USER MOD reduce.3.24.130724 H: found=0, std=0, add=1271, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1271 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 139 HIS :FLIP no HE2:sc= -7.48! C(o=-10!,f=-8.7!) USER MOD Set 1.2: A 141 MET CE :methyl -109:sc= -1.19 (180deg=-0.382) USER MOD Set 2.1: A 100 HIS : no HD1:sc= -0.819 X(o=-3.4,f=-3.7) USER MOD Set 2.2: A 101 SER OG : rot -93:sc= -2.53! USER MOD Set 3.1: A 61 GLN :FLIP amide:sc= -0.0886 F(o=-1.5,f=-0.28) USER MOD Set 3.2: A 62 GLN :FLIP amide:sc= -0.194 X(o=-0.33,f=-0.28) USER MOD Set 4.1: A 28 GLN : amide:sc= -0.172 K(o=1,f=-6.4) USER MOD Set 4.2: A 34 LYS NZ :NH3+ -124:sc= 1.22 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ 134:sc= 0.0711 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 88:sc= 1.34 USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 7 MET CE :methyl -114:sc= -0.0726 (180deg=-1.87) USER MOD Single : A 12 LYS NZ :NH3+ -179:sc= 1.24 (180deg=1.2) USER MOD Single : A 19 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.118) USER MOD Single : A 23 THR OG1 : rot -173:sc= 0.176 USER MOD Single : A 25 LYS NZ :NH3+ -168:sc=-0.00257 (180deg=-0.122) USER MOD Single : A 26 GLN :FLIP amide:sc= 0.303 F(o=-3.2!,f=0.3) USER MOD Single : A 35 MET CE :methyl -178:sc=-0.00399 (180deg=-0.0173) USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=0.0024) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= 0 K(o=0,f=-0.91) USER MOD Single : A 44 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0.0133 USER MOD Single : A 46 ASN : amide:sc= -0.0263 X(o=-0.026,f=-0.02) USER MOD Single : A 49 LYS NZ :NH3+ 179:sc= 2.09 (180deg=2.01) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ -169:sc= -0.0218 (180deg=-0.205) USER MOD Single : A 64 CYS SG : rot 3:sc= -1.55! USER MOD Single : A 66 MET CE :methyl -173:sc= -1.02 (180deg=-1.2) USER MOD Single : A 68 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= 0.816 K(o=0.82,f=-0.18) USER MOD Single : A 83 ASN :FLIP amide:sc= -0.117 F(o=-1,f=-0.12) USER MOD Single : A 85 TYR OH : rot 18:sc= 1.27 USER MOD Single : A 87 SER OG : rot -69:sc= 0.685 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 112 MET CE :methyl -178:sc= -0.243 (180deg=-0.253) USER MOD Single : A 114 LYS NZ :NH3+ -149:sc= 1.24 (180deg=1.16) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 GLN :FLIP amide:sc= -2.64! C(o=-3.7!,f=-2.6!) USER MOD Single : A 118 ASN : amide:sc= 0.637 K(o=0.64,f=0) USER MOD Single : A 125 GLN : amide:sc= -0.684 X(o=-0.68,f=-0.87) USER MOD Single : A 127 LYS NZ :NH3+ 160:sc= -3.09! (180deg=-3.63!) USER MOD Single : A 128 GLN : amide:sc= -0.052 K(o=-0.052,f=-0.72) USER MOD Single : A 132 THR OG1 : rot 137:sc= -1.78! USER MOD Single : A 136 LYS NZ :NH3+ -179:sc= 0.551 (180deg=0.549) USER MOD Single : A 147 CYS SG : rot 44:sc= -3.54! USER MOD Single : A 149 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 155 ASN : amide:sc= 1.21 K(o=1.2,f=-0.043) USER MOD Single : A 159 GLN : amide:sc= -0.27 X(o=-0.27,f=-0.14) USER MOD Single : A 160 SER OG : rot 180:sc= 0 USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -17.150 -12.476 -10.308 1.00 0.00 N ATOM 2 CA GLY A 1 -15.861 -11.871 -9.902 1.00 0.00 C ATOM 3 C GLY A 1 -16.008 -11.011 -8.667 1.00 0.00 C ATOM 4 O GLY A 1 -17.108 -10.559 -8.346 1.00 0.00 O ATOM 0 H1 GLY A 1 -17.279 -12.363 -11.334 1.00 0.00 H new ATOM 0 H2 GLY A 1 -17.149 -13.488 -10.068 1.00 0.00 H new ATOM 0 H3 GLY A 1 -17.929 -12.002 -9.807 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -15.134 -12.660 -9.711 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -15.469 -11.267 -10.721 1.00 0.00 H new ATOM 10 N THR A 2 -14.905 -10.788 -7.973 1.00 0.00 N ATOM 11 CA THR A 2 -14.920 -10.029 -6.738 1.00 0.00 C ATOM 12 C THR A 2 -14.864 -8.524 -6.987 1.00 0.00 C ATOM 13 O THR A 2 -13.786 -7.950 -7.146 1.00 0.00 O ATOM 14 CB THR A 2 -13.746 -10.452 -5.839 1.00 0.00 C ATOM 15 OG1 THR A 2 -12.709 -11.033 -6.644 1.00 0.00 O ATOM 16 CG2 THR A 2 -14.201 -11.449 -4.785 1.00 0.00 C ATOM 0 H THR A 2 -13.982 -11.125 -8.248 1.00 0.00 H new ATOM 0 HA THR A 2 -15.863 -10.247 -6.237 1.00 0.00 H new ATOM 0 HB THR A 2 -13.363 -9.568 -5.330 1.00 0.00 H new ATOM 0 HG1 THR A 2 -12.110 -10.327 -6.966 1.00 0.00 H new ATOM 0 HG21 THR A 2 -13.353 -11.733 -4.162 1.00 0.00 H new ATOM 0 HG22 THR A 2 -14.972 -10.994 -4.163 1.00 0.00 H new ATOM 0 HG23 THR A 2 -14.605 -12.336 -5.273 1.00 0.00 H new ATOM 24 N VAL A 3 -16.036 -7.902 -7.048 1.00 0.00 N ATOM 25 CA VAL A 3 -16.144 -6.451 -7.106 1.00 0.00 C ATOM 26 C VAL A 3 -17.078 -5.962 -6.007 1.00 0.00 C ATOM 27 O VAL A 3 -18.277 -6.248 -6.023 1.00 0.00 O ATOM 28 CB VAL A 3 -16.662 -5.949 -8.480 1.00 0.00 C ATOM 29 CG1 VAL A 3 -17.039 -4.471 -8.419 1.00 0.00 C ATOM 30 CG2 VAL A 3 -15.620 -6.167 -9.565 1.00 0.00 C ATOM 0 H VAL A 3 -16.933 -8.387 -7.059 1.00 0.00 H new ATOM 0 HA VAL A 3 -15.142 -6.047 -6.964 1.00 0.00 H new ATOM 0 HB VAL A 3 -17.553 -6.527 -8.724 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -17.398 -4.147 -9.396 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -17.824 -4.326 -7.677 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -16.164 -3.883 -8.141 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -16.007 -5.807 -10.518 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -14.712 -5.620 -9.312 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -15.393 -7.230 -9.643 1.00 0.00 H new ATOM 40 N GLN A 4 -16.523 -5.251 -5.039 1.00 0.00 N ATOM 41 CA GLN A 4 -17.322 -4.681 -3.964 1.00 0.00 C ATOM 42 C GLN A 4 -17.309 -3.164 -4.053 1.00 0.00 C ATOM 43 O GLN A 4 -16.301 -2.567 -4.443 1.00 0.00 O ATOM 44 CB GLN A 4 -16.812 -5.136 -2.595 1.00 0.00 C ATOM 45 CG GLN A 4 -16.903 -6.638 -2.379 1.00 0.00 C ATOM 46 CD GLN A 4 -16.569 -7.045 -0.956 1.00 0.00 C ATOM 47 OE1 GLN A 4 -15.791 -6.382 -0.270 1.00 0.00 O ATOM 48 NE2 GLN A 4 -17.155 -8.141 -0.501 1.00 0.00 N ATOM 0 H GLN A 4 -15.524 -5.054 -4.975 1.00 0.00 H new ATOM 0 HA GLN A 4 -18.346 -5.037 -4.076 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -15.774 -4.823 -2.481 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -17.384 -4.630 -1.817 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -17.910 -6.976 -2.622 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -16.223 -7.142 -3.066 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -17.794 -8.664 -1.100 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -16.968 -8.463 0.449 1.00 0.00 H new ATOM 57 N GLU A 5 -18.428 -2.548 -3.703 1.00 0.00 N ATOM 58 CA GLU A 5 -18.565 -1.105 -3.804 1.00 0.00 C ATOM 59 C GLU A 5 -18.598 -0.447 -2.433 1.00 0.00 C ATOM 60 O GLU A 5 -19.548 -0.615 -1.666 1.00 0.00 O ATOM 61 CB GLU A 5 -19.822 -0.739 -4.594 1.00 0.00 C ATOM 62 CG GLU A 5 -19.701 -1.026 -6.080 1.00 0.00 C ATOM 63 CD GLU A 5 -20.968 -0.722 -6.848 1.00 0.00 C ATOM 64 OE1 GLU A 5 -21.148 0.440 -7.271 1.00 0.00 O ATOM 65 OE2 GLU A 5 -21.782 -1.645 -7.046 1.00 0.00 O ATOM 0 H GLU A 5 -19.255 -3.027 -3.346 1.00 0.00 H new ATOM 0 HA GLU A 5 -17.690 -0.730 -4.334 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -20.670 -1.293 -4.192 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -20.037 0.320 -4.452 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -18.883 -0.436 -6.493 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -19.440 -2.075 -6.221 1.00 0.00 H new ATOM 72 N ILE A 6 -17.549 0.298 -2.136 1.00 0.00 N ATOM 73 CA ILE A 6 -17.490 1.095 -0.925 1.00 0.00 C ATOM 74 C ILE A 6 -17.697 2.551 -1.312 1.00 0.00 C ATOM 75 O ILE A 6 -17.194 2.994 -2.341 1.00 0.00 O ATOM 76 CB ILE A 6 -16.140 0.928 -0.162 1.00 0.00 C ATOM 77 CG1 ILE A 6 -15.964 -0.508 0.364 1.00 0.00 C ATOM 78 CG2 ILE A 6 -16.048 1.916 0.997 1.00 0.00 C ATOM 79 CD1 ILE A 6 -15.635 -1.532 -0.704 1.00 0.00 C ATOM 0 H ILE A 6 -16.718 0.368 -2.724 1.00 0.00 H new ATOM 0 HA ILE A 6 -18.271 0.754 -0.245 1.00 0.00 H new ATOM 0 HB ILE A 6 -15.339 1.135 -0.872 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -15.170 -0.513 1.111 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -16.881 -0.811 0.870 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -15.098 1.782 1.515 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -16.111 2.934 0.613 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -16.869 1.739 1.692 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -15.528 -2.515 -0.245 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -16.438 -1.560 -1.440 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -14.702 -1.258 -1.196 1.00 0.00 H new ATOM 91 N MET A 7 -18.461 3.281 -0.522 1.00 0.00 N ATOM 92 CA MET A 7 -18.809 4.646 -0.878 1.00 0.00 C ATOM 93 C MET A 7 -17.861 5.633 -0.211 1.00 0.00 C ATOM 94 O MET A 7 -17.686 5.627 1.008 1.00 0.00 O ATOM 95 CB MET A 7 -20.267 4.931 -0.515 1.00 0.00 C ATOM 96 CG MET A 7 -21.231 3.907 -1.099 1.00 0.00 C ATOM 97 SD MET A 7 -22.958 4.422 -1.010 1.00 0.00 S ATOM 98 CE MET A 7 -22.958 5.758 -2.202 1.00 0.00 C ATOM 0 H MET A 7 -18.850 2.957 0.363 1.00 0.00 H new ATOM 0 HA MET A 7 -18.702 4.769 -1.956 1.00 0.00 H new ATOM 0 HB2 MET A 7 -20.371 4.944 0.570 1.00 0.00 H new ATOM 0 HB3 MET A 7 -20.538 5.924 -0.873 1.00 0.00 H new ATOM 0 HG2 MET A 7 -20.967 3.722 -2.140 1.00 0.00 H new ATOM 0 HG3 MET A 7 -21.113 2.963 -0.568 1.00 0.00 H new ATOM 0 HE1 MET A 7 -23.148 6.702 -1.691 1.00 0.00 H new ATOM 0 HE2 MET A 7 -21.989 5.803 -2.698 1.00 0.00 H new ATOM 0 HE3 MET A 7 -23.737 5.584 -2.944 1.00 0.00 H new ATOM 108 N ILE A 8 -17.229 6.453 -1.037 1.00 0.00 N ATOM 109 CA ILE A 8 -16.213 7.393 -0.594 1.00 0.00 C ATOM 110 C ILE A 8 -16.815 8.779 -0.383 1.00 0.00 C ATOM 111 O ILE A 8 -17.291 9.424 -1.328 1.00 0.00 O ATOM 112 CB ILE A 8 -15.034 7.466 -1.607 1.00 0.00 C ATOM 113 CG1 ILE A 8 -14.068 6.280 -1.427 1.00 0.00 C ATOM 114 CG2 ILE A 8 -14.267 8.776 -1.470 1.00 0.00 C ATOM 115 CD1 ILE A 8 -14.712 4.914 -1.501 1.00 0.00 C ATOM 0 H ILE A 8 -17.409 6.484 -2.041 1.00 0.00 H new ATOM 0 HA ILE A 8 -15.822 7.034 0.358 1.00 0.00 H new ATOM 0 HB ILE A 8 -15.468 7.416 -2.606 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -13.294 6.342 -2.192 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -13.571 6.379 -0.462 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -13.450 8.796 -2.191 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -14.939 9.613 -1.660 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -13.863 8.857 -0.461 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -13.952 4.145 -1.363 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -15.465 4.824 -0.718 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -15.184 4.787 -2.475 1.00 0.00 H new ATOM 127 N PRO A 9 -16.813 9.234 0.875 1.00 0.00 N ATOM 128 CA PRO A 9 -17.326 10.549 1.266 1.00 0.00 C ATOM 129 C PRO A 9 -16.539 11.702 0.653 1.00 0.00 C ATOM 130 O PRO A 9 -15.330 11.595 0.420 1.00 0.00 O ATOM 131 CB PRO A 9 -17.138 10.561 2.792 1.00 0.00 C ATOM 132 CG PRO A 9 -17.065 9.127 3.169 1.00 0.00 C ATOM 133 CD PRO A 9 -16.327 8.479 2.040 1.00 0.00 C ATOM 0 HA PRO A 9 -18.354 10.688 0.930 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -16.230 11.093 3.076 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -17.969 11.061 3.290 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -16.541 8.992 4.115 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -18.059 8.698 3.291 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -15.247 8.564 2.158 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -16.556 7.416 1.961 1.00 0.00 H new ATOM 141 N ALA A 10 -17.229 12.802 0.383 1.00 0.00 N ATOM 142 CA ALA A 10 -16.560 14.039 0.029 1.00 0.00 C ATOM 143 C ALA A 10 -15.803 14.537 1.249 1.00 0.00 C ATOM 144 O ALA A 10 -16.346 14.556 2.350 1.00 0.00 O ATOM 145 CB ALA A 10 -17.555 15.083 -0.455 1.00 0.00 C ATOM 0 H ALA A 10 -18.247 12.860 0.403 1.00 0.00 H new ATOM 0 HA ALA A 10 -15.865 13.858 -0.791 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -17.024 15.999 -0.713 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -18.078 14.707 -1.334 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -18.276 15.292 0.335 1.00 0.00 H new ATOM 151 N GLY A 11 -14.551 14.909 1.065 1.00 0.00 N ATOM 152 CA GLY A 11 -13.698 15.190 2.200 1.00 0.00 C ATOM 153 C GLY A 11 -12.774 14.023 2.467 1.00 0.00 C ATOM 154 O GLY A 11 -11.578 14.202 2.689 1.00 0.00 O ATOM 0 H GLY A 11 -14.108 15.022 0.153 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -13.112 16.089 2.009 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -14.308 15.388 3.081 1.00 0.00 H new ATOM 158 N LYS A 12 -13.332 12.815 2.418 1.00 0.00 N ATOM 159 CA LYS A 12 -12.535 11.601 2.527 1.00 0.00 C ATOM 160 C LYS A 12 -11.729 11.393 1.257 1.00 0.00 C ATOM 161 O LYS A 12 -10.675 10.765 1.273 1.00 0.00 O ATOM 162 CB LYS A 12 -13.409 10.374 2.771 1.00 0.00 C ATOM 163 CG LYS A 12 -13.366 9.864 4.199 1.00 0.00 C ATOM 164 CD LYS A 12 -14.004 10.845 5.167 1.00 0.00 C ATOM 165 CE LYS A 12 -14.008 10.296 6.587 1.00 0.00 C ATOM 166 NZ LYS A 12 -14.453 11.309 7.583 1.00 0.00 N ATOM 0 H LYS A 12 -14.333 12.654 2.304 1.00 0.00 H new ATOM 0 HA LYS A 12 -11.867 11.723 3.379 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -14.440 10.617 2.513 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -13.092 9.575 2.100 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -13.883 8.906 4.259 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -12.331 9.686 4.491 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -13.461 11.790 5.141 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -15.026 11.056 4.853 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -14.665 9.428 6.637 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -13.006 9.953 6.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -14.423 10.895 8.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -13.822 12.135 7.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -15.425 11.606 7.365 1.00 0.00 H new ATOM 180 N ALA A 13 -12.243 11.933 0.156 1.00 0.00 N ATOM 181 CA ALA A 13 -11.602 11.810 -1.147 1.00 0.00 C ATOM 182 C ALA A 13 -10.134 12.220 -1.088 1.00 0.00 C ATOM 183 O ALA A 13 -9.300 11.660 -1.794 1.00 0.00 O ATOM 184 CB ALA A 13 -12.344 12.649 -2.178 1.00 0.00 C ATOM 0 H ALA A 13 -13.112 12.466 0.143 1.00 0.00 H new ATOM 0 HA ALA A 13 -11.643 10.762 -1.443 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -11.856 12.549 -3.148 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -13.375 12.304 -2.254 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -12.333 13.695 -1.872 1.00 0.00 H new ATOM 190 N GLY A 14 -9.823 13.178 -0.225 1.00 0.00 N ATOM 191 CA GLY A 14 -8.459 13.647 -0.106 1.00 0.00 C ATOM 192 C GLY A 14 -7.498 12.560 0.320 1.00 0.00 C ATOM 193 O GLY A 14 -6.370 12.512 -0.160 1.00 0.00 O ATOM 0 H GLY A 14 -10.491 13.638 0.394 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -8.136 14.056 -1.063 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -8.422 14.462 0.617 1.00 0.00 H new ATOM 197 N LEU A 15 -7.924 11.689 1.221 1.00 0.00 N ATOM 198 CA LEU A 15 -7.086 10.573 1.623 1.00 0.00 C ATOM 199 C LEU A 15 -7.345 9.341 0.758 1.00 0.00 C ATOM 200 O LEU A 15 -6.463 8.509 0.597 1.00 0.00 O ATOM 201 CB LEU A 15 -7.243 10.253 3.119 1.00 0.00 C ATOM 202 CG LEU A 15 -8.670 10.076 3.651 1.00 0.00 C ATOM 203 CD1 LEU A 15 -9.246 8.728 3.259 1.00 0.00 C ATOM 204 CD2 LEU A 15 -8.678 10.225 5.156 1.00 0.00 C ATOM 0 H LEU A 15 -8.833 11.732 1.682 1.00 0.00 H new ATOM 0 HA LEU A 15 -6.050 10.874 1.465 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -6.688 9.339 3.329 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -6.767 11.052 3.687 1.00 0.00 H new ATOM 0 HG LEU A 15 -9.296 10.849 3.204 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -10.258 8.637 3.653 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -9.270 8.645 2.172 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -8.624 7.933 3.670 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -9.694 10.098 5.529 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -8.032 9.468 5.600 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -8.314 11.216 5.425 1.00 0.00 H new ATOM 216 N VAL A 16 -8.557 9.225 0.213 1.00 0.00 N ATOM 217 CA VAL A 16 -8.902 8.093 -0.648 1.00 0.00 C ATOM 218 C VAL A 16 -8.178 8.155 -1.992 1.00 0.00 C ATOM 219 O VAL A 16 -7.448 7.237 -2.353 1.00 0.00 O ATOM 220 CB VAL A 16 -10.423 8.000 -0.899 1.00 0.00 C ATOM 221 CG1 VAL A 16 -10.734 6.905 -1.910 1.00 0.00 C ATOM 222 CG2 VAL A 16 -11.162 7.743 0.402 1.00 0.00 C ATOM 0 H VAL A 16 -9.312 9.897 0.351 1.00 0.00 H new ATOM 0 HA VAL A 16 -8.577 7.202 -0.111 1.00 0.00 H new ATOM 0 HB VAL A 16 -10.761 8.952 -1.308 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -11.811 6.855 -2.073 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -10.234 7.127 -2.853 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -10.380 5.947 -1.529 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -12.232 7.680 0.206 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -10.817 6.805 0.837 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -10.968 8.559 1.098 1.00 0.00 H new ATOM 232 N ILE A 17 -8.387 9.227 -2.744 1.00 0.00 N ATOM 233 CA ILE A 17 -7.738 9.353 -4.041 1.00 0.00 C ATOM 234 C ILE A 17 -6.413 10.086 -3.909 1.00 0.00 C ATOM 235 O ILE A 17 -5.520 9.932 -4.735 1.00 0.00 O ATOM 236 CB ILE A 17 -8.622 10.063 -5.095 1.00 0.00 C ATOM 237 CG1 ILE A 17 -8.967 11.492 -4.672 1.00 0.00 C ATOM 238 CG2 ILE A 17 -9.889 9.261 -5.341 1.00 0.00 C ATOM 239 CD1 ILE A 17 -9.771 12.259 -5.701 1.00 0.00 C ATOM 0 H ILE A 17 -8.989 10.008 -2.485 1.00 0.00 H new ATOM 0 HA ILE A 17 -7.565 8.336 -4.394 1.00 0.00 H new ATOM 0 HB ILE A 17 -8.053 10.124 -6.022 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -9.528 11.459 -3.738 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -8.043 12.034 -4.470 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -10.503 9.770 -6.084 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -9.626 8.268 -5.706 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -10.448 9.169 -4.410 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -9.976 13.263 -5.328 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -9.204 12.326 -6.630 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -10.712 11.742 -5.887 1.00 0.00 H new ATOM 251 N GLY A 18 -6.283 10.862 -2.847 1.00 0.00 N ATOM 252 CA GLY A 18 -5.088 11.650 -2.645 1.00 0.00 C ATOM 253 C GLY A 18 -5.164 12.960 -3.389 1.00 0.00 C ATOM 254 O GLY A 18 -4.144 13.597 -3.643 1.00 0.00 O ATOM 0 H GLY A 18 -6.988 10.961 -2.117 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -4.951 11.841 -1.581 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -4.217 11.088 -2.982 1.00 0.00 H new ATOM 258 N LYS A 19 -6.395 13.343 -3.737 1.00 0.00 N ATOM 259 CA LYS A 19 -6.678 14.533 -4.545 1.00 0.00 C ATOM 260 C LYS A 19 -6.126 14.386 -5.963 1.00 0.00 C ATOM 261 O LYS A 19 -6.889 14.244 -6.914 1.00 0.00 O ATOM 262 CB LYS A 19 -6.142 15.808 -3.884 1.00 0.00 C ATOM 263 CG LYS A 19 -6.890 16.193 -2.615 1.00 0.00 C ATOM 264 CD LYS A 19 -8.381 16.343 -2.876 1.00 0.00 C ATOM 265 CE LYS A 19 -9.122 16.848 -1.649 1.00 0.00 C ATOM 266 NZ LYS A 19 -8.764 18.254 -1.323 1.00 0.00 N ATOM 0 H LYS A 19 -7.233 12.830 -3.463 1.00 0.00 H new ATOM 0 HA LYS A 19 -7.762 14.624 -4.611 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -5.087 15.669 -3.647 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -6.203 16.631 -4.596 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -6.727 15.434 -1.850 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -6.491 17.129 -2.225 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -8.537 17.034 -3.704 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -8.795 15.382 -3.180 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -10.196 16.777 -1.819 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -8.892 16.208 -0.797 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -9.419 18.621 -0.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -7.792 18.288 -0.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -8.831 18.837 -2.181 1.00 0.00 H new ATOM 280 N GLY A 20 -4.807 14.387 -6.089 1.00 0.00 N ATOM 281 CA GLY A 20 -4.179 14.274 -7.390 1.00 0.00 C ATOM 282 C GLY A 20 -4.032 12.834 -7.846 1.00 0.00 C ATOM 283 O GLY A 20 -3.407 12.563 -8.870 1.00 0.00 O ATOM 0 H GLY A 20 -4.156 14.465 -5.307 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -4.769 14.824 -8.123 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -3.195 14.742 -7.356 1.00 0.00 H new ATOM 287 N GLY A 21 -4.590 11.904 -7.079 1.00 0.00 N ATOM 288 CA GLY A 21 -4.547 10.507 -7.471 1.00 0.00 C ATOM 289 C GLY A 21 -3.386 9.758 -6.847 1.00 0.00 C ATOM 290 O GLY A 21 -3.112 8.615 -7.209 1.00 0.00 O ATOM 0 H GLY A 21 -5.069 12.090 -6.198 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -5.481 10.025 -7.184 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -4.475 10.441 -8.557 1.00 0.00 H new ATOM 294 N GLU A 22 -2.711 10.393 -5.894 1.00 0.00 N ATOM 295 CA GLU A 22 -1.537 9.796 -5.265 1.00 0.00 C ATOM 296 C GLU A 22 -1.907 8.556 -4.450 1.00 0.00 C ATOM 297 O GLU A 22 -1.185 7.558 -4.468 1.00 0.00 O ATOM 298 CB GLU A 22 -0.811 10.826 -4.393 1.00 0.00 C ATOM 299 CG GLU A 22 0.465 10.288 -3.760 1.00 0.00 C ATOM 300 CD GLU A 22 1.393 11.384 -3.278 1.00 0.00 C ATOM 301 OE1 GLU A 22 1.037 12.102 -2.324 1.00 0.00 O ATOM 302 OE2 GLU A 22 2.488 11.539 -3.863 1.00 0.00 O ATOM 0 H GLU A 22 -2.955 11.318 -5.541 1.00 0.00 H new ATOM 0 HA GLU A 22 -0.861 9.477 -6.058 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -0.567 11.698 -5.000 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -1.484 11.164 -3.605 1.00 0.00 H new ATOM 0 HG2 GLU A 22 0.204 9.645 -2.920 1.00 0.00 H new ATOM 0 HG3 GLU A 22 0.991 9.667 -4.486 1.00 0.00 H new ATOM 309 N THR A 23 -3.035 8.600 -3.758 1.00 0.00 N ATOM 310 CA THR A 23 -3.482 7.446 -2.997 1.00 0.00 C ATOM 311 C THR A 23 -4.091 6.402 -3.927 1.00 0.00 C ATOM 312 O THR A 23 -3.948 5.206 -3.699 1.00 0.00 O ATOM 313 CB THR A 23 -4.506 7.826 -1.911 1.00 0.00 C ATOM 314 OG1 THR A 23 -4.013 8.928 -1.137 1.00 0.00 O ATOM 315 CG2 THR A 23 -4.783 6.642 -0.991 1.00 0.00 C ATOM 0 H THR A 23 -3.650 9.412 -3.708 1.00 0.00 H new ATOM 0 HA THR A 23 -2.605 7.033 -2.500 1.00 0.00 H new ATOM 0 HB THR A 23 -5.435 8.112 -2.403 1.00 0.00 H new ATOM 0 HG1 THR A 23 -4.618 9.096 -0.384 1.00 0.00 H new ATOM 0 HG21 THR A 23 -5.509 6.933 -0.232 1.00 0.00 H new ATOM 0 HG22 THR A 23 -5.182 5.813 -1.575 1.00 0.00 H new ATOM 0 HG23 THR A 23 -3.857 6.332 -0.507 1.00 0.00 H new ATOM 323 N ILE A 24 -4.750 6.852 -4.994 1.00 0.00 N ATOM 324 CA ILE A 24 -5.330 5.922 -5.957 1.00 0.00 C ATOM 325 C ILE A 24 -4.221 5.173 -6.688 1.00 0.00 C ATOM 326 O ILE A 24 -4.399 4.029 -7.095 1.00 0.00 O ATOM 327 CB ILE A 24 -6.289 6.623 -6.960 1.00 0.00 C ATOM 328 CG1 ILE A 24 -7.694 6.030 -6.842 1.00 0.00 C ATOM 329 CG2 ILE A 24 -5.802 6.518 -8.400 1.00 0.00 C ATOM 330 CD1 ILE A 24 -7.727 4.515 -6.850 1.00 0.00 C ATOM 0 H ILE A 24 -4.893 7.838 -5.210 1.00 0.00 H new ATOM 0 HA ILE A 24 -5.938 5.208 -5.401 1.00 0.00 H new ATOM 0 HB ILE A 24 -6.310 7.681 -6.700 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -8.152 6.388 -5.920 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -8.304 6.401 -7.666 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -6.507 7.023 -9.060 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -4.822 6.987 -8.488 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -5.728 5.468 -8.683 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -8.758 4.173 -6.763 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -7.300 4.147 -7.783 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -7.146 4.134 -6.010 1.00 0.00 H new ATOM 342 N LYS A 25 -3.074 5.829 -6.840 1.00 0.00 N ATOM 343 CA LYS A 25 -1.867 5.161 -7.298 1.00 0.00 C ATOM 344 C LYS A 25 -1.652 3.903 -6.474 1.00 0.00 C ATOM 345 O LYS A 25 -1.572 2.797 -6.997 1.00 0.00 O ATOM 346 CB LYS A 25 -0.660 6.086 -7.121 1.00 0.00 C ATOM 347 CG LYS A 25 0.679 5.387 -7.283 1.00 0.00 C ATOM 348 CD LYS A 25 1.748 6.054 -6.433 1.00 0.00 C ATOM 349 CE LYS A 25 2.168 7.405 -6.991 1.00 0.00 C ATOM 350 NZ LYS A 25 2.925 7.272 -8.265 1.00 0.00 N ATOM 0 H LYS A 25 -2.958 6.825 -6.651 1.00 0.00 H new ATOM 0 HA LYS A 25 -1.975 4.906 -8.352 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -0.726 6.897 -7.847 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -0.705 6.540 -6.131 1.00 0.00 H new ATOM 0 HG2 LYS A 25 0.583 4.339 -6.997 1.00 0.00 H new ATOM 0 HG3 LYS A 25 0.979 5.406 -8.331 1.00 0.00 H new ATOM 0 HD2 LYS A 25 1.374 6.183 -5.417 1.00 0.00 H new ATOM 0 HD3 LYS A 25 2.619 5.402 -6.371 1.00 0.00 H new ATOM 0 HE2 LYS A 25 1.283 8.019 -7.158 1.00 0.00 H new ATOM 0 HE3 LYS A 25 2.783 7.925 -6.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 3.364 8.184 -8.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 3.665 6.549 -8.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 2.276 6.990 -9.027 1.00 0.00 H new ATOM 364 N GLN A 26 -1.609 4.094 -5.171 1.00 0.00 N ATOM 365 CA GLN A 26 -1.349 3.025 -4.235 1.00 0.00 C ATOM 366 C GLN A 26 -2.522 2.054 -4.156 1.00 0.00 C ATOM 367 O GLN A 26 -2.331 0.855 -4.080 1.00 0.00 O ATOM 368 CB GLN A 26 -1.070 3.634 -2.874 1.00 0.00 C ATOM 369 CG GLN A 26 0.201 4.455 -2.821 1.00 0.00 C ATOM 370 CD GLN A 26 0.222 5.402 -1.641 1.00 0.00 C ATOM 371 OE1 GLN A 26 0.543 4.884 -0.472 1.00 0.00 O flip ATOM 372 NE2 GLN A 26 -0.102 6.583 -1.770 1.00 0.00 N flip ATOM 0 H GLN A 26 -1.755 5.003 -4.731 1.00 0.00 H new ATOM 0 HA GLN A 26 -0.484 2.455 -4.575 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -1.912 4.266 -2.589 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -1.007 2.835 -2.135 1.00 0.00 H new ATOM 0 HG2 GLN A 26 1.061 3.787 -2.764 1.00 0.00 H new ATOM 0 HG3 GLN A 26 0.302 5.026 -3.744 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -0.344 6.948 -2.691 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -0.129 7.196 -0.956 1.00 0.00 H new ATOM 381 N LEU A 27 -3.734 2.565 -4.192 1.00 0.00 N ATOM 382 CA LEU A 27 -4.909 1.710 -4.114 1.00 0.00 C ATOM 383 C LEU A 27 -5.035 0.819 -5.347 1.00 0.00 C ATOM 384 O LEU A 27 -5.637 -0.248 -5.289 1.00 0.00 O ATOM 385 CB LEU A 27 -6.164 2.558 -3.923 1.00 0.00 C ATOM 386 CG LEU A 27 -6.297 3.226 -2.553 1.00 0.00 C ATOM 387 CD1 LEU A 27 -7.656 3.900 -2.424 1.00 0.00 C ATOM 388 CD2 LEU A 27 -6.089 2.212 -1.439 1.00 0.00 C ATOM 0 H LEU A 27 -3.936 3.561 -4.274 1.00 0.00 H new ATOM 0 HA LEU A 27 -4.795 1.054 -3.251 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -6.180 3.332 -4.690 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -7.038 1.928 -4.088 1.00 0.00 H new ATOM 0 HG LEU A 27 -5.524 3.989 -2.463 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -7.737 4.371 -1.444 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -7.762 4.657 -3.201 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -8.444 3.155 -2.534 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -6.188 2.707 -0.473 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -6.837 1.423 -1.521 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -5.093 1.777 -1.524 1.00 0.00 H new ATOM 400 N GLN A 28 -4.473 1.258 -6.460 1.00 0.00 N ATOM 401 CA GLN A 28 -4.422 0.429 -7.654 1.00 0.00 C ATOM 402 C GLN A 28 -3.203 -0.497 -7.638 1.00 0.00 C ATOM 403 O GLN A 28 -3.296 -1.665 -8.012 1.00 0.00 O ATOM 404 CB GLN A 28 -4.411 1.295 -8.914 1.00 0.00 C ATOM 405 CG GLN A 28 -5.700 2.072 -9.136 1.00 0.00 C ATOM 406 CD GLN A 28 -5.736 2.750 -10.489 1.00 0.00 C ATOM 407 OE1 GLN A 28 -6.231 2.190 -11.463 1.00 0.00 O ATOM 408 NE2 GLN A 28 -5.191 3.951 -10.567 1.00 0.00 N ATOM 0 H GLN A 28 -4.047 2.179 -6.563 1.00 0.00 H new ATOM 0 HA GLN A 28 -5.318 -0.191 -7.662 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -3.580 1.998 -8.853 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -4.228 0.658 -9.780 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -6.550 1.395 -9.049 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -5.809 2.822 -8.353 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -4.790 4.384 -9.735 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -5.172 4.445 -11.459 1.00 0.00 H new ATOM 417 N GLU A 29 -2.058 0.025 -7.203 1.00 0.00 N ATOM 418 CA GLU A 29 -0.811 -0.743 -7.228 1.00 0.00 C ATOM 419 C GLU A 29 -0.637 -1.595 -5.966 1.00 0.00 C ATOM 420 O GLU A 29 -0.460 -2.812 -6.048 1.00 0.00 O ATOM 421 CB GLU A 29 0.392 0.190 -7.392 1.00 0.00 C ATOM 422 CG GLU A 29 0.316 1.102 -8.611 1.00 0.00 C ATOM 423 CD GLU A 29 0.239 0.347 -9.923 1.00 0.00 C ATOM 424 OE1 GLU A 29 1.302 0.003 -10.480 1.00 0.00 O ATOM 425 OE2 GLU A 29 -0.885 0.112 -10.412 1.00 0.00 O ATOM 0 H GLU A 29 -1.966 0.970 -6.831 1.00 0.00 H new ATOM 0 HA GLU A 29 -0.867 -1.417 -8.083 1.00 0.00 H new ATOM 0 HB2 GLU A 29 0.484 0.806 -6.497 1.00 0.00 H new ATOM 0 HB3 GLU A 29 1.298 -0.412 -7.459 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -0.558 1.747 -8.519 1.00 0.00 H new ATOM 0 HG3 GLU A 29 1.191 1.752 -8.625 1.00 0.00 H new ATOM 432 N ARG A 30 -0.696 -0.953 -4.803 1.00 0.00 N ATOM 433 CA ARG A 30 -0.484 -1.629 -3.522 1.00 0.00 C ATOM 434 C ARG A 30 -1.607 -2.614 -3.237 1.00 0.00 C ATOM 435 O ARG A 30 -1.368 -3.781 -2.925 1.00 0.00 O ATOM 436 CB ARG A 30 -0.411 -0.622 -2.378 1.00 0.00 C ATOM 437 CG ARG A 30 0.366 -1.155 -1.193 1.00 0.00 C ATOM 438 CD ARG A 30 1.201 -0.069 -0.552 1.00 0.00 C ATOM 439 NE ARG A 30 2.091 0.571 -1.521 1.00 0.00 N ATOM 440 CZ ARG A 30 2.573 1.802 -1.380 1.00 0.00 C ATOM 441 NH1 ARG A 30 2.223 2.537 -0.334 1.00 0.00 N ATOM 442 NH2 ARG A 30 3.370 2.313 -2.308 1.00 0.00 N ATOM 0 H ARG A 30 -0.891 0.045 -4.719 1.00 0.00 H new ATOM 0 HA ARG A 30 0.462 -2.166 -3.592 1.00 0.00 H new ATOM 0 HB2 ARG A 30 0.057 0.296 -2.734 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -1.421 -0.362 -2.061 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -0.325 -1.568 -0.458 1.00 0.00 H new ATOM 0 HG3 ARG A 30 1.012 -1.971 -1.516 1.00 0.00 H new ATOM 0 HD2 ARG A 30 0.545 0.681 -0.109 1.00 0.00 H new ATOM 0 HD3 ARG A 30 1.792 -0.495 0.259 1.00 0.00 H new ATOM 0 HE ARG A 30 2.357 0.043 -2.352 1.00 0.00 H new ATOM 0 HH11 ARG A 30 1.583 2.158 0.364 1.00 0.00 H new ATOM 0 HH12 ARG A 30 2.594 3.481 -0.227 1.00 0.00 H new ATOM 0 HH21 ARG A 30 3.614 1.762 -3.131 1.00 0.00 H new ATOM 0 HH22 ARG A 30 3.739 3.258 -2.199 1.00 0.00 H new ATOM 456 N ALA A 31 -2.840 -2.144 -3.353 1.00 0.00 N ATOM 457 CA ALA A 31 -3.997 -3.000 -3.140 1.00 0.00 C ATOM 458 C ALA A 31 -4.126 -4.010 -4.272 1.00 0.00 C ATOM 459 O ALA A 31 -4.914 -4.949 -4.193 1.00 0.00 O ATOM 460 CB ALA A 31 -5.267 -2.177 -2.997 1.00 0.00 C ATOM 0 H ALA A 31 -3.065 -1.178 -3.593 1.00 0.00 H new ATOM 0 HA ALA A 31 -3.851 -3.546 -2.208 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -6.116 -2.842 -2.839 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -5.170 -1.504 -2.145 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -5.427 -1.594 -3.904 1.00 0.00 H new ATOM 466 N GLY A 32 -3.325 -3.807 -5.322 1.00 0.00 N ATOM 467 CA GLY A 32 -3.231 -4.760 -6.414 1.00 0.00 C ATOM 468 C GLY A 32 -4.546 -4.979 -7.120 1.00 0.00 C ATOM 469 O GLY A 32 -4.756 -6.015 -7.750 1.00 0.00 O ATOM 0 H GLY A 32 -2.732 -2.984 -5.432 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -2.493 -4.407 -7.134 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -2.869 -5.713 -6.027 1.00 0.00 H new ATOM 473 N VAL A 33 -5.433 -4.006 -7.009 1.00 0.00 N ATOM 474 CA VAL A 33 -6.750 -4.110 -7.602 1.00 0.00 C ATOM 475 C VAL A 33 -7.077 -2.840 -8.371 1.00 0.00 C ATOM 476 O VAL A 33 -6.527 -1.774 -8.090 1.00 0.00 O ATOM 477 CB VAL A 33 -7.836 -4.353 -6.528 1.00 0.00 C ATOM 478 CG1 VAL A 33 -7.585 -5.654 -5.780 1.00 0.00 C ATOM 479 CG2 VAL A 33 -7.902 -3.181 -5.559 1.00 0.00 C ATOM 0 H VAL A 33 -5.262 -3.132 -6.511 1.00 0.00 H new ATOM 0 HA VAL A 33 -6.741 -4.962 -8.282 1.00 0.00 H new ATOM 0 HB VAL A 33 -8.798 -4.437 -7.034 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -8.364 -5.799 -5.031 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -7.598 -6.487 -6.483 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -6.613 -5.610 -5.289 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -8.672 -3.370 -4.811 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -6.937 -3.062 -5.065 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -8.144 -2.270 -6.106 1.00 0.00 H new ATOM 489 N LYS A 34 -7.963 -2.950 -9.342 1.00 0.00 N ATOM 490 CA LYS A 34 -8.389 -1.789 -10.090 1.00 0.00 C ATOM 491 C LYS A 34 -9.593 -1.175 -9.403 1.00 0.00 C ATOM 492 O LYS A 34 -10.681 -1.749 -9.399 1.00 0.00 O ATOM 493 CB LYS A 34 -8.722 -2.158 -11.541 1.00 0.00 C ATOM 494 CG LYS A 34 -9.368 -1.028 -12.337 1.00 0.00 C ATOM 495 CD LYS A 34 -8.492 0.216 -12.384 1.00 0.00 C ATOM 496 CE LYS A 34 -9.154 1.329 -13.185 1.00 0.00 C ATOM 497 NZ LYS A 34 -8.302 2.548 -13.261 1.00 0.00 N ATOM 0 H LYS A 34 -8.398 -3.827 -9.628 1.00 0.00 H new ATOM 0 HA LYS A 34 -7.576 -1.064 -10.118 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -7.806 -2.467 -12.046 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -9.392 -3.018 -11.542 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -9.567 -1.369 -13.353 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -10.330 -0.776 -11.891 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -8.295 0.563 -11.370 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -7.528 -0.032 -12.829 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -9.367 0.972 -14.193 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -10.111 1.584 -12.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -8.833 3.366 -12.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -7.446 2.410 -12.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -8.031 2.721 -14.250 1.00 0.00 H new ATOM 511 N MET A 35 -9.386 -0.024 -8.802 1.00 0.00 N ATOM 512 CA MET A 35 -10.470 0.688 -8.167 1.00 0.00 C ATOM 513 C MET A 35 -11.002 1.736 -9.117 1.00 0.00 C ATOM 514 O MET A 35 -10.287 2.662 -9.499 1.00 0.00 O ATOM 515 CB MET A 35 -10.023 1.336 -6.850 1.00 0.00 C ATOM 516 CG MET A 35 -9.541 0.334 -5.817 1.00 0.00 C ATOM 517 SD MET A 35 -9.260 1.085 -4.202 1.00 0.00 S ATOM 518 CE MET A 35 -8.684 -0.328 -3.268 1.00 0.00 C ATOM 0 H MET A 35 -8.478 0.437 -8.740 1.00 0.00 H new ATOM 0 HA MET A 35 -11.259 -0.024 -7.927 1.00 0.00 H new ATOM 0 HB2 MET A 35 -9.223 2.047 -7.057 1.00 0.00 H new ATOM 0 HB3 MET A 35 -10.854 1.905 -6.433 1.00 0.00 H new ATOM 0 HG2 MET A 35 -10.277 -0.464 -5.719 1.00 0.00 H new ATOM 0 HG3 MET A 35 -8.616 -0.126 -6.166 1.00 0.00 H new ATOM 0 HE1 MET A 35 -8.501 -0.031 -2.235 1.00 0.00 H new ATOM 0 HE2 MET A 35 -9.440 -1.113 -3.292 1.00 0.00 H new ATOM 0 HE3 MET A 35 -7.759 -0.702 -3.707 1.00 0.00 H new ATOM 528 N ILE A 36 -12.247 1.576 -9.515 1.00 0.00 N ATOM 529 CA ILE A 36 -12.875 2.533 -10.396 1.00 0.00 C ATOM 530 C ILE A 36 -13.930 3.303 -9.612 1.00 0.00 C ATOM 531 O ILE A 36 -14.969 2.774 -9.209 1.00 0.00 O ATOM 532 CB ILE A 36 -13.442 1.847 -11.676 1.00 0.00 C ATOM 533 CG1 ILE A 36 -14.020 2.871 -12.676 1.00 0.00 C ATOM 534 CG2 ILE A 36 -14.468 0.774 -11.331 1.00 0.00 C ATOM 535 CD1 ILE A 36 -15.395 3.414 -12.330 1.00 0.00 C ATOM 0 H ILE A 36 -12.841 0.793 -9.242 1.00 0.00 H new ATOM 0 HA ILE A 36 -12.134 3.245 -10.758 1.00 0.00 H new ATOM 0 HB ILE A 36 -12.602 1.356 -12.167 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -13.326 3.708 -12.754 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -14.069 2.405 -13.660 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -14.841 0.318 -12.248 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -14.000 0.010 -10.710 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -15.298 1.225 -10.787 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -15.709 4.124 -13.095 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -16.109 2.592 -12.283 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -15.355 3.916 -11.363 1.00 0.00 H new ATOM 547 N LEU A 37 -13.588 4.545 -9.338 1.00 0.00 N ATOM 548 CA LEU A 37 -14.402 5.429 -8.532 1.00 0.00 C ATOM 549 C LEU A 37 -14.507 6.772 -9.225 1.00 0.00 C ATOM 550 O LEU A 37 -13.570 7.192 -9.907 1.00 0.00 O ATOM 551 CB LEU A 37 -13.813 5.596 -7.119 1.00 0.00 C ATOM 552 CG LEU A 37 -12.362 6.096 -7.033 1.00 0.00 C ATOM 553 CD1 LEU A 37 -12.051 6.545 -5.618 1.00 0.00 C ATOM 554 CD2 LEU A 37 -11.385 5.007 -7.452 1.00 0.00 C ATOM 0 H LEU A 37 -12.725 4.974 -9.674 1.00 0.00 H new ATOM 0 HA LEU A 37 -15.395 4.993 -8.422 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -14.446 6.290 -6.566 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -13.873 4.634 -6.609 1.00 0.00 H new ATOM 0 HG LEU A 37 -12.252 6.940 -7.714 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -11.021 6.898 -5.566 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -12.726 7.353 -5.336 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -12.182 5.707 -4.933 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -10.366 5.386 -7.382 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -11.497 4.145 -6.795 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -11.592 4.709 -8.480 1.00 0.00 H new ATOM 566 N ILE A 38 -15.661 7.408 -9.098 1.00 0.00 N ATOM 567 CA ILE A 38 -15.880 8.722 -9.684 1.00 0.00 C ATOM 568 C ILE A 38 -14.835 9.708 -9.169 1.00 0.00 C ATOM 569 O ILE A 38 -14.697 9.909 -7.963 1.00 0.00 O ATOM 570 CB ILE A 38 -17.299 9.264 -9.375 1.00 0.00 C ATOM 571 CG1 ILE A 38 -18.382 8.466 -10.119 1.00 0.00 C ATOM 572 CG2 ILE A 38 -17.405 10.741 -9.730 1.00 0.00 C ATOM 573 CD1 ILE A 38 -18.594 7.058 -9.600 1.00 0.00 C ATOM 0 H ILE A 38 -16.464 7.034 -8.592 1.00 0.00 H new ATOM 0 HA ILE A 38 -15.788 8.615 -10.765 1.00 0.00 H new ATOM 0 HB ILE A 38 -17.464 9.146 -8.304 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -19.325 9.009 -10.054 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -18.116 8.414 -11.175 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -18.410 11.098 -9.504 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -16.679 11.308 -9.148 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -17.202 10.875 -10.793 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -19.375 6.569 -10.183 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -17.666 6.493 -9.691 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -18.894 7.098 -8.553 1.00 0.00 H new ATOM 585 N GLN A 39 -14.093 10.298 -10.088 1.00 0.00 N ATOM 586 CA GLN A 39 -13.053 11.253 -9.747 1.00 0.00 C ATOM 587 C GLN A 39 -13.207 12.523 -10.577 1.00 0.00 C ATOM 588 O GLN A 39 -14.292 12.792 -11.104 1.00 0.00 O ATOM 589 CB GLN A 39 -11.680 10.625 -9.967 1.00 0.00 C ATOM 590 CG GLN A 39 -11.295 9.624 -8.888 1.00 0.00 C ATOM 591 CD GLN A 39 -10.105 8.769 -9.277 1.00 0.00 C ATOM 592 OE1 GLN A 39 -10.261 7.679 -9.825 1.00 0.00 O ATOM 593 NE2 GLN A 39 -8.904 9.266 -9.022 1.00 0.00 N ATOM 0 H GLN A 39 -14.193 10.130 -11.089 1.00 0.00 H new ATOM 0 HA GLN A 39 -13.147 11.522 -8.695 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -11.668 10.126 -10.936 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -10.929 11.414 -10.005 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -11.066 10.160 -7.967 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -12.147 8.978 -8.677 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -8.814 10.174 -8.566 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -8.069 8.741 -9.282 1.00 0.00 H new ATOM 602 N ASP A 40 -12.135 13.299 -10.695 1.00 0.00 N ATOM 603 CA ASP A 40 -12.186 14.555 -11.437 1.00 0.00 C ATOM 604 C ASP A 40 -12.314 14.283 -12.931 1.00 0.00 C ATOM 605 O ASP A 40 -11.337 13.973 -13.616 1.00 0.00 O ATOM 606 CB ASP A 40 -10.957 15.420 -11.153 1.00 0.00 C ATOM 607 CG ASP A 40 -10.966 16.723 -11.937 1.00 0.00 C ATOM 608 OD1 ASP A 40 -11.813 17.596 -11.649 1.00 0.00 O ATOM 609 OD2 ASP A 40 -10.127 16.881 -12.850 1.00 0.00 O ATOM 0 H ASP A 40 -11.225 13.083 -10.289 1.00 0.00 H new ATOM 0 HA ASP A 40 -13.065 15.107 -11.103 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -10.912 15.642 -10.087 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -10.056 14.858 -11.400 1.00 0.00 H new ATOM 614 N GLY A 41 -13.539 14.389 -13.409 1.00 0.00 N ATOM 615 CA GLY A 41 -13.857 14.100 -14.789 1.00 0.00 C ATOM 616 C GLY A 41 -15.330 13.802 -14.922 1.00 0.00 C ATOM 617 O GLY A 41 -15.985 14.216 -15.878 1.00 0.00 O ATOM 0 H GLY A 41 -14.341 14.678 -12.849 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -13.590 14.949 -15.419 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -13.272 13.249 -15.136 1.00 0.00 H new ATOM 621 N SER A 42 -15.847 13.086 -13.934 1.00 0.00 N ATOM 622 CA SER A 42 -17.273 12.851 -13.818 1.00 0.00 C ATOM 623 C SER A 42 -17.900 13.988 -13.017 1.00 0.00 C ATOM 624 O SER A 42 -17.191 14.825 -12.456 1.00 0.00 O ATOM 625 CB SER A 42 -17.521 11.505 -13.138 1.00 0.00 C ATOM 626 OG SER A 42 -16.808 10.467 -13.790 1.00 0.00 O ATOM 0 H SER A 42 -15.291 12.655 -13.196 1.00 0.00 H new ATOM 0 HA SER A 42 -17.729 12.821 -14.808 1.00 0.00 H new ATOM 0 HB2 SER A 42 -17.216 11.560 -12.093 1.00 0.00 H new ATOM 0 HB3 SER A 42 -18.587 11.280 -13.147 1.00 0.00 H new ATOM 0 HG SER A 42 -16.981 9.616 -13.336 1.00 0.00 H new ATOM 632 N GLN A 43 -19.222 14.015 -12.958 1.00 0.00 N ATOM 633 CA GLN A 43 -19.935 15.146 -12.379 1.00 0.00 C ATOM 634 C GLN A 43 -20.161 14.957 -10.881 1.00 0.00 C ATOM 635 O GLN A 43 -20.496 15.902 -10.169 1.00 0.00 O ATOM 636 CB GLN A 43 -21.271 15.328 -13.095 1.00 0.00 C ATOM 637 CG GLN A 43 -22.003 16.602 -12.723 1.00 0.00 C ATOM 638 CD GLN A 43 -23.361 16.693 -13.376 1.00 0.00 C ATOM 639 OE1 GLN A 43 -24.009 15.679 -13.631 1.00 0.00 O ATOM 640 NE2 GLN A 43 -23.799 17.906 -13.665 1.00 0.00 N ATOM 0 H GLN A 43 -19.824 13.268 -13.303 1.00 0.00 H new ATOM 0 HA GLN A 43 -19.324 16.039 -12.510 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -21.098 15.322 -14.171 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -21.911 14.475 -12.870 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -22.119 16.649 -11.640 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -21.402 17.463 -13.017 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -23.230 18.721 -13.437 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -24.706 18.027 -14.116 1.00 0.00 H new ATOM 649 N ASN A 44 -19.956 13.741 -10.400 1.00 0.00 N ATOM 650 CA ASN A 44 -20.212 13.424 -8.995 1.00 0.00 C ATOM 651 C ASN A 44 -18.993 13.708 -8.118 1.00 0.00 C ATOM 652 O ASN A 44 -18.758 13.006 -7.143 1.00 0.00 O ATOM 653 CB ASN A 44 -20.623 11.953 -8.836 1.00 0.00 C ATOM 654 CG ASN A 44 -21.969 11.643 -9.463 1.00 0.00 C ATOM 655 OD1 ASN A 44 -22.834 12.511 -9.575 1.00 0.00 O ATOM 656 ND2 ASN A 44 -22.159 10.396 -9.870 1.00 0.00 N ATOM 0 H ASN A 44 -19.614 12.957 -10.956 1.00 0.00 H new ATOM 0 HA ASN A 44 -21.029 14.067 -8.667 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -19.862 11.318 -9.289 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -20.656 11.703 -7.776 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -23.047 10.127 -10.294 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -21.417 9.705 -9.760 1.00 0.00 H new ATOM 663 N THR A 45 -18.238 14.747 -8.445 1.00 0.00 N ATOM 664 CA THR A 45 -17.010 15.058 -7.719 1.00 0.00 C ATOM 665 C THR A 45 -17.285 15.447 -6.265 1.00 0.00 C ATOM 666 O THR A 45 -16.631 14.952 -5.343 1.00 0.00 O ATOM 667 CB THR A 45 -16.229 16.180 -8.421 1.00 0.00 C ATOM 668 OG1 THR A 45 -17.124 17.233 -8.815 1.00 0.00 O ATOM 669 CG2 THR A 45 -15.499 15.633 -9.640 1.00 0.00 C ATOM 0 H THR A 45 -18.452 15.390 -9.207 1.00 0.00 H new ATOM 0 HA THR A 45 -16.407 14.150 -7.715 1.00 0.00 H new ATOM 0 HB THR A 45 -15.494 16.582 -7.724 1.00 0.00 H new ATOM 0 HG1 THR A 45 -16.617 17.944 -9.260 1.00 0.00 H new ATOM 0 HG21 THR A 45 -14.950 16.439 -10.127 1.00 0.00 H new ATOM 0 HG22 THR A 45 -14.801 14.856 -9.328 1.00 0.00 H new ATOM 0 HG23 THR A 45 -16.222 15.212 -10.339 1.00 0.00 H new ATOM 677 N ASN A 46 -18.268 16.313 -6.065 1.00 0.00 N ATOM 678 CA ASN A 46 -18.638 16.774 -4.730 1.00 0.00 C ATOM 679 C ASN A 46 -19.615 15.785 -4.094 1.00 0.00 C ATOM 680 O ASN A 46 -19.847 15.795 -2.887 1.00 0.00 O ATOM 681 CB ASN A 46 -19.264 18.171 -4.825 1.00 0.00 C ATOM 682 CG ASN A 46 -19.670 18.749 -3.482 1.00 0.00 C ATOM 683 OD1 ASN A 46 -18.868 19.380 -2.795 1.00 0.00 O ATOM 684 ND2 ASN A 46 -20.925 18.555 -3.110 1.00 0.00 N ATOM 0 H ASN A 46 -18.829 16.715 -6.816 1.00 0.00 H new ATOM 0 HA ASN A 46 -17.749 16.832 -4.102 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -18.554 18.846 -5.302 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -20.141 18.124 -5.471 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -21.259 18.935 -2.224 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -21.558 18.026 -3.709 1.00 0.00 H new ATOM 691 N VAL A 47 -20.156 14.916 -4.932 1.00 0.00 N ATOM 692 CA VAL A 47 -21.133 13.918 -4.521 1.00 0.00 C ATOM 693 C VAL A 47 -20.438 12.732 -3.860 1.00 0.00 C ATOM 694 O VAL A 47 -19.252 12.506 -4.079 1.00 0.00 O ATOM 695 CB VAL A 47 -21.917 13.429 -5.759 1.00 0.00 C ATOM 696 CG1 VAL A 47 -23.046 12.489 -5.376 1.00 0.00 C ATOM 697 CG2 VAL A 47 -22.448 14.618 -6.539 1.00 0.00 C ATOM 0 H VAL A 47 -19.928 14.882 -5.926 1.00 0.00 H new ATOM 0 HA VAL A 47 -21.817 14.369 -3.802 1.00 0.00 H new ATOM 0 HB VAL A 47 -21.231 12.866 -6.391 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -23.573 12.168 -6.275 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -22.636 11.618 -4.865 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -23.741 13.005 -4.713 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -22.999 14.265 -7.410 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -23.111 15.204 -5.903 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -21.615 15.241 -6.865 1.00 0.00 H new ATOM 707 N ASP A 48 -21.166 11.996 -3.032 1.00 0.00 N ATOM 708 CA ASP A 48 -20.645 10.763 -2.452 1.00 0.00 C ATOM 709 C ASP A 48 -20.457 9.735 -3.568 1.00 0.00 C ATOM 710 O ASP A 48 -21.364 9.518 -4.374 1.00 0.00 O ATOM 711 CB ASP A 48 -21.602 10.236 -1.382 1.00 0.00 C ATOM 712 CG ASP A 48 -20.955 9.205 -0.483 1.00 0.00 C ATOM 713 OD1 ASP A 48 -20.298 9.605 0.504 1.00 0.00 O ATOM 714 OD2 ASP A 48 -21.121 7.998 -0.740 1.00 0.00 O ATOM 0 H ASP A 48 -22.117 12.229 -2.746 1.00 0.00 H new ATOM 0 HA ASP A 48 -19.684 10.955 -1.974 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -21.959 11.069 -0.776 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -22.475 9.796 -1.865 1.00 0.00 H new ATOM 719 N LYS A 49 -19.289 9.106 -3.614 1.00 0.00 N ATOM 720 CA LYS A 49 -18.878 8.356 -4.796 1.00 0.00 C ATOM 721 C LYS A 49 -18.596 6.897 -4.475 1.00 0.00 C ATOM 722 O LYS A 49 -17.796 6.592 -3.597 1.00 0.00 O ATOM 723 CB LYS A 49 -17.628 9.001 -5.399 1.00 0.00 C ATOM 724 CG LYS A 49 -17.860 10.426 -5.869 1.00 0.00 C ATOM 725 CD LYS A 49 -16.554 11.182 -6.056 1.00 0.00 C ATOM 726 CE LYS A 49 -15.914 11.543 -4.726 1.00 0.00 C ATOM 727 NZ LYS A 49 -16.681 12.586 -3.999 1.00 0.00 N ATOM 0 H LYS A 49 -18.612 9.100 -2.851 1.00 0.00 H new ATOM 0 HA LYS A 49 -19.700 8.384 -5.511 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -16.830 8.995 -4.657 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -17.286 8.399 -6.240 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -18.410 10.413 -6.810 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -18.482 10.950 -5.144 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -15.862 10.574 -6.639 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -16.739 12.091 -6.629 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -15.841 10.650 -4.106 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -14.897 11.896 -4.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -16.217 12.788 -3.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -16.715 13.454 -4.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -17.649 12.247 -3.826 1.00 0.00 H new ATOM 741 N PRO A 50 -19.243 5.978 -5.198 1.00 0.00 N ATOM 742 CA PRO A 50 -19.027 4.546 -5.023 1.00 0.00 C ATOM 743 C PRO A 50 -17.769 4.056 -5.743 1.00 0.00 C ATOM 744 O PRO A 50 -17.548 4.353 -6.919 1.00 0.00 O ATOM 745 CB PRO A 50 -20.287 3.942 -5.633 1.00 0.00 C ATOM 746 CG PRO A 50 -20.675 4.896 -6.711 1.00 0.00 C ATOM 747 CD PRO A 50 -20.248 6.263 -6.240 1.00 0.00 C ATOM 0 HA PRO A 50 -18.867 4.267 -3.982 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -20.096 2.947 -6.034 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -21.078 3.840 -4.890 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -20.188 4.639 -7.652 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -21.750 4.864 -6.890 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -19.825 6.852 -7.053 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -21.089 6.829 -5.840 1.00 0.00 H new ATOM 755 N LEU A 51 -16.949 3.316 -5.019 1.00 0.00 N ATOM 756 CA LEU A 51 -15.698 2.799 -5.543 1.00 0.00 C ATOM 757 C LEU A 51 -15.812 1.296 -5.753 1.00 0.00 C ATOM 758 O LEU A 51 -16.220 0.569 -4.846 1.00 0.00 O ATOM 759 CB LEU A 51 -14.560 3.143 -4.563 1.00 0.00 C ATOM 760 CG LEU A 51 -13.165 2.583 -4.884 1.00 0.00 C ATOM 761 CD1 LEU A 51 -12.100 3.430 -4.216 1.00 0.00 C ATOM 762 CD2 LEU A 51 -13.025 1.145 -4.412 1.00 0.00 C ATOM 0 H LEU A 51 -17.132 3.056 -4.050 1.00 0.00 H new ATOM 0 HA LEU A 51 -15.476 3.257 -6.507 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -14.483 4.229 -4.502 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -14.847 2.788 -3.573 1.00 0.00 H new ATOM 0 HG LEU A 51 -13.038 2.609 -5.966 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -11.115 3.026 -4.449 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -12.168 4.455 -4.582 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -12.251 3.419 -3.137 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -12.027 0.778 -4.654 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -13.177 1.100 -3.334 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -13.770 0.525 -4.910 1.00 0.00 H new ATOM 774 N ARG A 52 -15.463 0.832 -6.945 1.00 0.00 N ATOM 775 CA ARG A 52 -15.474 -0.600 -7.228 1.00 0.00 C ATOM 776 C ARG A 52 -14.082 -1.181 -7.078 1.00 0.00 C ATOM 777 O ARG A 52 -13.155 -0.768 -7.775 1.00 0.00 O ATOM 778 CB ARG A 52 -15.985 -0.911 -8.639 1.00 0.00 C ATOM 779 CG ARG A 52 -17.471 -0.685 -8.829 1.00 0.00 C ATOM 780 CD ARG A 52 -17.777 0.755 -9.205 1.00 0.00 C ATOM 781 NE ARG A 52 -19.202 1.057 -9.111 1.00 0.00 N ATOM 782 CZ ARG A 52 -19.858 1.859 -9.946 1.00 0.00 C ATOM 783 NH1 ARG A 52 -19.243 2.400 -10.992 1.00 0.00 N ATOM 784 NH2 ARG A 52 -21.142 2.101 -9.736 1.00 0.00 N ATOM 0 H ARG A 52 -15.171 1.419 -7.727 1.00 0.00 H new ATOM 0 HA ARG A 52 -16.154 -1.053 -6.507 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -15.441 -0.293 -9.354 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -15.754 -1.950 -8.875 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -17.844 -1.351 -9.607 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -17.998 -0.941 -7.910 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -17.221 1.426 -8.550 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -17.433 0.944 -10.222 1.00 0.00 H new ATOM 0 HE ARG A 52 -19.731 0.624 -8.354 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -18.257 2.202 -11.162 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -19.757 3.013 -11.625 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -21.618 1.675 -8.941 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -21.656 2.714 -10.369 1.00 0.00 H new ATOM 798 N ILE A 53 -13.934 -2.121 -6.159 1.00 0.00 N ATOM 799 CA ILE A 53 -12.682 -2.846 -6.014 1.00 0.00 C ATOM 800 C ILE A 53 -12.694 -4.059 -6.936 1.00 0.00 C ATOM 801 O ILE A 53 -13.443 -5.008 -6.706 1.00 0.00 O ATOM 802 CB ILE A 53 -12.458 -3.315 -4.559 1.00 0.00 C ATOM 803 CG1 ILE A 53 -12.508 -2.125 -3.599 1.00 0.00 C ATOM 804 CG2 ILE A 53 -11.129 -4.046 -4.431 1.00 0.00 C ATOM 805 CD1 ILE A 53 -12.336 -2.509 -2.145 1.00 0.00 C ATOM 0 H ILE A 53 -14.664 -2.400 -5.503 1.00 0.00 H new ATOM 0 HA ILE A 53 -11.869 -2.171 -6.280 1.00 0.00 H new ATOM 0 HB ILE A 53 -13.258 -4.007 -4.294 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -11.727 -1.415 -3.873 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -13.462 -1.612 -3.720 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -10.989 -4.369 -3.399 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -11.128 -4.917 -5.087 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -10.317 -3.377 -4.715 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -12.383 -1.614 -1.524 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -13.131 -3.195 -1.853 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -11.370 -2.995 -2.009 1.00 0.00 H new ATOM 817 N ILE A 54 -11.886 -4.016 -7.986 1.00 0.00 N ATOM 818 CA ILE A 54 -11.816 -5.114 -8.940 1.00 0.00 C ATOM 819 C ILE A 54 -10.476 -5.827 -8.820 1.00 0.00 C ATOM 820 O ILE A 54 -9.429 -5.223 -9.039 1.00 0.00 O ATOM 821 CB ILE A 54 -11.970 -4.594 -10.385 1.00 0.00 C ATOM 822 CG1 ILE A 54 -13.179 -3.658 -10.493 1.00 0.00 C ATOM 823 CG2 ILE A 54 -12.105 -5.760 -11.356 1.00 0.00 C ATOM 824 CD1 ILE A 54 -13.218 -2.871 -11.783 1.00 0.00 C ATOM 0 H ILE A 54 -11.269 -3.232 -8.199 1.00 0.00 H new ATOM 0 HA ILE A 54 -12.629 -5.805 -8.715 1.00 0.00 H new ATOM 0 HB ILE A 54 -11.076 -4.029 -10.648 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -14.093 -4.246 -10.408 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -13.167 -2.963 -9.653 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -12.213 -5.378 -12.371 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -11.216 -6.387 -11.297 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -12.983 -6.351 -11.096 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -14.099 -2.230 -11.792 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -12.321 -2.256 -11.861 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -13.261 -3.559 -12.628 1.00 0.00 H new ATOM 836 N GLY A 55 -10.500 -7.109 -8.486 1.00 0.00 N ATOM 837 CA GLY A 55 -9.260 -7.841 -8.346 1.00 0.00 C ATOM 838 C GLY A 55 -9.458 -9.227 -7.774 1.00 0.00 C ATOM 839 O GLY A 55 -10.590 -9.700 -7.654 1.00 0.00 O ATOM 0 H GLY A 55 -11.347 -7.650 -8.311 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -8.779 -7.921 -9.321 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -8.583 -7.280 -7.701 1.00 0.00 H new ATOM 843 N ASP A 56 -8.349 -9.873 -7.441 1.00 0.00 N ATOM 844 CA ASP A 56 -8.360 -11.195 -6.821 1.00 0.00 C ATOM 845 C ASP A 56 -9.004 -11.143 -5.439 1.00 0.00 C ATOM 846 O ASP A 56 -8.759 -10.200 -4.688 1.00 0.00 O ATOM 847 CB ASP A 56 -6.926 -11.727 -6.707 1.00 0.00 C ATOM 848 CG ASP A 56 -6.820 -12.997 -5.880 1.00 0.00 C ATOM 849 OD1 ASP A 56 -6.924 -14.095 -6.458 1.00 0.00 O ATOM 850 OD2 ASP A 56 -6.617 -12.901 -4.649 1.00 0.00 O ATOM 0 H ASP A 56 -7.413 -9.496 -7.593 1.00 0.00 H new ATOM 0 HA ASP A 56 -8.948 -11.865 -7.449 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -6.537 -11.919 -7.707 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -6.295 -10.958 -6.262 1.00 0.00 H new ATOM 855 N PRO A 57 -9.848 -12.136 -5.104 1.00 0.00 N ATOM 856 CA PRO A 57 -10.593 -12.178 -3.837 1.00 0.00 C ATOM 857 C PRO A 57 -9.783 -11.722 -2.626 1.00 0.00 C ATOM 858 O PRO A 57 -10.240 -10.877 -1.854 1.00 0.00 O ATOM 859 CB PRO A 57 -10.955 -13.652 -3.711 1.00 0.00 C ATOM 860 CG PRO A 57 -11.118 -14.116 -5.116 1.00 0.00 C ATOM 861 CD PRO A 57 -10.165 -13.301 -5.954 1.00 0.00 C ATOM 0 HA PRO A 57 -11.444 -11.497 -3.852 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -10.173 -14.210 -3.197 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -11.873 -13.788 -3.139 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -10.896 -15.180 -5.201 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -12.145 -13.977 -5.453 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -9.268 -13.868 -6.204 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -10.622 -12.996 -6.895 1.00 0.00 H new ATOM 869 N TYR A 58 -8.576 -12.260 -2.476 1.00 0.00 N ATOM 870 CA TYR A 58 -7.730 -11.930 -1.337 1.00 0.00 C ATOM 871 C TYR A 58 -7.356 -10.452 -1.353 1.00 0.00 C ATOM 872 O TYR A 58 -7.437 -9.771 -0.331 1.00 0.00 O ATOM 873 CB TYR A 58 -6.464 -12.792 -1.335 1.00 0.00 C ATOM 874 CG TYR A 58 -5.474 -12.408 -0.258 1.00 0.00 C ATOM 875 CD1 TYR A 58 -5.687 -12.764 1.068 1.00 0.00 C ATOM 876 CD2 TYR A 58 -4.338 -11.670 -0.567 1.00 0.00 C ATOM 877 CE1 TYR A 58 -4.789 -12.402 2.053 1.00 0.00 C ATOM 878 CE2 TYR A 58 -3.434 -11.309 0.412 1.00 0.00 C ATOM 879 CZ TYR A 58 -3.668 -11.668 1.721 1.00 0.00 C ATOM 880 OH TYR A 58 -2.776 -11.298 2.699 1.00 0.00 O ATOM 0 H TYR A 58 -8.163 -12.926 -3.129 1.00 0.00 H new ATOM 0 HA TYR A 58 -8.294 -12.137 -0.428 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -6.746 -13.837 -1.203 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -5.979 -12.713 -2.308 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -6.567 -13.332 1.332 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -4.159 -11.374 -1.590 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -4.963 -12.692 3.079 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -2.548 -10.748 0.153 1.00 0.00 H new ATOM 0 HH TYR A 58 -2.043 -10.787 2.297 1.00 0.00 H new ATOM 890 N LYS A 59 -6.965 -9.963 -2.522 1.00 0.00 N ATOM 891 CA LYS A 59 -6.576 -8.568 -2.678 1.00 0.00 C ATOM 892 C LYS A 59 -7.760 -7.666 -2.378 1.00 0.00 C ATOM 893 O LYS A 59 -7.632 -6.671 -1.676 1.00 0.00 O ATOM 894 CB LYS A 59 -6.077 -8.307 -4.095 1.00 0.00 C ATOM 895 CG LYS A 59 -5.112 -9.360 -4.596 1.00 0.00 C ATOM 896 CD LYS A 59 -4.549 -8.997 -5.963 1.00 0.00 C ATOM 897 CE LYS A 59 -3.696 -10.116 -6.548 1.00 0.00 C ATOM 898 NZ LYS A 59 -2.655 -10.585 -5.595 1.00 0.00 N ATOM 0 H LYS A 59 -6.909 -10.514 -3.379 1.00 0.00 H new ATOM 0 HA LYS A 59 -5.769 -8.352 -1.978 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -6.932 -8.257 -4.770 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -5.589 -7.333 -4.127 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -4.295 -9.474 -3.884 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -5.621 -10.322 -4.655 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -5.370 -8.773 -6.645 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -3.949 -8.091 -5.878 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -4.337 -10.953 -6.824 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -3.218 -9.766 -7.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -1.985 -11.207 -6.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -2.145 -9.766 -5.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -3.106 -11.111 -4.819 1.00 0.00 H new ATOM 912 N VAL A 60 -8.918 -8.046 -2.900 1.00 0.00 N ATOM 913 CA VAL A 60 -10.150 -7.309 -2.666 1.00 0.00 C ATOM 914 C VAL A 60 -10.518 -7.334 -1.188 1.00 0.00 C ATOM 915 O VAL A 60 -11.109 -6.389 -0.672 1.00 0.00 O ATOM 916 CB VAL A 60 -11.316 -7.892 -3.497 1.00 0.00 C ATOM 917 CG1 VAL A 60 -12.624 -7.173 -3.204 1.00 0.00 C ATOM 918 CG2 VAL A 60 -10.999 -7.819 -4.977 1.00 0.00 C ATOM 0 H VAL A 60 -9.029 -8.868 -3.493 1.00 0.00 H new ATOM 0 HA VAL A 60 -9.980 -6.278 -2.977 1.00 0.00 H new ATOM 0 HB VAL A 60 -11.436 -8.937 -3.210 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -13.422 -7.609 -3.806 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -12.868 -7.278 -2.147 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -12.521 -6.116 -3.449 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -11.830 -8.233 -5.548 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -10.844 -6.779 -5.265 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -10.095 -8.392 -5.184 1.00 0.00 H new ATOM 928 N GLN A 61 -10.123 -8.397 -0.500 1.00 0.00 N ATOM 929 CA GLN A 61 -10.531 -8.593 0.884 1.00 0.00 C ATOM 930 C GLN A 61 -9.652 -7.752 1.786 1.00 0.00 C ATOM 931 O GLN A 61 -10.131 -7.048 2.674 1.00 0.00 O ATOM 932 CB GLN A 61 -10.448 -10.073 1.282 1.00 0.00 C ATOM 933 CG GLN A 61 -11.527 -10.511 2.270 1.00 0.00 C ATOM 934 CD GLN A 61 -11.397 -9.883 3.652 1.00 0.00 C ATOM 935 OE1 GLN A 61 -10.170 -9.674 4.105 1.00 0.00 O flip ATOM 936 NE2 GLN A 61 -12.397 -9.624 4.321 1.00 0.00 N flip ATOM 0 H GLN A 61 -9.524 -9.133 -0.875 1.00 0.00 H new ATOM 0 HA GLN A 61 -11.570 -8.281 0.993 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -10.522 -10.685 0.383 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -9.469 -10.267 1.720 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -12.505 -10.259 1.859 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -11.493 -11.596 2.371 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -13.326 -9.799 3.938 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -12.297 -9.235 5.258 1.00 0.00 H new ATOM 945 N GLN A 62 -8.361 -7.809 1.545 1.00 0.00 N ATOM 946 CA GLN A 62 -7.437 -6.990 2.293 1.00 0.00 C ATOM 947 C GLN A 62 -7.665 -5.527 1.950 1.00 0.00 C ATOM 948 O GLN A 62 -7.515 -4.650 2.801 1.00 0.00 O ATOM 949 CB GLN A 62 -5.998 -7.392 1.996 1.00 0.00 C ATOM 950 CG GLN A 62 -5.683 -8.835 2.336 1.00 0.00 C ATOM 951 CD GLN A 62 -6.022 -9.166 3.776 1.00 0.00 C ATOM 952 OE1 GLN A 62 -5.145 -8.791 4.691 1.00 0.00 O flip ATOM 953 NE2 GLN A 62 -7.097 -9.695 4.066 1.00 0.00 N flip ATOM 0 H GLN A 62 -7.931 -8.410 0.842 1.00 0.00 H new ATOM 0 HA GLN A 62 -7.612 -7.139 3.358 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -5.795 -7.225 0.938 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -5.326 -6.742 2.556 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -6.241 -9.494 1.671 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -4.625 -9.026 2.159 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -7.746 -9.969 3.328 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -7.338 -9.858 5.044 1.00 0.00 H new ATOM 962 N ALA A 63 -8.062 -5.271 0.707 1.00 0.00 N ATOM 963 CA ALA A 63 -8.351 -3.916 0.277 1.00 0.00 C ATOM 964 C ALA A 63 -9.627 -3.389 0.922 1.00 0.00 C ATOM 965 O ALA A 63 -9.647 -2.268 1.408 1.00 0.00 O ATOM 966 CB ALA A 63 -8.434 -3.803 -1.237 1.00 0.00 C ATOM 0 H ALA A 63 -8.189 -5.982 -0.013 1.00 0.00 H new ATOM 0 HA ALA A 63 -7.517 -3.298 0.609 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -8.652 -2.771 -1.513 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -7.483 -4.103 -1.677 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -9.227 -4.453 -1.607 1.00 0.00 H new ATOM 972 N CYS A 64 -10.693 -4.191 0.953 1.00 0.00 N ATOM 973 CA CYS A 64 -11.933 -3.747 1.592 1.00 0.00 C ATOM 974 C CYS A 64 -11.705 -3.506 3.077 1.00 0.00 C ATOM 975 O CYS A 64 -12.376 -2.684 3.697 1.00 0.00 O ATOM 976 CB CYS A 64 -13.082 -4.741 1.383 1.00 0.00 C ATOM 977 SG CYS A 64 -12.789 -6.411 2.007 1.00 0.00 S ATOM 0 H CYS A 64 -10.725 -5.129 0.554 1.00 0.00 H new ATOM 0 HA CYS A 64 -12.225 -2.811 1.116 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -13.975 -4.343 1.865 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -13.296 -4.803 0.316 1.00 0.00 H new ATOM 0 HG CYS A 64 -11.633 -6.456 2.599 1.00 0.00 H new ATOM 983 N GLU A 65 -10.736 -4.213 3.633 1.00 0.00 N ATOM 984 CA GLU A 65 -10.353 -4.012 5.012 1.00 0.00 C ATOM 985 C GLU A 65 -9.549 -2.723 5.153 1.00 0.00 C ATOM 986 O GLU A 65 -9.829 -1.893 6.022 1.00 0.00 O ATOM 987 CB GLU A 65 -9.544 -5.216 5.516 1.00 0.00 C ATOM 988 CG GLU A 65 -8.918 -5.007 6.887 1.00 0.00 C ATOM 989 CD GLU A 65 -8.305 -6.270 7.457 1.00 0.00 C ATOM 990 OE1 GLU A 65 -9.049 -7.247 7.678 1.00 0.00 O ATOM 991 OE2 GLU A 65 -7.078 -6.288 7.706 1.00 0.00 O ATOM 0 H GLU A 65 -10.201 -4.932 3.146 1.00 0.00 H new ATOM 0 HA GLU A 65 -11.253 -3.923 5.621 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -10.196 -6.089 5.554 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -8.755 -5.438 4.797 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -8.150 -4.237 6.816 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -9.678 -4.636 7.575 1.00 0.00 H new ATOM 998 N MET A 66 -8.568 -2.548 4.273 1.00 0.00 N ATOM 999 CA MET A 66 -7.678 -1.396 4.331 1.00 0.00 C ATOM 1000 C MET A 66 -8.413 -0.103 3.973 1.00 0.00 C ATOM 1001 O MET A 66 -8.173 0.922 4.597 1.00 0.00 O ATOM 1002 CB MET A 66 -6.462 -1.596 3.413 1.00 0.00 C ATOM 1003 CG MET A 66 -6.793 -1.542 1.935 1.00 0.00 C ATOM 1004 SD MET A 66 -5.545 -2.326 0.899 1.00 0.00 S ATOM 1005 CE MET A 66 -4.639 -0.895 0.329 1.00 0.00 C ATOM 0 H MET A 66 -8.370 -3.193 3.508 1.00 0.00 H new ATOM 0 HA MET A 66 -7.324 -1.307 5.358 1.00 0.00 H new ATOM 0 HB2 MET A 66 -5.720 -0.830 3.637 1.00 0.00 H new ATOM 0 HB3 MET A 66 -6.004 -2.559 3.638 1.00 0.00 H new ATOM 0 HG2 MET A 66 -7.754 -2.029 1.766 1.00 0.00 H new ATOM 0 HG3 MET A 66 -6.905 -0.501 1.632 1.00 0.00 H new ATOM 0 HE1 MET A 66 -3.910 -1.201 -0.421 1.00 0.00 H new ATOM 0 HE2 MET A 66 -5.332 -0.177 -0.110 1.00 0.00 H new ATOM 0 HE3 MET A 66 -4.122 -0.433 1.170 1.00 0.00 H new ATOM 1015 N VAL A 67 -9.322 -0.149 2.992 1.00 0.00 N ATOM 1016 CA VAL A 67 -10.038 1.059 2.570 1.00 0.00 C ATOM 1017 C VAL A 67 -10.899 1.614 3.696 1.00 0.00 C ATOM 1018 O VAL A 67 -11.086 2.816 3.796 1.00 0.00 O ATOM 1019 CB VAL A 67 -10.919 0.847 1.313 1.00 0.00 C ATOM 1020 CG1 VAL A 67 -10.061 0.493 0.110 1.00 0.00 C ATOM 1021 CG2 VAL A 67 -11.981 -0.215 1.552 1.00 0.00 C ATOM 0 H VAL A 67 -9.576 -0.996 2.483 1.00 0.00 H new ATOM 0 HA VAL A 67 -9.260 1.777 2.310 1.00 0.00 H new ATOM 0 HB VAL A 67 -11.433 1.785 1.104 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -10.699 0.348 -0.762 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -9.357 1.302 -0.086 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -9.511 -0.426 0.313 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -12.581 -0.339 0.651 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -11.500 -1.161 1.800 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -12.624 0.093 2.377 1.00 0.00 H new ATOM 1031 N MET A 68 -11.413 0.740 4.550 1.00 0.00 N ATOM 1032 CA MET A 68 -12.211 1.176 5.692 1.00 0.00 C ATOM 1033 C MET A 68 -11.297 1.621 6.825 1.00 0.00 C ATOM 1034 O MET A 68 -11.700 2.362 7.720 1.00 0.00 O ATOM 1035 CB MET A 68 -13.140 0.057 6.171 1.00 0.00 C ATOM 1036 CG MET A 68 -14.115 -0.415 5.106 1.00 0.00 C ATOM 1037 SD MET A 68 -15.266 -1.661 5.716 1.00 0.00 S ATOM 1038 CE MET A 68 -16.192 -2.012 4.225 1.00 0.00 C ATOM 0 H MET A 68 -11.294 -0.270 4.476 1.00 0.00 H new ATOM 0 HA MET A 68 -12.828 2.018 5.378 1.00 0.00 H new ATOM 0 HB2 MET A 68 -12.537 -0.789 6.502 1.00 0.00 H new ATOM 0 HB3 MET A 68 -13.701 0.407 7.038 1.00 0.00 H new ATOM 0 HG2 MET A 68 -14.677 0.440 4.730 1.00 0.00 H new ATOM 0 HG3 MET A 68 -13.556 -0.824 4.264 1.00 0.00 H new ATOM 0 HE1 MET A 68 -16.948 -2.768 4.436 1.00 0.00 H new ATOM 0 HE2 MET A 68 -16.678 -1.101 3.875 1.00 0.00 H new ATOM 0 HE3 MET A 68 -15.515 -2.381 3.455 1.00 0.00 H new ATOM 1048 N ASP A 69 -10.059 1.154 6.770 1.00 0.00 N ATOM 1049 CA ASP A 69 -9.070 1.458 7.790 1.00 0.00 C ATOM 1050 C ASP A 69 -8.411 2.807 7.534 1.00 0.00 C ATOM 1051 O ASP A 69 -8.388 3.664 8.408 1.00 0.00 O ATOM 1052 CB ASP A 69 -8.006 0.366 7.831 1.00 0.00 C ATOM 1053 CG ASP A 69 -7.021 0.564 8.961 1.00 0.00 C ATOM 1054 OD1 ASP A 69 -7.302 0.104 10.088 1.00 0.00 O ATOM 1055 OD2 ASP A 69 -5.956 1.164 8.725 1.00 0.00 O ATOM 0 H ASP A 69 -9.714 0.556 6.019 1.00 0.00 H new ATOM 0 HA ASP A 69 -9.582 1.503 8.751 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -8.489 -0.605 7.940 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -7.469 0.350 6.883 1.00 0.00 H new ATOM 1060 N ILE A 70 -7.893 3.001 6.328 1.00 0.00 N ATOM 1061 CA ILE A 70 -7.196 4.240 5.998 1.00 0.00 C ATOM 1062 C ILE A 70 -8.173 5.407 5.853 1.00 0.00 C ATOM 1063 O ILE A 70 -7.792 6.570 5.979 1.00 0.00 O ATOM 1064 CB ILE A 70 -6.312 4.099 4.732 1.00 0.00 C ATOM 1065 CG1 ILE A 70 -7.055 3.436 3.571 1.00 0.00 C ATOM 1066 CG2 ILE A 70 -5.065 3.301 5.062 1.00 0.00 C ATOM 1067 CD1 ILE A 70 -8.038 4.330 2.854 1.00 0.00 C ATOM 0 H ILE A 70 -7.941 2.323 5.567 1.00 0.00 H new ATOM 0 HA ILE A 70 -6.530 4.455 6.833 1.00 0.00 H new ATOM 0 HB ILE A 70 -6.041 5.106 4.413 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -6.323 3.073 2.850 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -7.588 2.564 3.950 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -4.448 3.205 4.169 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -4.500 3.814 5.840 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -5.350 2.310 5.414 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -8.515 3.773 2.048 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -8.797 4.673 3.557 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -7.512 5.190 2.439 1.00 0.00 H new ATOM 1079 N LEU A 71 -9.433 5.081 5.602 1.00 0.00 N ATOM 1080 CA LEU A 71 -10.481 6.083 5.440 1.00 0.00 C ATOM 1081 C LEU A 71 -11.076 6.486 6.795 1.00 0.00 C ATOM 1082 O LEU A 71 -11.890 7.404 6.872 1.00 0.00 O ATOM 1083 CB LEU A 71 -11.534 5.544 4.444 1.00 0.00 C ATOM 1084 CG LEU A 71 -12.833 6.339 4.253 1.00 0.00 C ATOM 1085 CD1 LEU A 71 -13.381 6.075 2.860 1.00 0.00 C ATOM 1086 CD2 LEU A 71 -13.881 5.936 5.285 1.00 0.00 C ATOM 0 H LEU A 71 -9.758 4.119 5.505 1.00 0.00 H new ATOM 0 HA LEU A 71 -10.065 7.000 5.024 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -11.054 5.454 3.470 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -11.805 4.537 4.760 1.00 0.00 H new ATOM 0 HG LEU A 71 -12.610 7.398 4.381 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -14.304 6.638 2.719 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -12.649 6.387 2.116 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -13.584 5.010 2.745 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -14.790 6.515 5.125 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -14.104 4.874 5.181 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -13.498 6.130 6.287 1.00 0.00 H new ATOM 1098 N ARG A 72 -10.627 5.821 7.871 1.00 0.00 N ATOM 1099 CA ARG A 72 -11.033 6.190 9.233 1.00 0.00 C ATOM 1100 C ARG A 72 -10.796 7.679 9.448 1.00 0.00 C ATOM 1101 O ARG A 72 -11.625 8.373 10.032 1.00 0.00 O ATOM 1102 CB ARG A 72 -10.233 5.400 10.280 1.00 0.00 C ATOM 1103 CG ARG A 72 -8.764 5.803 10.345 1.00 0.00 C ATOM 1104 CD ARG A 72 -8.043 5.173 11.512 1.00 0.00 C ATOM 1105 NE ARG A 72 -8.702 5.462 12.782 1.00 0.00 N ATOM 1106 CZ ARG A 72 -8.841 4.588 13.775 1.00 0.00 C ATOM 1107 NH1 ARG A 72 -8.368 3.353 13.659 1.00 0.00 N ATOM 1108 NH2 ARG A 72 -9.457 4.960 14.887 1.00 0.00 N ATOM 0 H ARG A 72 -9.986 5.029 7.823 1.00 0.00 H new ATOM 0 HA ARG A 72 -12.091 5.954 9.349 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -10.687 5.546 11.260 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -10.301 4.336 10.053 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -8.270 5.514 9.418 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -8.691 6.888 10.420 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -7.992 4.094 11.367 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -7.017 5.539 11.544 1.00 0.00 H new ATOM 0 HE ARG A 72 -9.082 6.399 12.917 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -7.893 3.067 12.803 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -8.480 2.690 14.426 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -9.820 5.909 14.976 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -9.569 4.297 15.654 1.00 0.00 H new ATOM 1122 N GLU A 73 -9.649 8.139 8.954 1.00 0.00 N ATOM 1123 CA GLU A 73 -9.291 9.546 8.937 1.00 0.00 C ATOM 1124 C GLU A 73 -9.211 10.172 10.334 1.00 0.00 C ATOM 1125 O GLU A 73 -10.223 10.510 10.955 1.00 0.00 O ATOM 1126 CB GLU A 73 -10.279 10.305 8.052 1.00 0.00 C ATOM 1127 CG GLU A 73 -10.167 11.816 8.133 1.00 0.00 C ATOM 1128 CD GLU A 73 -11.302 12.517 7.414 1.00 0.00 C ATOM 1129 OE1 GLU A 73 -11.181 12.764 6.202 1.00 0.00 O ATOM 1130 OE2 GLU A 73 -12.327 12.814 8.069 1.00 0.00 O ATOM 0 H GLU A 73 -8.935 7.532 8.550 1.00 0.00 H new ATOM 0 HA GLU A 73 -8.285 9.623 8.525 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -10.130 9.998 7.017 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -11.292 10.013 8.328 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -10.159 12.122 9.179 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -9.217 12.131 7.701 1.00 0.00 H new ATOM 1137 N ARG A 74 -7.987 10.323 10.811 1.00 0.00 N ATOM 1138 CA ARG A 74 -7.711 11.084 12.018 1.00 0.00 C ATOM 1139 C ARG A 74 -7.175 12.459 11.628 1.00 0.00 C ATOM 1140 O ARG A 74 -7.493 13.472 12.249 1.00 0.00 O ATOM 1141 CB ARG A 74 -6.688 10.333 12.878 1.00 0.00 C ATOM 1142 CG ARG A 74 -6.183 11.113 14.080 1.00 0.00 C ATOM 1143 CD ARG A 74 -5.097 10.341 14.816 1.00 0.00 C ATOM 1144 NE ARG A 74 -5.613 9.119 15.434 1.00 0.00 N ATOM 1145 CZ ARG A 74 -5.340 7.883 15.006 1.00 0.00 C ATOM 1146 NH1 ARG A 74 -4.503 7.688 13.990 1.00 0.00 N ATOM 1147 NH2 ARG A 74 -5.873 6.837 15.620 1.00 0.00 N ATOM 0 H ARG A 74 -7.158 9.922 10.373 1.00 0.00 H new ATOM 0 HA ARG A 74 -8.626 11.208 12.598 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -7.138 9.403 13.227 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -5.837 10.061 12.254 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -5.791 12.077 13.754 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -7.011 11.318 14.758 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -4.299 10.085 14.119 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -4.658 10.977 15.584 1.00 0.00 H new ATOM 0 HE ARG A 74 -6.222 9.217 16.246 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -4.064 8.486 13.531 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -4.301 6.741 13.670 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -6.492 6.975 16.419 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -5.665 5.893 15.294 1.00 0.00 H new ATOM 1161 N ASP A 75 -6.382 12.472 10.567 1.00 0.00 N ATOM 1162 CA ASP A 75 -5.708 13.680 10.095 1.00 0.00 C ATOM 1163 C ASP A 75 -6.130 14.024 8.668 1.00 0.00 C ATOM 1164 O ASP A 75 -5.545 14.904 8.039 1.00 0.00 O ATOM 1165 CB ASP A 75 -4.189 13.467 10.140 1.00 0.00 C ATOM 1166 CG ASP A 75 -3.733 12.318 9.251 1.00 0.00 C ATOM 1167 OD1 ASP A 75 -4.586 11.500 8.831 1.00 0.00 O ATOM 1168 OD2 ASP A 75 -2.517 12.205 8.988 1.00 0.00 O ATOM 0 H ASP A 75 -6.185 11.644 10.005 1.00 0.00 H new ATOM 0 HA ASP A 75 -5.990 14.508 10.746 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -3.688 14.384 9.829 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -3.884 13.270 11.168 1.00 0.00 H new ATOM 1173 N GLN A 76 -7.134 13.302 8.172 1.00 0.00 N ATOM 1174 CA GLN A 76 -7.631 13.443 6.799 1.00 0.00 C ATOM 1175 C GLN A 76 -6.595 12.944 5.789 1.00 0.00 C ATOM 1176 O GLN A 76 -6.706 13.165 4.584 1.00 0.00 O ATOM 1177 CB GLN A 76 -8.068 14.883 6.493 1.00 0.00 C ATOM 1178 CG GLN A 76 -8.894 14.997 5.219 1.00 0.00 C ATOM 1179 CD GLN A 76 -9.601 16.327 5.078 1.00 0.00 C ATOM 1180 OE1 GLN A 76 -9.121 17.357 5.547 1.00 0.00 O ATOM 1181 NE2 GLN A 76 -10.755 16.307 4.433 1.00 0.00 N ATOM 0 H GLN A 76 -7.631 12.596 8.715 1.00 0.00 H new ATOM 0 HA GLN A 76 -8.519 12.817 6.706 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -8.649 15.266 7.332 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -7.184 15.514 6.404 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -8.243 14.847 4.358 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -9.634 14.197 5.202 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -11.116 15.429 4.060 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -11.285 17.170 4.308 1.00 0.00 H new ATOM 1190 N GLY A 77 -5.585 12.260 6.299 1.00 0.00 N ATOM 1191 CA GLY A 77 -4.663 11.550 5.445 1.00 0.00 C ATOM 1192 C GLY A 77 -4.802 10.060 5.652 1.00 0.00 C ATOM 1193 O GLY A 77 -4.413 9.258 4.802 1.00 0.00 O ATOM 0 H GLY A 77 -5.387 12.184 7.297 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -4.857 11.799 4.402 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -3.641 11.861 5.663 1.00 0.00 H new ATOM 1197 N GLY A 78 -5.385 9.704 6.792 1.00 0.00 N ATOM 1198 CA GLY A 78 -5.573 8.315 7.149 1.00 0.00 C ATOM 1199 C GLY A 78 -4.240 7.619 7.333 1.00 0.00 C ATOM 1200 O GLY A 78 -3.585 7.804 8.361 1.00 0.00 O ATOM 0 H GLY A 78 -5.735 10.367 7.483 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -6.153 8.247 8.069 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -6.147 7.810 6.372 1.00 0.00 H new ATOM 1204 N PHE A 79 -3.824 6.832 6.347 1.00 0.00 N ATOM 1205 CA PHE A 79 -2.489 6.235 6.360 1.00 0.00 C ATOM 1206 C PHE A 79 -1.835 6.353 4.989 1.00 0.00 C ATOM 1207 O PHE A 79 -0.610 6.430 4.879 1.00 0.00 O ATOM 1208 CB PHE A 79 -2.518 4.763 6.809 1.00 0.00 C ATOM 1209 CG PHE A 79 -3.090 4.557 8.185 1.00 0.00 C ATOM 1210 CD1 PHE A 79 -2.275 4.627 9.305 1.00 0.00 C ATOM 1211 CD2 PHE A 79 -4.441 4.299 8.358 1.00 0.00 C ATOM 1212 CE1 PHE A 79 -2.798 4.442 10.571 1.00 0.00 C ATOM 1213 CE2 PHE A 79 -4.969 4.116 9.621 1.00 0.00 C ATOM 1214 CZ PHE A 79 -4.146 4.187 10.729 1.00 0.00 C ATOM 0 H PHE A 79 -4.387 6.592 5.531 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.897 6.790 7.088 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -3.103 4.186 6.093 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -1.503 4.366 6.785 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -1.221 4.828 9.187 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -5.088 4.240 7.495 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -2.153 4.497 11.436 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -6.024 3.918 9.743 1.00 0.00 H new ATOM 0 HZ PHE A 79 -4.557 4.043 11.717 1.00 0.00 H new ATOM 1224 N GLY A 80 -2.662 6.369 3.945 1.00 0.00 N ATOM 1225 CA GLY A 80 -2.158 6.496 2.601 1.00 0.00 C ATOM 1226 C GLY A 80 -2.124 5.151 1.939 1.00 0.00 C ATOM 1227 O GLY A 80 -1.074 4.518 1.901 1.00 0.00 O ATOM 0 H GLY A 80 -3.677 6.295 4.015 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -2.789 7.176 2.029 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -1.157 6.928 2.618 1.00 0.00 H new ATOM 1231 N ASP A 81 -3.292 4.710 1.460 1.00 0.00 N ATOM 1232 CA ASP A 81 -3.480 3.355 0.933 1.00 0.00 C ATOM 1233 C ASP A 81 -3.449 2.334 2.069 1.00 0.00 C ATOM 1234 O ASP A 81 -4.452 1.662 2.320 1.00 0.00 O ATOM 1235 CB ASP A 81 -2.461 3.044 -0.168 1.00 0.00 C ATOM 1236 CG ASP A 81 -1.530 1.887 0.123 1.00 0.00 C ATOM 1237 OD1 ASP A 81 -1.930 0.732 -0.105 1.00 0.00 O ATOM 1238 OD2 ASP A 81 -0.381 2.142 0.561 1.00 0.00 O ATOM 0 H ASP A 81 -4.135 5.284 1.427 1.00 0.00 H new ATOM 0 HA ASP A 81 -4.464 3.291 0.468 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -3.001 2.832 -1.091 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -1.861 3.936 -0.348 1.00 0.00 H new ATOM 1243 N ARG A 82 -2.308 2.298 2.764 1.00 0.00 N ATOM 1244 CA ARG A 82 -2.035 1.464 3.932 1.00 0.00 C ATOM 1245 C ARG A 82 -0.590 1.000 3.854 1.00 0.00 C ATOM 1246 O ARG A 82 -0.281 -0.014 3.226 1.00 0.00 O ATOM 1247 CB ARG A 82 -2.969 0.250 4.077 1.00 0.00 C ATOM 1248 CG ARG A 82 -2.587 -0.661 5.232 1.00 0.00 C ATOM 1249 CD ARG A 82 -3.783 -1.398 5.810 1.00 0.00 C ATOM 1250 NE ARG A 82 -4.209 -0.802 7.079 1.00 0.00 N ATOM 1251 CZ ARG A 82 -3.678 -1.121 8.262 1.00 0.00 C ATOM 1252 NH1 ARG A 82 -2.793 -2.106 8.354 1.00 0.00 N ATOM 1253 NH2 ARG A 82 -4.054 -0.474 9.356 1.00 0.00 N ATOM 0 H ARG A 82 -1.510 2.881 2.512 1.00 0.00 H new ATOM 0 HA ARG A 82 -2.218 2.075 4.816 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -3.991 0.600 4.221 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -2.956 -0.323 3.150 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -1.848 -1.386 4.890 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -2.115 -0.070 6.016 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -4.608 -1.373 5.098 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -3.528 -2.446 5.965 1.00 0.00 H new ATOM 0 HE ARG A 82 -4.953 -0.104 7.058 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -2.516 -2.622 7.519 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -2.390 -2.346 9.260 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -4.750 0.269 9.295 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -3.647 -0.719 10.259 1.00 0.00 H new ATOM 1267 N ASN A 83 0.294 1.779 4.469 1.00 0.00 N ATOM 1268 CA ASN A 83 1.729 1.468 4.532 1.00 0.00 C ATOM 1269 C ASN A 83 1.987 0.230 5.403 1.00 0.00 C ATOM 1270 O ASN A 83 2.808 0.254 6.316 1.00 0.00 O ATOM 1271 CB ASN A 83 2.485 2.683 5.096 1.00 0.00 C ATOM 1272 CG ASN A 83 4.000 2.579 4.972 1.00 0.00 C ATOM 1273 OD1 ASN A 83 4.475 1.971 3.897 1.00 0.00 O flip ATOM 1274 ND2 ASN A 83 4.739 3.067 5.831 1.00 0.00 N flip ATOM 0 H ASN A 83 0.041 2.647 4.941 1.00 0.00 H new ATOM 0 HA ASN A 83 2.087 1.248 3.526 1.00 0.00 H new ATOM 0 HB2 ASN A 83 2.149 3.581 4.577 1.00 0.00 H new ATOM 0 HB3 ASN A 83 2.224 2.805 6.147 1.00 0.00 H new ATOM 0 HD21 ASN A 83 4.337 3.528 6.647 1.00 0.00 H new ATOM 0 HD22 ASN A 83 5.752 3.009 5.725 1.00 0.00 H new ATOM 1281 N GLU A 84 1.276 -0.851 5.099 1.00 0.00 N ATOM 1282 CA GLU A 84 1.341 -2.083 5.873 1.00 0.00 C ATOM 1283 C GLU A 84 1.021 -3.295 4.992 1.00 0.00 C ATOM 1284 O GLU A 84 1.713 -4.307 5.045 1.00 0.00 O ATOM 1285 CB GLU A 84 0.373 -2.021 7.060 1.00 0.00 C ATOM 1286 CG GLU A 84 0.869 -1.171 8.218 1.00 0.00 C ATOM 1287 CD GLU A 84 -0.155 -1.025 9.319 1.00 0.00 C ATOM 1288 OE1 GLU A 84 -0.356 -1.997 10.081 1.00 0.00 O ATOM 1289 OE2 GLU A 84 -0.779 0.049 9.416 1.00 0.00 O ATOM 0 H GLU A 84 0.636 -0.896 4.306 1.00 0.00 H new ATOM 0 HA GLU A 84 2.356 -2.192 6.254 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -0.583 -1.626 6.716 1.00 0.00 H new ATOM 0 HB3 GLU A 84 0.189 -3.034 7.419 1.00 0.00 H new ATOM 0 HG2 GLU A 84 1.775 -1.617 8.628 1.00 0.00 H new ATOM 0 HG3 GLU A 84 1.140 -0.183 7.847 1.00 0.00 H new ATOM 1296 N TYR A 85 -0.026 -3.191 4.177 1.00 0.00 N ATOM 1297 CA TYR A 85 -0.415 -4.282 3.286 1.00 0.00 C ATOM 1298 C TYR A 85 -1.601 -3.890 2.417 1.00 0.00 C ATOM 1299 O TYR A 85 -2.484 -3.151 2.853 1.00 0.00 O ATOM 1300 CB TYR A 85 -0.749 -5.567 4.068 1.00 0.00 C ATOM 1301 CG TYR A 85 -1.814 -5.429 5.142 1.00 0.00 C ATOM 1302 CD1 TYR A 85 -3.169 -5.447 4.821 1.00 0.00 C ATOM 1303 CD2 TYR A 85 -1.461 -5.303 6.478 1.00 0.00 C ATOM 1304 CE1 TYR A 85 -4.138 -5.341 5.802 1.00 0.00 C ATOM 1305 CE2 TYR A 85 -2.423 -5.195 7.463 1.00 0.00 C ATOM 1306 CZ TYR A 85 -3.760 -5.212 7.121 1.00 0.00 C ATOM 1307 OH TYR A 85 -4.719 -5.106 8.104 1.00 0.00 O ATOM 0 H TYR A 85 -0.620 -2.364 4.115 1.00 0.00 H new ATOM 0 HA TYR A 85 0.443 -4.482 2.644 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -1.072 -6.328 3.358 1.00 0.00 H new ATOM 0 HB3 TYR A 85 0.165 -5.934 4.534 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -3.468 -5.545 3.788 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -0.416 -5.289 6.752 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -5.185 -5.359 5.536 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -2.130 -5.098 8.498 1.00 0.00 H new ATOM 0 HH TYR A 85 -5.580 -5.420 7.756 1.00 0.00 H new ATOM 1317 N GLY A 86 -1.597 -4.382 1.186 1.00 0.00 N ATOM 1318 CA GLY A 86 -2.723 -4.194 0.294 1.00 0.00 C ATOM 1319 C GLY A 86 -3.174 -5.515 -0.292 1.00 0.00 C ATOM 1320 O GLY A 86 -3.929 -6.249 0.327 1.00 0.00 O ATOM 0 H GLY A 86 -0.824 -4.914 0.786 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -3.548 -3.731 0.836 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -2.446 -3.511 -0.509 1.00 0.00 H new ATOM 1324 N SER A 87 -2.673 -5.841 -1.472 1.00 0.00 N ATOM 1325 CA SER A 87 -2.957 -7.128 -2.104 1.00 0.00 C ATOM 1326 C SER A 87 -1.951 -8.175 -1.641 1.00 0.00 C ATOM 1327 O SER A 87 -1.841 -9.254 -2.223 1.00 0.00 O ATOM 1328 CB SER A 87 -2.860 -6.982 -3.619 1.00 0.00 C ATOM 1329 OG SER A 87 -1.646 -6.347 -3.998 1.00 0.00 O ATOM 0 H SER A 87 -2.064 -5.231 -2.018 1.00 0.00 H new ATOM 0 HA SER A 87 -3.961 -7.444 -1.823 1.00 0.00 H new ATOM 0 HB2 SER A 87 -2.920 -7.965 -4.086 1.00 0.00 H new ATOM 0 HB3 SER A 87 -3.707 -6.402 -3.986 1.00 0.00 H new ATOM 0 HG SER A 87 -1.667 -5.408 -3.718 1.00 0.00 H new ATOM 1335 N ARG A 88 -1.216 -7.838 -0.594 1.00 0.00 N ATOM 1336 CA ARG A 88 -0.085 -8.637 -0.153 1.00 0.00 C ATOM 1337 C ARG A 88 0.020 -8.655 1.344 1.00 0.00 C ATOM 1338 O ARG A 88 -0.688 -7.927 2.037 1.00 0.00 O ATOM 1339 CB ARG A 88 1.230 -8.093 -0.687 1.00 0.00 C ATOM 1340 CG ARG A 88 1.328 -6.574 -0.703 1.00 0.00 C ATOM 1341 CD ARG A 88 0.733 -5.973 -1.969 1.00 0.00 C ATOM 1342 NE ARG A 88 1.406 -4.731 -2.338 1.00 0.00 N ATOM 1343 CZ ARG A 88 1.584 -4.316 -3.591 1.00 0.00 C ATOM 1344 NH1 ARG A 88 1.005 -4.956 -4.601 1.00 0.00 N ATOM 1345 NH2 ARG A 88 2.312 -3.233 -3.821 1.00 0.00 N ATOM 0 H ARG A 88 -1.386 -7.007 -0.028 1.00 0.00 H new ATOM 0 HA ARG A 88 -0.261 -9.642 -0.537 1.00 0.00 H new ATOM 0 HB2 ARG A 88 2.045 -8.490 -0.082 1.00 0.00 H new ATOM 0 HB3 ARG A 88 1.376 -8.464 -1.701 1.00 0.00 H new ATOM 0 HG2 ARG A 88 0.811 -6.169 0.167 1.00 0.00 H new ATOM 0 HG3 ARG A 88 2.374 -6.278 -0.619 1.00 0.00 H new ATOM 0 HD2 ARG A 88 0.815 -6.689 -2.786 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -0.329 -5.782 -1.818 1.00 0.00 H new ATOM 0 HE ARG A 88 1.764 -4.142 -1.586 1.00 0.00 H new ATOM 0 HH11 ARG A 88 0.419 -5.771 -4.420 1.00 0.00 H new ATOM 0 HH12 ARG A 88 1.146 -4.632 -5.558 1.00 0.00 H new ATOM 0 HH21 ARG A 88 2.730 -2.725 -3.042 1.00 0.00 H new ATOM 0 HH22 ARG A 88 2.454 -2.908 -4.777 1.00 0.00 H new ATOM 1359 N ILE A 89 0.963 -9.457 1.808 1.00 0.00 N ATOM 1360 CA ILE A 89 1.333 -9.539 3.207 1.00 0.00 C ATOM 1361 C ILE A 89 0.164 -9.952 4.106 1.00 0.00 C ATOM 1362 O ILE A 89 0.044 -11.115 4.484 1.00 0.00 O ATOM 1363 CB ILE A 89 1.918 -8.212 3.735 1.00 0.00 C ATOM 1364 CG1 ILE A 89 2.938 -7.643 2.751 1.00 0.00 C ATOM 1365 CG2 ILE A 89 2.564 -8.437 5.096 1.00 0.00 C ATOM 1366 CD1 ILE A 89 3.672 -6.434 3.273 1.00 0.00 C ATOM 0 H ILE A 89 1.503 -10.081 1.209 1.00 0.00 H new ATOM 0 HA ILE A 89 2.099 -10.313 3.250 1.00 0.00 H new ATOM 0 HB ILE A 89 1.108 -7.490 3.841 1.00 0.00 H new ATOM 0 HG12 ILE A 89 3.663 -8.418 2.503 1.00 0.00 H new ATOM 0 HG13 ILE A 89 2.428 -7.376 1.826 1.00 0.00 H new ATOM 0 HG21 ILE A 89 2.975 -7.497 5.464 1.00 0.00 H new ATOM 0 HG22 ILE A 89 1.815 -8.805 5.798 1.00 0.00 H new ATOM 0 HG23 ILE A 89 3.364 -9.171 5.002 1.00 0.00 H new ATOM 0 HD11 ILE A 89 4.379 -6.085 2.521 1.00 0.00 H new ATOM 0 HD12 ILE A 89 2.957 -5.642 3.494 1.00 0.00 H new ATOM 0 HD13 ILE A 89 4.211 -6.700 4.182 1.00 0.00 H new ATOM 1378 N GLY A 90 -0.690 -8.992 4.442 1.00 0.00 N ATOM 1379 CA GLY A 90 -1.755 -9.239 5.390 1.00 0.00 C ATOM 1380 C GLY A 90 -1.213 -9.482 6.787 1.00 0.00 C ATOM 1381 O GLY A 90 -1.687 -10.361 7.503 1.00 0.00 O ATOM 0 H GLY A 90 -0.661 -8.042 4.071 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -2.434 -8.387 5.406 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -2.336 -10.104 5.069 1.00 0.00 H new ATOM 1385 N GLY A 91 -0.210 -8.697 7.164 1.00 0.00 N ATOM 1386 CA GLY A 91 0.411 -8.836 8.469 1.00 0.00 C ATOM 1387 C GLY A 91 1.864 -8.401 8.446 1.00 0.00 C ATOM 1388 O GLY A 91 2.770 -9.220 8.614 1.00 0.00 O ATOM 0 H GLY A 91 0.188 -7.959 6.583 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -0.136 -8.239 9.198 1.00 0.00 H new ATOM 0 HA3 GLY A 91 0.347 -9.874 8.794 1.00 0.00 H new ATOM 1392 N GLY A 92 2.078 -7.113 8.221 1.00 0.00 N ATOM 1393 CA GLY A 92 3.413 -6.579 8.084 1.00 0.00 C ATOM 1394 C GLY A 92 3.365 -5.166 7.554 1.00 0.00 C ATOM 1395 O GLY A 92 2.459 -4.411 7.910 1.00 0.00 O ATOM 0 H GLY A 92 1.335 -6.420 8.130 1.00 0.00 H new ATOM 0 HA2 GLY A 92 3.918 -6.595 9.050 1.00 0.00 H new ATOM 0 HA3 GLY A 92 3.995 -7.207 7.410 1.00 0.00 H new ATOM 1399 N ILE A 93 4.317 -4.803 6.699 1.00 0.00 N ATOM 1400 CA ILE A 93 4.318 -3.492 6.064 1.00 0.00 C ATOM 1401 C ILE A 93 4.805 -3.577 4.618 1.00 0.00 C ATOM 1402 O ILE A 93 5.695 -4.368 4.288 1.00 0.00 O ATOM 1403 CB ILE A 93 5.183 -2.457 6.812 1.00 0.00 C ATOM 1404 CG1 ILE A 93 6.636 -2.899 6.849 1.00 0.00 C ATOM 1405 CG2 ILE A 93 4.653 -2.216 8.220 1.00 0.00 C ATOM 1406 CD1 ILE A 93 7.568 -1.790 7.259 1.00 0.00 C ATOM 0 H ILE A 93 5.099 -5.401 6.431 1.00 0.00 H new ATOM 0 HA ILE A 93 3.281 -3.156 6.094 1.00 0.00 H new ATOM 0 HB ILE A 93 5.127 -1.514 6.268 1.00 0.00 H new ATOM 0 HG12 ILE A 93 6.741 -3.732 7.544 1.00 0.00 H new ATOM 0 HG13 ILE A 93 6.925 -3.267 5.864 1.00 0.00 H new ATOM 0 HG21 ILE A 93 5.281 -1.482 8.725 1.00 0.00 H new ATOM 0 HG22 ILE A 93 3.631 -1.842 8.165 1.00 0.00 H new ATOM 0 HG23 ILE A 93 4.667 -3.152 8.779 1.00 0.00 H new ATOM 0 HD11 ILE A 93 8.593 -2.161 7.269 1.00 0.00 H new ATOM 0 HD12 ILE A 93 7.487 -0.966 6.550 1.00 0.00 H new ATOM 0 HD13 ILE A 93 7.300 -1.439 8.255 1.00 0.00 H new ATOM 1418 N ASP A 94 4.206 -2.761 3.762 1.00 0.00 N ATOM 1419 CA ASP A 94 4.596 -2.695 2.356 1.00 0.00 C ATOM 1420 C ASP A 94 5.681 -1.650 2.179 1.00 0.00 C ATOM 1421 O ASP A 94 5.518 -0.501 2.588 1.00 0.00 O ATOM 1422 CB ASP A 94 3.402 -2.370 1.448 1.00 0.00 C ATOM 1423 CG ASP A 94 3.043 -3.514 0.520 1.00 0.00 C ATOM 1424 OD1 ASP A 94 3.175 -4.686 0.916 1.00 0.00 O ATOM 1425 OD2 ASP A 94 2.673 -3.247 -0.639 1.00 0.00 O ATOM 0 H ASP A 94 3.444 -2.132 4.016 1.00 0.00 H new ATOM 0 HA ASP A 94 4.974 -3.675 2.065 1.00 0.00 H new ATOM 0 HB2 ASP A 94 2.538 -2.124 2.065 1.00 0.00 H new ATOM 0 HB3 ASP A 94 3.632 -1.485 0.855 1.00 0.00 H new ATOM 1430 N VAL A 95 6.786 -2.045 1.568 1.00 0.00 N ATOM 1431 CA VAL A 95 7.971 -1.202 1.513 1.00 0.00 C ATOM 1432 C VAL A 95 8.345 -0.788 0.091 1.00 0.00 C ATOM 1433 O VAL A 95 9.025 -1.527 -0.607 1.00 0.00 O ATOM 1434 CB VAL A 95 9.163 -1.953 2.133 1.00 0.00 C ATOM 1435 CG1 VAL A 95 10.457 -1.190 1.913 1.00 0.00 C ATOM 1436 CG2 VAL A 95 8.920 -2.205 3.611 1.00 0.00 C ATOM 0 H VAL A 95 6.888 -2.946 1.102 1.00 0.00 H new ATOM 0 HA VAL A 95 7.738 -0.295 2.071 1.00 0.00 H new ATOM 0 HB VAL A 95 9.259 -2.918 1.635 1.00 0.00 H new ATOM 0 HG11 VAL A 95 11.285 -1.741 2.360 1.00 0.00 H new ATOM 0 HG12 VAL A 95 10.634 -1.074 0.844 1.00 0.00 H new ATOM 0 HG13 VAL A 95 10.383 -0.207 2.377 1.00 0.00 H new ATOM 0 HG21 VAL A 95 9.772 -2.737 4.034 1.00 0.00 H new ATOM 0 HG22 VAL A 95 8.794 -1.253 4.127 1.00 0.00 H new ATOM 0 HG23 VAL A 95 8.019 -2.806 3.734 1.00 0.00 H new ATOM 1446 N PRO A 96 7.913 0.392 -0.367 1.00 0.00 N ATOM 1447 CA PRO A 96 8.413 0.952 -1.626 1.00 0.00 C ATOM 1448 C PRO A 96 9.861 1.421 -1.488 1.00 0.00 C ATOM 1449 O PRO A 96 10.132 2.452 -0.869 1.00 0.00 O ATOM 1450 CB PRO A 96 7.495 2.156 -1.869 1.00 0.00 C ATOM 1451 CG PRO A 96 6.969 2.524 -0.519 1.00 0.00 C ATOM 1452 CD PRO A 96 6.898 1.247 0.270 1.00 0.00 C ATOM 0 HA PRO A 96 8.405 0.224 -2.437 1.00 0.00 H new ATOM 0 HB2 PRO A 96 8.042 2.985 -2.318 1.00 0.00 H new ATOM 0 HB3 PRO A 96 6.684 1.902 -2.552 1.00 0.00 H new ATOM 0 HG2 PRO A 96 7.623 3.246 -0.031 1.00 0.00 H new ATOM 0 HG3 PRO A 96 5.985 2.987 -0.598 1.00 0.00 H new ATOM 0 HD2 PRO A 96 7.118 1.414 1.324 1.00 0.00 H new ATOM 0 HD3 PRO A 96 5.906 0.798 0.219 1.00 0.00 H new ATOM 1460 N VAL A 97 10.786 0.675 -2.068 1.00 0.00 N ATOM 1461 CA VAL A 97 12.189 1.048 -2.012 1.00 0.00 C ATOM 1462 C VAL A 97 12.635 1.621 -3.354 1.00 0.00 C ATOM 1463 O VAL A 97 12.372 1.046 -4.415 1.00 0.00 O ATOM 1464 CB VAL A 97 13.098 -0.142 -1.602 1.00 0.00 C ATOM 1465 CG1 VAL A 97 13.126 -1.218 -2.667 1.00 0.00 C ATOM 1466 CG2 VAL A 97 14.506 0.338 -1.297 1.00 0.00 C ATOM 0 H VAL A 97 10.593 -0.186 -2.579 1.00 0.00 H new ATOM 0 HA VAL A 97 12.293 1.812 -1.241 1.00 0.00 H new ATOM 0 HB VAL A 97 12.674 -0.580 -0.699 1.00 0.00 H new ATOM 0 HG11 VAL A 97 13.773 -2.034 -2.343 1.00 0.00 H new ATOM 0 HG12 VAL A 97 12.117 -1.597 -2.828 1.00 0.00 H new ATOM 0 HG13 VAL A 97 13.509 -0.799 -3.598 1.00 0.00 H new ATOM 0 HG21 VAL A 97 15.126 -0.512 -1.012 1.00 0.00 H new ATOM 0 HG22 VAL A 97 14.928 0.814 -2.182 1.00 0.00 H new ATOM 0 HG23 VAL A 97 14.476 1.056 -0.478 1.00 0.00 H new ATOM 1476 N PRO A 98 13.273 2.798 -3.314 1.00 0.00 N ATOM 1477 CA PRO A 98 13.782 3.474 -4.506 1.00 0.00 C ATOM 1478 C PRO A 98 14.673 2.576 -5.353 1.00 0.00 C ATOM 1479 O PRO A 98 15.625 1.966 -4.858 1.00 0.00 O ATOM 1480 CB PRO A 98 14.580 4.644 -3.938 1.00 0.00 C ATOM 1481 CG PRO A 98 13.976 4.905 -2.606 1.00 0.00 C ATOM 1482 CD PRO A 98 13.530 3.569 -2.091 1.00 0.00 C ATOM 0 HA PRO A 98 12.976 3.777 -5.175 1.00 0.00 H new ATOM 0 HB2 PRO A 98 15.638 4.396 -3.851 1.00 0.00 H new ATOM 0 HB3 PRO A 98 14.510 5.520 -4.582 1.00 0.00 H new ATOM 0 HG2 PRO A 98 14.700 5.362 -1.931 1.00 0.00 H new ATOM 0 HG3 PRO A 98 13.135 5.594 -2.686 1.00 0.00 H new ATOM 0 HD2 PRO A 98 14.297 3.100 -1.475 1.00 0.00 H new ATOM 0 HD3 PRO A 98 12.635 3.655 -1.475 1.00 0.00 H new ATOM 1490 N ARG A 99 14.350 2.523 -6.637 1.00 0.00 N ATOM 1491 CA ARG A 99 15.040 1.676 -7.606 1.00 0.00 C ATOM 1492 C ARG A 99 16.538 1.977 -7.662 1.00 0.00 C ATOM 1493 O ARG A 99 17.342 1.116 -8.015 1.00 0.00 O ATOM 1494 CB ARG A 99 14.417 1.890 -8.984 1.00 0.00 C ATOM 1495 CG ARG A 99 14.619 3.298 -9.532 1.00 0.00 C ATOM 1496 CD ARG A 99 13.602 3.636 -10.612 1.00 0.00 C ATOM 1497 NE ARG A 99 13.509 2.597 -11.634 1.00 0.00 N ATOM 1498 CZ ARG A 99 13.538 2.831 -12.943 1.00 0.00 C ATOM 1499 NH1 ARG A 99 13.730 4.062 -13.400 1.00 0.00 N ATOM 1500 NH2 ARG A 99 13.388 1.824 -13.792 1.00 0.00 N ATOM 0 H ARG A 99 13.593 3.073 -7.043 1.00 0.00 H new ATOM 0 HA ARG A 99 14.928 0.638 -7.294 1.00 0.00 H new ATOM 0 HB2 ARG A 99 14.846 1.172 -9.683 1.00 0.00 H new ATOM 0 HB3 ARG A 99 13.349 1.681 -8.927 1.00 0.00 H new ATOM 0 HG2 ARG A 99 14.539 4.019 -8.719 1.00 0.00 H new ATOM 0 HG3 ARG A 99 15.626 3.388 -9.940 1.00 0.00 H new ATOM 0 HD2 ARG A 99 12.624 3.780 -10.154 1.00 0.00 H new ATOM 0 HD3 ARG A 99 13.876 4.581 -11.082 1.00 0.00 H new ATOM 0 HE ARG A 99 13.416 1.630 -11.324 1.00 0.00 H new ATOM 0 HH11 ARG A 99 13.856 4.835 -12.746 1.00 0.00 H new ATOM 0 HH12 ARG A 99 13.751 4.235 -14.405 1.00 0.00 H new ATOM 0 HH21 ARG A 99 13.251 0.876 -13.440 1.00 0.00 H new ATOM 0 HH22 ARG A 99 13.409 1.997 -14.797 1.00 0.00 H new ATOM 1514 N HIS A 100 16.900 3.199 -7.297 1.00 0.00 N ATOM 1515 CA HIS A 100 18.290 3.644 -7.347 1.00 0.00 C ATOM 1516 C HIS A 100 19.005 3.407 -6.017 1.00 0.00 C ATOM 1517 O HIS A 100 20.049 4.002 -5.760 1.00 0.00 O ATOM 1518 CB HIS A 100 18.367 5.136 -7.719 1.00 0.00 C ATOM 1519 CG HIS A 100 17.521 6.026 -6.853 1.00 0.00 C ATOM 1520 ND1 HIS A 100 17.648 6.091 -5.481 1.00 0.00 N ATOM 1521 CD2 HIS A 100 16.508 6.863 -7.172 1.00 0.00 C ATOM 1522 CE1 HIS A 100 16.746 6.922 -4.997 1.00 0.00 C ATOM 1523 NE2 HIS A 100 16.044 7.405 -6.002 1.00 0.00 N ATOM 0 H HIS A 100 16.247 3.906 -6.960 1.00 0.00 H new ATOM 0 HA HIS A 100 18.792 3.055 -8.114 1.00 0.00 H new ATOM 0 HB2 HIS A 100 19.405 5.463 -7.654 1.00 0.00 H new ATOM 0 HB3 HIS A 100 18.059 5.257 -8.757 1.00 0.00 H new ATOM 0 HD2 HIS A 100 16.134 7.067 -8.165 1.00 0.00 H new ATOM 0 HE1 HIS A 100 16.606 7.165 -3.954 1.00 0.00 H new ATOM 0 HE2 HIS A 100 15.279 8.074 -5.922 1.00 0.00 H new ATOM 1532 N SER A 101 18.430 2.569 -5.161 1.00 0.00 N ATOM 1533 CA SER A 101 19.049 2.269 -3.876 1.00 0.00 C ATOM 1534 C SER A 101 18.598 0.919 -3.318 1.00 0.00 C ATOM 1535 O SER A 101 18.852 0.612 -2.159 1.00 0.00 O ATOM 1536 CB SER A 101 18.742 3.389 -2.877 1.00 0.00 C ATOM 1537 OG SER A 101 17.417 3.865 -3.040 1.00 0.00 O ATOM 0 H SER A 101 17.546 2.090 -5.331 1.00 0.00 H new ATOM 0 HA SER A 101 20.126 2.206 -4.035 1.00 0.00 H new ATOM 0 HB2 SER A 101 18.878 3.021 -1.860 1.00 0.00 H new ATOM 0 HB3 SER A 101 19.447 4.209 -3.016 1.00 0.00 H new ATOM 0 HG SER A 101 17.418 4.635 -3.646 1.00 0.00 H new ATOM 1543 N VAL A 102 17.946 0.105 -4.139 1.00 0.00 N ATOM 1544 CA VAL A 102 17.504 -1.211 -3.681 1.00 0.00 C ATOM 1545 C VAL A 102 18.683 -2.187 -3.639 1.00 0.00 C ATOM 1546 O VAL A 102 18.656 -3.189 -2.919 1.00 0.00 O ATOM 1547 CB VAL A 102 16.345 -1.779 -4.547 1.00 0.00 C ATOM 1548 CG1 VAL A 102 16.758 -1.966 -5.999 1.00 0.00 C ATOM 1549 CG2 VAL A 102 15.823 -3.092 -3.971 1.00 0.00 C ATOM 0 H VAL A 102 17.714 0.324 -5.108 1.00 0.00 H new ATOM 0 HA VAL A 102 17.113 -1.088 -2.671 1.00 0.00 H new ATOM 0 HB VAL A 102 15.541 -1.043 -4.523 1.00 0.00 H new ATOM 0 HG11 VAL A 102 15.918 -2.365 -6.568 1.00 0.00 H new ATOM 0 HG12 VAL A 102 17.057 -1.006 -6.419 1.00 0.00 H new ATOM 0 HG13 VAL A 102 17.595 -2.662 -6.052 1.00 0.00 H new ATOM 0 HG21 VAL A 102 15.013 -3.467 -4.596 1.00 0.00 H new ATOM 0 HG22 VAL A 102 16.630 -3.824 -3.945 1.00 0.00 H new ATOM 0 HG23 VAL A 102 15.453 -2.924 -2.960 1.00 0.00 H new ATOM 1559 N GLY A 103 19.736 -1.861 -4.383 1.00 0.00 N ATOM 1560 CA GLY A 103 20.913 -2.707 -4.431 1.00 0.00 C ATOM 1561 C GLY A 103 21.593 -2.852 -3.080 1.00 0.00 C ATOM 1562 O GLY A 103 22.144 -3.908 -2.772 1.00 0.00 O ATOM 0 H GLY A 103 19.794 -1.020 -4.957 1.00 0.00 H new ATOM 0 HA2 GLY A 103 20.630 -3.694 -4.797 1.00 0.00 H new ATOM 0 HA3 GLY A 103 21.623 -2.293 -5.147 1.00 0.00 H new ATOM 1566 N VAL A 104 21.553 -1.801 -2.265 1.00 0.00 N ATOM 1567 CA VAL A 104 22.183 -1.836 -0.948 1.00 0.00 C ATOM 1568 C VAL A 104 21.346 -2.669 0.021 1.00 0.00 C ATOM 1569 O VAL A 104 21.859 -3.210 1.000 1.00 0.00 O ATOM 1570 CB VAL A 104 22.392 -0.417 -0.368 1.00 0.00 C ATOM 1571 CG1 VAL A 104 21.066 0.235 0.001 1.00 0.00 C ATOM 1572 CG2 VAL A 104 23.331 -0.449 0.830 1.00 0.00 C ATOM 0 H VAL A 104 21.094 -0.919 -2.492 1.00 0.00 H new ATOM 0 HA VAL A 104 23.163 -2.296 -1.073 1.00 0.00 H new ATOM 0 HB VAL A 104 22.855 0.190 -1.146 1.00 0.00 H new ATOM 0 HG11 VAL A 104 21.250 1.230 0.405 1.00 0.00 H new ATOM 0 HG12 VAL A 104 20.440 0.314 -0.888 1.00 0.00 H new ATOM 0 HG13 VAL A 104 20.558 -0.372 0.750 1.00 0.00 H new ATOM 0 HG21 VAL A 104 23.460 0.561 1.218 1.00 0.00 H new ATOM 0 HG22 VAL A 104 22.907 -1.085 1.607 1.00 0.00 H new ATOM 0 HG23 VAL A 104 24.299 -0.847 0.523 1.00 0.00 H new ATOM 1582 N VAL A 105 20.056 -2.779 -0.277 1.00 0.00 N ATOM 1583 CA VAL A 105 19.133 -3.538 0.554 1.00 0.00 C ATOM 1584 C VAL A 105 19.382 -5.032 0.382 1.00 0.00 C ATOM 1585 O VAL A 105 19.307 -5.804 1.336 1.00 0.00 O ATOM 1586 CB VAL A 105 17.662 -3.219 0.198 1.00 0.00 C ATOM 1587 CG1 VAL A 105 16.707 -3.899 1.167 1.00 0.00 C ATOM 1588 CG2 VAL A 105 17.429 -1.714 0.180 1.00 0.00 C ATOM 0 H VAL A 105 19.625 -2.348 -1.095 1.00 0.00 H new ATOM 0 HA VAL A 105 19.307 -3.252 1.591 1.00 0.00 H new ATOM 0 HB VAL A 105 17.463 -3.610 -0.800 1.00 0.00 H new ATOM 0 HG11 VAL A 105 15.679 -3.658 0.894 1.00 0.00 H new ATOM 0 HG12 VAL A 105 16.851 -4.979 1.122 1.00 0.00 H new ATOM 0 HG13 VAL A 105 16.905 -3.548 2.180 1.00 0.00 H new ATOM 0 HG21 VAL A 105 16.388 -1.510 -0.072 1.00 0.00 H new ATOM 0 HG22 VAL A 105 17.652 -1.300 1.163 1.00 0.00 H new ATOM 0 HG23 VAL A 105 18.080 -1.254 -0.564 1.00 0.00 H new ATOM 1598 N ILE A 106 19.691 -5.426 -0.845 1.00 0.00 N ATOM 1599 CA ILE A 106 19.978 -6.819 -1.144 1.00 0.00 C ATOM 1600 C ILE A 106 21.437 -7.138 -0.842 1.00 0.00 C ATOM 1601 O ILE A 106 21.762 -8.204 -0.317 1.00 0.00 O ATOM 1602 CB ILE A 106 19.681 -7.155 -2.622 1.00 0.00 C ATOM 1603 CG1 ILE A 106 18.237 -6.790 -2.978 1.00 0.00 C ATOM 1604 CG2 ILE A 106 19.943 -8.628 -2.906 1.00 0.00 C ATOM 1605 CD1 ILE A 106 17.200 -7.522 -2.151 1.00 0.00 C ATOM 0 H ILE A 106 19.749 -4.800 -1.648 1.00 0.00 H new ATOM 0 HA ILE A 106 19.330 -7.426 -0.512 1.00 0.00 H new ATOM 0 HB ILE A 106 20.351 -6.563 -3.245 1.00 0.00 H new ATOM 0 HG12 ILE A 106 18.101 -5.716 -2.847 1.00 0.00 H new ATOM 0 HG13 ILE A 106 18.067 -7.007 -4.032 1.00 0.00 H new ATOM 0 HG21 ILE A 106 19.727 -8.841 -3.953 1.00 0.00 H new ATOM 0 HG22 ILE A 106 20.988 -8.859 -2.697 1.00 0.00 H new ATOM 0 HG23 ILE A 106 19.302 -9.240 -2.272 1.00 0.00 H new ATOM 0 HD11 ILE A 106 16.202 -7.211 -2.461 1.00 0.00 H new ATOM 0 HD12 ILE A 106 17.308 -8.596 -2.300 1.00 0.00 H new ATOM 0 HD13 ILE A 106 17.343 -7.286 -1.097 1.00 0.00 H new ATOM 1617 N GLY A 107 22.310 -6.193 -1.158 1.00 0.00 N ATOM 1618 CA GLY A 107 23.729 -6.405 -0.982 1.00 0.00 C ATOM 1619 C GLY A 107 24.370 -6.903 -2.257 1.00 0.00 C ATOM 1620 O GLY A 107 24.112 -6.366 -3.336 1.00 0.00 O ATOM 0 H GLY A 107 22.058 -5.279 -1.535 1.00 0.00 H new ATOM 0 HA2 GLY A 107 24.203 -5.473 -0.674 1.00 0.00 H new ATOM 0 HA3 GLY A 107 23.895 -7.127 -0.182 1.00 0.00 H new ATOM 1624 N ARG A 108 25.193 -7.928 -2.148 1.00 0.00 N ATOM 1625 CA ARG A 108 25.811 -8.528 -3.318 1.00 0.00 C ATOM 1626 C ARG A 108 25.106 -9.825 -3.685 1.00 0.00 C ATOM 1627 O ARG A 108 24.343 -9.879 -4.649 1.00 0.00 O ATOM 1628 CB ARG A 108 27.296 -8.795 -3.080 1.00 0.00 C ATOM 1629 CG ARG A 108 28.155 -7.545 -3.044 1.00 0.00 C ATOM 1630 CD ARG A 108 29.631 -7.899 -2.951 1.00 0.00 C ATOM 1631 NE ARG A 108 30.041 -8.807 -4.022 1.00 0.00 N ATOM 1632 CZ ARG A 108 31.207 -8.729 -4.662 1.00 0.00 C ATOM 1633 NH1 ARG A 108 32.094 -7.799 -4.324 1.00 0.00 N ATOM 1634 NH2 ARG A 108 31.487 -9.587 -5.635 1.00 0.00 N ATOM 0 H ARG A 108 25.450 -8.364 -1.262 1.00 0.00 H new ATOM 0 HA ARG A 108 25.715 -7.823 -4.144 1.00 0.00 H new ATOM 0 HB2 ARG A 108 27.411 -9.329 -2.136 1.00 0.00 H new ATOM 0 HB3 ARG A 108 27.666 -9.454 -3.866 1.00 0.00 H new ATOM 0 HG2 ARG A 108 27.976 -6.951 -3.940 1.00 0.00 H new ATOM 0 HG3 ARG A 108 27.871 -6.929 -2.191 1.00 0.00 H new ATOM 0 HD2 ARG A 108 30.227 -6.988 -2.999 1.00 0.00 H new ATOM 0 HD3 ARG A 108 29.834 -8.362 -1.985 1.00 0.00 H new ATOM 0 HE ARG A 108 29.394 -9.546 -4.296 1.00 0.00 H new ATOM 0 HH11 ARG A 108 31.883 -7.142 -3.573 1.00 0.00 H new ATOM 0 HH12 ARG A 108 32.986 -7.742 -4.816 1.00 0.00 H new ATOM 0 HH21 ARG A 108 30.810 -10.305 -5.892 1.00 0.00 H new ATOM 0 HH22 ARG A 108 32.379 -9.528 -6.126 1.00 0.00 H new ATOM 1648 N SER A 109 25.348 -10.861 -2.897 1.00 0.00 N ATOM 1649 CA SER A 109 24.747 -12.161 -3.145 1.00 0.00 C ATOM 1650 C SER A 109 23.398 -12.283 -2.434 1.00 0.00 C ATOM 1651 O SER A 109 22.683 -13.273 -2.598 1.00 0.00 O ATOM 1652 CB SER A 109 25.697 -13.266 -2.689 1.00 0.00 C ATOM 1653 OG SER A 109 26.964 -13.145 -3.320 1.00 0.00 O ATOM 0 H SER A 109 25.957 -10.826 -2.080 1.00 0.00 H new ATOM 0 HA SER A 109 24.571 -12.265 -4.216 1.00 0.00 H new ATOM 0 HB2 SER A 109 25.820 -13.220 -1.607 1.00 0.00 H new ATOM 0 HB3 SER A 109 25.264 -14.240 -2.919 1.00 0.00 H new ATOM 0 HG SER A 109 27.554 -13.863 -3.010 1.00 0.00 H new ATOM 1659 N GLY A 110 23.049 -11.264 -1.652 1.00 0.00 N ATOM 1660 CA GLY A 110 21.761 -11.250 -0.986 1.00 0.00 C ATOM 1661 C GLY A 110 21.872 -11.337 0.523 1.00 0.00 C ATOM 1662 O GLY A 110 20.869 -11.441 1.218 1.00 0.00 O ATOM 0 H GLY A 110 23.636 -10.450 -1.469 1.00 0.00 H new ATOM 0 HA2 GLY A 110 21.230 -10.336 -1.253 1.00 0.00 H new ATOM 0 HA3 GLY A 110 21.162 -12.085 -1.349 1.00 0.00 H new ATOM 1666 N GLU A 111 23.088 -11.274 1.036 1.00 0.00 N ATOM 1667 CA GLU A 111 23.323 -11.402 2.472 1.00 0.00 C ATOM 1668 C GLU A 111 22.710 -10.247 3.264 1.00 0.00 C ATOM 1669 O GLU A 111 22.403 -10.397 4.447 1.00 0.00 O ATOM 1670 CB GLU A 111 24.821 -11.490 2.757 1.00 0.00 C ATOM 1671 CG GLU A 111 25.379 -12.903 2.690 1.00 0.00 C ATOM 1672 CD GLU A 111 24.898 -13.682 1.482 1.00 0.00 C ATOM 1673 OE1 GLU A 111 25.280 -13.332 0.350 1.00 0.00 O ATOM 1674 OE2 GLU A 111 24.131 -14.652 1.663 1.00 0.00 O ATOM 0 H GLU A 111 23.933 -11.135 0.482 1.00 0.00 H new ATOM 0 HA GLU A 111 22.834 -12.320 2.797 1.00 0.00 H new ATOM 0 HB2 GLU A 111 25.354 -10.865 2.041 1.00 0.00 H new ATOM 0 HB3 GLU A 111 25.017 -11.079 3.747 1.00 0.00 H new ATOM 0 HG2 GLU A 111 26.468 -12.856 2.673 1.00 0.00 H new ATOM 0 HG3 GLU A 111 25.098 -13.440 3.596 1.00 0.00 H new ATOM 1681 N MET A 112 22.514 -9.107 2.610 1.00 0.00 N ATOM 1682 CA MET A 112 22.002 -7.918 3.290 1.00 0.00 C ATOM 1683 C MET A 112 20.498 -8.036 3.537 1.00 0.00 C ATOM 1684 O MET A 112 20.002 -7.674 4.602 1.00 0.00 O ATOM 1685 CB MET A 112 22.300 -6.661 2.474 1.00 0.00 C ATOM 1686 CG MET A 112 22.010 -5.375 3.226 1.00 0.00 C ATOM 1687 SD MET A 112 23.074 -5.170 4.666 1.00 0.00 S ATOM 1688 CE MET A 112 22.421 -3.650 5.350 1.00 0.00 C ATOM 0 H MET A 112 22.700 -8.979 1.615 1.00 0.00 H new ATOM 0 HA MET A 112 22.506 -7.840 4.253 1.00 0.00 H new ATOM 0 HB2 MET A 112 23.348 -6.670 2.175 1.00 0.00 H new ATOM 0 HB3 MET A 112 21.707 -6.681 1.560 1.00 0.00 H new ATOM 0 HG2 MET A 112 22.143 -4.526 2.555 1.00 0.00 H new ATOM 0 HG3 MET A 112 20.967 -5.370 3.544 1.00 0.00 H new ATOM 0 HE1 MET A 112 23.000 -3.369 6.230 1.00 0.00 H new ATOM 0 HE2 MET A 112 22.486 -2.858 4.604 1.00 0.00 H new ATOM 0 HE3 MET A 112 21.379 -3.797 5.633 1.00 0.00 H new ATOM 1698 N ILE A 113 19.783 -8.562 2.551 1.00 0.00 N ATOM 1699 CA ILE A 113 18.342 -8.751 2.671 1.00 0.00 C ATOM 1700 C ILE A 113 18.051 -9.865 3.679 1.00 0.00 C ATOM 1701 O ILE A 113 17.059 -9.821 4.406 1.00 0.00 O ATOM 1702 CB ILE A 113 17.679 -9.067 1.297 1.00 0.00 C ATOM 1703 CG1 ILE A 113 16.151 -9.073 1.405 1.00 0.00 C ATOM 1704 CG2 ILE A 113 18.163 -10.392 0.729 1.00 0.00 C ATOM 1705 CD1 ILE A 113 15.535 -7.693 1.472 1.00 0.00 C ATOM 0 H ILE A 113 20.176 -8.865 1.660 1.00 0.00 H new ATOM 0 HA ILE A 113 17.908 -7.817 3.027 1.00 0.00 H new ATOM 0 HB ILE A 113 17.979 -8.273 0.613 1.00 0.00 H new ATOM 0 HG12 ILE A 113 15.738 -9.603 0.547 1.00 0.00 H new ATOM 0 HG13 ILE A 113 15.862 -9.633 2.294 1.00 0.00 H new ATOM 0 HG21 ILE A 113 17.677 -10.576 -0.229 1.00 0.00 H new ATOM 0 HG22 ILE A 113 19.243 -10.354 0.587 1.00 0.00 H new ATOM 0 HG23 ILE A 113 17.916 -11.197 1.421 1.00 0.00 H new ATOM 0 HD11 ILE A 113 14.451 -7.782 1.547 1.00 0.00 H new ATOM 0 HD12 ILE A 113 15.917 -7.166 2.346 1.00 0.00 H new ATOM 0 HD13 ILE A 113 15.792 -7.136 0.571 1.00 0.00 H new ATOM 1717 N LYS A 114 18.952 -10.844 3.738 1.00 0.00 N ATOM 1718 CA LYS A 114 18.862 -11.915 4.724 1.00 0.00 C ATOM 1719 C LYS A 114 19.189 -11.367 6.106 1.00 0.00 C ATOM 1720 O LYS A 114 18.698 -11.857 7.124 1.00 0.00 O ATOM 1721 CB LYS A 114 19.837 -13.043 4.382 1.00 0.00 C ATOM 1722 CG LYS A 114 19.667 -13.606 2.983 1.00 0.00 C ATOM 1723 CD LYS A 114 20.779 -14.585 2.648 1.00 0.00 C ATOM 1724 CE LYS A 114 20.746 -14.999 1.185 1.00 0.00 C ATOM 1725 NZ LYS A 114 21.882 -15.891 0.839 1.00 0.00 N ATOM 0 H LYS A 114 19.754 -10.916 3.112 1.00 0.00 H new ATOM 0 HA LYS A 114 17.847 -12.311 4.715 1.00 0.00 H new ATOM 0 HB2 LYS A 114 20.856 -12.673 4.492 1.00 0.00 H new ATOM 0 HB3 LYS A 114 19.711 -13.849 5.104 1.00 0.00 H new ATOM 0 HG2 LYS A 114 18.702 -14.106 2.904 1.00 0.00 H new ATOM 0 HG3 LYS A 114 19.664 -12.792 2.258 1.00 0.00 H new ATOM 0 HD2 LYS A 114 21.744 -14.131 2.876 1.00 0.00 H new ATOM 0 HD3 LYS A 114 20.686 -15.470 3.278 1.00 0.00 H new ATOM 0 HE2 LYS A 114 19.806 -15.508 0.972 1.00 0.00 H new ATOM 0 HE3 LYS A 114 20.777 -14.110 0.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 22.151 -15.741 -0.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 22.693 -15.675 1.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 21.599 -16.882 0.975 1.00 0.00 H new ATOM 1739 N LYS A 115 20.027 -10.339 6.122 1.00 0.00 N ATOM 1740 CA LYS A 115 20.427 -9.678 7.353 1.00 0.00 C ATOM 1741 C LYS A 115 19.237 -8.969 7.998 1.00 0.00 C ATOM 1742 O LYS A 115 19.101 -8.966 9.218 1.00 0.00 O ATOM 1743 CB LYS A 115 21.587 -8.707 7.078 1.00 0.00 C ATOM 1744 CG LYS A 115 21.541 -7.429 7.895 1.00 0.00 C ATOM 1745 CD LYS A 115 22.848 -6.655 7.826 1.00 0.00 C ATOM 1746 CE LYS A 115 24.006 -7.443 8.417 1.00 0.00 C ATOM 1747 NZ LYS A 115 25.235 -6.618 8.543 1.00 0.00 N ATOM 0 H LYS A 115 20.447 -9.942 5.282 1.00 0.00 H new ATOM 0 HA LYS A 115 20.778 -10.429 8.061 1.00 0.00 H new ATOM 0 HB2 LYS A 115 22.528 -9.219 7.279 1.00 0.00 H new ATOM 0 HB3 LYS A 115 21.585 -8.448 6.019 1.00 0.00 H new ATOM 0 HG2 LYS A 115 20.728 -6.799 7.535 1.00 0.00 H new ATOM 0 HG3 LYS A 115 21.319 -7.672 8.934 1.00 0.00 H new ATOM 0 HD2 LYS A 115 23.069 -6.408 6.788 1.00 0.00 H new ATOM 0 HD3 LYS A 115 22.740 -5.712 8.362 1.00 0.00 H new ATOM 0 HE2 LYS A 115 23.722 -7.823 9.399 1.00 0.00 H new ATOM 0 HE3 LYS A 115 24.214 -8.309 7.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 25.999 -7.194 8.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 25.522 -6.276 7.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 25.046 -5.806 9.164 1.00 0.00 H new ATOM 1761 N ILE A 116 18.361 -8.394 7.181 1.00 0.00 N ATOM 1762 CA ILE A 116 17.152 -7.760 7.695 1.00 0.00 C ATOM 1763 C ILE A 116 16.249 -8.813 8.330 1.00 0.00 C ATOM 1764 O ILE A 116 15.657 -8.591 9.389 1.00 0.00 O ATOM 1765 CB ILE A 116 16.375 -7.015 6.587 1.00 0.00 C ATOM 1766 CG1 ILE A 116 17.317 -6.080 5.821 1.00 0.00 C ATOM 1767 CG2 ILE A 116 15.223 -6.224 7.187 1.00 0.00 C ATOM 1768 CD1 ILE A 116 16.642 -5.317 4.704 1.00 0.00 C ATOM 0 H ILE A 116 18.464 -8.354 6.167 1.00 0.00 H new ATOM 0 HA ILE A 116 17.456 -7.026 8.441 1.00 0.00 H new ATOM 0 HB ILE A 116 15.967 -7.750 5.893 1.00 0.00 H new ATOM 0 HG12 ILE A 116 17.756 -5.369 6.521 1.00 0.00 H new ATOM 0 HG13 ILE A 116 18.137 -6.666 5.405 1.00 0.00 H new ATOM 0 HG21 ILE A 116 14.686 -5.705 6.393 1.00 0.00 H new ATOM 0 HG22 ILE A 116 14.543 -6.904 7.701 1.00 0.00 H new ATOM 0 HG23 ILE A 116 15.613 -5.495 7.898 1.00 0.00 H new ATOM 0 HD11 ILE A 116 17.371 -4.677 4.208 1.00 0.00 H new ATOM 0 HD12 ILE A 116 16.227 -6.020 3.982 1.00 0.00 H new ATOM 0 HD13 ILE A 116 15.841 -4.703 5.115 1.00 0.00 H new ATOM 1780 N GLN A 117 16.181 -9.973 7.686 1.00 0.00 N ATOM 1781 CA GLN A 117 15.416 -11.106 8.198 1.00 0.00 C ATOM 1782 C GLN A 117 16.004 -11.592 9.520 1.00 0.00 C ATOM 1783 O GLN A 117 15.317 -12.196 10.339 1.00 0.00 O ATOM 1784 CB GLN A 117 15.433 -12.251 7.182 1.00 0.00 C ATOM 1785 CG GLN A 117 14.995 -11.835 5.786 1.00 0.00 C ATOM 1786 CD GLN A 117 15.186 -12.931 4.753 1.00 0.00 C ATOM 1787 OE1 GLN A 117 14.367 -12.913 3.714 1.00 0.00 O flip ATOM 1788 NE2 GLN A 117 16.075 -13.775 4.878 1.00 0.00 N flip ATOM 0 H GLN A 117 16.651 -10.155 6.799 1.00 0.00 H new ATOM 0 HA GLN A 117 14.389 -10.782 8.364 1.00 0.00 H new ATOM 0 HB2 GLN A 117 16.441 -12.664 7.129 1.00 0.00 H new ATOM 0 HB3 GLN A 117 14.780 -13.049 7.536 1.00 0.00 H new ATOM 0 HG2 GLN A 117 13.944 -11.547 5.812 1.00 0.00 H new ATOM 0 HG3 GLN A 117 15.560 -10.954 5.481 1.00 0.00 H new ATOM 0 HE21 GLN A 117 16.686 -13.755 5.694 1.00 0.00 H new ATOM 0 HE22 GLN A 117 16.200 -14.494 4.165 1.00 0.00 H new ATOM 1797 N ASN A 118 17.287 -11.320 9.710 1.00 0.00 N ATOM 1798 CA ASN A 118 18.003 -11.747 10.904 1.00 0.00 C ATOM 1799 C ASN A 118 17.860 -10.728 12.027 1.00 0.00 C ATOM 1800 O ASN A 118 17.496 -11.072 13.151 1.00 0.00 O ATOM 1801 CB ASN A 118 19.487 -11.941 10.576 1.00 0.00 C ATOM 1802 CG ASN A 118 20.306 -12.370 11.781 1.00 0.00 C ATOM 1803 OD1 ASN A 118 20.419 -13.562 12.074 1.00 0.00 O ATOM 1804 ND2 ASN A 118 20.902 -11.407 12.470 1.00 0.00 N ATOM 0 H ASN A 118 17.859 -10.800 9.045 1.00 0.00 H new ATOM 0 HA ASN A 118 17.571 -12.690 11.239 1.00 0.00 H new ATOM 0 HB2 ASN A 118 19.586 -12.690 9.790 1.00 0.00 H new ATOM 0 HB3 ASN A 118 19.892 -11.009 10.181 1.00 0.00 H new ATOM 0 HD21 ASN A 118 21.481 -11.640 13.277 1.00 0.00 H new ATOM 0 HD22 ASN A 118 20.782 -10.433 12.193 1.00 0.00 H new ATOM 1811 N ASP A 119 18.134 -9.475 11.703 1.00 0.00 N ATOM 1812 CA ASP A 119 18.197 -8.411 12.697 1.00 0.00 C ATOM 1813 C ASP A 119 16.815 -7.921 13.101 1.00 0.00 C ATOM 1814 O ASP A 119 16.564 -7.659 14.279 1.00 0.00 O ATOM 1815 CB ASP A 119 19.034 -7.248 12.161 1.00 0.00 C ATOM 1816 CG ASP A 119 20.513 -7.408 12.457 1.00 0.00 C ATOM 1817 OD1 ASP A 119 21.064 -8.511 12.235 1.00 0.00 O ATOM 1818 OD2 ASP A 119 21.132 -6.434 12.931 1.00 0.00 O ATOM 0 H ASP A 119 18.319 -9.166 10.749 1.00 0.00 H new ATOM 0 HA ASP A 119 18.668 -8.821 13.590 1.00 0.00 H new ATOM 0 HB2 ASP A 119 18.890 -7.168 11.084 1.00 0.00 H new ATOM 0 HB3 ASP A 119 18.678 -6.316 12.601 1.00 0.00 H new ATOM 1823 N ALA A 120 15.911 -7.802 12.140 1.00 0.00 N ATOM 1824 CA ALA A 120 14.565 -7.341 12.445 1.00 0.00 C ATOM 1825 C ALA A 120 13.605 -8.514 12.622 1.00 0.00 C ATOM 1826 O ALA A 120 12.527 -8.367 13.189 1.00 0.00 O ATOM 1827 CB ALA A 120 14.062 -6.382 11.377 1.00 0.00 C ATOM 0 H ALA A 120 16.081 -8.015 11.157 1.00 0.00 H new ATOM 0 HA ALA A 120 14.606 -6.800 13.391 1.00 0.00 H new ATOM 0 HB1 ALA A 120 13.054 -6.053 11.629 1.00 0.00 H new ATOM 0 HB2 ALA A 120 14.724 -5.517 11.324 1.00 0.00 H new ATOM 0 HB3 ALA A 120 14.047 -6.888 10.412 1.00 0.00 H new ATOM 1833 N GLY A 121 14.025 -9.684 12.147 1.00 0.00 N ATOM 1834 CA GLY A 121 13.214 -10.884 12.274 1.00 0.00 C ATOM 1835 C GLY A 121 11.990 -10.851 11.381 1.00 0.00 C ATOM 1836 O GLY A 121 10.902 -11.253 11.789 1.00 0.00 O ATOM 0 H GLY A 121 14.918 -9.823 11.674 1.00 0.00 H new ATOM 0 HA2 GLY A 121 13.819 -11.756 12.025 1.00 0.00 H new ATOM 0 HA3 GLY A 121 12.900 -10.999 13.312 1.00 0.00 H new ATOM 1840 N VAL A 122 12.177 -10.387 10.155 1.00 0.00 N ATOM 1841 CA VAL A 122 11.071 -10.191 9.229 1.00 0.00 C ATOM 1842 C VAL A 122 11.148 -11.154 8.050 1.00 0.00 C ATOM 1843 O VAL A 122 12.230 -11.584 7.650 1.00 0.00 O ATOM 1844 CB VAL A 122 11.042 -8.738 8.710 1.00 0.00 C ATOM 1845 CG1 VAL A 122 10.633 -7.789 9.826 1.00 0.00 C ATOM 1846 CG2 VAL A 122 12.400 -8.341 8.144 1.00 0.00 C ATOM 0 H VAL A 122 13.090 -10.138 9.776 1.00 0.00 H new ATOM 0 HA VAL A 122 10.152 -10.394 9.779 1.00 0.00 H new ATOM 0 HB VAL A 122 10.306 -8.672 7.908 1.00 0.00 H new ATOM 0 HG11 VAL A 122 10.616 -6.767 9.447 1.00 0.00 H new ATOM 0 HG12 VAL A 122 9.640 -8.058 10.187 1.00 0.00 H new ATOM 0 HG13 VAL A 122 11.349 -7.861 10.645 1.00 0.00 H new ATOM 0 HG21 VAL A 122 12.358 -7.313 7.784 1.00 0.00 H new ATOM 0 HG22 VAL A 122 13.157 -8.421 8.924 1.00 0.00 H new ATOM 0 HG23 VAL A 122 12.658 -9.004 7.319 1.00 0.00 H new ATOM 1856 N ARG A 123 9.987 -11.500 7.512 1.00 0.00 N ATOM 1857 CA ARG A 123 9.903 -12.391 6.361 1.00 0.00 C ATOM 1858 C ARG A 123 9.776 -11.566 5.085 1.00 0.00 C ATOM 1859 O ARG A 123 8.839 -10.777 4.938 1.00 0.00 O ATOM 1860 CB ARG A 123 8.702 -13.328 6.512 1.00 0.00 C ATOM 1861 CG ARG A 123 8.631 -14.014 7.871 1.00 0.00 C ATOM 1862 CD ARG A 123 9.877 -14.836 8.158 1.00 0.00 C ATOM 1863 NE ARG A 123 9.955 -16.027 7.317 1.00 0.00 N ATOM 1864 CZ ARG A 123 11.086 -16.504 6.801 1.00 0.00 C ATOM 1865 NH1 ARG A 123 12.233 -15.866 6.997 1.00 0.00 N ATOM 1866 NH2 ARG A 123 11.070 -17.623 6.089 1.00 0.00 N ATOM 0 H ARG A 123 9.084 -11.175 7.856 1.00 0.00 H new ATOM 0 HA ARG A 123 10.809 -12.995 6.304 1.00 0.00 H new ATOM 0 HB2 ARG A 123 7.786 -12.759 6.353 1.00 0.00 H new ATOM 0 HB3 ARG A 123 8.745 -14.088 5.732 1.00 0.00 H new ATOM 0 HG2 ARG A 123 8.504 -13.263 8.651 1.00 0.00 H new ATOM 0 HG3 ARG A 123 7.754 -14.660 7.906 1.00 0.00 H new ATOM 0 HD2 ARG A 123 10.762 -14.220 7.997 1.00 0.00 H new ATOM 0 HD3 ARG A 123 9.882 -15.132 9.207 1.00 0.00 H new ATOM 0 HE ARG A 123 9.089 -16.525 7.112 1.00 0.00 H new ATOM 0 HH11 ARG A 123 12.251 -15.006 7.545 1.00 0.00 H new ATOM 0 HH12 ARG A 123 13.097 -16.236 6.600 1.00 0.00 H new ATOM 0 HH21 ARG A 123 10.191 -18.118 5.937 1.00 0.00 H new ATOM 0 HH22 ARG A 123 11.936 -17.988 5.694 1.00 0.00 H new ATOM 1880 N ILE A 124 10.706 -11.762 4.160 1.00 0.00 N ATOM 1881 CA ILE A 124 10.826 -10.893 2.993 1.00 0.00 C ATOM 1882 C ILE A 124 10.400 -11.599 1.708 1.00 0.00 C ATOM 1883 O ILE A 124 10.662 -12.787 1.522 1.00 0.00 O ATOM 1884 CB ILE A 124 12.280 -10.382 2.828 1.00 0.00 C ATOM 1885 CG1 ILE A 124 12.733 -9.625 4.079 1.00 0.00 C ATOM 1886 CG2 ILE A 124 12.409 -9.494 1.596 1.00 0.00 C ATOM 1887 CD1 ILE A 124 11.922 -8.382 4.374 1.00 0.00 C ATOM 0 H ILE A 124 11.391 -12.517 4.194 1.00 0.00 H new ATOM 0 HA ILE A 124 10.158 -10.049 3.165 1.00 0.00 H new ATOM 0 HB ILE A 124 12.927 -11.249 2.694 1.00 0.00 H new ATOM 0 HG12 ILE A 124 12.677 -10.295 4.937 1.00 0.00 H new ATOM 0 HG13 ILE A 124 13.780 -9.344 3.962 1.00 0.00 H new ATOM 0 HG21 ILE A 124 13.439 -9.148 1.503 1.00 0.00 H new ATOM 0 HG22 ILE A 124 12.135 -10.063 0.707 1.00 0.00 H new ATOM 0 HG23 ILE A 124 11.746 -8.635 1.696 1.00 0.00 H new ATOM 0 HD11 ILE A 124 12.305 -7.903 5.275 1.00 0.00 H new ATOM 0 HD12 ILE A 124 11.998 -7.690 3.535 1.00 0.00 H new ATOM 0 HD13 ILE A 124 10.878 -8.656 4.525 1.00 0.00 H new ATOM 1899 N GLN A 125 9.734 -10.850 0.834 1.00 0.00 N ATOM 1900 CA GLN A 125 9.379 -11.324 -0.499 1.00 0.00 C ATOM 1901 C GLN A 125 9.120 -10.113 -1.389 1.00 0.00 C ATOM 1902 O GLN A 125 8.632 -9.091 -0.917 1.00 0.00 O ATOM 1903 CB GLN A 125 8.153 -12.261 -0.436 1.00 0.00 C ATOM 1904 CG GLN A 125 6.802 -11.624 -0.763 1.00 0.00 C ATOM 1905 CD GLN A 125 5.644 -12.574 -0.524 1.00 0.00 C ATOM 1906 OE1 GLN A 125 5.687 -13.402 0.384 1.00 0.00 O ATOM 1907 NE2 GLN A 125 4.609 -12.468 -1.343 1.00 0.00 N ATOM 0 H GLN A 125 9.426 -9.898 1.030 1.00 0.00 H new ATOM 0 HA GLN A 125 10.198 -11.907 -0.921 1.00 0.00 H new ATOM 0 HB2 GLN A 125 8.318 -13.089 -1.126 1.00 0.00 H new ATOM 0 HB3 GLN A 125 8.098 -12.687 0.566 1.00 0.00 H new ATOM 0 HG2 GLN A 125 6.667 -10.730 -0.154 1.00 0.00 H new ATOM 0 HG3 GLN A 125 6.797 -11.303 -1.805 1.00 0.00 H new ATOM 0 HE21 GLN A 125 4.614 -11.767 -2.084 1.00 0.00 H new ATOM 0 HE22 GLN A 125 3.806 -13.088 -1.233 1.00 0.00 H new ATOM 1916 N PHE A 126 9.484 -10.187 -2.649 1.00 0.00 N ATOM 1917 CA PHE A 126 9.223 -9.084 -3.559 1.00 0.00 C ATOM 1918 C PHE A 126 7.948 -9.351 -4.335 1.00 0.00 C ATOM 1919 O PHE A 126 7.904 -10.210 -5.216 1.00 0.00 O ATOM 1920 CB PHE A 126 10.411 -8.854 -4.495 1.00 0.00 C ATOM 1921 CG PHE A 126 11.543 -8.111 -3.843 1.00 0.00 C ATOM 1922 CD1 PHE A 126 12.529 -8.792 -3.145 1.00 0.00 C ATOM 1923 CD2 PHE A 126 11.616 -6.731 -3.926 1.00 0.00 C ATOM 1924 CE1 PHE A 126 13.564 -8.107 -2.542 1.00 0.00 C ATOM 1925 CE2 PHE A 126 12.651 -6.040 -3.326 1.00 0.00 C ATOM 1926 CZ PHE A 126 13.626 -6.730 -2.631 1.00 0.00 C ATOM 0 H PHE A 126 9.957 -10.988 -3.068 1.00 0.00 H new ATOM 0 HA PHE A 126 9.089 -8.171 -2.980 1.00 0.00 H new ATOM 0 HB2 PHE A 126 10.775 -9.817 -4.853 1.00 0.00 H new ATOM 0 HB3 PHE A 126 10.074 -8.296 -5.369 1.00 0.00 H new ATOM 0 HD1 PHE A 126 12.486 -9.869 -3.073 1.00 0.00 H new ATOM 0 HD2 PHE A 126 10.855 -6.188 -4.466 1.00 0.00 H new ATOM 0 HE1 PHE A 126 14.326 -8.648 -2.000 1.00 0.00 H new ATOM 0 HE2 PHE A 126 12.698 -4.964 -3.400 1.00 0.00 H new ATOM 0 HZ PHE A 126 14.435 -6.193 -2.158 1.00 0.00 H new ATOM 1936 N LYS A 127 6.907 -8.611 -3.986 1.00 0.00 N ATOM 1937 CA LYS A 127 5.582 -8.877 -4.510 1.00 0.00 C ATOM 1938 C LYS A 127 5.110 -7.755 -5.430 1.00 0.00 C ATOM 1939 O LYS A 127 5.275 -6.578 -5.113 1.00 0.00 O ATOM 1940 CB LYS A 127 4.590 -9.129 -3.352 1.00 0.00 C ATOM 1941 CG LYS A 127 4.588 -8.089 -2.233 1.00 0.00 C ATOM 1942 CD LYS A 127 3.900 -6.803 -2.635 1.00 0.00 C ATOM 1943 CE LYS A 127 4.668 -5.593 -2.167 1.00 0.00 C ATOM 1944 NZ LYS A 127 4.972 -5.645 -0.711 1.00 0.00 N ATOM 0 H LYS A 127 6.957 -7.822 -3.342 1.00 0.00 H new ATOM 0 HA LYS A 127 5.626 -9.781 -5.117 1.00 0.00 H new ATOM 0 HB2 LYS A 127 3.584 -9.188 -3.768 1.00 0.00 H new ATOM 0 HB3 LYS A 127 4.812 -10.103 -2.915 1.00 0.00 H new ATOM 0 HG2 LYS A 127 4.090 -8.504 -1.357 1.00 0.00 H new ATOM 0 HG3 LYS A 127 5.616 -7.871 -1.942 1.00 0.00 H new ATOM 0 HD2 LYS A 127 3.794 -6.770 -3.719 1.00 0.00 H new ATOM 0 HD3 LYS A 127 2.894 -6.781 -2.215 1.00 0.00 H new ATOM 0 HE2 LYS A 127 5.600 -5.517 -2.728 1.00 0.00 H new ATOM 0 HE3 LYS A 127 4.092 -4.694 -2.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 5.761 -5.002 -0.498 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 4.133 -5.353 -0.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 5.235 -6.616 -0.446 1.00 0.00 H new ATOM 1958 N GLN A 128 4.564 -8.146 -6.579 1.00 0.00 N ATOM 1959 CA GLN A 128 3.950 -7.223 -7.540 1.00 0.00 C ATOM 1960 C GLN A 128 4.940 -6.193 -8.093 1.00 0.00 C ATOM 1961 O GLN A 128 5.443 -6.349 -9.206 1.00 0.00 O ATOM 1962 CB GLN A 128 2.736 -6.523 -6.917 1.00 0.00 C ATOM 1963 CG GLN A 128 2.045 -5.535 -7.853 1.00 0.00 C ATOM 1964 CD GLN A 128 1.592 -6.174 -9.157 1.00 0.00 C ATOM 1965 OE1 GLN A 128 1.270 -7.360 -9.201 1.00 0.00 O ATOM 1966 NE2 GLN A 128 1.566 -5.394 -10.228 1.00 0.00 N ATOM 0 H GLN A 128 4.533 -9.122 -6.875 1.00 0.00 H new ATOM 0 HA GLN A 128 3.620 -7.826 -8.386 1.00 0.00 H new ATOM 0 HB2 GLN A 128 2.014 -7.278 -6.604 1.00 0.00 H new ATOM 0 HB3 GLN A 128 3.055 -5.995 -6.018 1.00 0.00 H new ATOM 0 HG2 GLN A 128 1.182 -5.105 -7.346 1.00 0.00 H new ATOM 0 HG3 GLN A 128 2.727 -4.714 -8.074 1.00 0.00 H new ATOM 0 HE21 GLN A 128 1.840 -4.415 -10.152 1.00 0.00 H new ATOM 0 HE22 GLN A 128 1.272 -5.773 -11.128 1.00 0.00 H new ATOM 1975 N ASP A 129 5.222 -5.159 -7.310 1.00 0.00 N ATOM 1976 CA ASP A 129 6.008 -4.019 -7.770 1.00 0.00 C ATOM 1977 C ASP A 129 7.499 -4.339 -7.832 1.00 0.00 C ATOM 1978 O ASP A 129 8.287 -3.877 -7.008 1.00 0.00 O ATOM 1979 CB ASP A 129 5.772 -2.804 -6.867 1.00 0.00 C ATOM 1980 CG ASP A 129 4.362 -2.244 -6.966 1.00 0.00 C ATOM 1981 OD1 ASP A 129 4.122 -1.375 -7.830 1.00 0.00 O ATOM 1982 OD2 ASP A 129 3.493 -2.651 -6.155 1.00 0.00 O ATOM 0 H ASP A 129 4.914 -5.086 -6.340 1.00 0.00 H new ATOM 0 HA ASP A 129 5.675 -3.787 -8.782 1.00 0.00 H new ATOM 0 HB2 ASP A 129 5.972 -3.085 -5.833 1.00 0.00 H new ATOM 0 HB3 ASP A 129 6.485 -2.022 -7.129 1.00 0.00 H new ATOM 1987 N ASP A 130 7.869 -5.152 -8.810 1.00 0.00 N ATOM 1988 CA ASP A 130 9.266 -5.411 -9.131 1.00 0.00 C ATOM 1989 C ASP A 130 9.408 -5.516 -10.636 1.00 0.00 C ATOM 1990 O ASP A 130 9.085 -6.546 -11.230 1.00 0.00 O ATOM 1991 CB ASP A 130 9.777 -6.694 -8.464 1.00 0.00 C ATOM 1992 CG ASP A 130 11.199 -7.045 -8.889 1.00 0.00 C ATOM 1993 OD1 ASP A 130 12.160 -6.461 -8.345 1.00 0.00 O ATOM 1994 OD2 ASP A 130 11.364 -7.911 -9.778 1.00 0.00 O ATOM 0 H ASP A 130 7.208 -5.652 -9.405 1.00 0.00 H new ATOM 0 HA ASP A 130 9.868 -4.587 -8.749 1.00 0.00 H new ATOM 0 HB2 ASP A 130 9.744 -6.575 -7.381 1.00 0.00 H new ATOM 0 HB3 ASP A 130 9.112 -7.520 -8.715 1.00 0.00 H new ATOM 1999 N GLY A 131 9.837 -4.427 -11.251 1.00 0.00 N ATOM 2000 CA GLY A 131 9.957 -4.386 -12.695 1.00 0.00 C ATOM 2001 C GLY A 131 8.682 -3.902 -13.357 1.00 0.00 C ATOM 2002 O GLY A 131 8.646 -3.683 -14.564 1.00 0.00 O ATOM 0 H GLY A 131 10.106 -3.566 -10.775 1.00 0.00 H new ATOM 0 HA2 GLY A 131 10.781 -3.729 -12.972 1.00 0.00 H new ATOM 0 HA3 GLY A 131 10.204 -5.381 -13.067 1.00 0.00 H new ATOM 2006 N THR A 132 7.632 -3.744 -12.563 1.00 0.00 N ATOM 2007 CA THR A 132 6.359 -3.248 -13.063 1.00 0.00 C ATOM 2008 C THR A 132 6.297 -1.727 -12.953 1.00 0.00 C ATOM 2009 O THR A 132 5.772 -1.045 -13.834 1.00 0.00 O ATOM 2010 CB THR A 132 5.190 -3.872 -12.277 1.00 0.00 C ATOM 2011 OG1 THR A 132 5.406 -3.691 -10.871 1.00 0.00 O ATOM 2012 CG2 THR A 132 5.060 -5.358 -12.582 1.00 0.00 C ATOM 0 H THR A 132 7.638 -3.954 -11.565 1.00 0.00 H new ATOM 0 HA THR A 132 6.273 -3.532 -14.112 1.00 0.00 H new ATOM 0 HB THR A 132 4.268 -3.375 -12.579 1.00 0.00 H new ATOM 0 HG1 THR A 132 4.567 -3.420 -10.443 1.00 0.00 H new ATOM 0 HG21 THR A 132 4.228 -5.774 -12.015 1.00 0.00 H new ATOM 0 HG22 THR A 132 4.878 -5.496 -13.648 1.00 0.00 H new ATOM 0 HG23 THR A 132 5.981 -5.869 -12.302 1.00 0.00 H new ATOM 2020 N GLY A 133 6.852 -1.208 -11.864 1.00 0.00 N ATOM 2021 CA GLY A 133 6.876 0.220 -11.642 1.00 0.00 C ATOM 2022 C GLY A 133 8.271 0.708 -11.315 1.00 0.00 C ATOM 2023 O GLY A 133 9.217 -0.084 -11.309 1.00 0.00 O ATOM 0 H GLY A 133 7.289 -1.760 -11.126 1.00 0.00 H new ATOM 0 HA2 GLY A 133 6.509 0.733 -12.531 1.00 0.00 H new ATOM 0 HA3 GLY A 133 6.200 0.474 -10.825 1.00 0.00 H new ATOM 2027 N PRO A 134 8.433 2.011 -11.047 1.00 0.00 N ATOM 2028 CA PRO A 134 9.740 2.590 -10.721 1.00 0.00 C ATOM 2029 C PRO A 134 10.314 2.041 -9.414 1.00 0.00 C ATOM 2030 O PRO A 134 11.372 1.409 -9.411 1.00 0.00 O ATOM 2031 CB PRO A 134 9.464 4.093 -10.608 1.00 0.00 C ATOM 2032 CG PRO A 134 7.990 4.217 -10.401 1.00 0.00 C ATOM 2033 CD PRO A 134 7.361 3.021 -11.057 1.00 0.00 C ATOM 0 HA PRO A 134 10.486 2.347 -11.478 1.00 0.00 H new ATOM 0 HB2 PRO A 134 10.015 4.531 -9.776 1.00 0.00 H new ATOM 0 HB3 PRO A 134 9.779 4.618 -11.510 1.00 0.00 H new ATOM 0 HG2 PRO A 134 7.749 4.247 -9.338 1.00 0.00 H new ATOM 0 HG3 PRO A 134 7.614 5.141 -10.839 1.00 0.00 H new ATOM 0 HD2 PRO A 134 6.484 2.679 -10.508 1.00 0.00 H new ATOM 0 HD3 PRO A 134 7.034 3.247 -12.072 1.00 0.00 H new ATOM 2041 N GLU A 135 9.614 2.274 -8.310 1.00 0.00 N ATOM 2042 CA GLU A 135 10.069 1.801 -7.011 1.00 0.00 C ATOM 2043 C GLU A 135 9.607 0.374 -6.763 1.00 0.00 C ATOM 2044 O GLU A 135 8.614 -0.078 -7.336 1.00 0.00 O ATOM 2045 CB GLU A 135 9.576 2.720 -5.889 1.00 0.00 C ATOM 2046 CG GLU A 135 10.638 3.688 -5.390 1.00 0.00 C ATOM 2047 CD GLU A 135 11.189 4.586 -6.481 1.00 0.00 C ATOM 2048 OE1 GLU A 135 10.587 5.650 -6.745 1.00 0.00 O ATOM 2049 OE2 GLU A 135 12.239 4.245 -7.063 1.00 0.00 O ATOM 0 H GLU A 135 8.732 2.786 -8.289 1.00 0.00 H new ATOM 0 HA GLU A 135 11.159 1.817 -7.015 1.00 0.00 H new ATOM 0 HB2 GLU A 135 8.717 3.288 -6.246 1.00 0.00 H new ATOM 0 HB3 GLU A 135 9.231 2.109 -5.055 1.00 0.00 H new ATOM 0 HG2 GLU A 135 10.214 4.307 -4.599 1.00 0.00 H new ATOM 0 HG3 GLU A 135 11.457 3.122 -4.947 1.00 0.00 H new ATOM 2056 N LYS A 136 10.334 -0.325 -5.907 1.00 0.00 N ATOM 2057 CA LYS A 136 10.074 -1.732 -5.647 1.00 0.00 C ATOM 2058 C LYS A 136 9.530 -1.941 -4.238 1.00 0.00 C ATOM 2059 O LYS A 136 10.218 -1.697 -3.254 1.00 0.00 O ATOM 2060 CB LYS A 136 11.362 -2.532 -5.845 1.00 0.00 C ATOM 2061 CG LYS A 136 11.889 -2.482 -7.268 1.00 0.00 C ATOM 2062 CD LYS A 136 13.144 -3.319 -7.424 1.00 0.00 C ATOM 2063 CE LYS A 136 13.553 -3.434 -8.881 1.00 0.00 C ATOM 2064 NZ LYS A 136 14.370 -4.648 -9.134 1.00 0.00 N ATOM 0 H LYS A 136 11.115 0.062 -5.377 1.00 0.00 H new ATOM 0 HA LYS A 136 9.317 -2.082 -6.349 1.00 0.00 H new ATOM 0 HB2 LYS A 136 12.126 -2.150 -5.169 1.00 0.00 H new ATOM 0 HB3 LYS A 136 11.182 -3.571 -5.568 1.00 0.00 H new ATOM 0 HG2 LYS A 136 11.122 -2.842 -7.954 1.00 0.00 H new ATOM 0 HG3 LYS A 136 12.103 -1.449 -7.542 1.00 0.00 H new ATOM 0 HD2 LYS A 136 13.956 -2.871 -6.851 1.00 0.00 H new ATOM 0 HD3 LYS A 136 12.974 -4.314 -7.012 1.00 0.00 H new ATOM 0 HE2 LYS A 136 12.661 -3.460 -9.507 1.00 0.00 H new ATOM 0 HE3 LYS A 136 14.120 -2.549 -9.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 14.643 -4.680 -10.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 15.225 -4.620 -8.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 13.815 -5.495 -8.899 1.00 0.00 H new ATOM 2078 N ILE A 137 8.281 -2.370 -4.149 1.00 0.00 N ATOM 2079 CA ILE A 137 7.663 -2.667 -2.863 1.00 0.00 C ATOM 2080 C ILE A 137 8.096 -4.035 -2.329 1.00 0.00 C ATOM 2081 O ILE A 137 7.766 -5.077 -2.900 1.00 0.00 O ATOM 2082 CB ILE A 137 6.129 -2.676 -2.936 1.00 0.00 C ATOM 2083 CG1 ILE A 137 5.575 -1.533 -3.790 1.00 0.00 C ATOM 2084 CG2 ILE A 137 5.552 -2.616 -1.536 1.00 0.00 C ATOM 2085 CD1 ILE A 137 5.613 -0.178 -3.132 1.00 0.00 C ATOM 0 H ILE A 137 7.672 -2.521 -4.954 1.00 0.00 H new ATOM 0 HA ILE A 137 7.997 -1.871 -2.198 1.00 0.00 H new ATOM 0 HB ILE A 137 5.829 -3.605 -3.421 1.00 0.00 H new ATOM 0 HG12 ILE A 137 6.141 -1.486 -4.720 1.00 0.00 H new ATOM 0 HG13 ILE A 137 4.543 -1.764 -4.056 1.00 0.00 H new ATOM 0 HG21 ILE A 137 4.463 -2.622 -1.591 1.00 0.00 H new ATOM 0 HG22 ILE A 137 5.892 -3.480 -0.965 1.00 0.00 H new ATOM 0 HG23 ILE A 137 5.885 -1.702 -1.044 1.00 0.00 H new ATOM 0 HD11 ILE A 137 5.201 0.568 -3.811 1.00 0.00 H new ATOM 0 HD12 ILE A 137 5.022 -0.201 -2.217 1.00 0.00 H new ATOM 0 HD13 ILE A 137 6.644 0.081 -2.891 1.00 0.00 H new ATOM 2097 N ALA A 138 8.803 -4.022 -1.214 1.00 0.00 N ATOM 2098 CA ALA A 138 9.206 -5.237 -0.527 1.00 0.00 C ATOM 2099 C ALA A 138 8.118 -5.693 0.446 1.00 0.00 C ATOM 2100 O ALA A 138 7.420 -4.875 1.044 1.00 0.00 O ATOM 2101 CB ALA A 138 10.521 -5.022 0.208 1.00 0.00 C ATOM 0 H ALA A 138 9.116 -3.165 -0.757 1.00 0.00 H new ATOM 0 HA ALA A 138 9.350 -6.020 -1.272 1.00 0.00 H new ATOM 0 HB1 ALA A 138 10.808 -5.942 0.717 1.00 0.00 H new ATOM 0 HB2 ALA A 138 11.296 -4.746 -0.507 1.00 0.00 H new ATOM 0 HB3 ALA A 138 10.402 -4.224 0.941 1.00 0.00 H new ATOM 2107 N HIS A 139 7.933 -7.001 0.539 1.00 0.00 N ATOM 2108 CA HIS A 139 7.019 -7.601 1.507 1.00 0.00 C ATOM 2109 C HIS A 139 7.733 -7.829 2.828 1.00 0.00 C ATOM 2110 O HIS A 139 8.591 -8.706 2.929 1.00 0.00 O ATOM 2111 CB HIS A 139 6.473 -8.922 0.943 1.00 0.00 C ATOM 2112 CG HIS A 139 5.867 -9.888 1.925 1.00 0.00 C ATOM 2113 ND1 HIS A 139 4.589 -10.296 2.084 1.00 0.00 N flip ATOM 2114 CD2 HIS A 139 6.613 -10.633 2.815 1.00 0.00 C flip ATOM 2115 CE1 HIS A 139 4.586 -11.273 3.044 1.00 0.00 C flip ATOM 2116 NE2 HIS A 139 5.820 -11.456 3.465 1.00 0.00 N flip ATOM 0 H HIS A 139 8.411 -7.679 -0.054 1.00 0.00 H new ATOM 0 HA HIS A 139 6.183 -6.925 1.688 1.00 0.00 H new ATOM 0 HB2 HIS A 139 5.718 -8.684 0.193 1.00 0.00 H new ATOM 0 HB3 HIS A 139 7.286 -9.431 0.426 1.00 0.00 H new ATOM 0 HD1 HIS A 139 3.775 -9.941 1.581 1.00 0.00 H new ATOM 0 HD2 HIS A 139 7.681 -10.553 2.956 1.00 0.00 H new ATOM 0 HE1 HIS A 139 3.715 -11.805 3.397 1.00 0.00 H new ATOM 2125 N ILE A 140 7.396 -7.027 3.818 1.00 0.00 N ATOM 2126 CA ILE A 140 7.882 -7.240 5.167 1.00 0.00 C ATOM 2127 C ILE A 140 6.758 -7.802 6.022 1.00 0.00 C ATOM 2128 O ILE A 140 5.693 -7.201 6.128 1.00 0.00 O ATOM 2129 CB ILE A 140 8.431 -5.936 5.789 1.00 0.00 C ATOM 2130 CG1 ILE A 140 9.774 -5.580 5.143 1.00 0.00 C ATOM 2131 CG2 ILE A 140 8.565 -6.059 7.303 1.00 0.00 C ATOM 2132 CD1 ILE A 140 10.449 -4.371 5.752 1.00 0.00 C ATOM 0 H ILE A 140 6.784 -6.218 3.713 1.00 0.00 H new ATOM 0 HA ILE A 140 8.707 -7.952 5.128 1.00 0.00 H new ATOM 0 HB ILE A 140 7.723 -5.131 5.593 1.00 0.00 H new ATOM 0 HG12 ILE A 140 10.443 -6.437 5.225 1.00 0.00 H new ATOM 0 HG13 ILE A 140 9.617 -5.399 4.080 1.00 0.00 H new ATOM 0 HG21 ILE A 140 8.954 -5.126 7.711 1.00 0.00 H new ATOM 0 HG22 ILE A 140 7.588 -6.267 7.739 1.00 0.00 H new ATOM 0 HG23 ILE A 140 9.250 -6.873 7.543 1.00 0.00 H new ATOM 0 HD11 ILE A 140 11.393 -4.185 5.240 1.00 0.00 H new ATOM 0 HD12 ILE A 140 9.801 -3.501 5.646 1.00 0.00 H new ATOM 0 HD13 ILE A 140 10.640 -4.555 6.809 1.00 0.00 H new ATOM 2144 N MET A 141 6.985 -8.969 6.601 1.00 0.00 N ATOM 2145 CA MET A 141 5.959 -9.641 7.380 1.00 0.00 C ATOM 2146 C MET A 141 6.495 -10.063 8.737 1.00 0.00 C ATOM 2147 O MET A 141 7.635 -10.522 8.852 1.00 0.00 O ATOM 2148 CB MET A 141 5.436 -10.851 6.610 1.00 0.00 C ATOM 2149 CG MET A 141 4.377 -11.659 7.344 1.00 0.00 C ATOM 2150 SD MET A 141 3.561 -12.858 6.272 1.00 0.00 S ATOM 2151 CE MET A 141 4.956 -13.819 5.692 1.00 0.00 C ATOM 0 H MET A 141 7.871 -9.471 6.546 1.00 0.00 H new ATOM 0 HA MET A 141 5.138 -8.944 7.549 1.00 0.00 H new ATOM 0 HB2 MET A 141 5.021 -10.510 5.661 1.00 0.00 H new ATOM 0 HB3 MET A 141 6.275 -11.506 6.374 1.00 0.00 H new ATOM 0 HG2 MET A 141 4.838 -12.180 8.183 1.00 0.00 H new ATOM 0 HG3 MET A 141 3.631 -10.982 7.761 1.00 0.00 H new ATOM 0 HE1 MET A 141 5.136 -13.601 4.639 1.00 0.00 H new ATOM 0 HE2 MET A 141 5.842 -13.561 6.272 1.00 0.00 H new ATOM 0 HE3 MET A 141 4.741 -14.881 5.811 1.00 0.00 H new ATOM 2161 N GLY A 142 5.663 -9.896 9.753 1.00 0.00 N ATOM 2162 CA GLY A 142 6.037 -10.243 11.104 1.00 0.00 C ATOM 2163 C GLY A 142 5.246 -9.431 12.105 1.00 0.00 C ATOM 2164 O GLY A 142 4.146 -8.975 11.792 1.00 0.00 O ATOM 0 H GLY A 142 4.720 -9.519 9.660 1.00 0.00 H new ATOM 0 HA2 GLY A 142 5.863 -11.306 11.273 1.00 0.00 H new ATOM 0 HA3 GLY A 142 7.103 -10.067 11.248 1.00 0.00 H new ATOM 2168 N PRO A 143 5.770 -9.229 13.317 1.00 0.00 N ATOM 2169 CA PRO A 143 5.126 -8.383 14.319 1.00 0.00 C ATOM 2170 C PRO A 143 5.195 -6.911 13.924 1.00 0.00 C ATOM 2171 O PRO A 143 6.219 -6.465 13.404 1.00 0.00 O ATOM 2172 CB PRO A 143 5.938 -8.633 15.599 1.00 0.00 C ATOM 2173 CG PRO A 143 6.799 -9.814 15.304 1.00 0.00 C ATOM 2174 CD PRO A 143 7.017 -9.810 13.820 1.00 0.00 C ATOM 0 HA PRO A 143 4.068 -8.616 14.435 1.00 0.00 H new ATOM 0 HB2 PRO A 143 6.541 -7.763 15.856 1.00 0.00 H new ATOM 0 HB3 PRO A 143 5.282 -8.828 16.447 1.00 0.00 H new ATOM 0 HG2 PRO A 143 7.747 -9.748 15.837 1.00 0.00 H new ATOM 0 HG3 PRO A 143 6.317 -10.738 15.625 1.00 0.00 H new ATOM 0 HD2 PRO A 143 7.885 -9.213 13.539 1.00 0.00 H new ATOM 0 HD3 PRO A 143 7.182 -10.815 13.432 1.00 0.00 H new ATOM 2182 N PRO A 144 4.105 -6.152 14.139 1.00 0.00 N ATOM 2183 CA PRO A 144 3.979 -4.757 13.686 1.00 0.00 C ATOM 2184 C PRO A 144 5.240 -3.929 13.927 1.00 0.00 C ATOM 2185 O PRO A 144 5.735 -3.248 13.021 1.00 0.00 O ATOM 2186 CB PRO A 144 2.808 -4.207 14.515 1.00 0.00 C ATOM 2187 CG PRO A 144 2.409 -5.302 15.453 1.00 0.00 C ATOM 2188 CD PRO A 144 2.900 -6.584 14.848 1.00 0.00 C ATOM 0 HA PRO A 144 3.819 -4.706 12.609 1.00 0.00 H new ATOM 0 HB2 PRO A 144 3.106 -3.314 15.064 1.00 0.00 H new ATOM 0 HB3 PRO A 144 1.975 -3.923 13.872 1.00 0.00 H new ATOM 0 HG2 PRO A 144 2.847 -5.146 16.439 1.00 0.00 H new ATOM 0 HG3 PRO A 144 1.327 -5.325 15.584 1.00 0.00 H new ATOM 0 HD2 PRO A 144 3.122 -7.334 15.608 1.00 0.00 H new ATOM 0 HD3 PRO A 144 2.166 -7.022 14.172 1.00 0.00 H new ATOM 2196 N ASP A 145 5.769 -4.024 15.141 1.00 0.00 N ATOM 2197 CA ASP A 145 6.961 -3.280 15.532 1.00 0.00 C ATOM 2198 C ASP A 145 8.165 -3.661 14.673 1.00 0.00 C ATOM 2199 O ASP A 145 8.859 -2.789 14.152 1.00 0.00 O ATOM 2200 CB ASP A 145 7.274 -3.520 17.014 1.00 0.00 C ATOM 2201 CG ASP A 145 7.399 -4.993 17.359 1.00 0.00 C ATOM 2202 OD1 ASP A 145 6.354 -5.664 17.493 1.00 0.00 O ATOM 2203 OD2 ASP A 145 8.537 -5.486 17.490 1.00 0.00 O ATOM 0 H ASP A 145 5.387 -4.615 15.879 1.00 0.00 H new ATOM 0 HA ASP A 145 6.758 -2.221 15.375 1.00 0.00 H new ATOM 0 HB2 ASP A 145 8.203 -3.011 17.271 1.00 0.00 H new ATOM 0 HB3 ASP A 145 6.488 -3.075 17.623 1.00 0.00 H new ATOM 2208 N ARG A 146 8.396 -4.962 14.510 1.00 0.00 N ATOM 2209 CA ARG A 146 9.536 -5.444 13.736 1.00 0.00 C ATOM 2210 C ARG A 146 9.380 -5.090 12.266 1.00 0.00 C ATOM 2211 O ARG A 146 10.369 -4.887 11.568 1.00 0.00 O ATOM 2212 CB ARG A 146 9.711 -6.957 13.892 1.00 0.00 C ATOM 2213 CG ARG A 146 10.014 -7.393 15.316 1.00 0.00 C ATOM 2214 CD ARG A 146 10.349 -8.875 15.384 1.00 0.00 C ATOM 2215 NE ARG A 146 10.414 -9.362 16.761 1.00 0.00 N ATOM 2216 CZ ARG A 146 11.343 -10.201 17.215 1.00 0.00 C ATOM 2217 NH1 ARG A 146 12.357 -10.568 16.441 1.00 0.00 N ATOM 2218 NH2 ARG A 146 11.274 -10.658 18.458 1.00 0.00 N ATOM 0 H ARG A 146 7.810 -5.699 14.903 1.00 0.00 H new ATOM 0 HA ARG A 146 10.427 -4.951 14.124 1.00 0.00 H new ATOM 0 HB2 ARG A 146 8.803 -7.456 13.554 1.00 0.00 H new ATOM 0 HB3 ARG A 146 10.519 -7.290 13.240 1.00 0.00 H new ATOM 0 HG2 ARG A 146 10.849 -6.811 15.706 1.00 0.00 H new ATOM 0 HG3 ARG A 146 9.155 -7.183 15.953 1.00 0.00 H new ATOM 0 HD2 ARG A 146 9.597 -9.442 14.835 1.00 0.00 H new ATOM 0 HD3 ARG A 146 11.305 -9.053 14.892 1.00 0.00 H new ATOM 0 HE ARG A 146 9.702 -9.038 17.416 1.00 0.00 H new ATOM 0 HH11 ARG A 146 12.429 -10.207 15.490 1.00 0.00 H new ATOM 0 HH12 ARG A 146 13.064 -11.211 16.797 1.00 0.00 H new ATOM 0 HH21 ARG A 146 10.509 -10.367 19.067 1.00 0.00 H new ATOM 0 HH22 ARG A 146 11.986 -11.301 18.805 1.00 0.00 H new ATOM 2232 N CYS A 147 8.135 -5.012 11.807 1.00 0.00 N ATOM 2233 CA CYS A 147 7.847 -4.616 10.437 1.00 0.00 C ATOM 2234 C CYS A 147 8.403 -3.225 10.171 1.00 0.00 C ATOM 2235 O CYS A 147 9.302 -3.053 9.347 1.00 0.00 O ATOM 2236 CB CYS A 147 6.337 -4.645 10.188 1.00 0.00 C ATOM 2237 SG CYS A 147 5.585 -6.256 10.493 1.00 0.00 S ATOM 0 H CYS A 147 7.308 -5.219 12.368 1.00 0.00 H new ATOM 0 HA CYS A 147 8.325 -5.319 9.755 1.00 0.00 H new ATOM 0 HB2 CYS A 147 5.858 -3.903 10.827 1.00 0.00 H new ATOM 0 HB3 CYS A 147 6.142 -4.352 9.157 1.00 0.00 H new ATOM 0 HG CYS A 147 6.052 -6.750 11.601 1.00 0.00 H new ATOM 2243 N GLU A 148 7.891 -2.244 10.902 1.00 0.00 N ATOM 2244 CA GLU A 148 8.344 -0.866 10.765 1.00 0.00 C ATOM 2245 C GLU A 148 9.840 -0.755 11.044 1.00 0.00 C ATOM 2246 O GLU A 148 10.568 -0.085 10.312 1.00 0.00 O ATOM 2247 CB GLU A 148 7.550 0.033 11.713 1.00 0.00 C ATOM 2248 CG GLU A 148 6.153 0.351 11.208 1.00 0.00 C ATOM 2249 CD GLU A 148 6.173 1.351 10.073 1.00 0.00 C ATOM 2250 OE1 GLU A 148 6.470 0.960 8.933 1.00 0.00 O ATOM 2251 OE2 GLU A 148 5.903 2.544 10.329 1.00 0.00 O ATOM 0 H GLU A 148 7.158 -2.378 11.599 1.00 0.00 H new ATOM 0 HA GLU A 148 8.172 -0.540 9.739 1.00 0.00 H new ATOM 0 HB2 GLU A 148 7.476 -0.452 12.686 1.00 0.00 H new ATOM 0 HB3 GLU A 148 8.096 0.965 11.862 1.00 0.00 H new ATOM 0 HG2 GLU A 148 5.671 -0.568 10.873 1.00 0.00 H new ATOM 0 HG3 GLU A 148 5.553 0.745 12.028 1.00 0.00 H new ATOM 2258 N HIS A 149 10.290 -1.446 12.085 1.00 0.00 N ATOM 2259 CA HIS A 149 11.700 -1.448 12.474 1.00 0.00 C ATOM 2260 C HIS A 149 12.590 -1.949 11.332 1.00 0.00 C ATOM 2261 O HIS A 149 13.764 -1.600 11.249 1.00 0.00 O ATOM 2262 CB HIS A 149 11.883 -2.324 13.723 1.00 0.00 C ATOM 2263 CG HIS A 149 13.287 -2.386 14.251 1.00 0.00 C ATOM 2264 ND1 HIS A 149 13.881 -3.562 14.652 1.00 0.00 N ATOM 2265 CD2 HIS A 149 14.208 -1.414 14.459 1.00 0.00 C ATOM 2266 CE1 HIS A 149 15.106 -3.312 15.078 1.00 0.00 C ATOM 2267 NE2 HIS A 149 15.328 -2.016 14.972 1.00 0.00 N ATOM 0 H HIS A 149 9.693 -2.019 12.682 1.00 0.00 H new ATOM 0 HA HIS A 149 12.001 -0.425 12.701 1.00 0.00 H new ATOM 0 HB2 HIS A 149 11.230 -1.949 14.511 1.00 0.00 H new ATOM 0 HB3 HIS A 149 11.553 -3.336 13.491 1.00 0.00 H new ATOM 0 HD2 HIS A 149 14.083 -0.360 14.258 1.00 0.00 H new ATOM 0 HE1 HIS A 149 15.807 -4.044 15.450 1.00 0.00 H new ATOM 0 HE2 HIS A 149 16.192 -1.539 15.230 1.00 0.00 H new ATOM 2276 N ALA A 150 12.013 -2.742 10.442 1.00 0.00 N ATOM 2277 CA ALA A 150 12.759 -3.336 9.340 1.00 0.00 C ATOM 2278 C ALA A 150 12.930 -2.348 8.192 1.00 0.00 C ATOM 2279 O ALA A 150 14.045 -2.107 7.728 1.00 0.00 O ATOM 2280 CB ALA A 150 12.062 -4.591 8.843 1.00 0.00 C ATOM 0 H ALA A 150 11.024 -2.991 10.461 1.00 0.00 H new ATOM 0 HA ALA A 150 13.748 -3.601 9.713 1.00 0.00 H new ATOM 0 HB1 ALA A 150 12.632 -5.022 8.020 1.00 0.00 H new ATOM 0 HB2 ALA A 150 11.993 -5.315 9.655 1.00 0.00 H new ATOM 0 HB3 ALA A 150 11.060 -4.338 8.497 1.00 0.00 H new ATOM 2286 N ALA A 151 11.820 -1.771 7.746 1.00 0.00 N ATOM 2287 CA ALA A 151 11.840 -0.833 6.627 1.00 0.00 C ATOM 2288 C ALA A 151 12.657 0.401 6.964 1.00 0.00 C ATOM 2289 O ALA A 151 13.199 1.061 6.083 1.00 0.00 O ATOM 2290 CB ALA A 151 10.431 -0.425 6.245 1.00 0.00 C ATOM 0 H ALA A 151 10.894 -1.936 8.141 1.00 0.00 H new ATOM 0 HA ALA A 151 12.305 -1.338 5.781 1.00 0.00 H new ATOM 0 HB1 ALA A 151 10.469 0.274 5.409 1.00 0.00 H new ATOM 0 HB2 ALA A 151 9.863 -1.308 5.954 1.00 0.00 H new ATOM 0 HB3 ALA A 151 9.947 0.053 7.097 1.00 0.00 H new ATOM 2296 N ARG A 152 12.746 0.706 8.243 1.00 0.00 N ATOM 2297 CA ARG A 152 13.471 1.875 8.698 1.00 0.00 C ATOM 2298 C ARG A 152 14.973 1.604 8.727 1.00 0.00 C ATOM 2299 O ARG A 152 15.782 2.533 8.725 1.00 0.00 O ATOM 2300 CB ARG A 152 12.921 2.312 10.049 1.00 0.00 C ATOM 2301 CG ARG A 152 11.483 2.796 9.928 1.00 0.00 C ATOM 2302 CD ARG A 152 10.775 2.886 11.264 1.00 0.00 C ATOM 2303 NE ARG A 152 9.349 3.178 11.089 1.00 0.00 N ATOM 2304 CZ ARG A 152 8.813 4.400 11.153 1.00 0.00 C ATOM 2305 NH1 ARG A 152 9.582 5.463 11.352 1.00 0.00 N ATOM 2306 NH2 ARG A 152 7.505 4.556 10.985 1.00 0.00 N ATOM 0 H ARG A 152 12.322 0.156 8.990 1.00 0.00 H new ATOM 0 HA ARG A 152 13.327 2.699 7.999 1.00 0.00 H new ATOM 0 HB2 ARG A 152 12.969 1.479 10.751 1.00 0.00 H new ATOM 0 HB3 ARG A 152 13.543 3.109 10.457 1.00 0.00 H new ATOM 0 HG2 ARG A 152 11.474 3.776 9.451 1.00 0.00 H new ATOM 0 HG3 ARG A 152 10.931 2.119 9.275 1.00 0.00 H new ATOM 0 HD2 ARG A 152 10.893 1.947 11.805 1.00 0.00 H new ATOM 0 HD3 ARG A 152 11.237 3.664 11.872 1.00 0.00 H new ATOM 0 HE ARG A 152 8.723 2.394 10.906 1.00 0.00 H new ATOM 0 HH11 ARG A 152 10.590 5.351 11.457 1.00 0.00 H new ATOM 0 HH12 ARG A 152 9.165 6.393 11.400 1.00 0.00 H new ATOM 0 HH21 ARG A 152 6.913 3.744 10.808 1.00 0.00 H new ATOM 0 HH22 ARG A 152 7.092 5.487 11.033 1.00 0.00 H new ATOM 2320 N ILE A 153 15.343 0.327 8.735 1.00 0.00 N ATOM 2321 CA ILE A 153 16.728 -0.064 8.495 1.00 0.00 C ATOM 2322 C ILE A 153 17.044 0.151 7.020 1.00 0.00 C ATOM 2323 O ILE A 153 18.100 0.669 6.658 1.00 0.00 O ATOM 2324 CB ILE A 153 16.990 -1.544 8.861 1.00 0.00 C ATOM 2325 CG1 ILE A 153 16.698 -1.789 10.343 1.00 0.00 C ATOM 2326 CG2 ILE A 153 18.430 -1.927 8.534 1.00 0.00 C ATOM 2327 CD1 ILE A 153 16.834 -3.236 10.764 1.00 0.00 C ATOM 0 H ILE A 153 14.706 -0.452 8.904 1.00 0.00 H new ATOM 0 HA ILE A 153 17.369 0.549 9.129 1.00 0.00 H new ATOM 0 HB ILE A 153 16.322 -2.169 8.268 1.00 0.00 H new ATOM 0 HG12 ILE A 153 17.376 -1.181 10.942 1.00 0.00 H new ATOM 0 HG13 ILE A 153 15.686 -1.450 10.565 1.00 0.00 H new ATOM 0 HG21 ILE A 153 18.598 -2.971 8.798 1.00 0.00 H new ATOM 0 HG22 ILE A 153 18.610 -1.788 7.468 1.00 0.00 H new ATOM 0 HG23 ILE A 153 19.113 -1.295 9.102 1.00 0.00 H new ATOM 0 HD11 ILE A 153 16.611 -3.328 11.827 1.00 0.00 H new ATOM 0 HD12 ILE A 153 16.136 -3.848 10.193 1.00 0.00 H new ATOM 0 HD13 ILE A 153 17.853 -3.575 10.576 1.00 0.00 H new ATOM 2339 N ILE A 154 16.092 -0.236 6.177 1.00 0.00 N ATOM 2340 CA ILE A 154 16.194 -0.037 4.736 1.00 0.00 C ATOM 2341 C ILE A 154 16.294 1.452 4.411 1.00 0.00 C ATOM 2342 O ILE A 154 17.183 1.881 3.679 1.00 0.00 O ATOM 2343 CB ILE A 154 14.971 -0.639 4.010 1.00 0.00 C ATOM 2344 CG1 ILE A 154 14.848 -2.133 4.321 1.00 0.00 C ATOM 2345 CG2 ILE A 154 15.072 -0.411 2.509 1.00 0.00 C ATOM 2346 CD1 ILE A 154 13.618 -2.783 3.724 1.00 0.00 C ATOM 0 H ILE A 154 15.230 -0.695 6.473 1.00 0.00 H new ATOM 0 HA ILE A 154 17.095 -0.544 4.391 1.00 0.00 H new ATOM 0 HB ILE A 154 14.074 -0.136 4.371 1.00 0.00 H new ATOM 0 HG12 ILE A 154 15.735 -2.646 3.949 1.00 0.00 H new ATOM 0 HG13 ILE A 154 14.831 -2.269 5.402 1.00 0.00 H new ATOM 0 HG21 ILE A 154 14.201 -0.843 2.016 1.00 0.00 H new ATOM 0 HG22 ILE A 154 15.111 0.659 2.305 1.00 0.00 H new ATOM 0 HG23 ILE A 154 15.976 -0.886 2.129 1.00 0.00 H new ATOM 0 HD11 ILE A 154 13.601 -3.840 3.988 1.00 0.00 H new ATOM 0 HD12 ILE A 154 12.724 -2.297 4.115 1.00 0.00 H new ATOM 0 HD13 ILE A 154 13.642 -2.680 2.639 1.00 0.00 H new ATOM 2358 N ASN A 155 15.377 2.232 4.983 1.00 0.00 N ATOM 2359 CA ASN A 155 15.351 3.683 4.794 1.00 0.00 C ATOM 2360 C ASN A 155 16.699 4.314 5.122 1.00 0.00 C ATOM 2361 O ASN A 155 17.155 5.210 4.413 1.00 0.00 O ATOM 2362 CB ASN A 155 14.261 4.327 5.657 1.00 0.00 C ATOM 2363 CG ASN A 155 12.914 4.402 4.957 1.00 0.00 C ATOM 2364 OD1 ASN A 155 12.612 5.380 4.275 1.00 0.00 O ATOM 2365 ND2 ASN A 155 12.097 3.375 5.122 1.00 0.00 N ATOM 0 H ASN A 155 14.635 1.879 5.587 1.00 0.00 H new ATOM 0 HA ASN A 155 15.130 3.865 3.742 1.00 0.00 H new ATOM 0 HB2 ASN A 155 14.153 3.758 6.580 1.00 0.00 H new ATOM 0 HB3 ASN A 155 14.575 5.333 5.938 1.00 0.00 H new ATOM 0 HD21 ASN A 155 11.180 3.376 4.676 1.00 0.00 H new ATOM 0 HD22 ASN A 155 12.384 2.582 5.696 1.00 0.00 H new ATOM 2372 N ASP A 156 17.339 3.831 6.184 1.00 0.00 N ATOM 2373 CA ASP A 156 18.651 4.337 6.582 1.00 0.00 C ATOM 2374 C ASP A 156 19.669 4.123 5.466 1.00 0.00 C ATOM 2375 O ASP A 156 20.444 5.021 5.137 1.00 0.00 O ATOM 2376 CB ASP A 156 19.127 3.648 7.864 1.00 0.00 C ATOM 2377 CG ASP A 156 20.457 4.187 8.355 1.00 0.00 C ATOM 2378 OD1 ASP A 156 20.456 5.174 9.124 1.00 0.00 O ATOM 2379 OD2 ASP A 156 21.506 3.623 7.990 1.00 0.00 O ATOM 0 H ASP A 156 16.972 3.092 6.783 1.00 0.00 H new ATOM 0 HA ASP A 156 18.559 5.406 6.772 1.00 0.00 H new ATOM 0 HB2 ASP A 156 18.376 3.779 8.643 1.00 0.00 H new ATOM 0 HB3 ASP A 156 19.217 2.577 7.685 1.00 0.00 H new ATOM 2384 N LEU A 157 19.633 2.938 4.870 1.00 0.00 N ATOM 2385 CA LEU A 157 20.522 2.600 3.764 1.00 0.00 C ATOM 2386 C LEU A 157 20.236 3.492 2.560 1.00 0.00 C ATOM 2387 O LEU A 157 21.151 3.947 1.870 1.00 0.00 O ATOM 2388 CB LEU A 157 20.335 1.135 3.364 1.00 0.00 C ATOM 2389 CG LEU A 157 20.519 0.116 4.484 1.00 0.00 C ATOM 2390 CD1 LEU A 157 20.195 -1.278 3.974 1.00 0.00 C ATOM 2391 CD2 LEU A 157 21.939 0.170 5.031 1.00 0.00 C ATOM 0 H LEU A 157 18.993 2.190 5.136 1.00 0.00 H new ATOM 0 HA LEU A 157 21.550 2.758 4.091 1.00 0.00 H new ATOM 0 HB2 LEU A 157 19.334 1.015 2.950 1.00 0.00 H new ATOM 0 HB3 LEU A 157 21.040 0.902 2.566 1.00 0.00 H new ATOM 0 HG LEU A 157 19.835 0.361 5.296 1.00 0.00 H new ATOM 0 HD11 LEU A 157 20.329 -2.000 4.779 1.00 0.00 H new ATOM 0 HD12 LEU A 157 19.162 -1.308 3.628 1.00 0.00 H new ATOM 0 HD13 LEU A 157 20.862 -1.528 3.149 1.00 0.00 H new ATOM 0 HD21 LEU A 157 22.050 -0.564 5.829 1.00 0.00 H new ATOM 0 HD22 LEU A 157 22.646 -0.053 4.232 1.00 0.00 H new ATOM 0 HD23 LEU A 157 22.140 1.166 5.425 1.00 0.00 H new ATOM 2403 N LEU A 158 18.955 3.746 2.324 1.00 0.00 N ATOM 2404 CA LEU A 158 18.526 4.562 1.194 1.00 0.00 C ATOM 2405 C LEU A 158 19.007 5.995 1.357 1.00 0.00 C ATOM 2406 O LEU A 158 19.379 6.651 0.387 1.00 0.00 O ATOM 2407 CB LEU A 158 17.000 4.540 1.074 1.00 0.00 C ATOM 2408 CG LEU A 158 16.372 3.152 1.132 1.00 0.00 C ATOM 2409 CD1 LEU A 158 14.864 3.254 1.032 1.00 0.00 C ATOM 2410 CD2 LEU A 158 16.930 2.270 0.028 1.00 0.00 C ATOM 0 H LEU A 158 18.191 3.397 2.903 1.00 0.00 H new ATOM 0 HA LEU A 158 18.962 4.146 0.286 1.00 0.00 H new ATOM 0 HB2 LEU A 158 16.578 5.148 1.875 1.00 0.00 H new ATOM 0 HB3 LEU A 158 16.717 5.012 0.133 1.00 0.00 H new ATOM 0 HG LEU A 158 16.621 2.694 2.089 1.00 0.00 H new ATOM 0 HD11 LEU A 158 14.428 2.256 1.075 1.00 0.00 H new ATOM 0 HD12 LEU A 158 14.484 3.852 1.861 1.00 0.00 H new ATOM 0 HD13 LEU A 158 14.593 3.728 0.089 1.00 0.00 H new ATOM 0 HD21 LEU A 158 16.471 1.283 0.084 1.00 0.00 H new ATOM 0 HD22 LEU A 158 16.711 2.718 -0.941 1.00 0.00 H new ATOM 0 HD23 LEU A 158 18.009 2.176 0.148 1.00 0.00 H new ATOM 2422 N GLN A 159 19.006 6.471 2.593 1.00 0.00 N ATOM 2423 CA GLN A 159 19.472 7.818 2.896 1.00 0.00 C ATOM 2424 C GLN A 159 20.997 7.856 2.942 1.00 0.00 C ATOM 2425 O GLN A 159 21.603 8.928 2.897 1.00 0.00 O ATOM 2426 CB GLN A 159 18.887 8.300 4.226 1.00 0.00 C ATOM 2427 CG GLN A 159 17.367 8.389 4.227 1.00 0.00 C ATOM 2428 CD GLN A 159 16.831 9.353 3.185 1.00 0.00 C ATOM 2429 OE1 GLN A 159 16.652 10.540 3.454 1.00 0.00 O ATOM 2430 NE2 GLN A 159 16.562 8.851 1.989 1.00 0.00 N ATOM 0 H GLN A 159 18.687 5.943 3.406 1.00 0.00 H new ATOM 0 HA GLN A 159 19.132 8.487 2.105 1.00 0.00 H new ATOM 0 HB2 GLN A 159 19.203 7.623 5.019 1.00 0.00 H new ATOM 0 HB3 GLN A 159 19.300 9.281 4.461 1.00 0.00 H new ATOM 0 HG2 GLN A 159 16.950 7.398 4.047 1.00 0.00 H new ATOM 0 HG3 GLN A 159 17.027 8.703 5.214 1.00 0.00 H new ATOM 0 HE21 GLN A 159 16.724 7.861 1.803 1.00 0.00 H new ATOM 0 HE22 GLN A 159 16.193 9.454 1.254 1.00 0.00 H new ATOM 2439 N SER A 160 21.607 6.681 3.039 1.00 0.00 N ATOM 2440 CA SER A 160 23.057 6.563 3.022 1.00 0.00 C ATOM 2441 C SER A 160 23.576 6.653 1.585 1.00 0.00 C ATOM 2442 O SER A 160 24.637 7.224 1.330 1.00 0.00 O ATOM 2443 CB SER A 160 23.489 5.241 3.674 1.00 0.00 C ATOM 2444 OG SER A 160 24.903 5.129 3.745 1.00 0.00 O ATOM 0 H SER A 160 21.115 5.792 3.131 1.00 0.00 H new ATOM 0 HA SER A 160 23.486 7.385 3.595 1.00 0.00 H new ATOM 0 HB2 SER A 160 23.068 5.175 4.677 1.00 0.00 H new ATOM 0 HB3 SER A 160 23.086 4.405 3.103 1.00 0.00 H new ATOM 0 HG SER A 160 25.143 4.277 4.166 1.00 0.00 H new ATOM 2450 N LEU A 161 22.821 6.089 0.644 1.00 0.00 N ATOM 2451 CA LEU A 161 23.197 6.154 -0.765 1.00 0.00 C ATOM 2452 C LEU A 161 22.645 7.413 -1.415 1.00 0.00 C ATOM 2453 O LEU A 161 23.334 8.064 -2.204 1.00 0.00 O ATOM 2454 CB LEU A 161 22.695 4.936 -1.542 1.00 0.00 C ATOM 2455 CG LEU A 161 23.233 3.580 -1.085 1.00 0.00 C ATOM 2456 CD1 LEU A 161 22.835 2.503 -2.080 1.00 0.00 C ATOM 2457 CD2 LEU A 161 24.746 3.618 -0.921 1.00 0.00 C ATOM 0 H LEU A 161 21.953 5.586 0.830 1.00 0.00 H new ATOM 0 HA LEU A 161 24.286 6.169 -0.799 1.00 0.00 H new ATOM 0 HB2 LEU A 161 21.607 4.913 -1.479 1.00 0.00 H new ATOM 0 HB3 LEU A 161 22.950 5.070 -2.593 1.00 0.00 H new ATOM 0 HG LEU A 161 22.797 3.347 -0.114 1.00 0.00 H new ATOM 0 HD11 LEU A 161 23.222 1.540 -1.748 1.00 0.00 H new ATOM 0 HD12 LEU A 161 21.748 2.454 -2.148 1.00 0.00 H new ATOM 0 HD13 LEU A 161 23.249 2.742 -3.060 1.00 0.00 H new ATOM 0 HD21 LEU A 161 25.101 2.640 -0.595 1.00 0.00 H new ATOM 0 HD22 LEU A 161 25.209 3.873 -1.874 1.00 0.00 H new ATOM 0 HD23 LEU A 161 25.012 4.368 -0.176 1.00 0.00 H new ATOM 2469 N ARG A 162 21.397 7.737 -1.068 1.00 0.00 N ATOM 2470 CA ARG A 162 20.672 8.881 -1.630 1.00 0.00 C ATOM 2471 C ARG A 162 20.343 8.634 -3.100 1.00 0.00 C ATOM 2472 O ARG A 162 19.197 8.351 -3.452 1.00 0.00 O ATOM 2473 CB ARG A 162 21.469 10.179 -1.453 1.00 0.00 C ATOM 2474 CG ARG A 162 21.818 10.470 -0.004 1.00 0.00 C ATOM 2475 CD ARG A 162 22.681 11.708 0.132 1.00 0.00 C ATOM 2476 NE ARG A 162 23.105 11.925 1.513 1.00 0.00 N ATOM 2477 CZ ARG A 162 23.180 13.123 2.090 1.00 0.00 C ATOM 2478 NH1 ARG A 162 22.852 14.216 1.408 1.00 0.00 N ATOM 2479 NH2 ARG A 162 23.577 13.225 3.351 1.00 0.00 N ATOM 0 H ARG A 162 20.856 7.209 -0.383 1.00 0.00 H new ATOM 0 HA ARG A 162 19.735 8.993 -1.085 1.00 0.00 H new ATOM 0 HB2 ARG A 162 22.388 10.117 -2.036 1.00 0.00 H new ATOM 0 HB3 ARG A 162 20.891 11.011 -1.856 1.00 0.00 H new ATOM 0 HG2 ARG A 162 20.901 10.602 0.571 1.00 0.00 H new ATOM 0 HG3 ARG A 162 22.341 9.614 0.422 1.00 0.00 H new ATOM 0 HD2 ARG A 162 23.559 11.611 -0.507 1.00 0.00 H new ATOM 0 HD3 ARG A 162 22.126 12.578 -0.219 1.00 0.00 H new ATOM 0 HE ARG A 162 23.359 11.109 2.070 1.00 0.00 H new ATOM 0 HH11 ARG A 162 22.542 14.139 0.439 1.00 0.00 H new ATOM 0 HH12 ARG A 162 22.911 15.132 1.853 1.00 0.00 H new ATOM 0 HH21 ARG A 162 23.824 12.387 3.877 1.00 0.00 H new ATOM 0 HH22 ARG A 162 23.635 14.142 3.795 1.00 0.00 H new ATOM 2493 N SER A 163 21.354 8.711 -3.945 1.00 0.00 N ATOM 2494 CA SER A 163 21.201 8.435 -5.358 1.00 0.00 C ATOM 2495 C SER A 163 22.376 7.591 -5.832 1.00 0.00 C ATOM 2496 O SER A 163 23.536 7.944 -5.600 1.00 0.00 O ATOM 2497 CB SER A 163 21.120 9.742 -6.151 1.00 0.00 C ATOM 2498 OG SER A 163 20.878 9.497 -7.527 1.00 0.00 O ATOM 0 H SER A 163 22.302 8.966 -3.670 1.00 0.00 H new ATOM 0 HA SER A 163 20.275 7.885 -5.523 1.00 0.00 H new ATOM 0 HB2 SER A 163 20.324 10.367 -5.745 1.00 0.00 H new ATOM 0 HB3 SER A 163 22.051 10.297 -6.037 1.00 0.00 H new ATOM 0 HG SER A 163 20.830 10.350 -8.008 1.00 0.00 H new ATOM 2504 N GLY A 164 22.078 6.461 -6.456 1.00 0.00 N ATOM 2505 CA GLY A 164 23.124 5.600 -6.961 1.00 0.00 C ATOM 2506 C GLY A 164 22.715 4.863 -8.222 1.00 0.00 C ATOM 2507 O GLY A 164 22.581 3.640 -8.202 1.00 0.00 O ATOM 0 H GLY A 164 21.129 6.126 -6.621 1.00 0.00 H new ATOM 0 HA2 GLY A 164 24.013 6.196 -7.165 1.00 0.00 H new ATOM 0 HA3 GLY A 164 23.396 4.876 -6.193 1.00 0.00 H new TER 2511 GLY A 164