3 PRO A 103 23.614 -2.387 -1.582 1.00 0.00 H new ATOM 1543 N ASN A 104 19.962 1.519 -1.230 1.00 0.00 N ATOM 1544 CA ASN A 104 19.049 2.517 -1.753 1.00 0.00 C ATOM 1545 C ASN A 104 18.421 3.249 -0.580 1.00 0.00 C ATOM 1546 O ASN A 104 17.428 2.789 -0.014 1.00 0.00 O ATOM 1547 CB ASN A 104 17.955 1.861 -2.606 1.00 0.00 C ATOM 1548 CG ASN A 104 17.219 2.853 -3.490 1.00 0.00 C ATOM 1549 OD1 ASN A 104 17.169 4.050 -3.204 1.00 0.00 O ATOM 1550 ND2 ASN A 104 16.624 2.358 -4.566 1.00 0.00 N ATOM 0 H ASN A 104 19.538 0.883 -0.555 1.00 0.00 H new ATOM 0 HA ASN A 104 19.596 3.214 -2.388 1.00 0.00 H new ATOM 0 HB2 ASN A 104 18.403 1.088 -3.231 1.00 0.00 H new ATOM 0 HB3 ASN A 104 17.239 1.365 -1.951 1.00 0.00 H new ATOM 0 HD21 ASN A 104 16.103 2.974 -5.190 1.00 0.00 H new ATOM 0 HD22 ASN A 104 16.687 1.361 -4.771 1.00 0.00 H new ATOM 1557 N ASP A 105 19.016 4.366 -0.191 1.00 0.00 N ATOM 1558 CA ASP A 105 18.555 5.088 0.985 1.00 0.00 C ATOM 1559 C ASP A 105 17.352 5.957 0.652 1.00 0.00 C ATOM 1560 O ASP A 105 17.409 7.187 0.711 1.00 0.00 O ATOM 1561 CB ASP A 105 19.679 5.928 1.595 1.00 0.00 C ATOM 1562 CG ASP A 105 19.271 6.578 2.905 1.00 0.00 C ATOM 1563 OD1 ASP A 105 18.635 5.900 3.742 1.00 0.00 O ATOM 1564 OD2 ASP A 105 19.606 7.768 3.110 1.00 0.00 O ATOM 0 H ASP A 105 19.812 4.790 -0.667 1.00 0.00 H new ATOM 0 HA ASP A 105 18.247 4.351 1.727 1.00 0.00 H new ATOM 0 HB2 ASP A 105 20.551 5.296 1.762 1.00 0.00 H new ATOM 0 HB3 ASP A 105 19.977 6.701 0.886 1.00 0.00 H new ATOM 1569 N ASP A 106 16.273 5.307 0.264 1.00 0.00 N ATOM 1570 CA ASP A 106 15.010 5.982 0.060 1.00 0.00 C ATOM 1571 C ASP A 106 13.948 5.320 0.912 1.00 0.00 C ATOM 1572 O ASP A 106 13.616 4.151 0.704 1.00 0.00 O ATOM 1573 CB ASP A 106 14.586 5.969 -1.408 1.00 0.00 C ATOM 1574 CG ASP A 106 13.303 6.747 -1.626 1.00 0.00 C ATOM 1575 OD1 ASP A 106 12.211 6.184 -1.399 1.00 0.00 O ATOM 1576 OD2 ASP A 106 13.380 7.931 -2.009 1.00 0.00 O ATOM 0 H ASP A 106 16.248 4.304 0.083 1.00 0.00 H new ATOM 0 HA ASP A 106 15.131 7.025 0.354 1.00 0.00 H new ATOM 0 HB2 ASP A 106 15.380 6.397 -2.020 1.00 0.00 H new ATOM 0 HB3 ASP A 106 14.448 4.939 -1.738 1.00 0.00 H new ATOM 1581 N LYS A 107 13.481 6.068 1.905 1.00 0.00 N ATOM 1582 CA LYS A 107 12.441 5.610 2.837 1.00 0.00 C ATOM 1583 C LYS A 107 11.392 4.684 2.206 1.00 0.00 C ATOM 1584 O LYS A 107 11.179 3.582 2.708 1.00 0.00 O ATOM 1585 CB LYS A 107 11.738 6.794 3.519 1.00 0.00 C ATOM 1586 CG LYS A 107 12.277 7.091 4.908 1.00 0.00 C ATOM 1587 CD LYS A 107 13.574 7.885 4.861 1.00 0.00 C ATOM 1588 CE LYS A 107 14.487 7.542 6.026 1.00 0.00 C ATOM 1589 NZ LYS A 107 15.827 8.177 5.887 1.00 0.00 N ATOM 0 H LYS A 107 13.811 7.015 2.093 1.00 0.00 H new ATOM 0 HA LYS A 107 12.976 5.019 3.580 1.00 0.00 H new ATOM 0 HB2 LYS A 107 11.849 7.682 2.896 1.00 0.00 H new ATOM 0 HB3 LYS A 107 10.671 6.584 3.588 1.00 0.00 H new ATOM 0 HG2 LYS A 107 11.531 7.649 5.474 1.00 0.00 H new ATOM 0 HG3 LYS A 107 12.445 6.154 5.439 1.00 0.00 H new ATOM 0 HD2 LYS A 107 14.090 7.683 3.923 1.00 0.00 H new ATOM 0 HD3 LYS A 107 13.348 8.951 4.877 1.00 0.00 H new ATOM 0 HE2 LYS A 107 14.025 7.869 6.958 1.00 0.00 H new ATOM 0 HE3 LYS A 107 14.603 6.460 6.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 16.420 7.919 6.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 16.279 7.846 5.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 15.719 9.211 5.851 1.00 0.00 H new ATOM 1603 N CYS A 108 10.728 5.099 1.127 1.00 0.00 N ATOM 1604 CA CYS A 108 9.656 4.290 0.582 1.00 0.00 C ATOM 1605 C CYS A 108 10.166 3.256 -0.442 1.00 0.00 C ATOM 1606 O CYS A 108 9.599 2.171 -0.553 1.00 0.00 O ATOM 1607 CB CYS A 108 8.591 5.199 -0.045 1.00 0.00 C ATOM 1608 SG CYS A 108 6.902 4.504 -0.065 1.00 0.00 S ATOM 0 H CYS A 108 10.912 5.970 0.629 1.00 0.00 H new ATOM 0 HA CYS A 108 9.213 3.725 1.402 1.00 0.00 H new ATOM 0 HB2 CYS A 108 8.573 6.143 0.500 1.00 0.00 H new ATOM 0 HB3 CYS A 108 8.886 5.427 -1.069 1.00 0.00 H new ATOM 1613 N MET A 109 11.250 3.570 -1.165 1.00 0.00 N ATOM 1614 CA MET A 109 11.749 2.684 -2.229 1.00 0.00 C ATOM 1615 C MET A 109 12.255 1.346 -1.698 1.00 0.00 C ATOM 1616 O MET A 109 12.092 0.315 -2.351 1.00 0.00 O ATOM 1617 CB MET A 109 12.868 3.351 -3.030 1.00 0.00 C ATOM 1618 CG MET A 109 12.373 4.300 -4.106 1.00 0.00 C ATOM 1619 SD MET A 109 11.340 3.485 -5.341 1.00 0.00 S ATOM 1620 CE MET A 109 12.480 2.264 -5.993 1.00 0.00 C ATOM 0 H MET A 109 11.795 4.423 -1.035 1.00 0.00 H new ATOM 0 HA MET A 109 10.893 2.493 -2.876 1.00 0.00 H new ATOM 0 HB2 MET A 109 13.514 3.900 -2.345 1.00 0.00 H new ATOM 0 HB3 MET A 109 13.479 2.578 -3.495 1.00 0.00 H new ATOM 0 HG2 MET A 109 11.806 5.106 -3.640 1.00 0.00 H new ATOM 0 HG3 MET A 109 13.229 4.758 -4.601 1.00 0.00 H new ATOM 0 HE1 MET A 109 12.117 1.905 -6.956 1.00 0.00 H new ATOM 0 HE2 MET A 109 13.463 2.716 -6.121 1.00 0.00 H new ATOM 0 HE3 MET A 109 12.553 1.427 -5.298 1.00 0.00 H new ATOM 1630 N LYS A 110 12.877 1.361 -0.526 1.00 0.00 N ATOM 1631 CA LYS A 110 13.431 0.133 0.055 1.00 0.00 C ATOM 1632 C LYS A 110 12.339 -0.913 0.221 1.00 0.00 C ATOM 1633 O LYS A 110 12.494 -2.079 -0.149 1.00 0.00 O ATOM 1634 CB LYS A 110 14.072 0.412 1.414 1.00 0.00 C ATOM 1635 CG LYS A 110 13.187 1.196 2.364 1.00 0.00 C ATOM 1636 CD LYS A 110 13.683 1.084 3.790 1.00 0.00 C ATOM 1637 CE LYS A 110 15.030 1.773 3.965 1.00 0.00 C ATOM 1638 NZ LYS A 110 15.876 1.092 4.980 1.00 0.00 N ATOM 0 H LYS A 110 13.013 2.198 0.040 1.00 0.00 H new ATOM 0 HA LYS A 110 14.195 -0.242 -0.626 1.00 0.00 H new ATOM 0 HB2 LYS A 110 14.338 -0.537 1.881 1.00 0.00 H new ATOM 0 HB3 LYS A 110 15.000 0.963 1.260 1.00 0.00 H new ATOM 0 HG2 LYS A 110 13.166 2.244 2.065 1.00 0.00 H new ATOM 0 HG3 LYS A 110 12.164 0.826 2.302 1.00 0.00 H new ATOM 0 HD2 LYS A 110 12.954 1.530 4.467 1.00 0.00 H new ATOM 0 HD3 LYS A 110 13.772 0.033 4.065 1.00 0.00 H new ATOM 0 HE2 LYS A 110 15.554 1.792 3.010 1.00 0.00 H new ATOM 0 HE3 LYS A 110 14.871 2.810 4.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 16.620 1.742 5.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 15.287 0.808 5.789 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 16.313 0.248 4.558 1.00 0.00 H new ATOM 1652 N THR A 111 11.241 -0.471 0.799 1.00 0.00 N ATOM 1653 CA THR A 111 10.041 -1.269 0.953 1.00 0.00 C ATOM 1654 C THR A 111 9.496 -1.788 -0.396 1.00 0.00 C ATOM 1655 O THR A 111 8.646 -2.678 -0.425 1.00 0.00 O ATOM 1656 CB THR A 111 8.979 -0.449 1.730 1.00 0.00 C ATOM 1657 OG1 THR A 111 8.549 -1.191 2.879 1.00 0.00 O ATOM 1658 CG2 THR A 111 7.752 -0.077 0.882 1.00 0.00 C ATOM 0 H THR A 111 11.156 0.470 1.182 1.00 0.00 H new ATOM 0 HA THR A 111 10.293 -2.161 1.527 1.00 0.00 H new ATOM 0 HB THR A 111 9.459 0.485 2.022 1.00 0.00 H new ATOM 0 HG1 THR A 111 7.879 -0.672 3.371 1.00 0.00 H new ATOM 0 HG21 THR A 111 7.050 0.495 1.489 1.00 0.00 H new ATOM 0 HG22 THR A 111 8.068 0.523 0.029 1.00 0.00 H new ATOM 0 HG23 THR A 111 7.266 -0.986 0.526 1.00 0.00 H new ATOM 1666 N ILE A 112 10.028 -1.284 -1.508 1.00 0.00 N ATOM 1667 CA ILE A 112 9.595 -1.731 -2.819 1.00 0.00 C ATOM 1668 C ILE A 112 10.456 -2.910 -3.239 1.00 0.00 C ATOM 1669 O ILE A 112 9.951 -3.907 -3.768 1.00 0.00 O ATOM 1670 CB ILE A 112 9.671 -0.591 -3.865 1.00 0.00 C ATOM 1671 CG1 ILE A 112 8.296 0.041 -4.088 1.00 0.00 C ATOM 1672 CG2 ILE A 112 10.265 -1.057 -5.191 1.00 0.00 C ATOM 1673 CD1 ILE A 112 7.878 0.978 -2.982 1.00 0.00 C ATOM 0 H ILE A 112 10.756 -0.569 -1.522 1.00 0.00 H new ATOM 0 HA ILE A 112 8.550 -2.037 -2.764 1.00 0.00 H new ATOM 0 HB ILE A 112 10.343 0.164 -3.457 1.00 0.00 H new ATOM 0 HG12 ILE A 112 8.304 0.586 -5.032 1.00 0.00 H new ATOM 0 HG13 ILE A 112 7.552 -0.750 -4.184 1.00 0.00 H new ATOM 0 HG21 ILE A 112 10.296 -0.221 -5.890 1.00 0.00 H new ATOM 0 HG22 ILE A 112 11.276 -1.430 -5.026 1.00 0.00 H new ATOM 0 HG23 ILE A 112 9.648 -1.854 -5.606 1.00 0.00 H new ATOM 0 HD11 ILE A 112 6.894 1.389 -3.206 1.00 0.00 H new ATOM 0 HD12 ILE A 112 7.837 0.433 -2.039 1.00 0.00 H new ATOM 0 HD13 ILE A 112 8.601 1.790 -2.900 1.00 0.00 H new ATOM 1685 N ASP A 113 11.757 -2.801 -2.962 1.00 0.00 N ATOM 1686 CA ASP A 113 12.684 -3.897 -3.198 1.00 0.00 C ATOM 1687 C ASP A 113 12.273 -5.119 -2.395 1.00 0.00 C ATOM 1688 O ASP A 113 12.414 -6.247 -2.856 1.00 0.00 O ATOM 1689 CB ASP A 113 14.126 -3.508 -2.841 1.00 0.00 C ATOM 1690 CG ASP A 113 14.754 -2.551 -3.837 1.00 0.00 C ATOM 1691 OD1 ASP A 113 14.534 -1.329 -3.715 1.00 0.00 O ATOM 1692 OD2 ASP A 113 15.495 -3.015 -4.735 1.00 0.00 O ATOM 0 H ASP A 113 12.188 -1.962 -2.574 1.00 0.00 H new ATOM 0 HA ASP A 113 12.648 -4.130 -4.262 1.00 0.00 H new ATOM 0 HB2 ASP A 113 14.137 -3.051 -1.852 1.00 0.00 H new ATOM 0 HB3 ASP A 113 14.734 -4.411 -2.782 1.00 0.00 H new ATOM 1697 N VAL A 114 11.745 -4.904 -1.194 1.00 0.00 N ATOM 1698 CA VAL A 114 11.332 -6.018 -0.368 1.00 0.00 C ATOM 1699 C VAL A 114 9.957 -6.536 -0.792 1.00 0.00 C ATOM 1700 O VAL A 114 9.708 -7.736 -0.768 1.00 0.00 O ATOM 1701 CB VAL A 114 11.352 -5.678 1.127 1.00 0.00 C ATOM 1702 CG1 VAL A 114 12.687 -5.073 1.488 1.00 0.00 C ATOM 1703 CG2 VAL A 114 10.258 -4.731 1.500 1.00 0.00 C ATOM 0 H VAL A 114 11.597 -3.983 -0.782 1.00 0.00 H new ATOM 0 HA VAL A 114 12.063 -6.812 -0.522 1.00 0.00 H new ATOM 0 HB VAL A 114 11.193 -6.603 1.681 1.00 0.00 H new ATOM 0 HG11 VAL A 114 12.701 -4.831 2.551 1.00 0.00 H new ATOM 0 HG12 VAL A 114 13.481 -5.786 1.267 1.00 0.00 H new ATOM 0 HG13 VAL A 114 12.844 -4.164 0.907 1.00 0.00 H new ATOM 0 HG21 VAL A 114 10.310 -4.518 2.568 1.00 0.00 H new ATOM 0 HG22 VAL A 114 10.372 -3.804 0.939 1.00 0.00 H new ATOM 0 HG23 VAL A 114 9.293 -5.180 1.266 1.00 0.00 H new ATOM 1713 N ALA A 115 9.078 -5.631 -1.213 1.00 0.00 N ATOM 1714 CA ALA A 115 7.753 -6.017 -1.696 1.00 0.00 C ATOM 1715 C ALA A 115 7.847 -6.937 -2.908 1.00 0.00 C ATOM 1716 O ALA A 115 7.250 -8.028 -2.940 1.00 0.00 O ATOM 1717 CB ALA A 115 6.943 -4.782 -2.043 1.00 0.00 C ATOM 0 H ALA A 115 9.257 -4.627 -1.230 1.00 0.00 H new ATOM 0 HA ALA A 115 7.253 -6.564 -0.897 1.00 0.00 H new ATOM 0 HB1 ALA A 115 5.958 -5.082 -2.402 1.00 0.00 H new ATOM 0 HB2 ALA A 115 6.832 -4.159 -1.156 1.00 0.00 H new ATOM 0 HB3 ALA A 115 7.456 -4.217 -2.821 1.00 0.00 H new ATOM 1723 N MET A 116 8.611 -6.515 -3.908 1.00 0.00 N ATOM 1724 CA MET A 116 8.769 -7.330 -5.101 1.00 0.00 C ATOM 1725 C MET A 116 9.575 -8.589 -4.779 1.00 0.00 C ATOM 1726 O MET A 116 9.392 -9.629 -5.407 1.00 0.00 O ATOM 1727 CB MET A 116 9.352 -6.529 -6.293 1.00 0.00 C ATOM 1728 CG MET A 116 10.707 -5.853 -6.088 1.00 0.00 C ATOM 1729 SD MET A 116 12.075 -7.018 -5.904 1.00 0.00 S ATOM 1730 CE MET A 116 13.471 -5.894 -5.914 1.00 0.00 C ATOM 0 H MET A 116 9.121 -5.631 -3.917 1.00 0.00 H new ATOM 0 HA MET A 116 7.779 -7.647 -5.428 1.00 0.00 H new ATOM 0 HB2 MET A 116 9.438 -7.205 -7.144 1.00 0.00 H new ATOM 0 HB3 MET A 116 8.630 -5.760 -6.568 1.00 0.00 H new ATOM 0 HG2 MET A 116 10.909 -5.199 -6.936 1.00 0.00 H new ATOM 0 HG3 MET A 116 10.658 -5.220 -5.202 1.00 0.00 H new ATOM 0 HE1 MET A 116 14.230 -6.263 -6.603 1.00 0.00 H new ATOM 0 HE2 MET A 116 13.140 -4.906 -6.234 1.00 0.00 H new ATOM 0 HE3 MET A 116 13.893 -5.829 -4.911 1.00 0.00 H new ATOM 1740 N CYS A 117 10.397 -8.506 -3.739 1.00 0.00 N ATOM 1741 CA CYS A 117 11.171 -9.642 -3.249 1.00 0.00 C ATOM 1742 C CYS A 117 10.239 -10.671 -2.635 1.00 0.00 C ATOM 1743 O CYS A 117 10.523 -11.868 -2.640 1.00 0.00 O ATOM 1744 CB CYS A 117 12.200 -9.155 -2.222 1.00 0.00 C ATOM 1745 SG CYS A 117 13.365 -10.423 -1.619 1.00 0.00 S ATOM 0 H CYS A 117 10.546 -7.647 -3.210 1.00 0.00 H new ATOM 0 HA CYS A 117 11.702 -10.111 -4.077 1.00 0.00 H new ATOM 0 HB2 CYS A 117 12.773 -8.341 -2.665 1.00 0.00 H new ATOM 0 HB3 CYS A 117 11.666 -8.740 -1.367 1.00 0.00 H new ATOM 1750 N PHE A 118 9.102 -10.200 -2.144 1.00 0.00 N ATOM 1751 CA PHE A 118 8.124 -11.085 -1.549 1.00 0.00 C ATOM 1752 C PHE A 118 7.402 -11.869 -2.625 1.00 0.00 C ATOM 1753 O PHE A 118 7.210 -13.071 -2.482 1.00 0.00 O ATOM 1754 CB PHE A 118 7.121 -10.323 -0.664 1.00 0.00 C ATOM 1755 CG PHE A 118 5.986 -11.181 -0.157 1.00 0.00 C ATOM 1756 CD1 PHE A 118 6.213 -12.177 0.781 1.00 0.00 C ATOM 1757 CD2 PHE A 118 4.694 -11.001 -0.633 1.00 0.00 C ATOM 1758 CE1 PHE A 118 5.179 -12.974 1.232 1.00 0.00 C ATOM 1759 CE2 PHE A 118 3.659 -11.798 -0.188 1.00 0.00 C ATOM 1760 CZ PHE A 118 3.901 -12.785 0.747 1.00 0.00 C ATOM 0 H PHE A 118 8.839 -9.214 -2.148 1.00 0.00 H new ATOM 0 HA PHE A 118 8.659 -11.781 -0.903 1.00 0.00 H new ATOM 0 HB2 PHE A 118 7.652 -9.897 0.188 1.00 0.00 H new ATOM 0 HB3 PHE A 118 6.709 -9.489 -1.232 1.00 0.00 H new ATOM 0 HD1 PHE A 118 7.211 -12.331 1.164 1.00 0.00 H new ATOM 0 HD2 PHE A 118 4.497 -10.228 -1.361 1.00 0.00 H new ATOM 0 HE1 PHE A 118 5.371 -13.745 1.964 1.00 0.00 H new ATOM 0 HE2 PHE A 118 2.660 -11.650 -0.571 1.00 0.00 H new ATOM 0 HZ PHE A 118 3.092 -13.408 1.098 1.00 0.00 H new ATOM 1770 N LYS A 119 6.996 -11.211 -3.709 1.00 0.00 N ATOM 1771 CA LYS A 119 6.320 -11.946 -4.772 1.00 0.00 C ATOM 1772 C LYS A 119 7.314 -12.859 -5.498 1.00 0.00 C ATOM 1773 O LYS A 119 6.933 -13.912 -6.005 1.00 0.00 O ATOM 1774 CB LYS A 119 5.591 -11.017 -5.750 1.00 0.00 C ATOM 1775 CG LYS A 119 6.462 -10.487 -6.869 1.00 0.00 C ATOM 1776 CD LYS A 119 6.216 -9.018 -7.128 1.00 0.00 C ATOM 1777 CE LYS A 119 7.098 -8.527 -8.255 1.00 0.00 C ATOM 1778 NZ LYS A 119 6.674 -9.073 -9.573 1.00 0.00 N ATOM 0 H LYS A 119 7.117 -10.211 -3.871 1.00 0.00 H new ATOM 0 HA LYS A 119 5.552 -12.566 -4.310 1.00 0.00 H new ATOM 0 HB2 LYS A 119 4.748 -11.555 -6.184 1.00 0.00 H new ATOM 0 HB3 LYS A 119 5.180 -10.174 -5.195 1.00 0.00 H new ATOM 0 HG2 LYS A 119 7.511 -10.640 -6.616 1.00 0.00 H new ATOM 0 HG3 LYS A 119 6.268 -11.054 -7.780 1.00 0.00 H new ATOM 0 HD2 LYS A 119 5.168 -8.857 -7.381 1.00 0.00 H new ATOM 0 HD3 LYS A 119 6.417 -8.444 -6.224 1.00 0.00 H new ATOM 0 HE2 LYS A 119 7.071 -7.438 -8.288 1.00 0.00 H new ATOM 0 HE3 LYS A 119 8.131 -8.815 -8.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 7.152 -8.551 -10.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 6.929 -10.080 -9.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 5.644 -8.970 -9.676 1.00 0.00 H new ATOM 1792 N LYS A 120 8.592 -12.455 -5.542 1.00 0.00 N ATOM 1793 CA LYS A 120 9.648 -13.349 -6.008 1.00 0.00 C ATOM 1794 C LYS A 120 9.640 -14.645 -5.201 1.00 0.00 C ATOM 1795 O LYS A 120 9.539 -15.740 -5.760 1.00 0.00 O ATOM 1796 CB LYS A 120 11.014 -12.675 -5.876 1.00 0.00 C ATOM 1797 CG LYS A 120 11.749 -12.543 -7.195 1.00 0.00 C ATOM 1798 CD LYS A 120 11.005 -11.624 -8.146 1.00 0.00 C ATOM 1799 CE LYS A 120 11.030 -10.182 -7.669 1.00 0.00 C ATOM 1800 NZ LYS A 120 12.388 -9.584 -7.760 1.00 0.00 N ATOM 0 H LYS A 120 8.911 -11.527 -5.264 1.00 0.00 H new ATOM 0 HA LYS A 120 9.463 -13.579 -7.057 1.00 0.00 H new ATOM 0 HB2 LYS A 120 10.882 -11.684 -5.441 1.00 0.00 H new ATOM 0 HB3 LYS A 120 11.628 -13.248 -5.182 1.00 0.00 H new ATOM 0 HG2 LYS A 120 12.752 -12.154 -7.019 1.00 0.00 H new ATOM 0 HG3 LYS A 120 11.864 -13.527 -7.651 1.00 0.00 H new ATOM 0 HD2 LYS A 120 11.453 -11.687 -9.138 1.00 0.00 H new ATOM 0 HD3 LYS A 120 9.972 -11.958 -8.241 1.00 0.00 H new ATOM 0 HE2 LYS A 120 10.334 -9.592 -8.265 1.00 0.00 H new ATOM 0 HE3 LYS A 120 10.683 -10.136 -6.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 12.372 -8.623 -7.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 13.062 -10.169 -7.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 12.682 -9.540 -8.757 1.00 0.00 H new ATOM 1814 N GLU A 121 9.752 -14.515 -3.883 1.00 0.00 N ATOM 1815 CA GLU A 121 9.663 -15.673 -2.991 1.00 0.00 C ATOM 1816 C GLU A 121 8.302 -16.383 -3.061 1.00 0.00 C ATOM 1817 O GLU A 121 8.258 -17.612 -3.059 1.00 0.00 O ATOM 1818 CB GLU A 121 9.988 -15.278 -1.550 1.00 0.00 C ATOM 1819 CG GLU A 121 11.461 -14.967 -1.335 1.00 0.00 C ATOM 1820 CD GLU A 121 12.362 -16.113 -1.750 1.00 0.00 C ATOM 1821 OE1 GLU A 121 12.628 -16.999 -0.910 1.00 0.00 O ATOM 1822 OE2 GLU A 121 12.808 -16.133 -2.920 1.00 0.00 O ATOM 0 H GLU A 121 9.904 -13.625 -3.408 1.00 0.00 H new ATOM 0 HA GLU A 121 10.408 -16.387 -3.341 1.00 0.00 H new ATOM 0 HB2 GLU A 121 9.395 -14.406 -1.276 1.00 0.00 H new ATOM 0 HB3 GLU A 121 9.692 -16.087 -0.882 1.00 0.00 H new ATOM 0 HG2 GLU A 121 11.728 -14.075 -1.903 1.00 0.00 H new ATOM 0 HG3 GLU A 121 11.631 -14.738 -0.283 1.00 0.00 H new ATOM 1829 N ILE A 122 7.192 -15.634 -3.105 1.00 0.00 N ATOM 1830 CA ILE A 122 5.877 -16.234 -3.266 1.00 0.00 C ATOM 1831 C ILE A 122 5.809 -17.085 -4.551 1.00 0.00 C ATOM 1832 O ILE A 122 5.138 -18.113 -4.576 1.00 0.00 O ATOM 1833 CB ILE A 122 4.753 -15.151 -3.220 1.00 0.00 C ATOM 1834 CG1 ILE A 122 3.767 -15.480 -2.100 1.00 0.00 C ATOM 1835 CG2 ILE A 122 4.015 -15.010 -4.551 1.00 0.00 C ATOM 1836 CD1 ILE A 122 2.980 -16.755 -2.316 1.00 0.00 C ATOM 0 H ILE A 122 7.186 -14.617 -3.031 1.00 0.00 H new ATOM 0 HA ILE A 122 5.707 -16.907 -2.425 1.00 0.00 H new ATOM 0 HB ILE A 122 5.232 -14.192 -3.024 1.00 0.00 H new ATOM 0 HG12 ILE A 122 4.315 -15.560 -1.161 1.00 0.00 H new ATOM 0 HG13 ILE A 122 3.069 -14.650 -1.991 1.00 0.00 H new ATOM 0 HG21 ILE A 122 3.245 -14.244 -4.461 1.00 0.00 H new ATOM 0 HG22 ILE A 122 4.722 -14.725 -5.330 1.00 0.00 H new ATOM 0 HG23 ILE A 122 3.551 -15.961 -4.812 1.00 0.00 H new ATOM 0 HD11 ILE A 122 2.305 -16.913 -1.475 1.00 0.00 H new ATOM 0 HD12 ILE A 122 2.401 -16.674 -3.236 1.00 0.00 H new ATOM 0 HD13 ILE A 122 3.667 -17.598 -2.393 1.00 0.00 H new ATOM 1848 N HIS A 123 6.523 -16.672 -5.606 1.00 0.00 N ATOM 1849 CA HIS A 123 6.619 -17.473 -6.828 1.00 0.00 C ATOM 1850 C HIS A 123 7.485 -18.721 -6.620 1.00 0.00 C ATOM 1851 O HIS A 123 7.230 -19.765 -7.217 1.00 0.00 O ATOM 1852 CB HIS A 123 7.180 -16.633 -7.981 1.00 0.00 C ATOM 1853 CG HIS A 123 6.157 -15.781 -8.673 1.00 0.00 C ATOM 1854 ND1 HIS A 123 6.254 -15.429 -10.001 1.00 0.00 N ATOM 1855 CD2 HIS A 123 5.008 -15.218 -8.224 1.00 0.00 C ATOM 1856 CE1 HIS A 123 5.214 -14.691 -10.340 1.00 0.00 C ATOM 1857 NE2 HIS A 123 4.442 -14.549 -9.280 1.00 0.00 N ATOM 0 H HIS A 123 7.039 -15.793 -5.636 1.00 0.00 H new ATOM 0 HA HIS A 123 5.611 -17.800 -7.082 1.00 0.00 H new ATOM 0 HB2 HIS A 123 7.972 -15.990 -7.596 1.00 0.00 H new ATOM 0 HB3 HIS A 123 7.637 -17.299 -8.713 1.00 0.00 H new ATOM 0 HD2 HIS A 123 4.612 -15.284 -7.221 1.00 0.00 H new ATOM 0 HE1 HIS A 123 5.027 -14.274 -11.319 1.00 0.00 H new ATOM 0 HE2 HIS A 123 3.566 -14.027 -9.250 1.00 0.00 H new ATOM 1866 N LYS A 124 8.493 -18.617 -5.756 1.00 0.00 N ATOM 1867 CA LYS A 124 9.337 -19.757 -5.408 1.00 0.00 C ATOM 1868 C LYS A 124 8.536 -20.777 -4.605 1.00 0.00 C ATOM 1869 O LYS A 124 8.702 -21.988 -4.761 1.00 0.00 O ATOM 1870 CB LYS A 124 10.550 -19.257 -4.611 1.00 0.00 C ATOM 1871 CG LYS A 124 11.148 -20.265 -3.640 1.00 0.00 C ATOM 1872 CD LYS A 124 12.237 -19.619 -2.802 1.00 0.00 C ATOM 1873 CE LYS A 124 12.552 -20.429 -1.556 1.00 0.00 C ATOM 1874 NZ LYS A 124 13.536 -19.732 -0.686 1.00 0.00 N ATOM 0 H LYS A 124 8.746 -17.750 -5.282 1.00 0.00 H new ATOM 0 HA LYS A 124 9.688 -20.249 -6.315 1.00 0.00 H new ATOM 0 HB2 LYS A 124 11.325 -18.950 -5.314 1.00 0.00 H new ATOM 0 HB3 LYS A 124 10.256 -18.369 -4.052 1.00 0.00 H new ATOM 0 HG2 LYS A 124 10.367 -20.659 -2.990 1.00 0.00 H new ATOM 0 HG3 LYS A 124 11.560 -21.110 -4.192 1.00 0.00 H new ATOM 0 HD2 LYS A 124 13.140 -19.511 -3.402 1.00 0.00 H new ATOM 0 HD3 LYS A 124 11.925 -18.616 -2.513 1.00 0.00 H new ATOM 0 HE2 LYS A 124 11.634 -20.609 -0.997 1.00 0.00 H new ATOM 0 HE3 LYS A 124 12.946 -21.403 -1.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 13.468 -20.104 0.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 14.497 -19.892 -1.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 13.333 -18.712 -0.680 1.00 0.00 H new ATOM 1888 N LEU A 125 7.640 -20.274 -3.769 1.00 0.00 N ATOM 1889 CA LEU A 125 6.700 -21.121 -3.044 1.00 0.00 C ATOM 1890 C LEU A 125 5.561 -21.600 -3.953 1.00 0.00 C ATOM 1891 O LEU A 125 4.679 -22.339 -3.512 1.00 0.00 O ATOM 1892 CB LEU A 125 6.121 -20.360 -1.849 1.00 0.00 C ATOM 1893 CG LEU A 125 7.151 -19.840 -0.843 1.00 0.00 C ATOM 1894 CD1 LEU A 125 6.462 -19.108 0.298 1.00 0.00 C ATOM 1895 CD2 LEU A 125 7.997 -20.984 -0.306 1.00 0.00 C ATOM 0 H LEU A 125 7.543 -19.278 -3.574 1.00 0.00 H new ATOM 0 HA LEU A 125 7.245 -21.997 -2.691 1.00 0.00 H new ATOM 0 HB2 LEU A 125 5.544 -19.514 -2.223 1.00 0.00 H new ATOM 0 HB3 LEU A 125 5.424 -21.015 -1.325 1.00 0.00 H new ATOM 0 HG LEU A 125 7.807 -19.137 -1.357 1.00 0.00 H new ATOM 0 HD11 LEU A 125 7.211 -18.746 1.003 1.00 0.00 H new ATOM 0 HD12 LEU A 125 5.899 -18.263 -0.099 1.00 0.00 H new ATOM 0 HD13 LEU A 125 5.782 -19.789 0.809 1.00 0.00 H new ATOM 0 HD21 LEU A 125 8.724 -20.595 0.408 1.00 0.00 H new ATOM 0 HD22 LEU A 125 7.354 -21.710 0.190 1.00 0.00 H new ATOM 0 HD23 LEU A 125 8.521 -21.467 -1.131 1.00 0.00 H new ATOM 1907 N ASN A 126 5.596 -21.176 -5.221 1.00 0.00 N ATOM 1908 CA ASN A 126 4.561 -21.497 -6.199 1.00 0.00 C ATOM 1909 C ASN A 126 3.221 -20.872 -5.824 1.00 0.00 C ATOM 1910 O ASN A 126 3.079 -20.234 -4.781 1.00 0.00 O ATOM 1911 CB ASN A 126 4.420 -23.009 -6.402 1.00 0.00 C ATOM 1912 CG ASN A 126 5.523 -23.598 -7.270 1.00 0.00 C ATOM 1913 OD1 ASN A 126 6.704 -22.997 -7.238 1.00 0.00 O flip ATOM 1914 ND2 ASN A 126 5.310 -24.584 -7.975 1.00 0.00 N flip ATOM 0 H ASN A 126 6.348 -20.598 -5.595 1.00 0.00 H new ATOM 0 HA ASN A 126 4.878 -21.064 -7.148 1.00 0.00 H new ATOM 0 HB2 ASN A 126 4.427 -23.503 -5.430 1.00 0.00 H new ATOM 0 HB3 ASN A 126 3.453 -23.220 -6.860 1.00 0.00 H new ATOM 0 HD21 ASN A 126 4.389 -25.022 -7.975 1.00 0.00 H new ATOM 0 HD22 ASN A 126 6.055 -24.964 -8.559 1.00 0.00 H new ATOM 1921 N TRP A 127 2.241 -21.060 -6.684 1.00 0.00 N ATOM 1922 CA TRP A 127 0.974 -20.363 -6.570 1.00 0.00 C ATOM 1923 C TRP A 127 -0.157 -21.303 -6.178 1.00 0.00 C ATOM 1924 O TRP A 127 -0.448 -22.277 -6.878 1.00 0.00 O ATOM 1925 CB TRP A 127 0.671 -19.678 -7.903 1.00 0.00 C ATOM 1926 CG TRP A 127 1.281 -20.408 -9.059 1.00 0.00 C ATOM 1927 CD1 TRP A 127 0.736 -21.446 -9.753 1.00 0.00 C ATOM 1928 CD2 TRP A 127 2.574 -20.173 -9.631 1.00 0.00 C ATOM 1929 NE1 TRP A 127 1.611 -21.874 -10.718 1.00 0.00 N ATOM 1930 CE2 TRP A 127 2.746 -21.107 -10.666 1.00 0.00 C ATOM 1931 CE3 TRP A 127 3.602 -19.262 -9.364 1.00 0.00 C ATOM 1932 CZ2 TRP A 127 3.903 -21.159 -11.436 1.00 0.00 C ATOM 1933 CZ3 TRP A 127 4.751 -19.315 -10.130 1.00 0.00 C ATOM 1934 CH2 TRP A 127 4.893 -20.258 -11.155 1.00 0.00 C ATOM 0 H TRP A 127 2.298 -21.697 -7.479 1.00 0.00 H new ATOM 0 HA TRP A 127 1.052 -19.619 -5.777 1.00 0.00 H new ATOM 0 HB2 TRP A 127 -0.408 -19.616 -8.042 1.00 0.00 H new ATOM 0 HB3 TRP A 127 1.049 -18.656 -7.880 1.00 0.00 H new ATOM 0 HD1 TRP A 127 -0.241 -21.869 -9.570 1.00 0.00 H new ATOM 0 HE1 TRP A 127 1.444 -22.640 -11.370 1.00 0.00 H new ATOM 0 HE3 TRP A 127 3.500 -18.532 -8.575 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 4.016 -21.885 -12.228 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 5.552 -18.618 -9.935 1.00 0.00 H new ATOM 0 HH2 TRP A 127 5.803 -20.274 -11.736 1.00 0.00 H new ATOM 1945 N VAL A 128 -0.779 -21.010 -5.048 1.00 0.00 N ATOM 1946 CA VAL A 128 -1.948 -21.750 -4.603 1.00 0.00 C ATOM 1947 C VAL A 128 -3.208 -21.026 -5.064 1.00 0.00 C ATOM 1948 O VAL A 128 -3.449 -19.882 -4.675 1.00 0.00 O ATOM 1949 CB VAL A 128 -1.972 -21.903 -3.066 1.00 0.00 C ATOM 1950 CG1 VAL A 128 -3.160 -22.747 -2.619 1.00 0.00 C ATOM 1951 CG2 VAL A 128 -0.667 -22.511 -2.569 1.00 0.00 C ATOM 0 H VAL A 128 -0.492 -20.260 -4.419 1.00 0.00 H new ATOM 0 HA VAL A 128 -1.906 -22.748 -5.039 1.00 0.00 H new ATOM 0 HB VAL A 128 -2.080 -20.910 -2.629 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -3.153 -22.839 -1.533 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -4.086 -22.268 -2.937 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -3.091 -23.738 -3.067 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -0.702 -22.611 -1.484 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -0.528 -23.494 -3.020 1.00 0.00 H new ATOM 0 HG23 VAL A 128 0.165 -21.864 -2.847 1.00 0.00 H new ATOM 1961 N PRO A 129 -4.002 -21.666 -5.931 1.00 0.00 N ATOM 1962 CA PRO A 129 -5.226 -21.071 -6.472 1.00 0.00 C ATOM 1963 C PRO A 129 -6.268 -20.800 -5.394 1.00 0.00 C ATOM 1964 O PRO A 129 -6.488 -21.622 -4.500 1.00 0.00 O ATOM 1965 CB PRO A 129 -5.740 -22.125 -7.456 1.00 0.00 C ATOM 1966 CG PRO A 129 -5.108 -23.399 -7.018 1.00 0.00 C ATOM 1967 CD PRO A 129 -3.770 -23.018 -6.459 1.00 0.00 C ATOM 0 HA PRO A 129 -5.032 -20.102 -6.931 1.00 0.00 H new ATOM 0 HB2 PRO A 129 -6.827 -22.194 -7.429 1.00 0.00 H new ATOM 0 HB3 PRO A 129 -5.462 -21.878 -8.481 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -5.718 -23.900 -6.266 1.00 0.00 H new ATOM 0 HG3 PRO A 129 -5.000 -24.090 -7.854 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -3.449 -23.706 -5.677 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -2.996 -23.024 -7.226 1.00 0.00 H new ATOM 1975 N ASN A 130 -6.900 -19.643 -5.483 1.00 0.00 N ATOM 1976 CA ASN A 130 -7.948 -19.274 -4.551 1.00 0.00 C ATOM 1977 C ASN A 130 -9.282 -19.792 -5.073 1.00 0.00 C ATOM 1978 O ASN A 130 -9.555 -19.703 -6.269 1.00 0.00 O ATOM 1979 CB ASN A 130 -7.977 -17.751 -4.369 1.00 0.00 C ATOM 1980 CG ASN A 130 -8.857 -17.312 -3.214 1.00 0.00 C ATOM 1981 OD1 ASN A 130 -8.434 -17.336 -2.057 1.00 0.00 O ATOM 1982 ND2 ASN A 130 -10.063 -16.862 -3.516 1.00 0.00 N ATOM 0 H ASN A 130 -6.703 -18.940 -6.196 1.00 0.00 H new ATOM 0 HA ASN A 130 -7.755 -19.722 -3.576 1.00 0.00 H new ATOM 0 HB2 ASN A 130 -6.962 -17.390 -4.203 1.00 0.00 H new ATOM 0 HB3 ASN A 130 -8.334 -17.287 -5.288 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -10.679 -16.519 -2.779 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -10.378 -16.858 -4.486 1.00 0.00 H new ATOM 1989 N MET A 131 -10.095 -20.357 -4.188 1.00 0.00 N ATOM 1990 CA MET A 131 -11.346 -20.989 -4.600 1.00 0.00 C ATOM 1991 C MET A 131 -12.338 -19.955 -5.106 1.00 0.00 C ATOM 1992 O MET A 131 -13.020 -20.180 -6.108 1.00 0.00 O ATOM 1993 CB MET A 131 -11.971 -21.777 -3.446 1.00 0.00 C ATOM 1994 CG MET A 131 -11.125 -22.948 -2.974 1.00 0.00 C ATOM 1995 SD MET A 131 -11.975 -23.975 -1.757 1.00 0.00 S ATOM 1996 CE MET A 131 -12.281 -22.780 -0.456 1.00 0.00 C ATOM 0 H MET A 131 -9.913 -20.391 -3.185 1.00 0.00 H new ATOM 0 HA MET A 131 -11.110 -21.679 -5.410 1.00 0.00 H new ATOM 0 HB2 MET A 131 -12.141 -21.102 -2.607 1.00 0.00 H new ATOM 0 HB3 MET A 131 -12.947 -22.148 -3.759 1.00 0.00 H new ATOM 0 HG2 MET A 131 -10.850 -23.561 -3.832 1.00 0.00 H new ATOM 0 HG3 MET A 131 -10.198 -22.571 -2.541 1.00 0.00 H new ATOM 0 HE1 MET A 131 -12.570 -23.302 0.456 1.00 0.00 H new ATOM 0 HE2 MET A 131 -11.375 -22.202 -0.272 1.00 0.00 H new ATOM 0 HE3 MET A 131 -13.084 -22.109 -0.760 1.00 0.00 H new ATOM 2006 N ASP A 132 -12.407 -18.829 -4.399 1.00 0.00 N ATOM 2007 CA ASP A 132 -13.322 -17.739 -4.738 1.00 0.00 C ATOM 2008 C ASP A 132 -14.780 -18.171 -4.640 1.00 0.00 C ATOM 2009 O ASP A 132 -15.092 -19.309 -4.269 1.00 0.00 O ATOM 2010 CB ASP A 132 -13.039 -17.184 -6.142 1.00 0.00 C ATOM 2011 CG ASP A 132 -12.072 -16.019 -6.127 1.00 0.00 C ATOM 2012 OD1 ASP A 132 -10.851 -16.256 -6.007 1.00 0.00 O ATOM 2013 OD2 ASP A 132 -12.530 -14.861 -6.233 1.00 0.00 O ATOM 0 H ASP A 132 -11.832 -18.646 -3.577 1.00 0.00 H new ATOM 0 HA ASP A 132 -13.148 -16.950 -4.007 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -12.633 -17.979 -6.767 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -13.977 -16.867 -6.598 1.00 0.00 H new ATOM 2018 N LEU A 133 -15.659 -17.239 -4.968 1.00 0.00 N ATOM 2019 CA LEU A 133 -17.098 -17.442 -4.922 1.00 0.00 C ATOM 2020 C LEU A 133 -17.744 -16.129 -5.337 1.00 0.00 C ATOM 2021 O LEU A 133 -17.162 -15.072 -5.100 1.00 0.00 O ATOM 2022 CB LEU A 133 -17.533 -17.847 -3.499 1.00 0.00 C ATOM 2023 CG LEU A 133 -18.847 -18.637 -3.381 1.00 0.00 C ATOM 2024 CD1 LEU A 133 -20.057 -17.725 -3.493 1.00 0.00 C ATOM 2025 CD2 LEU A 133 -18.904 -19.731 -4.436 1.00 0.00 C ATOM 0 H LEU A 133 -15.389 -16.306 -5.279 1.00 0.00 H new ATOM 0 HA LEU A 133 -17.405 -18.245 -5.592 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -16.736 -18.443 -3.055 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -17.625 -16.941 -2.900 1.00 0.00 H new ATOM 0 HG LEU A 133 -18.871 -19.099 -2.394 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -20.968 -18.317 -3.405 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -20.028 -16.983 -2.695 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -20.044 -17.220 -4.459 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -19.840 -20.281 -4.339 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -18.847 -19.283 -5.428 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -18.066 -20.414 -4.298 1.00 0.00 H new ATOM 2037 N VAL A 134 -18.897 -16.181 -5.990 1.00 0.00 N ATOM 2038 CA VAL A 134 -19.598 -14.964 -6.373 1.00 0.00 C ATOM 2039 C VAL A 134 -19.865 -14.086 -5.143 1.00 0.00 C ATOM 2040 O VAL A 134 -20.770 -14.348 -4.347 1.00 0.00 O ATOM 2041 CB VAL A 134 -20.913 -15.266 -7.140 1.00 0.00 C ATOM 2042 CG1 VAL A 134 -21.824 -16.198 -6.353 1.00 0.00 C ATOM 2043 CG2 VAL A 134 -21.638 -13.976 -7.493 1.00 0.00 C ATOM 0 H VAL A 134 -19.364 -17.046 -6.264 1.00 0.00 H new ATOM 0 HA VAL A 134 -18.951 -14.414 -7.057 1.00 0.00 H new ATOM 0 HB VAL A 134 -20.643 -15.777 -8.064 1.00 0.00 H new ATOM 0 HG11 VAL A 134 -22.734 -16.385 -6.924 1.00 0.00 H new ATOM 0 HG12 VAL A 134 -21.309 -17.142 -6.171 1.00 0.00 H new ATOM 0 HG13 VAL A 134 -22.082 -15.736 -5.400 1.00 0.00 H new ATOM 0 HG21 VAL A 134 -22.557 -14.210 -8.030 1.00 0.00 H new ATOM 0 HG22 VAL A 134 -21.880 -13.433 -6.579 1.00 0.00 H new ATOM 0 HG23 VAL A 134 -20.997 -13.359 -8.123 1.00 0.00 H new ATOM 2053 N ILE A 135 -19.046 -13.048 -4.987 1.00 0.00 N ATOM 2054 CA ILE A 135 -19.118 -12.157 -3.826 1.00 0.00 C ATOM 2055 C ILE A 135 -20.354 -11.254 -3.851 1.00 0.00 C ATOM 2056 O ILE A 135 -20.413 -10.250 -3.139 1.00 0.00 O ATOM 2057 CB ILE A 135 -17.850 -11.270 -3.690 1.00 0.00 C ATOM 2058 CG1 ILE A 135 -17.715 -10.264 -4.854 1.00 0.00 C ATOM 2059 CG2 ILE A 135 -16.602 -12.136 -3.582 1.00 0.00 C ATOM 2060 CD1 ILE A 135 -17.363 -10.880 -6.196 1.00 0.00 C ATOM 0 H ILE A 135 -18.317 -12.800 -5.656 1.00 0.00 H new ATOM 0 HA ILE A 135 -19.187 -12.819 -2.963 1.00 0.00 H new ATOM 0 HB ILE A 135 -17.958 -10.689 -2.774 1.00 0.00 H new ATOM 0 HG12 ILE A 135 -18.654 -9.721 -4.956 1.00 0.00 H new ATOM 0 HG13 ILE A 135 -16.950 -9.532 -4.595 1.00 0.00 H new ATOM 0 HG21 ILE A 135 -15.723 -11.498 -3.487 1.00 0.00 H new ATOM 0 HG22 ILE A 135 -16.680 -12.779 -2.705 1.00 0.00 H new ATOM 0 HG23 ILE A 135 -16.508 -12.752 -4.476 1.00 0.00 H new ATOM 0 HD11 ILE A 135 -17.291 -10.095 -6.949 1.00 0.00 H new ATOM 0 HD12 ILE A 135 -16.407 -11.398 -6.119 1.00 0.00 H new ATOM 0 HD13 ILE A 135 -18.138 -11.590 -6.485 1.00 0.00 H new ATOM 2072 N GLY A 136 -21.345 -11.620 -4.649 1.00 0.00 N ATOM 2073 CA GLY A 136 -22.561 -10.854 -4.706 1.00 0.00 C ATOM 2074 C GLY A 136 -22.568 -9.852 -5.833 1.00 0.00 C ATOM 2075 O GLY A 136 -22.128 -8.713 -5.663 1.00 0.00 O ATOM 0 H GLY A 136 -21.324 -12.438 -5.258 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -23.407 -11.532 -4.823 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -22.700 -10.331 -3.760 1.00 0.00 H new ATOM 2079 N GLU A 137 -23.049 -10.276 -6.994 1.00 0.00 N ATOM 2080 CA GLU A 137 -23.270 -9.358 -8.096 1.00 0.00 C ATOM 2081 C GLU A 137 -24.352 -8.373 -7.682 1.00 0.00 C ATOM 2082 O GLU A 137 -25.376 -8.788 -7.136 1.00 0.00 O ATOM 2083 CB GLU A 137 -23.684 -10.115 -9.361 1.00 0.00 C ATOM 2084 CG GLU A 137 -23.774 -9.233 -10.596 1.00 0.00 C ATOM 2085 CD GLU A 137 -24.155 -10.005 -11.843 1.00 0.00 C ATOM 2086 OE1 GLU A 137 -23.310 -10.770 -12.357 1.00 0.00 O ATOM 2087 OE2 GLU A 137 -25.295 -9.846 -12.323 1.00 0.00 O ATOM 0 H GLU A 137 -23.292 -11.246 -7.194 1.00 0.00 H new ATOM 0 HA GLU A 137 -22.347 -8.825 -8.325 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -22.967 -10.914 -9.547 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -24.651 -10.588 -9.191 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -24.509 -8.447 -10.422 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -22.814 -8.742 -10.757 1.00 0.00 H new ATOM 2094 N VAL A 138 -24.106 -7.087 -7.922 1.00 0.00 N ATOM 2095 CA VAL A 138 -24.979 -6.018 -7.437 1.00 0.00 C ATOM 2096 C VAL A 138 -26.452 -6.341 -7.664 1.00 0.00 C ATOM 2097 O VAL A 138 -26.889 -6.563 -8.794 1.00 0.00 O ATOM 2098 CB VAL A 138 -24.650 -4.668 -8.103 1.00 0.00 C ATOM 2099 CG1 VAL A 138 -25.532 -3.564 -7.540 1.00 0.00 C ATOM 2100 CG2 VAL A 138 -23.179 -4.327 -7.918 1.00 0.00 C ATOM 0 H VAL A 138 -23.301 -6.757 -8.455 1.00 0.00 H new ATOM 0 HA VAL A 138 -24.796 -5.940 -6.365 1.00 0.00 H new ATOM 0 HB VAL A 138 -24.851 -4.753 -9.171 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -25.284 -2.619 -8.023 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -26.579 -3.804 -7.727 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -25.366 -3.477 -6.466 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -22.965 -3.370 -8.395 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -22.952 -4.261 -6.854 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -22.565 -5.105 -8.373 1.00 0.00 H new ATOM 2110 N LEU A 139 -27.200 -6.384 -6.573 1.00 0.00 N ATOM 2111 CA LEU A 139 -28.620 -6.691 -6.627 1.00 0.00 C ATOM 2112 C LEU A 139 -29.403 -5.467 -7.064 1.00 0.00 C ATOM 2113 O LEU A 139 -29.109 -4.347 -6.642 1.00 0.00 O ATOM 2114 CB LEU A 139 -29.120 -7.177 -5.263 1.00 0.00 C ATOM 2115 CG LEU A 139 -28.505 -8.491 -4.780 1.00 0.00 C ATOM 2116 CD1 LEU A 139 -29.038 -8.857 -3.403 1.00 0.00 C ATOM 2117 CD2 LEU A 139 -28.782 -9.609 -5.774 1.00 0.00 C ATOM 0 H LEU A 139 -26.844 -6.209 -5.633 1.00 0.00 H new ATOM 0 HA LEU A 139 -28.773 -7.488 -7.355 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -28.917 -6.404 -4.522 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -30.202 -7.296 -5.311 1.00 0.00 H new ATOM 0 HG LEU A 139 -27.426 -8.357 -4.706 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -28.589 -9.795 -3.076 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -28.787 -8.068 -2.694 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -30.121 -8.971 -3.450 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -28.336 -10.536 -5.413 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -29.859 -9.742 -5.882 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -28.350 -9.352 -6.741 1.00 0.00 H new ATOM 2129 N ALA A 140 -30.391 -5.685 -7.912 1.00 0.00 N ATOM 2130 CA ALA A 140 -31.200 -4.601 -8.431 1.00 0.00 C ATOM 2131 C ALA A 140 -32.616 -5.073 -8.704 1.00 0.00 C ATOM 2132 O ALA A 140 -32.833 -6.184 -9.191 1.00 0.00 O ATOM 2133 CB ALA A 140 -30.577 -4.032 -9.696 1.00 0.00 C ATOM 0 H ALA A 140 -30.653 -6.609 -8.257 1.00 0.00 H new ATOM 0 HA ALA A 140 -31.240 -3.813 -7.679 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -31.197 -3.219 -10.073 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -29.579 -3.654 -9.472 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -30.507 -4.815 -10.451 1.00 0.00 H new ATOM 2139 N GLU A 141 -33.573 -4.225 -8.383 1.00 0.00 N ATOM 2140 CA GLU A 141 -34.972 -4.511 -8.629 1.00 0.00 C ATOM 2141 C GLU A 141 -35.298 -4.170 -10.072 1.00 0.00 C ATOM 2142 O GLU A 141 -35.906 -4.962 -10.793 1.00 0.00 O ATOM 2143 CB GLU A 141 -35.869 -3.694 -7.689 1.00 0.00 C ATOM 2144 CG GLU A 141 -35.667 -3.983 -6.206 1.00 0.00 C ATOM 2145 CD GLU A 141 -34.328 -3.509 -5.670 1.00 0.00 C ATOM 2146 OE1 GLU A 141 -33.997 -2.316 -5.843 1.00 0.00 O ATOM 2147 OE2 GLU A 141 -33.601 -4.328 -5.076 1.00 0.00 O ATOM 0 H GLU A 141 -33.403 -3.320 -7.945 1.00 0.00 H new ATOM 0 HA GLU A 141 -35.156 -5.569 -8.442 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -35.688 -2.634 -7.867 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -36.911 -3.887 -7.944 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -36.466 -3.504 -5.639 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -35.756 -5.056 -6.038 1.00 0.00 H new ATOM 2154 N VAL A 142 -34.858 -2.989 -10.483 1.00 0.00 N ATOM 2155 CA VAL A 142 -35.075 -2.503 -11.831 1.00 0.00 C ATOM 2156 C VAL A 142 -34.176 -1.294 -12.106 1.00 0.00 C ATOM 2157 O VAL A 142 -34.523 -0.161 -11.698 1.00 0.00 O ATOM 2158 CB VAL A 142 -36.570 -2.163 -12.090 1.00 0.00 C ATOM 2159 CG1 VAL A 142 -37.147 -1.279 -10.990 1.00 0.00 C ATOM 2160 CG2 VAL A 142 -36.750 -1.511 -13.453 1.00 0.00 C ATOM 2161 OXT VAL A 142 -33.102 -1.488 -12.713 1.00 0.00 O ATOM 0 H VAL A 142 -34.340 -2.343 -9.887 1.00 0.00 H new ATOM 0 HA VAL A 142 -34.808 -3.301 -12.524 1.00 0.00 H new ATOM 0 HB VAL A 142 -37.123 -3.102 -12.081 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -38.193 -1.064 -11.207 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -37.074 -1.795 -10.033 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -36.587 -0.345 -10.942 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -37.804 -1.283 -13.611 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -36.169 -0.590 -13.495 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -36.406 -2.193 -14.231 1.00 0.00 H new TER 2171 VAL A 142