USER MOD reduce.3.24.130724 H: found=0, std=0, add=1497, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1498 hydrogens (22 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 191 GLC O2 : rot 121:sc= 0.32 USER MOD Set 1.2: A 192 BGC O3 : rot 176:sc= 0.0221 USER MOD Set 2.1: A 73 TYR OH : rot 130:sc= 0 USER MOD Set 2.2: A 168 CYS SG : rot 74:sc= 0.0529 USER MOD Set 3.1: A 166 LYS NZ :NH3+ -132:sc= -0.0551 (180deg=-0.633) USER MOD Set 3.2: A 191 GLC O3 : rot -32:sc= 0 USER MOD Set 3.3: A 191 GLC O4 : rot -59:sc= 0.897 USER MOD Set 4.1: A 109 HIS : no HE2:sc= 0.0153 X(o=0.054,f=0.11) USER MOD Set 4.2: A 147 SER OG : rot 29:sc= 0.0388 USER MOD Set 5.1: A 88 LYS NZ :NH3+ -178:sc= 0.704 (180deg=0.701) USER MOD Set 5.2: A 182 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 6.1: A 15 ASN : amide:sc= -1.39 K(o=-0.65,f=-1.7!) USER MOD Set 6.2: A 63 THR OG1 : rot -93:sc= 0.74 USER MOD Set 7.1: A 58 GLN : amide:sc= -0.777 K(o=-0.72,f=-1.4) USER MOD Set 7.2: A 62 GLN :FLIP amide:sc= 0.0535 F(o=-1.4,f=-0.72) USER MOD Set 8.1: A 20 SER OG : rot -33:sc= -1.08 USER MOD Set 8.2: A 28 HIS : no HE2:sc= -1.99 K(o=-3.1,f=-3.8!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 131:sc= 0.00981 (180deg=-0.198) USER MOD Single : A 21 HIS : no HD1:sc= -0.573 X(o=-0.57,f=-0.36) USER MOD Single : A 25 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 29 TYR OH : rot 120:sc=-0.000962 USER MOD Single : A 31 LYS NZ :NH3+ -140:sc= -0.695 (180deg=-2.43!) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 SER OG : rot 60:sc= -2.49! USER MOD Single : A 54 ASN : amide:sc= -0.485 X(o=-0.48,f=-0.88) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -2.95 K(o=-2.9,f=-5.9!) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ -161:sc= -0.0487 (180deg=-0.39) USER MOD Single : A 83 TYR OH : rot 180:sc= -1.04 USER MOD Single : A 93 TYR OH : rot 180:sc=-0.00743 USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=-0.023) USER MOD Single : A 97 SER OG : rot 180:sc= -0.317 USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 GLN : amide:sc=-0.00115 X(o=-0.0012,f=-0.0043) USER MOD Single : A 100 LYS NZ :NH3+ -146:sc= -0.463 (180deg=-0.529) USER MOD Single : A 107 ASN : amide:sc= -2.68 K(o=-2.7,f=-5.8!) USER MOD Single : A 110 THR OG1 : rot 43:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 HIS : no HD1:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot -10:sc= 0.632 USER MOD Single : A 127 HIS : no HE2:sc=-0.00487 X(o=-0.0049,f=-0.11) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 148 THR OG1 : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot 180:sc= 0 USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 SER OG : rot -144:sc= 0.00255 USER MOD Single : A 159 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 TYR OH : rot 180:sc= 0 USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 164 ASN : amide:sc= -1.38 K(o=-1.4,f=-5.7!) USER MOD Single : A 173 MET CE :methyl 155:sc= -0.229 (180deg=-0.87) USER MOD Single : A 174 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 176 THR OG1 : rot 180:sc= 0 USER MOD Single : A 184 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 186 HIS : no HE2:sc= -0.0239 K(o=-0.024,f=-2.5) USER MOD Single : A 191 GLC O6 : rot -19:sc= 0.278 USER MOD Single : A 192 BGC O1 : rot 180:sc= 0 USER MOD Single : A 192 BGC O2 : rot 180:sc= 0 USER MOD Single : A 192 BGC O6 : rot -14:sc= 0.316 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 24.089 -17.657 -6.425 1.00 8.93 N ATOM 2 CA GLY A 1 23.417 -18.986 -6.419 1.00 8.42 C ATOM 3 C GLY A 1 21.955 -18.895 -6.033 1.00 7.62 C ATOM 4 O GLY A 1 21.123 -18.455 -6.832 1.00 7.93 O ATOM 0 H1 GLY A 1 25.087 -17.774 -6.695 1.00 8.93 H new ATOM 0 H2 GLY A 1 23.616 -17.032 -7.108 1.00 8.93 H new ATOM 0 H3 GLY A 1 24.034 -17.236 -5.476 1.00 8.93 H new ATOM 0 HA2 GLY A 1 23.501 -19.436 -7.408 1.00 8.42 H new ATOM 0 HA3 GLY A 1 23.933 -19.647 -5.723 1.00 8.42 H new ATOM 10 N ALA A 2 21.638 -19.321 -4.784 1.00 6.82 N ATOM 11 CA ALA A 2 20.255 -19.301 -4.247 1.00 6.18 C ATOM 12 C ALA A 2 20.089 -18.255 -3.106 1.00 5.26 C ATOM 13 O ALA A 2 20.874 -18.212 -2.140 1.00 5.28 O ATOM 14 CB ALA A 2 19.835 -20.719 -3.774 1.00 6.51 C ATOM 0 H ALA A 2 22.328 -19.685 -4.127 1.00 6.82 H new ATOM 0 HA ALA A 2 19.591 -18.996 -5.056 1.00 6.18 H new ATOM 0 HB1 ALA A 2 18.818 -20.686 -3.383 1.00 6.51 H new ATOM 0 HB2 ALA A 2 19.878 -21.411 -4.615 1.00 6.51 H new ATOM 0 HB3 ALA A 2 20.514 -21.057 -2.991 1.00 6.51 H new ATOM 20 N MET A 3 19.065 -17.388 -3.254 1.00 4.80 N ATOM 21 CA MET A 3 18.763 -16.334 -2.265 1.00 4.18 C ATOM 22 C MET A 3 17.260 -16.293 -1.937 1.00 3.48 C ATOM 23 O MET A 3 16.438 -15.896 -2.771 1.00 3.94 O ATOM 24 CB MET A 3 19.219 -14.952 -2.785 1.00 4.96 C ATOM 25 CG MET A 3 20.742 -14.762 -2.859 1.00 5.72 C ATOM 26 SD MET A 3 21.207 -13.157 -3.539 1.00 6.64 S ATOM 27 CE MET A 3 22.996 -13.264 -3.510 1.00 7.64 C ATOM 0 H MET A 3 18.431 -17.399 -4.053 1.00 4.80 H new ATOM 0 HA MET A 3 19.311 -16.572 -1.353 1.00 4.18 H new ATOM 0 HB2 MET A 3 18.799 -14.797 -3.779 1.00 4.96 H new ATOM 0 HB3 MET A 3 18.802 -14.180 -2.138 1.00 4.96 H new ATOM 0 HG2 MET A 3 21.167 -14.867 -1.861 1.00 5.72 H new ATOM 0 HG3 MET A 3 21.174 -15.552 -3.473 1.00 5.72 H new ATOM 0 HE1 MET A 3 23.422 -12.341 -3.903 1.00 7.64 H new ATOM 0 HE2 MET A 3 23.335 -13.413 -2.485 1.00 7.64 H new ATOM 0 HE3 MET A 3 23.320 -14.103 -4.125 1.00 7.64 H new ATOM 37 N SER A 4 16.919 -16.707 -0.704 1.00 2.65 N ATOM 38 CA SER A 4 15.521 -16.732 -0.233 1.00 2.27 C ATOM 39 C SER A 4 15.390 -16.178 1.194 1.00 1.31 C ATOM 40 O SER A 4 15.944 -16.740 2.148 1.00 0.88 O ATOM 41 CB SER A 4 14.959 -18.162 -0.285 1.00 2.95 C ATOM 42 OG SER A 4 14.487 -18.488 -1.583 1.00 3.86 O ATOM 0 H SER A 4 17.595 -17.030 -0.012 1.00 2.65 H new ATOM 0 HA SER A 4 14.945 -16.091 -0.901 1.00 2.27 H new ATOM 0 HB2 SER A 4 15.734 -18.870 0.010 1.00 2.95 H new ATOM 0 HB3 SER A 4 14.146 -18.261 0.434 1.00 2.95 H new ATOM 0 HG SER A 4 14.138 -19.404 -1.584 1.00 3.86 H new ATOM 48 N GLY A 5 14.641 -15.073 1.322 1.00 1.11 N ATOM 49 CA GLY A 5 14.431 -14.441 2.621 1.00 0.31 C ATOM 50 C GLY A 5 13.777 -13.070 2.521 1.00 0.28 C ATOM 51 O GLY A 5 14.466 -12.062 2.365 1.00 0.31 O ATOM 0 H GLY A 5 14.176 -14.605 0.544 1.00 1.11 H new ATOM 0 HA2 GLY A 5 13.808 -15.090 3.237 1.00 0.31 H new ATOM 0 HA3 GLY A 5 15.390 -14.343 3.130 1.00 0.31 H new ATOM 55 N LEU A 6 12.426 -13.043 2.612 1.00 0.23 N ATOM 56 CA LEU A 6 11.621 -11.793 2.546 1.00 0.22 C ATOM 57 C LEU A 6 11.434 -11.106 3.938 1.00 0.17 C ATOM 58 O LEU A 6 11.587 -9.878 4.068 1.00 0.16 O ATOM 59 CB LEU A 6 10.259 -12.116 1.880 1.00 0.24 C ATOM 60 CG LEU A 6 9.371 -10.911 1.458 1.00 0.27 C ATOM 61 CD1 LEU A 6 10.097 -9.895 0.572 1.00 0.33 C ATOM 62 CD2 LEU A 6 8.082 -11.346 0.753 1.00 0.35 C ATOM 0 H LEU A 6 11.861 -13.884 2.733 1.00 0.23 H new ATOM 0 HA LEU A 6 12.167 -11.067 1.944 1.00 0.22 H new ATOM 0 HB2 LEU A 6 10.451 -12.721 0.994 1.00 0.24 H new ATOM 0 HB3 LEU A 6 9.684 -12.734 2.569 1.00 0.24 H new ATOM 0 HG LEU A 6 9.120 -10.425 2.401 1.00 0.27 H new ATOM 0 HD11 LEU A 6 9.416 -9.083 0.317 1.00 0.33 H new ATOM 0 HD12 LEU A 6 10.957 -9.493 1.108 1.00 0.33 H new ATOM 0 HD13 LEU A 6 10.436 -10.385 -0.341 1.00 0.33 H new ATOM 0 HD21 LEU A 6 7.501 -10.465 0.481 1.00 0.35 H new ATOM 0 HD22 LEU A 6 8.331 -11.908 -0.147 1.00 0.35 H new ATOM 0 HD23 LEU A 6 7.495 -11.975 1.423 1.00 0.35 H new ATOM 74 N ALA A 7 11.095 -11.935 4.970 1.00 0.17 N ATOM 75 CA ALA A 7 10.928 -11.526 6.412 1.00 0.16 C ATOM 76 C ALA A 7 12.222 -10.915 7.087 1.00 0.15 C ATOM 77 O ALA A 7 12.128 -10.152 8.060 1.00 0.15 O ATOM 78 CB ALA A 7 10.441 -12.753 7.212 1.00 0.20 C ATOM 0 H ALA A 7 10.925 -12.930 4.826 1.00 0.17 H new ATOM 0 HA ALA A 7 10.198 -10.717 6.425 1.00 0.16 H new ATOM 0 HB1 ALA A 7 10.314 -12.478 8.259 1.00 0.20 H new ATOM 0 HB2 ALA A 7 9.488 -13.096 6.809 1.00 0.20 H new ATOM 0 HB3 ALA A 7 11.177 -13.554 7.134 1.00 0.20 H new ATOM 84 N ASP A 8 13.428 -11.247 6.530 1.00 0.16 N ATOM 85 CA ASP A 8 14.736 -10.733 7.011 1.00 0.18 C ATOM 86 C ASP A 8 15.140 -9.358 6.381 1.00 0.17 C ATOM 87 O ASP A 8 16.074 -8.712 6.864 1.00 0.21 O ATOM 88 CB ASP A 8 15.840 -11.768 6.734 1.00 0.21 C ATOM 89 CG ASP A 8 16.197 -12.602 7.960 1.00 0.26 C ATOM 90 OD1 ASP A 8 15.469 -13.576 8.248 1.00 0.31 O ATOM 91 OD2 ASP A 8 17.202 -12.279 8.627 1.00 0.32 O ATOM 0 H ASP A 8 13.512 -11.880 5.734 1.00 0.16 H new ATOM 0 HA ASP A 8 14.624 -10.567 8.082 1.00 0.18 H new ATOM 0 HB2 ASP A 8 15.515 -12.431 5.932 1.00 0.21 H new ATOM 0 HB3 ASP A 8 16.733 -11.253 6.380 1.00 0.21 H new ATOM 96 N LYS A 9 14.423 -8.921 5.306 1.00 0.14 N ATOM 97 CA LYS A 9 14.700 -7.630 4.634 1.00 0.14 C ATOM 98 C LYS A 9 13.665 -6.524 4.981 1.00 0.10 C ATOM 99 O LYS A 9 14.002 -5.346 4.842 1.00 0.10 O ATOM 100 CB LYS A 9 14.798 -7.768 3.090 1.00 0.19 C ATOM 101 CG LYS A 9 15.404 -9.098 2.578 1.00 0.32 C ATOM 102 CD LYS A 9 16.898 -9.260 2.948 1.00 0.92 C ATOM 103 CE LYS A 9 17.510 -10.537 2.345 1.00 1.20 C ATOM 104 NZ LYS A 9 17.479 -10.517 0.856 1.00 1.73 N ATOM 0 H LYS A 9 13.653 -9.447 4.892 1.00 0.14 H new ATOM 0 HA LYS A 9 15.671 -7.325 5.024 1.00 0.14 H new ATOM 0 HB2 LYS A 9 13.799 -7.658 2.668 1.00 0.19 H new ATOM 0 HB3 LYS A 9 15.399 -6.943 2.706 1.00 0.19 H new ATOM 0 HG2 LYS A 9 14.839 -9.933 2.993 1.00 0.32 H new ATOM 0 HG3 LYS A 9 15.296 -9.148 1.495 1.00 0.32 H new ATOM 0 HD2 LYS A 9 17.454 -8.391 2.596 1.00 0.92 H new ATOM 0 HD3 LYS A 9 17.001 -9.287 4.033 1.00 0.92 H new ATOM 0 HE2 LYS A 9 18.540 -10.642 2.685 1.00 1.20 H new ATOM 0 HE3 LYS A 9 16.964 -11.408 2.708 1.00 1.20 H new ATOM 0 HZ1 LYS A 9 18.418 -10.767 0.486 1.00 1.73 H new ATOM 0 HZ2 LYS A 9 16.777 -11.204 0.514 1.00 1.73 H new ATOM 0 HZ3 LYS A 9 17.220 -9.565 0.527 1.00 1.73 H new ATOM 118 N VAL A 10 12.393 -6.888 5.412 1.00 0.09 N ATOM 119 CA VAL A 10 11.332 -5.889 5.833 1.00 0.07 C ATOM 120 C VAL A 10 11.788 -4.850 6.953 1.00 0.06 C ATOM 121 O VAL A 10 12.403 -5.218 7.962 1.00 0.09 O ATOM 122 CB VAL A 10 9.949 -6.654 6.185 1.00 0.08 C ATOM 123 CG1 VAL A 10 9.926 -7.464 7.526 1.00 0.11 C ATOM 124 CG2 VAL A 10 8.700 -5.722 6.119 1.00 0.10 C ATOM 0 H VAL A 10 12.085 -7.858 5.475 1.00 0.09 H new ATOM 0 HA VAL A 10 11.156 -5.246 4.971 1.00 0.07 H new ATOM 0 HB VAL A 10 9.897 -7.394 5.387 1.00 0.08 H new ATOM 0 HG11 VAL A 10 8.949 -7.931 7.652 1.00 0.11 H new ATOM 0 HG12 VAL A 10 10.696 -8.235 7.499 1.00 0.11 H new ATOM 0 HG13 VAL A 10 10.117 -6.790 8.361 1.00 0.11 H new ATOM 0 HG21 VAL A 10 7.806 -6.294 6.365 1.00 0.10 H new ATOM 0 HG22 VAL A 10 8.817 -4.906 6.833 1.00 0.10 H new ATOM 0 HG23 VAL A 10 8.604 -5.313 5.113 1.00 0.10 H new ATOM 134 N ILE A 11 11.470 -3.568 6.707 1.00 0.06 N ATOM 135 CA ILE A 11 11.799 -2.481 7.666 1.00 0.07 C ATOM 136 C ILE A 11 10.539 -1.729 8.154 1.00 0.07 C ATOM 137 O ILE A 11 10.534 -1.209 9.273 1.00 0.08 O ATOM 138 CB ILE A 11 12.841 -1.422 7.111 1.00 0.10 C ATOM 139 CG1 ILE A 11 12.495 -0.973 5.645 1.00 0.10 C ATOM 140 CG2 ILE A 11 14.307 -1.969 7.225 1.00 0.13 C ATOM 141 CD1 ILE A 11 12.711 0.521 5.352 1.00 0.16 C ATOM 0 H ILE A 11 10.990 -3.253 5.864 1.00 0.06 H new ATOM 0 HA ILE A 11 12.266 -3.001 8.502 1.00 0.07 H new ATOM 0 HB ILE A 11 12.771 -0.530 7.734 1.00 0.10 H new ATOM 0 HG12 ILE A 11 13.101 -1.555 4.951 1.00 0.10 H new ATOM 0 HG13 ILE A 11 11.453 -1.220 5.442 1.00 0.10 H new ATOM 0 HG21 ILE A 11 15.004 -1.225 6.838 1.00 0.13 H new ATOM 0 HG22 ILE A 11 14.538 -2.174 8.270 1.00 0.13 H new ATOM 0 HG23 ILE A 11 14.399 -2.888 6.646 1.00 0.13 H new ATOM 0 HD11 ILE A 11 12.445 0.731 4.316 1.00 0.16 H new ATOM 0 HD12 ILE A 11 12.084 1.116 6.016 1.00 0.16 H new ATOM 0 HD13 ILE A 11 13.758 0.776 5.516 1.00 0.16 H new ATOM 153 N TRP A 12 9.469 -1.683 7.315 1.00 0.06 N ATOM 154 CA TRP A 12 8.235 -0.954 7.659 1.00 0.07 C ATOM 155 C TRP A 12 7.053 -1.385 6.740 1.00 0.08 C ATOM 156 O TRP A 12 7.104 -1.199 5.532 1.00 0.10 O ATOM 157 CB TRP A 12 8.579 0.545 7.538 1.00 0.10 C ATOM 158 CG TRP A 12 7.560 1.509 8.047 1.00 0.09 C ATOM 159 CD1 TRP A 12 7.502 2.125 9.266 1.00 0.19 C ATOM 160 CD2 TRP A 12 6.480 2.003 7.292 1.00 0.22 C ATOM 161 NE1 TRP A 12 6.432 2.982 9.298 1.00 0.26 N ATOM 162 CE2 TRP A 12 5.786 2.915 8.088 1.00 0.30 C ATOM 163 CE3 TRP A 12 6.044 1.742 6.005 1.00 0.35 C ATOM 164 CZ2 TRP A 12 4.666 3.576 7.623 1.00 0.44 C ATOM 165 CZ3 TRP A 12 4.950 2.380 5.534 1.00 0.51 C ATOM 166 CH2 TRP A 12 4.256 3.299 6.333 1.00 0.54 C ATOM 0 H TRP A 12 9.444 -2.141 6.404 1.00 0.06 H new ATOM 0 HA TRP A 12 7.897 -1.179 8.670 1.00 0.07 H new ATOM 0 HB2 TRP A 12 9.513 0.724 8.071 1.00 0.10 H new ATOM 0 HB3 TRP A 12 8.764 0.768 6.487 1.00 0.10 H new ATOM 0 HD1 TRP A 12 8.193 1.962 10.080 1.00 0.19 H new ATOM 0 HE1 TRP A 12 6.162 3.570 10.087 1.00 0.26 H new ATOM 0 HE3 TRP A 12 6.573 1.035 5.383 1.00 0.35 H new ATOM 0 HZ2 TRP A 12 4.132 4.281 8.243 1.00 0.44 H new ATOM 0 HZ3 TRP A 12 4.606 2.179 4.530 1.00 0.51 H new ATOM 0 HH2 TRP A 12 3.386 3.799 5.934 1.00 0.54 H new ATOM 177 N ALA A 13 5.978 -1.987 7.325 1.00 0.09 N ATOM 178 CA ALA A 13 4.770 -2.430 6.547 1.00 0.12 C ATOM 179 C ALA A 13 3.458 -2.030 7.272 1.00 0.16 C ATOM 180 O ALA A 13 3.306 -2.259 8.487 1.00 0.19 O ATOM 181 CB ALA A 13 4.785 -3.959 6.259 1.00 0.14 C ATOM 0 H ALA A 13 5.918 -2.178 8.325 1.00 0.09 H new ATOM 0 HA ALA A 13 4.809 -1.914 5.588 1.00 0.12 H new ATOM 0 HB1 ALA A 13 3.893 -4.232 5.695 1.00 0.14 H new ATOM 0 HB2 ALA A 13 5.672 -4.211 5.679 1.00 0.14 H new ATOM 0 HB3 ALA A 13 4.800 -4.507 7.201 1.00 0.14 H new ATOM 187 N VAL A 14 2.504 -1.400 6.530 1.00 0.20 N ATOM 188 CA VAL A 14 1.213 -0.941 7.144 1.00 0.26 C ATOM 189 C VAL A 14 -0.044 -1.228 6.244 1.00 0.27 C ATOM 190 O VAL A 14 -0.084 -0.858 5.071 1.00 0.28 O ATOM 191 CB VAL A 14 1.198 0.646 7.549 1.00 0.34 C ATOM 192 CG1 VAL A 14 -0.049 1.094 8.358 1.00 0.80 C ATOM 193 CG2 VAL A 14 2.378 1.118 8.402 1.00 1.05 C ATOM 0 H VAL A 14 2.594 -1.200 5.534 1.00 0.20 H new ATOM 0 HA VAL A 14 1.149 -1.537 8.054 1.00 0.26 H new ATOM 0 HB VAL A 14 1.226 1.091 6.554 1.00 0.34 H new ATOM 0 HG11 VAL A 14 0.026 2.158 8.582 1.00 0.80 H new ATOM 0 HG12 VAL A 14 -0.949 0.909 7.771 1.00 0.80 H new ATOM 0 HG13 VAL A 14 -0.101 0.530 9.289 1.00 0.80 H new ATOM 0 HG21 VAL A 14 2.271 2.182 8.614 1.00 1.05 H new ATOM 0 HG22 VAL A 14 2.395 0.561 9.339 1.00 1.05 H new ATOM 0 HG23 VAL A 14 3.309 0.947 7.861 1.00 1.05 H new ATOM 203 N ASN A 15 -1.081 -1.856 6.866 1.00 0.33 N ATOM 204 CA ASN A 15 -2.408 -2.026 6.219 1.00 0.43 C ATOM 205 C ASN A 15 -3.432 -1.245 7.075 1.00 0.46 C ATOM 206 O ASN A 15 -3.840 -1.703 8.140 1.00 0.55 O ATOM 207 CB ASN A 15 -2.875 -3.517 5.980 1.00 0.56 C ATOM 208 CG ASN A 15 -4.093 -3.632 5.049 1.00 1.40 C ATOM 209 OD1 ASN A 15 -4.153 -3.004 4.000 1.00 2.05 O ATOM 210 ND2 ASN A 15 -5.077 -4.416 5.460 1.00 2.11 N ATOM 0 H ASN A 15 -1.022 -2.248 7.806 1.00 0.33 H new ATOM 0 HA ASN A 15 -2.330 -1.634 5.205 1.00 0.43 H new ATOM 0 HB2 ASN A 15 -2.048 -4.086 5.556 1.00 0.56 H new ATOM 0 HB3 ASN A 15 -3.116 -3.973 6.940 1.00 0.56 H new ATOM 0 HD21 ASN A 15 -5.922 -4.512 4.896 1.00 2.11 H new ATOM 0 HD22 ASN A 15 -4.991 -4.924 6.340 1.00 2.11 H new ATOM 217 N ALA A 16 -3.872 -0.069 6.563 1.00 0.47 N ATOM 218 CA ALA A 16 -4.852 0.796 7.264 1.00 0.54 C ATOM 219 C ALA A 16 -6.308 0.269 7.090 1.00 0.58 C ATOM 220 O ALA A 16 -6.885 0.286 5.977 1.00 0.63 O ATOM 221 CB ALA A 16 -4.696 2.265 6.799 1.00 0.59 C ATOM 0 H ALA A 16 -3.562 0.302 5.665 1.00 0.47 H new ATOM 0 HA ALA A 16 -4.643 0.763 8.333 1.00 0.54 H new ATOM 0 HB1 ALA A 16 -5.421 2.891 7.320 1.00 0.59 H new ATOM 0 HB2 ALA A 16 -3.688 2.613 7.024 1.00 0.59 H new ATOM 0 HB3 ALA A 16 -4.870 2.327 5.725 1.00 0.59 H new ATOM 227 N GLY A 17 -6.839 -0.274 8.207 1.00 0.58 N ATOM 228 CA GLY A 17 -8.182 -0.844 8.219 1.00 0.61 C ATOM 229 C GLY A 17 -8.493 -1.782 9.387 1.00 0.62 C ATOM 230 O GLY A 17 -9.573 -1.685 9.975 1.00 0.71 O ATOM 0 H GLY A 17 -6.352 -0.324 9.102 1.00 0.58 H new ATOM 0 HA2 GLY A 17 -8.904 -0.027 8.231 1.00 0.61 H new ATOM 0 HA3 GLY A 17 -8.334 -1.390 7.288 1.00 0.61 H new ATOM 234 N GLY A 18 -7.553 -2.687 9.728 1.00 0.72 N ATOM 235 CA GLY A 18 -7.780 -3.651 10.820 1.00 0.73 C ATOM 236 C GLY A 18 -6.846 -3.465 12.013 1.00 0.68 C ATOM 237 O GLY A 18 -6.823 -2.390 12.621 1.00 0.80 O ATOM 0 H GLY A 18 -6.645 -2.769 9.271 1.00 0.72 H new ATOM 0 HA2 GLY A 18 -8.811 -3.562 11.161 1.00 0.73 H new ATOM 0 HA3 GLY A 18 -7.659 -4.662 10.430 1.00 0.73 H new ATOM 241 N GLU A 19 -6.074 -4.522 12.343 1.00 0.59 N ATOM 242 CA GLU A 19 -5.106 -4.503 13.462 1.00 0.60 C ATOM 243 C GLU A 19 -4.121 -5.685 13.365 1.00 0.54 C ATOM 244 O GLU A 19 -4.522 -6.845 13.507 1.00 0.65 O ATOM 245 CB GLU A 19 -5.834 -4.587 14.832 1.00 0.77 C ATOM 246 CG GLU A 19 -6.244 -3.243 15.450 1.00 1.43 C ATOM 247 CD GLU A 19 -7.052 -3.416 16.723 1.00 1.39 C ATOM 248 OE1 GLU A 19 -8.294 -3.511 16.629 1.00 1.50 O ATOM 249 OE2 GLU A 19 -6.444 -3.455 17.813 1.00 1.63 O ATOM 0 H GLU A 19 -6.103 -5.411 11.843 1.00 0.59 H new ATOM 0 HA GLU A 19 -4.560 -3.562 13.391 1.00 0.60 H new ATOM 0 HB2 GLU A 19 -6.728 -5.198 14.711 1.00 0.77 H new ATOM 0 HB3 GLU A 19 -5.185 -5.107 15.536 1.00 0.77 H new ATOM 0 HG2 GLU A 19 -5.350 -2.658 15.666 1.00 1.43 H new ATOM 0 HG3 GLU A 19 -6.829 -2.676 14.726 1.00 1.43 H new ATOM 256 N SER A 20 -2.806 -5.345 13.159 1.00 0.48 N ATOM 257 CA SER A 20 -1.612 -6.281 13.054 1.00 0.45 C ATOM 258 C SER A 20 -1.761 -7.592 12.217 1.00 0.43 C ATOM 259 O SER A 20 -2.457 -8.519 12.648 1.00 0.51 O ATOM 260 CB SER A 20 -1.124 -6.670 14.457 1.00 0.52 C ATOM 261 OG SER A 20 -0.091 -5.806 14.901 1.00 1.00 O ATOM 0 H SER A 20 -2.528 -4.369 13.056 1.00 0.48 H new ATOM 0 HA SER A 20 -0.901 -5.678 12.489 1.00 0.45 H new ATOM 0 HB2 SER A 20 -1.958 -6.633 15.158 1.00 0.52 H new ATOM 0 HB3 SER A 20 -0.762 -7.698 14.446 1.00 0.52 H new ATOM 0 HG SER A 20 0.451 -5.523 14.135 1.00 1.00 H new ATOM 267 N HIS A 21 -1.088 -7.689 11.045 1.00 0.39 N ATOM 268 CA HIS A 21 -1.185 -8.957 10.256 1.00 0.40 C ATOM 269 C HIS A 21 0.153 -9.450 9.681 1.00 0.40 C ATOM 270 O HIS A 21 0.867 -8.727 8.997 1.00 0.41 O ATOM 271 CB HIS A 21 -2.248 -8.888 9.118 1.00 0.43 C ATOM 272 CG HIS A 21 -2.374 -10.180 8.310 1.00 0.41 C ATOM 273 ND1 HIS A 21 -3.114 -11.265 8.728 1.00 0.39 N ATOM 274 CD2 HIS A 21 -1.773 -10.584 7.150 1.00 0.45 C ATOM 275 CE1 HIS A 21 -2.948 -12.259 7.867 1.00 0.40 C ATOM 276 NE2 HIS A 21 -2.143 -11.864 6.919 1.00 0.43 N ATOM 0 H HIS A 21 -0.504 -6.958 10.638 1.00 0.39 H new ATOM 0 HA HIS A 21 -1.510 -9.689 10.996 1.00 0.40 H new ATOM 0 HB2 HIS A 21 -3.218 -8.647 9.554 1.00 0.43 H new ATOM 0 HB3 HIS A 21 -1.991 -8.072 8.443 1.00 0.43 H new ATOM 0 HD2 HIS A 21 -1.120 -9.988 6.530 1.00 0.45 H new ATOM 0 HE1 HIS A 21 -3.404 -13.235 7.938 1.00 0.40 H new ATOM 0 HE2 HIS A 21 -1.840 -12.432 6.128 1.00 0.43 H new ATOM 285 N VAL A 22 0.397 -10.759 9.905 1.00 0.41 N ATOM 286 CA VAL A 22 1.584 -11.478 9.392 1.00 0.43 C ATOM 287 C VAL A 22 1.148 -12.389 8.184 1.00 0.44 C ATOM 288 O VAL A 22 0.368 -13.338 8.336 1.00 0.48 O ATOM 289 CB VAL A 22 2.424 -12.199 10.589 1.00 0.49 C ATOM 290 CG1 VAL A 22 1.728 -13.396 11.304 1.00 1.38 C ATOM 291 CG2 VAL A 22 3.855 -12.619 10.160 1.00 1.39 C ATOM 0 H VAL A 22 -0.229 -11.351 10.451 1.00 0.41 H new ATOM 0 HA VAL A 22 2.317 -10.782 8.984 1.00 0.43 H new ATOM 0 HB VAL A 22 2.477 -11.400 11.328 1.00 0.49 H new ATOM 0 HG11 VAL A 22 2.386 -13.790 12.079 1.00 1.38 H new ATOM 0 HG12 VAL A 22 0.796 -13.057 11.757 1.00 1.38 H new ATOM 0 HG13 VAL A 22 1.514 -14.180 10.577 1.00 1.38 H new ATOM 0 HG21 VAL A 22 4.362 -13.093 11.000 1.00 1.39 H new ATOM 0 HG22 VAL A 22 3.794 -13.322 9.329 1.00 1.39 H new ATOM 0 HG23 VAL A 22 4.415 -11.737 9.849 1.00 1.39 H new ATOM 301 N ASP A 23 1.670 -12.043 6.988 1.00 0.41 N ATOM 302 CA ASP A 23 1.344 -12.755 5.731 1.00 0.44 C ATOM 303 C ASP A 23 2.234 -14.017 5.491 1.00 0.43 C ATOM 304 O ASP A 23 3.305 -14.136 6.097 1.00 0.41 O ATOM 305 CB ASP A 23 1.293 -11.717 4.528 1.00 0.49 C ATOM 306 CG ASP A 23 2.598 -11.371 3.760 1.00 1.04 C ATOM 307 OD1 ASP A 23 3.628 -12.021 4.039 1.00 1.46 O ATOM 308 OD2 ASP A 23 2.584 -10.460 2.907 1.00 1.85 O ATOM 0 H ASP A 23 2.324 -11.270 6.865 1.00 0.41 H new ATOM 0 HA ASP A 23 0.346 -13.185 5.812 1.00 0.44 H new ATOM 0 HB2 ASP A 23 0.576 -12.096 3.800 1.00 0.49 H new ATOM 0 HB3 ASP A 23 0.887 -10.784 4.919 1.00 0.49 H new ATOM 313 N VAL A 24 1.777 -14.869 4.517 1.00 0.47 N ATOM 314 CA VAL A 24 2.379 -16.222 4.097 1.00 0.50 C ATOM 315 C VAL A 24 3.933 -16.329 3.911 1.00 0.47 C ATOM 316 O VAL A 24 4.498 -17.404 4.132 1.00 0.51 O ATOM 317 CB VAL A 24 1.665 -16.885 2.813 1.00 0.57 C ATOM 318 CG1 VAL A 24 0.445 -17.738 3.209 1.00 0.72 C ATOM 319 CG2 VAL A 24 1.208 -15.881 1.711 1.00 0.58 C ATOM 0 H VAL A 24 0.947 -14.641 3.969 1.00 0.47 H new ATOM 0 HA VAL A 24 2.158 -16.786 5.003 1.00 0.50 H new ATOM 0 HB VAL A 24 2.455 -17.502 2.386 1.00 0.57 H new ATOM 0 HG11 VAL A 24 -0.006 -18.166 2.314 1.00 0.72 H new ATOM 0 HG12 VAL A 24 0.763 -18.541 3.874 1.00 0.72 H new ATOM 0 HG13 VAL A 24 -0.286 -17.112 3.720 1.00 0.72 H new ATOM 0 HG21 VAL A 24 0.740 -16.428 0.892 1.00 0.58 H new ATOM 0 HG22 VAL A 24 0.491 -15.178 2.134 1.00 0.58 H new ATOM 0 HG23 VAL A 24 2.073 -15.335 1.335 1.00 0.58 H new ATOM 329 N HIS A 25 4.597 -15.231 3.509 1.00 0.42 N ATOM 330 CA HIS A 25 6.080 -15.190 3.377 1.00 0.40 C ATOM 331 C HIS A 25 6.749 -14.754 4.722 1.00 0.36 C ATOM 332 O HIS A 25 7.896 -15.105 5.009 1.00 0.39 O ATOM 333 CB HIS A 25 6.491 -14.219 2.261 1.00 0.38 C ATOM 334 CG HIS A 25 5.782 -14.440 0.948 1.00 0.42 C ATOM 335 ND1 HIS A 25 6.034 -15.518 0.126 1.00 0.45 N ATOM 336 CD2 HIS A 25 4.818 -13.714 0.326 1.00 0.48 C ATOM 337 CE1 HIS A 25 5.257 -15.446 -0.943 1.00 0.49 C ATOM 338 NE2 HIS A 25 4.512 -14.362 -0.843 1.00 0.51 N ATOM 0 H HIS A 25 4.136 -14.354 3.267 1.00 0.42 H new ATOM 0 HA HIS A 25 6.421 -16.194 3.125 1.00 0.40 H new ATOM 0 HB2 HIS A 25 6.300 -13.199 2.595 1.00 0.38 H new ATOM 0 HB3 HIS A 25 7.565 -14.306 2.099 1.00 0.38 H new ATOM 0 HD2 HIS A 25 4.375 -12.797 0.685 1.00 0.48 H new ATOM 0 HE1 HIS A 25 5.236 -16.154 -1.758 1.00 0.49 H new ATOM 0 HE2 HIS A 25 3.819 -14.055 -1.526 1.00 0.51 H new ATOM 347 N GLY A 26 5.977 -13.978 5.514 1.00 0.34 N ATOM 348 CA GLY A 26 6.374 -13.493 6.830 1.00 0.32 C ATOM 349 C GLY A 26 6.438 -11.976 6.939 1.00 0.27 C ATOM 350 O GLY A 26 7.361 -11.433 7.546 1.00 0.26 O ATOM 0 H GLY A 26 5.044 -13.672 5.240 1.00 0.34 H new ATOM 0 HA2 GLY A 26 5.671 -13.871 7.572 1.00 0.32 H new ATOM 0 HA3 GLY A 26 7.352 -13.906 7.078 1.00 0.32 H new ATOM 354 N ILE A 27 5.430 -11.292 6.363 1.00 0.26 N ATOM 355 CA ILE A 27 5.376 -9.807 6.387 1.00 0.23 C ATOM 356 C ILE A 27 4.257 -9.322 7.372 1.00 0.26 C ATOM 357 O ILE A 27 3.069 -9.542 7.142 1.00 0.33 O ATOM 358 CB ILE A 27 5.269 -9.236 4.888 1.00 0.22 C ATOM 359 CG1 ILE A 27 6.553 -9.556 4.016 1.00 0.18 C ATOM 360 CG2 ILE A 27 4.955 -7.707 4.741 1.00 0.26 C ATOM 361 CD1 ILE A 27 7.948 -9.260 4.592 1.00 0.55 C ATOM 0 H ILE A 27 4.648 -11.733 5.879 1.00 0.26 H new ATOM 0 HA ILE A 27 6.301 -9.391 6.785 1.00 0.23 H new ATOM 0 HB ILE A 27 4.397 -9.775 4.516 1.00 0.22 H new ATOM 0 HG12 ILE A 27 6.521 -10.616 3.763 1.00 0.18 H new ATOM 0 HG13 ILE A 27 6.460 -9.003 3.082 1.00 0.18 H new ATOM 0 HG21 ILE A 27 4.909 -7.445 3.684 1.00 0.26 H new ATOM 0 HG22 ILE A 27 3.997 -7.485 5.212 1.00 0.26 H new ATOM 0 HG23 ILE A 27 5.740 -7.126 5.225 1.00 0.26 H new ATOM 0 HD11 ILE A 27 8.709 -9.539 3.863 1.00 0.55 H new ATOM 0 HD12 ILE A 27 8.032 -8.196 4.815 1.00 0.55 H new ATOM 0 HD13 ILE A 27 8.093 -9.835 5.507 1.00 0.55 H new ATOM 373 N HIS A 28 4.681 -8.605 8.427 1.00 0.25 N ATOM 374 CA HIS A 28 3.775 -8.111 9.480 1.00 0.30 C ATOM 375 C HIS A 28 3.494 -6.583 9.437 1.00 0.28 C ATOM 376 O HIS A 28 4.414 -5.762 9.346 1.00 0.28 O ATOM 377 CB HIS A 28 4.387 -8.493 10.843 1.00 0.40 C ATOM 378 CG HIS A 28 3.421 -8.633 11.996 1.00 0.63 C ATOM 379 ND1 HIS A 28 3.336 -9.776 12.764 1.00 0.93 N ATOM 380 CD2 HIS A 28 2.527 -7.764 12.530 1.00 0.96 C ATOM 381 CE1 HIS A 28 2.434 -9.604 13.714 1.00 1.30 C ATOM 382 NE2 HIS A 28 1.930 -8.392 13.594 1.00 1.34 N ATOM 0 H HIS A 28 5.658 -8.352 8.574 1.00 0.25 H new ATOM 0 HA HIS A 28 2.805 -8.579 9.314 1.00 0.30 H new ATOM 0 HB2 HIS A 28 4.919 -9.437 10.726 1.00 0.40 H new ATOM 0 HB3 HIS A 28 5.129 -7.740 11.108 1.00 0.40 H new ATOM 0 HD1 HIS A 28 3.885 -10.624 12.620 1.00 0.93 H new ATOM 0 HD2 HIS A 28 2.323 -6.762 12.182 1.00 0.96 H new ATOM 0 HE1 HIS A 28 2.157 -10.332 14.462 1.00 1.30 H new ATOM 391 N TYR A 29 2.177 -6.231 9.524 1.00 0.33 N ATOM 392 CA TYR A 29 1.694 -4.829 9.593 1.00 0.38 C ATOM 393 C TYR A 29 1.535 -4.404 11.079 1.00 0.45 C ATOM 394 O TYR A 29 0.967 -5.145 11.895 1.00 0.46 O ATOM 395 CB TYR A 29 0.355 -4.640 8.756 1.00 0.45 C ATOM 396 CG TYR A 29 -0.869 -3.981 9.471 1.00 0.98 C ATOM 397 CD1 TYR A 29 -0.791 -2.677 9.982 1.00 1.31 C ATOM 398 CD2 TYR A 29 -2.094 -4.645 9.619 1.00 1.34 C ATOM 399 CE1 TYR A 29 -1.855 -2.073 10.604 1.00 1.91 C ATOM 400 CE2 TYR A 29 -3.171 -4.026 10.244 1.00 1.91 C ATOM 401 CZ TYR A 29 -3.033 -2.742 10.731 1.00 2.21 C ATOM 402 OH TYR A 29 -4.082 -2.115 11.345 1.00 2.79 O ATOM 0 H TYR A 29 1.424 -6.918 9.548 1.00 0.33 H new ATOM 0 HA TYR A 29 2.432 -4.170 9.135 1.00 0.38 H new ATOM 0 HB2 TYR A 29 0.592 -4.040 7.878 1.00 0.45 H new ATOM 0 HB3 TYR A 29 0.044 -5.621 8.397 1.00 0.45 H new ATOM 0 HD1 TYR A 29 0.136 -2.131 9.883 1.00 1.31 H new ATOM 0 HD2 TYR A 29 -2.203 -5.651 9.242 1.00 1.34 H new ATOM 0 HE1 TYR A 29 -1.757 -1.070 10.992 1.00 1.91 H new ATOM 0 HE2 TYR A 29 -4.111 -4.548 10.348 1.00 1.91 H new ATOM 0 HH TYR A 29 -4.835 -2.050 10.721 1.00 2.79 H new ATOM 412 N ARG A 30 1.984 -3.162 11.358 1.00 0.54 N ATOM 413 CA ARG A 30 1.963 -2.549 12.707 1.00 0.63 C ATOM 414 C ARG A 30 0.759 -1.584 12.928 1.00 0.91 C ATOM 415 O ARG A 30 0.710 -0.491 12.377 1.00 1.87 O ATOM 416 CB ARG A 30 3.302 -1.797 12.947 1.00 0.72 C ATOM 417 CG ARG A 30 3.768 -0.952 11.738 1.00 0.68 C ATOM 418 CD ARG A 30 4.988 -0.070 12.038 1.00 0.87 C ATOM 419 NE ARG A 30 4.734 0.888 13.115 1.00 1.70 N ATOM 420 CZ ARG A 30 5.658 1.710 13.606 1.00 2.08 C ATOM 421 NH1 ARG A 30 6.894 1.693 13.122 1.00 1.93 N ATOM 422 NH2 ARG A 30 5.347 2.550 14.584 1.00 3.00 N ATOM 0 H ARG A 30 2.377 -2.547 10.645 1.00 0.54 H new ATOM 0 HA ARG A 30 1.842 -3.358 13.428 1.00 0.63 H new ATOM 0 HB2 ARG A 30 3.192 -1.145 13.813 1.00 0.72 H new ATOM 0 HB3 ARG A 30 4.077 -2.523 13.191 1.00 0.72 H new ATOM 0 HG2 ARG A 30 4.007 -1.619 10.910 1.00 0.68 H new ATOM 0 HG3 ARG A 30 2.944 -0.318 11.409 1.00 0.68 H new ATOM 0 HD2 ARG A 30 5.832 -0.703 12.311 1.00 0.87 H new ATOM 0 HD3 ARG A 30 5.273 0.470 11.135 1.00 0.87 H new ATOM 0 HE ARG A 30 3.795 0.928 13.512 1.00 1.70 H new ATOM 0 HH11 ARG A 30 7.139 1.048 12.371 1.00 1.93 H new ATOM 0 HH12 ARG A 30 7.599 2.325 13.501 1.00 1.93 H new ATOM 0 HH21 ARG A 30 4.399 2.566 14.960 1.00 3.00 H new ATOM 0 HH22 ARG A 30 6.056 3.180 14.960 1.00 3.00 H new ATOM 436 N LYS A 31 -0.215 -2.091 13.725 1.00 0.57 N ATOM 437 CA LYS A 31 -1.526 -1.456 14.196 1.00 0.59 C ATOM 438 C LYS A 31 -1.687 0.100 14.237 1.00 0.64 C ATOM 439 O LYS A 31 -0.950 0.790 14.948 1.00 0.79 O ATOM 440 CB LYS A 31 -1.802 -1.935 15.637 1.00 0.73 C ATOM 441 CG LYS A 31 -2.012 -3.453 15.797 1.00 1.15 C ATOM 442 CD LYS A 31 -1.813 -3.955 17.253 1.00 1.44 C ATOM 443 CE LYS A 31 -2.731 -3.251 18.274 1.00 1.70 C ATOM 444 NZ LYS A 31 -2.247 -1.883 18.610 1.00 2.30 N ATOM 0 H LYS A 31 -0.120 -3.034 14.101 1.00 0.57 H new ATOM 0 HA LYS A 31 -2.214 -1.778 13.415 1.00 0.59 H new ATOM 0 HB2 LYS A 31 -0.968 -1.632 16.269 1.00 0.73 H new ATOM 0 HB3 LYS A 31 -2.688 -1.421 16.010 1.00 0.73 H new ATOM 0 HG2 LYS A 31 -3.019 -3.709 15.467 1.00 1.15 H new ATOM 0 HG3 LYS A 31 -1.318 -3.979 15.142 1.00 1.15 H new ATOM 0 HD2 LYS A 31 -1.999 -5.028 17.288 1.00 1.44 H new ATOM 0 HD3 LYS A 31 -0.774 -3.802 17.544 1.00 1.44 H new ATOM 0 HE2 LYS A 31 -3.742 -3.189 17.870 1.00 1.70 H new ATOM 0 HE3 LYS A 31 -2.787 -3.849 19.184 1.00 1.70 H new ATOM 0 HZ1 LYS A 31 -2.372 -1.711 19.628 1.00 2.30 H new ATOM 0 HZ2 LYS A 31 -1.239 -1.802 18.366 1.00 2.30 H new ATOM 0 HZ3 LYS A 31 -2.792 -1.180 18.071 1.00 2.30 H new ATOM 458 N ASP A 32 -2.697 0.601 13.448 1.00 0.61 N ATOM 459 CA ASP A 32 -3.163 2.061 13.340 1.00 0.72 C ATOM 460 C ASP A 32 -2.103 3.232 13.469 1.00 0.75 C ATOM 461 O ASP A 32 -2.280 4.129 14.299 1.00 1.00 O ATOM 462 CB ASP A 32 -4.267 2.292 14.396 1.00 0.86 C ATOM 463 CG ASP A 32 -5.673 1.994 13.894 1.00 0.95 C ATOM 464 OD1 ASP A 32 -5.876 0.904 13.323 1.00 1.01 O ATOM 465 OD2 ASP A 32 -6.561 2.857 14.063 1.00 1.17 O ATOM 0 H ASP A 32 -3.240 -0.012 12.840 1.00 0.61 H new ATOM 0 HA ASP A 32 -3.484 2.138 12.301 1.00 0.72 H new ATOM 0 HB2 ASP A 32 -4.062 1.666 15.265 1.00 0.86 H new ATOM 0 HB3 ASP A 32 -4.224 3.328 14.732 1.00 0.86 H new ATOM 470 N PRO A 33 -1.001 3.246 12.666 1.00 0.59 N ATOM 471 CA PRO A 33 0.041 4.295 12.730 1.00 0.66 C ATOM 472 C PRO A 33 0.134 5.279 11.511 1.00 0.83 C ATOM 473 O PRO A 33 0.627 4.932 10.431 1.00 1.45 O ATOM 474 CB PRO A 33 1.268 3.389 12.771 1.00 0.59 C ATOM 475 CG PRO A 33 0.941 2.366 11.706 1.00 0.57 C ATOM 476 CD PRO A 33 -0.592 2.209 11.720 1.00 0.49 C ATOM 0 HA PRO A 33 -0.124 4.994 13.550 1.00 0.66 H new ATOM 0 HB2 PRO A 33 2.185 3.934 12.545 1.00 0.59 H new ATOM 0 HB3 PRO A 33 1.403 2.929 13.750 1.00 0.59 H new ATOM 0 HG2 PRO A 33 1.290 2.697 10.728 1.00 0.57 H new ATOM 0 HG3 PRO A 33 1.432 1.416 11.915 1.00 0.57 H new ATOM 0 HD2 PRO A 33 -1.026 2.365 10.732 1.00 0.49 H new ATOM 0 HD3 PRO A 33 -0.896 1.215 12.049 1.00 0.49 H new ATOM 484 N LEU A 34 -0.354 6.493 11.717 1.00 0.72 N ATOM 485 CA LEU A 34 -0.275 7.575 10.707 1.00 0.91 C ATOM 486 C LEU A 34 0.367 8.838 11.325 1.00 1.43 C ATOM 487 O LEU A 34 1.592 8.991 11.279 1.00 1.91 O ATOM 488 CB LEU A 34 -1.653 7.928 10.078 1.00 1.02 C ATOM 489 CG LEU A 34 -2.046 7.227 8.743 1.00 0.88 C ATOM 490 CD1 LEU A 34 -2.902 6.000 8.963 1.00 1.67 C ATOM 491 CD2 LEU A 34 -2.803 8.170 7.825 1.00 1.33 C ATOM 0 H LEU A 34 -0.818 6.771 12.582 1.00 0.72 H new ATOM 0 HA LEU A 34 0.351 7.199 9.898 1.00 0.91 H new ATOM 0 HB2 LEU A 34 -2.424 7.702 10.814 1.00 1.02 H new ATOM 0 HB3 LEU A 34 -1.678 9.005 9.910 1.00 1.02 H new ATOM 0 HG LEU A 34 -1.105 6.926 8.282 1.00 0.88 H new ATOM 0 HD11 LEU A 34 -3.147 5.550 8.001 1.00 1.67 H new ATOM 0 HD12 LEU A 34 -2.356 5.280 9.572 1.00 1.67 H new ATOM 0 HD13 LEU A 34 -3.821 6.285 9.475 1.00 1.67 H new ATOM 0 HD21 LEU A 34 -3.062 7.650 6.903 1.00 1.33 H new ATOM 0 HD22 LEU A 34 -3.714 8.507 8.320 1.00 1.33 H new ATOM 0 HD23 LEU A 34 -2.177 9.031 7.592 1.00 1.33 H new ATOM 503 N GLU A 35 -0.462 9.739 11.894 1.00 1.77 N ATOM 504 CA GLU A 35 0.031 10.976 12.525 1.00 2.54 C ATOM 505 C GLU A 35 -0.883 11.465 13.687 1.00 2.66 C ATOM 506 O GLU A 35 -1.390 12.594 13.663 1.00 3.33 O ATOM 507 CB GLU A 35 0.199 12.059 11.425 1.00 3.34 C ATOM 508 CG GLU A 35 -1.098 12.495 10.714 1.00 3.49 C ATOM 509 CD GLU A 35 -0.847 13.548 9.651 1.00 4.38 C ATOM 510 OE1 GLU A 35 -0.544 13.170 8.499 1.00 4.80 O ATOM 511 OE2 GLU A 35 -0.955 14.751 9.969 1.00 4.84 O ATOM 0 H GLU A 35 -1.476 9.630 11.928 1.00 1.77 H new ATOM 0 HA GLU A 35 0.996 10.772 12.988 1.00 2.54 H new ATOM 0 HB2 GLU A 35 0.659 12.939 11.874 1.00 3.34 H new ATOM 0 HB3 GLU A 35 0.895 11.684 10.675 1.00 3.34 H new ATOM 0 HG2 GLU A 35 -1.569 11.625 10.256 1.00 3.49 H new ATOM 0 HG3 GLU A 35 -1.800 12.886 11.451 1.00 3.49 H new ATOM 518 N GLY A 36 -1.073 10.611 14.719 1.00 2.22 N ATOM 519 CA GLY A 36 -1.928 10.979 15.864 1.00 2.37 C ATOM 520 C GLY A 36 -3.257 10.197 15.984 1.00 1.99 C ATOM 521 O GLY A 36 -4.040 10.464 16.900 1.00 2.30 O ATOM 0 H GLY A 36 -0.655 9.683 14.781 1.00 2.22 H new ATOM 0 HA2 GLY A 36 -1.358 10.834 16.782 1.00 2.37 H new ATOM 0 HA3 GLY A 36 -2.158 12.042 15.796 1.00 2.37 H new ATOM 525 N ARG A 37 -3.508 9.232 15.065 1.00 1.73 N ATOM 526 CA ARG A 37 -4.753 8.441 15.035 1.00 2.21 C ATOM 527 C ARG A 37 -4.537 7.008 15.573 1.00 2.05 C ATOM 528 O ARG A 37 -4.445 6.044 14.805 1.00 2.64 O ATOM 529 CB ARG A 37 -5.313 8.373 13.587 1.00 3.16 C ATOM 530 CG ARG A 37 -5.575 9.742 12.898 1.00 3.40 C ATOM 531 CD ARG A 37 -4.291 10.405 12.353 1.00 3.20 C ATOM 532 NE ARG A 37 -4.563 11.717 11.756 1.00 3.69 N ATOM 533 CZ ARG A 37 -4.743 11.937 10.450 1.00 3.94 C ATOM 534 NH1 ARG A 37 -4.719 10.934 9.581 1.00 3.94 N ATOM 535 NH2 ARG A 37 -4.958 13.171 10.015 1.00 4.50 N ATOM 0 H ARG A 37 -2.850 8.984 14.326 1.00 1.73 H new ATOM 0 HA ARG A 37 -5.471 8.942 15.684 1.00 2.21 H new ATOM 0 HB2 ARG A 37 -4.613 7.807 12.973 1.00 3.16 H new ATOM 0 HB3 ARG A 37 -6.247 7.812 13.605 1.00 3.16 H new ATOM 0 HG2 ARG A 37 -6.279 9.600 12.078 1.00 3.40 H new ATOM 0 HG3 ARG A 37 -6.049 10.416 13.612 1.00 3.40 H new ATOM 0 HD2 ARG A 37 -3.569 10.517 13.162 1.00 3.20 H new ATOM 0 HD3 ARG A 37 -3.835 9.754 11.607 1.00 3.20 H new ATOM 0 HE ARG A 37 -4.619 12.520 12.383 1.00 3.69 H new ATOM 0 HH11 ARG A 37 -4.562 9.980 9.907 1.00 3.94 H new ATOM 0 HH12 ARG A 37 -4.858 11.117 8.587 1.00 3.94 H new ATOM 0 HH21 ARG A 37 -4.985 13.947 10.676 1.00 4.50 H new ATOM 0 HH22 ARG A 37 -5.096 13.344 9.019 1.00 4.50 H new ATOM 549 N VAL A 38 -4.461 6.891 16.910 1.00 1.67 N ATOM 550 CA VAL A 38 -4.254 5.577 17.594 1.00 1.61 C ATOM 551 C VAL A 38 -5.488 5.147 18.438 1.00 1.73 C ATOM 552 O VAL A 38 -5.854 5.809 19.417 1.00 2.44 O ATOM 553 CB VAL A 38 -2.925 5.470 18.496 1.00 2.08 C ATOM 554 CG1 VAL A 38 -1.732 4.941 17.676 1.00 2.70 C ATOM 555 CG2 VAL A 38 -2.485 6.786 19.218 1.00 2.63 C ATOM 0 H VAL A 38 -4.538 7.682 17.549 1.00 1.67 H new ATOM 0 HA VAL A 38 -4.117 4.887 16.762 1.00 1.61 H new ATOM 0 HB VAL A 38 -3.210 4.768 19.280 1.00 2.08 H new ATOM 0 HG11 VAL A 38 -0.850 4.881 18.314 1.00 2.70 H new ATOM 0 HG12 VAL A 38 -1.968 3.950 17.288 1.00 2.70 H new ATOM 0 HG13 VAL A 38 -1.533 5.618 16.845 1.00 2.70 H new ATOM 0 HG21 VAL A 38 -1.580 6.599 19.796 1.00 2.63 H new ATOM 0 HG22 VAL A 38 -2.288 7.560 18.476 1.00 2.63 H new ATOM 0 HG23 VAL A 38 -3.280 7.118 19.886 1.00 2.63 H new ATOM 565 N GLY A 39 -6.108 4.021 18.029 1.00 1.64 N ATOM 566 CA GLY A 39 -7.277 3.471 18.736 1.00 1.95 C ATOM 567 C GLY A 39 -8.616 3.602 17.990 1.00 1.52 C ATOM 568 O GLY A 39 -9.594 4.076 18.574 1.00 1.67 O ATOM 0 H GLY A 39 -5.818 3.478 17.215 1.00 1.64 H new ATOM 0 HA2 GLY A 39 -7.095 2.416 18.940 1.00 1.95 H new ATOM 0 HA3 GLY A 39 -7.366 3.971 19.700 1.00 1.95 H new ATOM 572 N ARG A 40 -8.662 3.181 16.704 1.00 1.49 N ATOM 573 CA ARG A 40 -9.894 3.253 15.892 1.00 1.54 C ATOM 574 C ARG A 40 -9.802 2.331 14.662 1.00 1.40 C ATOM 575 O ARG A 40 -9.235 2.699 13.627 1.00 1.40 O ATOM 576 CB ARG A 40 -10.175 4.718 15.460 1.00 2.19 C ATOM 577 CG ARG A 40 -11.640 5.012 15.053 1.00 2.54 C ATOM 578 CD ARG A 40 -11.884 6.507 14.765 1.00 3.29 C ATOM 579 NE ARG A 40 -11.056 7.006 13.668 1.00 3.83 N ATOM 580 CZ ARG A 40 -10.914 8.297 13.376 1.00 4.62 C ATOM 581 NH1 ARG A 40 -11.551 9.218 14.089 1.00 4.94 N ATOM 582 NH2 ARG A 40 -10.136 8.670 12.369 1.00 5.34 N ATOM 0 H ARG A 40 -7.860 2.789 16.210 1.00 1.49 H new ATOM 0 HA ARG A 40 -10.725 2.908 16.507 1.00 1.54 H new ATOM 0 HB2 ARG A 40 -9.902 5.381 16.281 1.00 2.19 H new ATOM 0 HB3 ARG A 40 -9.524 4.964 14.621 1.00 2.19 H new ATOM 0 HG2 ARG A 40 -11.892 4.429 14.167 1.00 2.54 H new ATOM 0 HG3 ARG A 40 -12.308 4.685 15.850 1.00 2.54 H new ATOM 0 HD2 ARG A 40 -12.935 6.660 14.522 1.00 3.29 H new ATOM 0 HD3 ARG A 40 -11.677 7.086 15.665 1.00 3.29 H new ATOM 0 HE ARG A 40 -10.559 6.326 13.093 1.00 3.83 H new ATOM 0 HH11 ARG A 40 -12.152 8.938 14.864 1.00 4.94 H new ATOM 0 HH12 ARG A 40 -11.439 10.206 13.862 1.00 4.94 H new ATOM 0 HH21 ARG A 40 -9.645 7.967 11.816 1.00 5.34 H new ATOM 0 HH22 ARG A 40 -10.029 9.660 12.147 1.00 5.34 H new ATOM 596 N ALA A 41 -10.388 1.114 14.794 1.00 1.35 N ATOM 597 CA ALA A 41 -10.407 0.089 13.716 1.00 1.29 C ATOM 598 C ALA A 41 -11.818 -0.040 13.073 1.00 1.31 C ATOM 599 O ALA A 41 -12.850 -0.042 13.770 1.00 1.64 O ATOM 600 CB ALA A 41 -9.923 -1.276 14.271 1.00 1.35 C ATOM 0 H ALA A 41 -10.860 0.815 15.648 1.00 1.35 H new ATOM 0 HA ALA A 41 -9.724 0.411 12.930 1.00 1.29 H new ATOM 0 HB1 ALA A 41 -9.941 -2.020 13.474 1.00 1.35 H new ATOM 0 HB2 ALA A 41 -8.906 -1.175 14.650 1.00 1.35 H new ATOM 0 HB3 ALA A 41 -10.582 -1.594 15.079 1.00 1.35 H new ATOM 606 N SER A 42 -11.850 -0.130 11.726 1.00 1.13 N ATOM 607 CA SER A 42 -13.111 -0.246 10.979 1.00 1.15 C ATOM 608 C SER A 42 -13.158 -1.508 10.102 1.00 1.10 C ATOM 609 O SER A 42 -12.475 -1.603 9.075 1.00 1.57 O ATOM 610 CB SER A 42 -13.338 1.001 10.111 1.00 1.23 C ATOM 611 OG SER A 42 -13.864 2.076 10.875 1.00 1.43 O ATOM 0 H SER A 42 -11.016 -0.124 11.139 1.00 1.13 H new ATOM 0 HA SER A 42 -13.910 -0.328 11.716 1.00 1.15 H new ATOM 0 HB2 SER A 42 -12.396 1.304 9.654 1.00 1.23 H new ATOM 0 HB3 SER A 42 -14.024 0.761 9.298 1.00 1.23 H new ATOM 0 HG SER A 42 -13.996 2.855 10.296 1.00 1.43 H new ATOM 617 N ASP A 43 -13.981 -2.475 10.531 1.00 0.99 N ATOM 618 CA ASP A 43 -14.174 -3.752 9.803 1.00 0.98 C ATOM 619 C ASP A 43 -15.679 -3.983 9.493 1.00 1.13 C ATOM 620 O ASP A 43 -16.338 -4.849 10.079 1.00 1.62 O ATOM 621 CB ASP A 43 -13.505 -4.986 10.541 1.00 1.01 C ATOM 622 CG ASP A 43 -13.766 -5.130 12.061 1.00 1.65 C ATOM 623 OD1 ASP A 43 -13.022 -4.512 12.853 1.00 1.80 O ATOM 624 OD2 ASP A 43 -14.710 -5.857 12.435 1.00 2.33 O ATOM 0 H ASP A 43 -14.532 -2.402 11.386 1.00 0.99 H new ATOM 0 HA ASP A 43 -13.650 -3.670 8.851 1.00 0.98 H new ATOM 0 HB2 ASP A 43 -13.847 -5.898 10.052 1.00 1.01 H new ATOM 0 HB3 ASP A 43 -12.427 -4.927 10.388 1.00 1.01 H new ATOM 629 N TYR A 44 -16.197 -3.173 8.545 1.00 1.26 N ATOM 630 CA TYR A 44 -17.602 -3.237 8.109 1.00 1.48 C ATOM 631 C TYR A 44 -17.697 -3.777 6.663 1.00 1.68 C ATOM 632 O TYR A 44 -17.964 -3.034 5.711 1.00 2.40 O ATOM 633 CB TYR A 44 -18.238 -1.830 8.231 1.00 1.58 C ATOM 634 CG TYR A 44 -19.775 -1.799 8.150 1.00 1.67 C ATOM 635 CD1 TYR A 44 -20.576 -2.209 9.225 1.00 2.02 C ATOM 636 CD2 TYR A 44 -20.421 -1.358 6.992 1.00 1.93 C ATOM 637 CE1 TYR A 44 -21.959 -2.179 9.140 1.00 2.50 C ATOM 638 CE2 TYR A 44 -21.804 -1.328 6.910 1.00 2.32 C ATOM 639 CZ TYR A 44 -22.566 -1.745 8.022 1.00 2.56 C ATOM 640 OH TYR A 44 -23.937 -1.708 7.901 1.00 3.16 O ATOM 0 H TYR A 44 -15.651 -2.459 8.063 1.00 1.26 H new ATOM 0 HA TYR A 44 -18.153 -3.926 8.749 1.00 1.48 H new ATOM 0 HB2 TYR A 44 -17.931 -1.390 9.180 1.00 1.58 H new ATOM 0 HB3 TYR A 44 -17.835 -1.196 7.441 1.00 1.58 H new ATOM 0 HD1 TYR A 44 -20.107 -2.554 10.135 1.00 2.02 H new ATOM 0 HD2 TYR A 44 -19.832 -1.035 6.146 1.00 1.93 H new ATOM 0 HE1 TYR A 44 -22.554 -2.507 9.979 1.00 2.50 H new ATOM 0 HE2 TYR A 44 -22.292 -0.990 6.008 1.00 2.32 H new ATOM 0 HH TYR A 44 -24.178 -1.362 7.017 1.00 3.16 H new ATOM 650 N GLY A 45 -17.450 -5.088 6.532 1.00 1.41 N ATOM 651 CA GLY A 45 -17.489 -5.753 5.240 1.00 1.52 C ATOM 652 C GLY A 45 -16.436 -6.850 5.092 1.00 1.29 C ATOM 653 O GLY A 45 -15.554 -6.747 4.238 1.00 1.22 O ATOM 0 H GLY A 45 -17.221 -5.703 7.313 1.00 1.41 H new ATOM 0 HA2 GLY A 45 -18.478 -6.186 5.092 1.00 1.52 H new ATOM 0 HA3 GLY A 45 -17.345 -5.012 4.454 1.00 1.52 H new ATOM 657 N MET A 46 -16.538 -7.913 5.931 1.00 1.26 N ATOM 658 CA MET A 46 -15.605 -9.081 5.887 1.00 1.14 C ATOM 659 C MET A 46 -16.121 -10.244 4.986 1.00 1.13 C ATOM 660 O MET A 46 -15.453 -11.273 4.844 1.00 1.13 O ATOM 661 CB MET A 46 -15.372 -9.646 7.301 1.00 1.28 C ATOM 662 CG MET A 46 -14.739 -8.653 8.274 1.00 1.04 C ATOM 663 SD MET A 46 -13.033 -8.238 7.843 1.00 1.58 S ATOM 664 CE MET A 46 -12.145 -8.750 9.316 1.00 1.67 C ATOM 0 H MET A 46 -17.258 -7.990 6.650 1.00 1.26 H new ATOM 0 HA MET A 46 -14.678 -8.698 5.461 1.00 1.14 H new ATOM 0 HB2 MET A 46 -16.326 -9.980 7.709 1.00 1.28 H new ATOM 0 HB3 MET A 46 -14.732 -10.525 7.228 1.00 1.28 H new ATOM 0 HG2 MET A 46 -15.336 -7.741 8.294 1.00 1.04 H new ATOM 0 HG3 MET A 46 -14.763 -9.072 9.280 1.00 1.04 H new ATOM 0 HE1 MET A 46 -11.081 -8.551 9.187 1.00 1.67 H new ATOM 0 HE2 MET A 46 -12.516 -8.194 10.177 1.00 1.67 H new ATOM 0 HE3 MET A 46 -12.297 -9.817 9.480 1.00 1.67 H new ATOM 674 N LYS A 47 -17.314 -10.050 4.380 1.00 1.20 N ATOM 675 CA LYS A 47 -17.967 -11.043 3.515 1.00 1.24 C ATOM 676 C LYS A 47 -17.903 -10.688 1.989 1.00 1.33 C ATOM 677 O LYS A 47 -18.733 -11.144 1.194 1.00 1.68 O ATOM 678 CB LYS A 47 -19.422 -11.199 4.019 1.00 1.34 C ATOM 679 CG LYS A 47 -20.322 -9.954 3.794 1.00 2.03 C ATOM 680 CD LYS A 47 -21.822 -10.216 4.094 1.00 2.90 C ATOM 681 CE LYS A 47 -22.569 -10.875 2.919 1.00 3.65 C ATOM 682 NZ LYS A 47 -24.013 -11.067 3.230 1.00 4.18 N ATOM 0 H LYS A 47 -17.851 -9.189 4.482 1.00 1.20 H new ATOM 0 HA LYS A 47 -17.430 -11.989 3.585 1.00 1.24 H new ATOM 0 HB2 LYS A 47 -19.876 -12.054 3.518 1.00 1.34 H new ATOM 0 HB3 LYS A 47 -19.401 -11.428 5.085 1.00 1.34 H new ATOM 0 HG2 LYS A 47 -19.969 -9.140 4.428 1.00 2.03 H new ATOM 0 HG3 LYS A 47 -20.218 -9.622 2.761 1.00 2.03 H new ATOM 0 HD2 LYS A 47 -21.904 -10.856 4.973 1.00 2.90 H new ATOM 0 HD3 LYS A 47 -22.307 -9.272 4.341 1.00 2.90 H new ATOM 0 HE2 LYS A 47 -22.467 -10.256 2.028 1.00 3.65 H new ATOM 0 HE3 LYS A 47 -22.113 -11.839 2.691 1.00 3.65 H new ATOM 0 HZ1 LYS A 47 -24.487 -11.513 2.418 1.00 4.18 H new ATOM 0 HZ2 LYS A 47 -24.110 -11.678 4.066 1.00 4.18 H new ATOM 0 HZ3 LYS A 47 -24.452 -10.144 3.423 1.00 4.18 H new ATOM 696 N LEU A 48 -16.893 -9.877 1.617 1.00 1.18 N ATOM 697 CA LEU A 48 -16.634 -9.452 0.242 1.00 1.29 C ATOM 698 C LEU A 48 -15.107 -9.479 0.017 1.00 1.00 C ATOM 699 O LEU A 48 -14.461 -8.423 -0.002 1.00 1.21 O ATOM 700 CB LEU A 48 -17.199 -8.032 -0.005 1.00 1.76 C ATOM 701 CG LEU A 48 -18.634 -7.942 -0.602 1.00 1.96 C ATOM 702 CD1 LEU A 48 -19.292 -6.607 -0.251 1.00 2.24 C ATOM 703 CD2 LEU A 48 -18.629 -8.122 -2.128 1.00 2.63 C ATOM 0 H LEU A 48 -16.224 -9.495 2.285 1.00 1.18 H new ATOM 0 HA LEU A 48 -17.128 -10.125 -0.459 1.00 1.29 H new ATOM 0 HB2 LEU A 48 -17.191 -7.493 0.943 1.00 1.76 H new ATOM 0 HB3 LEU A 48 -16.518 -7.507 -0.676 1.00 1.76 H new ATOM 0 HG LEU A 48 -19.210 -8.755 -0.159 1.00 1.96 H new ATOM 0 HD11 LEU A 48 -20.293 -6.571 -0.680 1.00 2.24 H new ATOM 0 HD12 LEU A 48 -19.358 -6.508 0.832 1.00 2.24 H new ATOM 0 HD13 LEU A 48 -18.694 -5.790 -0.655 1.00 2.24 H new ATOM 0 HD21 LEU A 48 -19.649 -8.053 -2.506 1.00 2.63 H new ATOM 0 HD22 LEU A 48 -18.019 -7.342 -2.584 1.00 2.63 H new ATOM 0 HD23 LEU A 48 -18.215 -9.099 -2.378 1.00 2.63 H new ATOM 715 N PRO A 49 -14.488 -10.715 -0.133 1.00 0.82 N ATOM 716 CA PRO A 49 -13.001 -10.915 -0.322 1.00 0.89 C ATOM 717 C PRO A 49 -12.359 -10.305 -1.590 1.00 0.75 C ATOM 718 O PRO A 49 -13.052 -9.911 -2.531 1.00 0.78 O ATOM 719 CB PRO A 49 -12.862 -12.452 -0.415 1.00 1.31 C ATOM 720 CG PRO A 49 -14.066 -12.984 0.293 1.00 1.37 C ATOM 721 CD PRO A 49 -15.181 -12.036 -0.080 1.00 1.05 C ATOM 0 HA PRO A 49 -12.484 -10.410 0.494 1.00 0.89 H new ATOM 0 HB2 PRO A 49 -12.833 -12.785 -1.452 1.00 1.31 H new ATOM 0 HB3 PRO A 49 -11.941 -12.796 0.056 1.00 1.31 H new ATOM 0 HG2 PRO A 49 -14.291 -14.003 -0.021 1.00 1.37 H new ATOM 0 HG3 PRO A 49 -13.912 -13.009 1.372 1.00 1.37 H new ATOM 0 HD2 PRO A 49 -15.629 -12.296 -1.039 1.00 1.05 H new ATOM 0 HD3 PRO A 49 -15.982 -12.043 0.659 1.00 1.05 H new ATOM 729 N ILE A 50 -11.003 -10.257 -1.586 1.00 0.67 N ATOM 730 CA ILE A 50 -10.209 -9.740 -2.696 1.00 0.60 C ATOM 731 C ILE A 50 -9.791 -10.926 -3.638 1.00 0.64 C ATOM 732 O ILE A 50 -9.177 -11.909 -3.197 1.00 0.69 O ATOM 733 CB ILE A 50 -9.019 -8.777 -2.091 1.00 0.57 C ATOM 734 CG1 ILE A 50 -9.275 -7.291 -2.496 1.00 0.54 C ATOM 735 CG2 ILE A 50 -7.533 -9.124 -2.460 1.00 0.59 C ATOM 736 CD1 ILE A 50 -10.552 -6.658 -1.966 1.00 0.59 C ATOM 0 H ILE A 50 -10.439 -10.582 -0.800 1.00 0.67 H new ATOM 0 HA ILE A 50 -10.768 -9.081 -3.360 1.00 0.60 H new ATOM 0 HB ILE A 50 -9.093 -8.958 -1.019 1.00 0.57 H new ATOM 0 HG12 ILE A 50 -8.430 -6.693 -2.155 1.00 0.54 H new ATOM 0 HG13 ILE A 50 -9.290 -7.231 -3.584 1.00 0.54 H new ATOM 0 HG21 ILE A 50 -6.864 -8.404 -1.990 1.00 0.59 H new ATOM 0 HG22 ILE A 50 -7.294 -10.126 -2.105 1.00 0.59 H new ATOM 0 HG23 ILE A 50 -7.408 -9.083 -3.542 1.00 0.59 H new ATOM 0 HD11 ILE A 50 -10.619 -5.627 -2.314 1.00 0.59 H new ATOM 0 HD12 ILE A 50 -11.414 -7.219 -2.328 1.00 0.59 H new ATOM 0 HD13 ILE A 50 -10.541 -6.673 -0.876 1.00 0.59 H new ATOM 748 N LEU A 51 -10.160 -10.809 -4.934 1.00 0.65 N ATOM 749 CA LEU A 51 -9.860 -11.849 -5.942 1.00 0.71 C ATOM 750 C LEU A 51 -8.502 -11.631 -6.619 1.00 0.78 C ATOM 751 O LEU A 51 -8.347 -10.797 -7.513 1.00 1.26 O ATOM 752 CB LEU A 51 -10.951 -11.923 -7.010 1.00 0.74 C ATOM 753 CG LEU A 51 -12.295 -12.580 -6.600 1.00 0.86 C ATOM 754 CD1 LEU A 51 -13.465 -11.936 -7.344 1.00 1.22 C ATOM 755 CD2 LEU A 51 -12.287 -14.087 -6.868 1.00 1.28 C ATOM 0 H LEU A 51 -10.666 -10.005 -5.305 1.00 0.65 H new ATOM 0 HA LEU A 51 -9.824 -12.793 -5.398 1.00 0.71 H new ATOM 0 HB2 LEU A 51 -11.160 -10.909 -7.352 1.00 0.74 H new ATOM 0 HB3 LEU A 51 -10.553 -12.471 -7.864 1.00 0.74 H new ATOM 0 HG LEU A 51 -12.418 -12.418 -5.529 1.00 0.86 H new ATOM 0 HD11 LEU A 51 -14.397 -12.413 -7.040 1.00 1.22 H new ATOM 0 HD12 LEU A 51 -13.507 -10.873 -7.105 1.00 1.22 H new ATOM 0 HD13 LEU A 51 -13.327 -12.062 -8.418 1.00 1.22 H new ATOM 0 HD21 LEU A 51 -13.244 -14.515 -6.569 1.00 1.28 H new ATOM 0 HD22 LEU A 51 -12.125 -14.267 -7.931 1.00 1.28 H new ATOM 0 HD23 LEU A 51 -11.486 -14.554 -6.295 1.00 1.28 H new ATOM 767 N ARG A 52 -7.554 -12.434 -6.133 1.00 0.58 N ATOM 768 CA ARG A 52 -6.114 -12.471 -6.527 1.00 0.58 C ATOM 769 C ARG A 52 -5.225 -12.873 -5.314 1.00 0.57 C ATOM 770 O ARG A 52 -4.051 -13.209 -5.490 1.00 0.65 O ATOM 771 CB ARG A 52 -5.579 -11.120 -7.092 1.00 0.57 C ATOM 772 CG ARG A 52 -5.045 -11.168 -8.550 1.00 0.70 C ATOM 773 CD ARG A 52 -6.162 -11.340 -9.597 1.00 0.64 C ATOM 774 NE ARG A 52 -5.618 -11.501 -10.944 1.00 0.87 N ATOM 775 CZ ARG A 52 -6.348 -11.848 -12.001 1.00 1.19 C ATOM 776 NH1 ARG A 52 -7.653 -12.057 -11.872 1.00 1.34 N ATOM 777 NH2 ARG A 52 -5.775 -11.987 -13.189 1.00 1.51 N ATOM 0 H ARG A 52 -7.766 -13.122 -5.411 1.00 0.58 H new ATOM 0 HA ARG A 52 -6.055 -13.212 -7.324 1.00 0.58 H new ATOM 0 HB2 ARG A 52 -6.380 -10.383 -7.041 1.00 0.57 H new ATOM 0 HB3 ARG A 52 -4.779 -10.766 -6.442 1.00 0.57 H new ATOM 0 HG2 ARG A 52 -4.496 -10.250 -8.760 1.00 0.70 H new ATOM 0 HG3 ARG A 52 -4.337 -11.991 -8.644 1.00 0.70 H new ATOM 0 HD2 ARG A 52 -6.769 -12.209 -9.343 1.00 0.64 H new ATOM 0 HD3 ARG A 52 -6.822 -10.473 -9.572 1.00 0.64 H new ATOM 0 HE ARG A 52 -4.621 -11.338 -11.082 1.00 0.87 H new ATOM 0 HH11 ARG A 52 -8.099 -11.952 -10.961 1.00 1.34 H new ATOM 0 HH12 ARG A 52 -8.210 -12.323 -12.684 1.00 1.34 H new ATOM 0 HH21 ARG A 52 -4.773 -11.828 -13.294 1.00 1.51 H new ATOM 0 HH22 ARG A 52 -6.336 -12.253 -13.998 1.00 1.51 H new ATOM 791 N SER A 53 -5.804 -12.836 -4.082 1.00 0.53 N ATOM 792 CA SER A 53 -5.096 -13.168 -2.835 1.00 0.54 C ATOM 793 C SER A 53 -5.689 -14.422 -2.107 1.00 0.57 C ATOM 794 O SER A 53 -6.646 -15.055 -2.574 1.00 0.67 O ATOM 795 CB SER A 53 -5.157 -11.932 -1.903 1.00 0.53 C ATOM 796 OG SER A 53 -4.014 -11.866 -1.066 1.00 1.09 O ATOM 0 H SER A 53 -6.779 -12.573 -3.937 1.00 0.53 H new ATOM 0 HA SER A 53 -4.066 -13.423 -3.086 1.00 0.54 H new ATOM 0 HB2 SER A 53 -5.226 -11.024 -2.502 1.00 0.53 H new ATOM 0 HB3 SER A 53 -6.058 -11.979 -1.291 1.00 0.53 H new ATOM 0 HG SER A 53 -3.207 -11.803 -1.619 1.00 1.09 H new ATOM 802 N ASN A 54 -5.083 -14.759 -0.937 1.00 0.59 N ATOM 803 CA ASN A 54 -5.510 -15.908 -0.055 1.00 0.64 C ATOM 804 C ASN A 54 -6.463 -15.371 1.081 1.00 0.63 C ATOM 805 O ASN A 54 -6.796 -14.188 1.054 1.00 0.66 O ATOM 806 CB ASN A 54 -4.283 -16.661 0.615 1.00 0.80 C ATOM 807 CG ASN A 54 -2.900 -16.478 -0.031 1.00 0.85 C ATOM 808 OD1 ASN A 54 -2.621 -17.019 -1.102 1.00 1.27 O ATOM 809 ND2 ASN A 54 -2.034 -15.728 0.643 1.00 1.12 N ATOM 0 H ASN A 54 -4.282 -14.248 -0.568 1.00 0.59 H new ATOM 0 HA ASN A 54 -6.026 -16.625 -0.693 1.00 0.64 H new ATOM 0 HB2 ASN A 54 -4.215 -16.336 1.653 1.00 0.80 H new ATOM 0 HB3 ASN A 54 -4.509 -17.727 0.629 1.00 0.80 H new ATOM 0 HD21 ASN A 54 -1.094 -15.581 0.277 1.00 1.12 H new ATOM 0 HD22 ASN A 54 -2.310 -15.300 1.527 1.00 1.12 H new ATOM 816 N PRO A 55 -6.966 -16.199 2.088 1.00 0.71 N ATOM 817 CA PRO A 55 -7.837 -15.678 3.221 1.00 0.75 C ATOM 818 C PRO A 55 -7.084 -14.751 4.224 1.00 0.74 C ATOM 819 O PRO A 55 -7.597 -13.688 4.638 1.00 0.80 O ATOM 820 CB PRO A 55 -8.293 -16.965 3.945 1.00 0.89 C ATOM 821 CG PRO A 55 -8.110 -18.054 2.926 1.00 0.95 C ATOM 822 CD PRO A 55 -6.853 -17.675 2.169 1.00 0.83 C ATOM 0 HA PRO A 55 -8.646 -15.060 2.831 1.00 0.75 H new ATOM 0 HB2 PRO A 55 -7.695 -17.152 4.837 1.00 0.89 H new ATOM 0 HB3 PRO A 55 -9.332 -16.893 4.267 1.00 0.89 H new ATOM 0 HG2 PRO A 55 -8.005 -19.028 3.404 1.00 0.95 H new ATOM 0 HG3 PRO A 55 -8.969 -18.118 2.258 1.00 0.95 H new ATOM 0 HD2 PRO A 55 -5.951 -17.985 2.697 1.00 0.83 H new ATOM 0 HD3 PRO A 55 -6.819 -18.135 1.181 1.00 0.83 H new ATOM 830 N GLU A 56 -5.810 -15.138 4.517 1.00 0.71 N ATOM 831 CA GLU A 56 -4.872 -14.397 5.421 1.00 0.73 C ATOM 832 C GLU A 56 -4.448 -13.026 4.827 1.00 0.65 C ATOM 833 O GLU A 56 -4.689 -11.941 5.412 1.00 0.67 O ATOM 834 CB GLU A 56 -3.602 -15.262 5.629 1.00 0.80 C ATOM 835 CG GLU A 56 -3.776 -16.480 6.555 1.00 0.97 C ATOM 836 CD GLU A 56 -4.072 -16.103 8.001 1.00 1.48 C ATOM 837 OE1 GLU A 56 -3.110 -15.841 8.754 1.00 1.63 O ATOM 838 OE2 GLU A 56 -5.263 -16.069 8.376 1.00 2.04 O ATOM 0 H GLU A 56 -5.397 -15.985 4.128 1.00 0.71 H new ATOM 0 HA GLU A 56 -5.388 -14.209 6.363 1.00 0.73 H new ATOM 0 HB2 GLU A 56 -3.259 -15.613 4.656 1.00 0.80 H new ATOM 0 HB3 GLU A 56 -2.814 -14.628 6.035 1.00 0.80 H new ATOM 0 HG2 GLU A 56 -4.587 -17.102 6.176 1.00 0.97 H new ATOM 0 HG3 GLU A 56 -2.869 -17.084 6.523 1.00 0.97 H new ATOM 845 N ASP A 57 -3.922 -13.081 3.585 1.00 0.62 N ATOM 846 CA ASP A 57 -3.499 -11.885 2.841 1.00 0.58 C ATOM 847 C ASP A 57 -4.713 -11.081 2.239 1.00 0.52 C ATOM 848 O ASP A 57 -4.533 -9.998 1.702 1.00 0.53 O ATOM 849 CB ASP A 57 -2.516 -12.299 1.757 1.00 0.60 C ATOM 850 CG ASP A 57 -1.126 -11.689 1.887 1.00 1.08 C ATOM 851 OD1 ASP A 57 -1.030 -10.544 2.377 1.00 1.62 O ATOM 852 OD2 ASP A 57 -0.138 -12.363 1.528 1.00 1.62 O ATOM 0 H ASP A 57 -3.781 -13.953 3.076 1.00 0.62 H new ATOM 0 HA ASP A 57 -3.011 -11.204 3.538 1.00 0.58 H new ATOM 0 HB2 ASP A 57 -2.423 -13.385 1.766 1.00 0.60 H new ATOM 0 HB3 ASP A 57 -2.929 -12.023 0.787 1.00 0.60 H new ATOM 857 N GLN A 58 -5.965 -11.649 2.383 1.00 0.52 N ATOM 858 CA GLN A 58 -7.259 -11.000 2.020 1.00 0.51 C ATOM 859 C GLN A 58 -7.540 -9.881 3.050 1.00 0.50 C ATOM 860 O GLN A 58 -7.877 -8.775 2.687 1.00 0.49 O ATOM 861 CB GLN A 58 -8.402 -12.041 2.056 1.00 0.60 C ATOM 862 CG GLN A 58 -9.827 -11.474 1.936 1.00 0.84 C ATOM 863 CD GLN A 58 -10.889 -12.465 2.386 1.00 0.91 C ATOM 864 OE1 GLN A 58 -10.751 -13.677 2.203 1.00 1.16 O ATOM 865 NE2 GLN A 58 -11.957 -11.953 2.989 1.00 1.77 N ATOM 0 H GLN A 58 -6.091 -12.587 2.762 1.00 0.52 H new ATOM 0 HA GLN A 58 -7.201 -10.585 1.014 1.00 0.51 H new ATOM 0 HB2 GLN A 58 -8.245 -12.753 1.246 1.00 0.60 H new ATOM 0 HB3 GLN A 58 -8.331 -12.599 2.990 1.00 0.60 H new ATOM 0 HG2 GLN A 58 -9.905 -10.566 2.535 1.00 0.84 H new ATOM 0 HG3 GLN A 58 -10.015 -11.190 0.901 1.00 0.84 H new ATOM 0 HE21 GLN A 58 -12.033 -10.945 3.121 1.00 1.77 H new ATOM 0 HE22 GLN A 58 -12.700 -12.569 3.319 1.00 1.77 H new ATOM 874 N VAL A 59 -7.314 -10.208 4.361 1.00 0.52 N ATOM 875 CA VAL A 59 -7.403 -9.219 5.513 1.00 0.54 C ATOM 876 C VAL A 59 -6.318 -8.084 5.319 1.00 0.52 C ATOM 877 O VAL A 59 -6.606 -6.923 5.569 1.00 0.55 O ATOM 878 CB VAL A 59 -7.256 -9.921 6.964 1.00 0.55 C ATOM 879 CG1 VAL A 59 -7.354 -8.952 8.181 1.00 0.80 C ATOM 880 CG2 VAL A 59 -8.326 -10.989 7.195 1.00 0.81 C ATOM 0 H VAL A 59 -7.067 -11.152 4.659 1.00 0.52 H new ATOM 0 HA VAL A 59 -8.401 -8.781 5.493 1.00 0.54 H new ATOM 0 HB VAL A 59 -6.251 -10.341 6.922 1.00 0.55 H new ATOM 0 HG11 VAL A 59 -7.244 -9.518 9.106 1.00 0.80 H new ATOM 0 HG12 VAL A 59 -6.563 -8.205 8.116 1.00 0.80 H new ATOM 0 HG13 VAL A 59 -8.324 -8.455 8.173 1.00 0.80 H new ATOM 0 HG21 VAL A 59 -8.189 -11.434 8.181 1.00 0.81 H new ATOM 0 HG22 VAL A 59 -9.314 -10.533 7.137 1.00 0.81 H new ATOM 0 HG23 VAL A 59 -8.238 -11.763 6.432 1.00 0.81 H new ATOM 890 N LEU A 60 -5.093 -8.443 4.838 1.00 0.49 N ATOM 891 CA LEU A 60 -4.047 -7.417 4.549 1.00 0.48 C ATOM 892 C LEU A 60 -4.201 -6.719 3.147 1.00 0.49 C ATOM 893 O LEU A 60 -3.477 -5.788 2.845 1.00 0.65 O ATOM 894 CB LEU A 60 -2.661 -8.060 4.649 1.00 0.52 C ATOM 895 CG LEU A 60 -1.440 -7.098 4.660 1.00 0.71 C ATOM 896 CD1 LEU A 60 -1.052 -6.687 6.069 1.00 1.15 C ATOM 897 CD2 LEU A 60 -0.232 -7.722 3.975 1.00 0.90 C ATOM 0 H LEU A 60 -4.811 -9.404 4.647 1.00 0.49 H new ATOM 0 HA LEU A 60 -4.173 -6.633 5.296 1.00 0.48 H new ATOM 0 HB2 LEU A 60 -2.629 -8.659 5.559 1.00 0.52 H new ATOM 0 HB3 LEU A 60 -2.544 -8.747 3.811 1.00 0.52 H new ATOM 0 HG LEU A 60 -1.749 -6.210 4.108 1.00 0.71 H new ATOM 0 HD11 LEU A 60 -0.195 -6.015 6.029 1.00 1.15 H new ATOM 0 HD12 LEU A 60 -1.891 -6.177 6.543 1.00 1.15 H new ATOM 0 HD13 LEU A 60 -0.792 -7.573 6.648 1.00 1.15 H new ATOM 0 HD21 LEU A 60 0.603 -7.022 4.001 1.00 0.90 H new ATOM 0 HD22 LEU A 60 0.047 -8.639 4.494 1.00 0.90 H new ATOM 0 HD23 LEU A 60 -0.480 -7.952 2.939 1.00 0.90 H new ATOM 909 N TYR A 61 -5.112 -7.217 2.310 1.00 0.44 N ATOM 910 CA TYR A 61 -5.412 -6.652 0.969 1.00 0.45 C ATOM 911 C TYR A 61 -6.928 -6.308 0.777 1.00 0.47 C ATOM 912 O TYR A 61 -7.394 -6.182 -0.356 1.00 0.52 O ATOM 913 CB TYR A 61 -4.931 -7.633 -0.129 1.00 0.44 C ATOM 914 CG TYR A 61 -3.389 -7.864 -0.239 1.00 0.46 C ATOM 915 CD1 TYR A 61 -2.499 -6.835 0.071 1.00 0.70 C ATOM 916 CD2 TYR A 61 -2.819 -9.079 -0.653 1.00 0.76 C ATOM 917 CE1 TYR A 61 -1.126 -6.999 -0.024 1.00 0.72 C ATOM 918 CE2 TYR A 61 -1.444 -9.241 -0.750 1.00 0.92 C ATOM 919 CZ TYR A 61 -0.632 -8.358 -0.440 1.00 0.72 C ATOM 920 OH TYR A 61 0.755 -8.360 -0.534 1.00 0.88 O ATOM 0 H TYR A 61 -5.677 -8.036 2.536 1.00 0.44 H new ATOM 0 HA TYR A 61 -4.871 -5.709 0.885 1.00 0.45 H new ATOM 0 HB2 TYR A 61 -5.408 -8.598 0.044 1.00 0.44 H new ATOM 0 HB3 TYR A 61 -5.290 -7.268 -1.092 1.00 0.44 H new ATOM 0 HD1 TYR A 61 -2.892 -5.882 0.395 1.00 0.70 H new ATOM 0 HD2 TYR A 61 -3.466 -9.907 -0.902 1.00 0.76 H new ATOM 0 HE1 TYR A 61 -0.443 -6.190 0.190 1.00 0.72 H new ATOM 0 HE2 TYR A 61 -1.063 -10.184 -1.114 1.00 0.92 H new ATOM 0 HH TYR A 61 1.063 -9.250 -0.804 1.00 0.88 H new ATOM 930 N GLN A 62 -7.671 -6.126 1.896 1.00 0.50 N ATOM 931 CA GLN A 62 -9.153 -5.849 1.859 1.00 0.57 C ATOM 932 C GLN A 62 -9.671 -4.866 2.944 1.00 0.70 C ATOM 933 O GLN A 62 -10.649 -4.157 2.696 1.00 1.33 O ATOM 934 CB GLN A 62 -9.934 -7.190 2.008 1.00 0.57 C ATOM 935 CG GLN A 62 -11.474 -7.141 1.814 1.00 0.75 C ATOM 936 CD GLN A 62 -12.227 -7.437 3.103 1.00 0.77 C ATOM 937 OE1 GLN A 62 -12.413 -8.719 3.400 1.00 1.26 O flip ATOM 938 NE2 GLN A 62 -12.613 -6.525 3.832 1.00 1.02 N flip ATOM 0 H GLN A 62 -7.282 -6.163 2.838 1.00 0.50 H new ATOM 0 HA GLN A 62 -9.327 -5.366 0.897 1.00 0.57 H new ATOM 0 HB2 GLN A 62 -9.526 -7.900 1.289 1.00 0.57 H new ATOM 0 HB3 GLN A 62 -9.731 -7.590 3.001 1.00 0.57 H new ATOM 0 HG2 GLN A 62 -11.761 -6.156 1.446 1.00 0.75 H new ATOM 0 HG3 GLN A 62 -11.765 -7.863 1.051 1.00 0.75 H new ATOM 0 HE21 GLN A 62 -12.449 -5.554 3.565 1.00 1.02 H new ATOM 0 HE22 GLN A 62 -13.097 -6.739 4.704 1.00 1.02 H new ATOM 947 N THR A 63 -9.042 -4.839 4.143 1.00 0.58 N ATOM 948 CA THR A 63 -9.494 -3.958 5.301 1.00 0.62 C ATOM 949 C THR A 63 -9.184 -2.430 5.110 1.00 0.76 C ATOM 950 O THR A 63 -8.073 -2.055 4.731 1.00 1.28 O ATOM 951 CB THR A 63 -8.940 -4.448 6.702 1.00 0.59 C ATOM 952 OG1 THR A 63 -7.521 -4.644 6.677 1.00 0.63 O ATOM 953 CG2 THR A 63 -9.626 -5.742 7.197 1.00 0.60 C ATOM 0 H THR A 63 -8.221 -5.406 4.356 1.00 0.58 H new ATOM 0 HA THR A 63 -10.578 -4.068 5.298 1.00 0.62 H new ATOM 0 HB THR A 63 -9.177 -3.647 7.403 1.00 0.59 H new ATOM 0 HG1 THR A 63 -7.324 -5.580 6.464 1.00 0.63 H new ATOM 0 HG21 THR A 63 -9.207 -6.030 8.161 1.00 0.60 H new ATOM 0 HG22 THR A 63 -10.697 -5.568 7.305 1.00 0.60 H new ATOM 0 HG23 THR A 63 -9.459 -6.541 6.475 1.00 0.60 H new ATOM 961 N GLU A 64 -10.197 -1.575 5.408 1.00 0.57 N ATOM 962 CA GLU A 64 -10.099 -0.095 5.220 1.00 0.60 C ATOM 963 C GLU A 64 -10.352 0.735 6.497 1.00 0.64 C ATOM 964 O GLU A 64 -11.242 0.436 7.301 1.00 0.69 O ATOM 965 CB GLU A 64 -11.105 0.394 4.137 1.00 0.67 C ATOM 966 CG GLU A 64 -12.322 -0.533 3.888 1.00 0.84 C ATOM 967 CD GLU A 64 -13.531 -0.166 4.734 1.00 1.07 C ATOM 968 OE1 GLU A 64 -14.143 0.890 4.470 1.00 1.53 O ATOM 969 OE2 GLU A 64 -13.868 -0.938 5.657 1.00 1.50 O ATOM 0 H GLU A 64 -11.095 -1.882 5.781 1.00 0.57 H new ATOM 0 HA GLU A 64 -9.065 0.068 4.916 1.00 0.60 H new ATOM 0 HB2 GLU A 64 -11.474 1.378 4.427 1.00 0.67 H new ATOM 0 HB3 GLU A 64 -10.567 0.519 3.197 1.00 0.67 H new ATOM 0 HG2 GLU A 64 -12.596 -0.489 2.834 1.00 0.84 H new ATOM 0 HG3 GLU A 64 -12.036 -1.563 4.100 1.00 0.84 H new ATOM 976 N ARG A 65 -9.543 1.806 6.641 1.00 0.74 N ATOM 977 CA ARG A 65 -9.624 2.755 7.775 1.00 0.91 C ATOM 978 C ARG A 65 -10.155 4.133 7.313 1.00 1.19 C ATOM 979 O ARG A 65 -9.814 4.618 6.225 1.00 2.12 O ATOM 980 CB ARG A 65 -8.225 2.927 8.410 1.00 0.98 C ATOM 981 CG ARG A 65 -8.143 2.664 9.935 1.00 0.90 C ATOM 982 CD ARG A 65 -6.720 2.898 10.503 1.00 0.96 C ATOM 983 NE ARG A 65 -6.272 4.286 10.319 1.00 1.63 N ATOM 984 CZ ARG A 65 -6.510 5.275 11.189 1.00 2.39 C ATOM 985 NH1 ARG A 65 -7.186 5.044 12.309 1.00 2.86 N ATOM 986 NH2 ARG A 65 -6.079 6.502 10.931 1.00 3.22 N ATOM 0 H ARG A 65 -8.811 2.039 5.971 1.00 0.74 H new ATOM 0 HA ARG A 65 -10.318 2.349 8.511 1.00 0.91 H new ATOM 0 HB2 ARG A 65 -7.532 2.253 7.906 1.00 0.98 H new ATOM 0 HB3 ARG A 65 -7.880 3.943 8.216 1.00 0.98 H new ATOM 0 HG2 ARG A 65 -8.848 3.316 10.451 1.00 0.90 H new ATOM 0 HG3 ARG A 65 -8.448 1.638 10.140 1.00 0.90 H new ATOM 0 HD2 ARG A 65 -6.709 2.652 11.565 1.00 0.96 H new ATOM 0 HD3 ARG A 65 -6.019 2.223 10.012 1.00 0.96 H new ATOM 0 HE ARG A 65 -5.746 4.510 9.474 1.00 1.63 H new ATOM 0 HH11 ARG A 65 -7.529 4.105 12.513 1.00 2.86 H new ATOM 0 HH12 ARG A 65 -7.362 5.805 12.965 1.00 2.86 H new ATOM 0 HH21 ARG A 65 -5.566 6.692 10.070 1.00 3.22 H new ATOM 0 HH22 ARG A 65 -6.260 7.256 11.594 1.00 3.22 H new ATOM 1000 N TYR A 66 -10.977 4.768 8.169 1.00 0.77 N ATOM 1001 CA TYR A 66 -11.587 6.078 7.861 1.00 0.92 C ATOM 1002 C TYR A 66 -10.972 7.228 8.691 1.00 1.10 C ATOM 1003 O TYR A 66 -10.852 7.138 9.919 1.00 1.80 O ATOM 1004 CB TYR A 66 -13.108 6.005 8.112 1.00 1.58 C ATOM 1005 CG TYR A 66 -13.955 6.963 7.253 1.00 1.83 C ATOM 1006 CD1 TYR A 66 -14.192 8.284 7.654 1.00 2.35 C ATOM 1007 CD2 TYR A 66 -14.514 6.545 6.039 1.00 2.21 C ATOM 1008 CE1 TYR A 66 -14.952 9.146 6.875 1.00 2.90 C ATOM 1009 CE2 TYR A 66 -15.274 7.408 5.263 1.00 2.72 C ATOM 1010 CZ TYR A 66 -15.500 8.702 5.700 1.00 2.96 C ATOM 1011 OH TYR A 66 -16.240 9.555 4.914 1.00 3.66 O ATOM 0 H TYR A 66 -11.236 4.395 9.082 1.00 0.77 H new ATOM 0 HA TYR A 66 -11.385 6.297 6.813 1.00 0.92 H new ATOM 0 HB2 TYR A 66 -13.443 4.984 7.929 1.00 1.58 H new ATOM 0 HB3 TYR A 66 -13.298 6.219 9.164 1.00 1.58 H new ATOM 0 HD1 TYR A 66 -13.776 8.638 8.586 1.00 2.35 H new ATOM 0 HD2 TYR A 66 -14.350 5.532 5.701 1.00 2.21 H new ATOM 0 HE1 TYR A 66 -15.111 10.165 7.195 1.00 2.90 H new ATOM 0 HE2 TYR A 66 -15.687 7.072 4.323 1.00 2.72 H new ATOM 0 HH TYR A 66 -16.553 9.077 4.117 1.00 3.66 H new ATOM 1021 N ASN A 67 -10.601 8.315 7.989 1.00 1.30 N ATOM 1022 CA ASN A 67 -10.007 9.505 8.627 1.00 1.97 C ATOM 1023 C ASN A 67 -10.798 10.787 8.274 1.00 1.59 C ATOM 1024 O ASN A 67 -11.731 11.143 9.001 1.00 1.69 O ATOM 1025 CB ASN A 67 -8.514 9.643 8.250 1.00 3.06 C ATOM 1026 CG ASN A 67 -7.566 9.176 9.353 1.00 3.99 C ATOM 1027 OD1 ASN A 67 -7.859 9.303 10.543 1.00 4.39 O ATOM 1028 ND2 ASN A 67 -6.420 8.635 8.957 1.00 4.70 N ATOM 0 H ASN A 67 -10.703 8.394 6.977 1.00 1.30 H new ATOM 0 HA ASN A 67 -10.069 9.372 9.707 1.00 1.97 H new ATOM 0 HB2 ASN A 67 -8.320 9.066 7.346 1.00 3.06 H new ATOM 0 HB3 ASN A 67 -8.301 10.686 8.015 1.00 3.06 H new ATOM 0 HD21 ASN A 67 -5.745 8.307 9.648 1.00 4.70 H new ATOM 0 HD22 ASN A 67 -6.214 8.547 7.962 1.00 4.70 H new ATOM 1035 N GLU A 68 -10.433 11.476 7.164 1.00 1.31 N ATOM 1036 CA GLU A 68 -11.130 12.709 6.750 1.00 1.11 C ATOM 1037 C GLU A 68 -10.849 13.078 5.272 1.00 0.91 C ATOM 1038 O GLU A 68 -11.675 12.793 4.404 1.00 1.18 O ATOM 1039 CB GLU A 68 -10.761 13.895 7.692 1.00 1.42 C ATOM 1040 CG GLU A 68 -11.669 15.133 7.570 1.00 1.26 C ATOM 1041 CD GLU A 68 -11.270 16.238 8.531 1.00 1.99 C ATOM 1042 OE1 GLU A 68 -11.761 16.233 9.680 1.00 2.25 O ATOM 1043 OE2 GLU A 68 -10.468 17.110 8.135 1.00 2.55 O ATOM 0 H GLU A 68 -9.668 11.199 6.549 1.00 1.31 H new ATOM 0 HA GLU A 68 -12.199 12.513 6.833 1.00 1.11 H new ATOM 0 HB2 GLU A 68 -10.790 13.542 8.723 1.00 1.42 H new ATOM 0 HB3 GLU A 68 -9.734 14.196 7.487 1.00 1.42 H new ATOM 0 HG2 GLU A 68 -11.629 15.511 6.548 1.00 1.26 H new ATOM 0 HG3 GLU A 68 -12.702 14.843 7.762 1.00 1.26 H new ATOM 1050 N ASP A 69 -9.667 13.688 5.002 1.00 0.76 N ATOM 1051 CA ASP A 69 -9.262 14.172 3.654 1.00 0.75 C ATOM 1052 C ASP A 69 -7.776 14.586 3.685 1.00 0.69 C ATOM 1053 O ASP A 69 -7.389 15.445 4.490 1.00 1.33 O ATOM 1054 CB ASP A 69 -10.115 15.404 3.239 1.00 1.17 C ATOM 1055 CG ASP A 69 -11.188 15.120 2.184 1.00 1.63 C ATOM 1056 OD1 ASP A 69 -11.425 13.928 1.894 1.00 2.06 O ATOM 1057 OD2 ASP A 69 -11.778 16.080 1.645 1.00 2.15 O ATOM 0 H ASP A 69 -8.961 13.860 5.718 1.00 0.76 H new ATOM 0 HA ASP A 69 -9.418 13.368 2.934 1.00 0.75 H new ATOM 0 HB2 ASP A 69 -10.599 15.809 4.128 1.00 1.17 H new ATOM 0 HB3 ASP A 69 -9.448 16.178 2.859 1.00 1.17 H new ATOM 1062 N SER A 70 -6.936 13.975 2.785 1.00 0.72 N ATOM 1063 CA SER A 70 -5.444 14.229 2.686 1.00 0.57 C ATOM 1064 C SER A 70 -4.684 13.638 3.892 1.00 0.53 C ATOM 1065 O SER A 70 -4.442 14.326 4.891 1.00 0.57 O ATOM 1066 CB SER A 70 -5.126 15.735 2.521 1.00 0.70 C ATOM 1067 OG SER A 70 -4.056 15.945 1.612 1.00 0.77 O ATOM 0 H SER A 70 -7.269 13.291 2.105 1.00 0.72 H new ATOM 0 HA SER A 70 -5.097 13.717 1.788 1.00 0.57 H new ATOM 0 HB2 SER A 70 -6.014 16.259 2.166 1.00 0.70 H new ATOM 0 HB3 SER A 70 -4.870 16.162 3.491 1.00 0.70 H new ATOM 0 HG SER A 70 -3.881 16.906 1.529 1.00 0.77 H new ATOM 1073 N PHE A 71 -4.323 12.353 3.780 1.00 0.49 N ATOM 1074 CA PHE A 71 -3.635 11.656 4.883 1.00 0.47 C ATOM 1075 C PHE A 71 -2.526 10.716 4.389 1.00 0.33 C ATOM 1076 O PHE A 71 -2.564 10.184 3.261 1.00 0.39 O ATOM 1077 CB PHE A 71 -4.634 10.938 5.859 1.00 0.66 C ATOM 1078 CG PHE A 71 -5.902 10.310 5.260 1.00 0.54 C ATOM 1079 CD1 PHE A 71 -7.006 11.103 4.937 1.00 0.75 C ATOM 1080 CD2 PHE A 71 -6.014 8.928 5.074 1.00 0.73 C ATOM 1081 CE1 PHE A 71 -8.172 10.539 4.437 1.00 0.81 C ATOM 1082 CE2 PHE A 71 -7.184 8.366 4.581 1.00 0.78 C ATOM 1083 CZ PHE A 71 -8.261 9.173 4.260 1.00 0.67 C ATOM 0 H PHE A 71 -4.491 11.780 2.953 1.00 0.49 H new ATOM 0 HA PHE A 71 -3.140 12.433 5.466 1.00 0.47 H new ATOM 0 HB2 PHE A 71 -4.086 10.152 6.379 1.00 0.66 H new ATOM 0 HB3 PHE A 71 -4.944 11.663 6.612 1.00 0.66 H new ATOM 0 HD1 PHE A 71 -6.952 12.172 5.079 1.00 0.75 H new ATOM 0 HD2 PHE A 71 -5.178 8.289 5.317 1.00 0.73 H new ATOM 0 HE1 PHE A 71 -9.011 11.171 4.186 1.00 0.81 H new ATOM 0 HE2 PHE A 71 -7.254 7.297 4.448 1.00 0.78 H new ATOM 0 HZ PHE A 71 -9.169 8.735 3.872 1.00 0.67 H new ATOM 1093 N GLY A 72 -1.503 10.568 5.248 1.00 0.31 N ATOM 1094 CA GLY A 72 -0.361 9.735 4.920 1.00 0.41 C ATOM 1095 C GLY A 72 0.465 9.243 6.105 1.00 0.33 C ATOM 1096 O GLY A 72 0.173 9.522 7.274 1.00 0.47 O ATOM 0 H GLY A 72 -1.454 11.015 6.164 1.00 0.31 H new ATOM 0 HA2 GLY A 72 -0.716 8.867 4.364 1.00 0.41 H new ATOM 0 HA3 GLY A 72 0.294 10.295 4.253 1.00 0.41 H new ATOM 1100 N TYR A 73 1.547 8.536 5.761 1.00 0.28 N ATOM 1101 CA TYR A 73 2.451 7.919 6.745 1.00 0.24 C ATOM 1102 C TYR A 73 3.916 8.425 6.651 1.00 0.21 C ATOM 1103 O TYR A 73 4.320 9.088 5.677 1.00 0.27 O ATOM 1104 CB TYR A 73 2.476 6.385 6.572 1.00 0.36 C ATOM 1105 CG TYR A 73 1.172 5.712 6.099 1.00 0.33 C ATOM 1106 CD1 TYR A 73 0.698 5.850 4.788 1.00 0.47 C ATOM 1107 CD2 TYR A 73 0.399 4.956 6.982 1.00 0.48 C ATOM 1108 CE1 TYR A 73 -0.487 5.250 4.390 1.00 0.63 C ATOM 1109 CE2 TYR A 73 -0.779 4.362 6.583 1.00 0.62 C ATOM 1110 CZ TYR A 73 -1.162 4.478 5.190 1.00 0.68 C ATOM 1111 OH TYR A 73 -2.392 3.917 4.900 1.00 0.89 O ATOM 0 H TYR A 73 1.823 8.374 4.793 1.00 0.28 H new ATOM 0 HA TYR A 73 2.052 8.206 7.718 1.00 0.24 H new ATOM 0 HB2 TYR A 73 3.263 6.137 5.859 1.00 0.36 H new ATOM 0 HB3 TYR A 73 2.759 5.941 7.526 1.00 0.36 H new ATOM 0 HD1 TYR A 73 1.264 6.433 4.076 1.00 0.47 H new ATOM 0 HD2 TYR A 73 0.732 4.834 8.002 1.00 0.48 H new ATOM 0 HE1 TYR A 73 -0.858 5.428 3.392 1.00 0.63 H new ATOM 0 HE2 TYR A 73 -1.398 3.826 7.287 1.00 0.62 H new ATOM 0 HH TYR A 73 -2.366 2.956 5.089 1.00 0.89 H new ATOM 1121 N ASP A 74 4.713 8.044 7.679 1.00 0.17 N ATOM 1122 CA ASP A 74 6.145 8.423 7.796 1.00 0.16 C ATOM 1123 C ASP A 74 7.059 7.182 7.981 1.00 0.15 C ATOM 1124 O ASP A 74 6.798 6.325 8.835 1.00 0.24 O ATOM 1125 CB ASP A 74 6.354 9.373 9.001 1.00 0.21 C ATOM 1126 CG ASP A 74 6.029 10.839 8.715 1.00 0.26 C ATOM 1127 OD1 ASP A 74 5.085 11.098 7.939 1.00 0.51 O ATOM 1128 OD2 ASP A 74 6.721 11.722 9.266 1.00 0.40 O ATOM 0 H ASP A 74 4.382 7.465 8.451 1.00 0.17 H new ATOM 0 HA ASP A 74 6.417 8.924 6.867 1.00 0.16 H new ATOM 0 HB2 ASP A 74 5.733 9.031 9.829 1.00 0.21 H new ATOM 0 HB3 ASP A 74 7.391 9.301 9.329 1.00 0.21 H new ATOM 1133 N ILE A 75 8.144 7.110 7.177 1.00 0.10 N ATOM 1134 CA ILE A 75 9.127 5.999 7.239 1.00 0.09 C ATOM 1135 C ILE A 75 10.565 6.582 7.476 1.00 0.08 C ATOM 1136 O ILE A 75 11.164 7.101 6.535 1.00 0.12 O ATOM 1137 CB ILE A 75 9.144 5.103 5.914 1.00 0.11 C ATOM 1138 CG1 ILE A 75 7.742 4.714 5.427 1.00 0.13 C ATOM 1139 CG2 ILE A 75 9.912 3.767 6.078 1.00 0.14 C ATOM 1140 CD1 ILE A 75 7.176 5.542 4.300 1.00 0.15 C ATOM 0 H ILE A 75 8.364 7.813 6.472 1.00 0.10 H new ATOM 0 HA ILE A 75 8.823 5.356 8.065 1.00 0.09 H new ATOM 0 HB ILE A 75 9.644 5.751 5.194 1.00 0.11 H new ATOM 0 HG12 ILE A 75 7.767 3.672 5.108 1.00 0.13 H new ATOM 0 HG13 ILE A 75 7.057 4.772 6.273 1.00 0.13 H new ATOM 0 HG21 ILE A 75 9.882 3.212 5.140 1.00 0.14 H new ATOM 0 HG22 ILE A 75 10.949 3.974 6.344 1.00 0.14 H new ATOM 0 HG23 ILE A 75 9.447 3.174 6.865 1.00 0.14 H new ATOM 0 HD11 ILE A 75 6.183 5.175 4.042 1.00 0.15 H new ATOM 0 HD12 ILE A 75 7.107 6.584 4.613 1.00 0.15 H new ATOM 0 HD13 ILE A 75 7.828 5.467 3.430 1.00 0.15 H new ATOM 1152 N PRO A 76 11.140 6.513 8.719 1.00 0.09 N ATOM 1153 CA PRO A 76 12.514 7.004 8.984 1.00 0.10 C ATOM 1154 C PRO A 76 13.647 5.981 8.652 1.00 0.09 C ATOM 1155 O PRO A 76 13.721 4.903 9.251 1.00 0.11 O ATOM 1156 CB PRO A 76 12.457 7.335 10.476 1.00 0.14 C ATOM 1157 CG PRO A 76 11.528 6.294 11.055 1.00 0.15 C ATOM 1158 CD PRO A 76 10.504 6.000 9.962 1.00 0.12 C ATOM 0 HA PRO A 76 12.775 7.847 8.344 1.00 0.10 H new ATOM 0 HB2 PRO A 76 13.445 7.284 10.933 1.00 0.14 H new ATOM 0 HB3 PRO A 76 12.079 8.343 10.645 1.00 0.14 H new ATOM 0 HG2 PRO A 76 12.074 5.393 11.332 1.00 0.15 H new ATOM 0 HG3 PRO A 76 11.042 6.662 11.958 1.00 0.15 H new ATOM 0 HD2 PRO A 76 10.293 4.933 9.890 1.00 0.12 H new ATOM 0 HD3 PRO A 76 9.556 6.500 10.160 1.00 0.12 H new ATOM 1166 N ILE A 77 14.511 6.349 7.685 1.00 0.09 N ATOM 1167 CA ILE A 77 15.641 5.490 7.235 1.00 0.10 C ATOM 1168 C ILE A 77 17.005 6.256 7.330 1.00 0.13 C ATOM 1169 O ILE A 77 17.066 7.492 7.323 1.00 0.19 O ATOM 1170 CB ILE A 77 15.423 4.943 5.749 1.00 0.12 C ATOM 1171 CG1 ILE A 77 13.919 4.748 5.422 1.00 0.11 C ATOM 1172 CG2 ILE A 77 16.146 3.573 5.485 1.00 0.18 C ATOM 1173 CD1 ILE A 77 13.348 5.662 4.355 1.00 0.19 C ATOM 0 H ILE A 77 14.452 7.241 7.193 1.00 0.09 H new ATOM 0 HA ILE A 77 15.671 4.632 7.907 1.00 0.10 H new ATOM 0 HB ILE A 77 15.858 5.708 5.106 1.00 0.12 H new ATOM 0 HG12 ILE A 77 13.767 3.715 5.108 1.00 0.11 H new ATOM 0 HG13 ILE A 77 13.347 4.890 6.339 1.00 0.11 H new ATOM 0 HG21 ILE A 77 15.960 3.255 4.459 1.00 0.18 H new ATOM 0 HG22 ILE A 77 17.218 3.692 5.639 1.00 0.18 H new ATOM 0 HG23 ILE A 77 15.762 2.820 6.174 1.00 0.18 H new ATOM 0 HD11 ILE A 77 12.292 5.436 4.210 1.00 0.19 H new ATOM 0 HD12 ILE A 77 13.458 6.700 4.669 1.00 0.19 H new ATOM 0 HD13 ILE A 77 13.884 5.507 3.419 1.00 0.19 H new ATOM 1185 N LYS A 78 18.088 5.465 7.400 1.00 0.15 N ATOM 1186 CA LYS A 78 19.469 5.972 7.481 1.00 0.20 C ATOM 1187 C LYS A 78 20.476 5.043 6.741 1.00 0.21 C ATOM 1188 O LYS A 78 21.673 5.051 7.057 1.00 0.25 O ATOM 1189 CB LYS A 78 19.896 6.120 8.963 1.00 0.27 C ATOM 1190 CG LYS A 78 19.426 7.425 9.666 1.00 0.87 C ATOM 1191 CD LYS A 78 20.328 8.658 9.365 1.00 1.32 C ATOM 1192 CE LYS A 78 21.586 8.712 10.257 1.00 1.91 C ATOM 1193 NZ LYS A 78 21.239 8.855 11.698 1.00 2.53 N ATOM 0 H LYS A 78 18.030 4.447 7.402 1.00 0.15 H new ATOM 0 HA LYS A 78 19.486 6.945 6.990 1.00 0.20 H new ATOM 0 HB2 LYS A 78 19.510 5.267 9.521 1.00 0.27 H new ATOM 0 HB3 LYS A 78 20.984 6.070 9.017 1.00 0.27 H new ATOM 0 HG2 LYS A 78 18.406 7.648 9.354 1.00 0.87 H new ATOM 0 HG3 LYS A 78 19.401 7.258 10.743 1.00 0.87 H new ATOM 0 HD2 LYS A 78 20.631 8.633 8.318 1.00 1.32 H new ATOM 0 HD3 LYS A 78 19.748 9.570 9.507 1.00 1.32 H new ATOM 0 HE2 LYS A 78 22.172 7.804 10.113 1.00 1.91 H new ATOM 0 HE3 LYS A 78 22.213 9.549 9.950 1.00 1.91 H new ATOM 0 HZ1 LYS A 78 22.067 9.205 12.221 1.00 2.53 H new ATOM 0 HZ2 LYS A 78 20.454 9.529 11.801 1.00 2.53 H new ATOM 0 HZ3 LYS A 78 20.954 7.931 12.080 1.00 2.53 H new ATOM 1207 N GLU A 79 19.994 4.252 5.746 1.00 0.19 N ATOM 1208 CA GLU A 79 20.846 3.336 4.972 1.00 0.22 C ATOM 1209 C GLU A 79 20.655 3.544 3.456 1.00 0.20 C ATOM 1210 O GLU A 79 19.635 4.086 3.004 1.00 0.18 O ATOM 1211 CB GLU A 79 20.529 1.876 5.353 1.00 0.24 C ATOM 1212 CG GLU A 79 21.080 1.426 6.722 1.00 0.55 C ATOM 1213 CD GLU A 79 22.582 1.187 6.706 1.00 1.17 C ATOM 1214 OE1 GLU A 79 23.001 0.063 6.359 1.00 1.03 O ATOM 1215 OE2 GLU A 79 23.337 2.124 7.043 1.00 2.12 O ATOM 0 H GLU A 79 19.013 4.237 5.467 1.00 0.19 H new ATOM 0 HA GLU A 79 21.887 3.553 5.212 1.00 0.22 H new ATOM 0 HB2 GLU A 79 19.447 1.743 5.352 1.00 0.24 H new ATOM 0 HB3 GLU A 79 20.932 1.219 4.582 1.00 0.24 H new ATOM 0 HG2 GLU A 79 20.846 2.184 7.469 1.00 0.55 H new ATOM 0 HG3 GLU A 79 20.575 0.510 7.028 1.00 0.55 H new ATOM 1222 N GLU A 80 21.638 3.087 2.666 1.00 0.26 N ATOM 1223 CA GLU A 80 21.593 3.254 1.208 1.00 0.25 C ATOM 1224 C GLU A 80 21.638 1.931 0.423 1.00 0.27 C ATOM 1225 O GLU A 80 22.351 0.982 0.773 1.00 0.32 O ATOM 1226 CB GLU A 80 22.755 4.151 0.749 1.00 0.27 C ATOM 1227 CG GLU A 80 22.649 5.639 1.147 1.00 0.28 C ATOM 1228 CD GLU A 80 23.764 6.060 2.087 1.00 0.36 C ATOM 1229 OE1 GLU A 80 24.902 6.254 1.610 1.00 0.40 O ATOM 1230 OE2 GLU A 80 23.498 6.196 3.299 1.00 0.42 O ATOM 0 H GLU A 80 22.467 2.603 3.010 1.00 0.26 H new ATOM 0 HA GLU A 80 20.630 3.715 0.990 1.00 0.25 H new ATOM 0 HB2 GLU A 80 23.683 3.750 1.157 1.00 0.27 H new ATOM 0 HB3 GLU A 80 22.831 4.089 -0.337 1.00 0.27 H new ATOM 0 HG2 GLU A 80 22.680 6.257 0.250 1.00 0.28 H new ATOM 0 HG3 GLU A 80 21.686 5.818 1.625 1.00 0.28 H new ATOM 1237 N GLY A 81 20.857 1.923 -0.661 1.00 0.22 N ATOM 1238 CA GLY A 81 20.762 0.775 -1.563 1.00 0.23 C ATOM 1239 C GLY A 81 19.502 0.822 -2.422 1.00 0.19 C ATOM 1240 O GLY A 81 19.164 1.888 -2.957 1.00 0.18 O ATOM 0 H GLY A 81 20.273 2.713 -0.937 1.00 0.22 H new ATOM 0 HA2 GLY A 81 21.640 0.749 -2.209 1.00 0.23 H new ATOM 0 HA3 GLY A 81 20.768 -0.145 -0.979 1.00 0.23 H new ATOM 1244 N GLU A 82 18.798 -0.327 -2.602 1.00 0.20 N ATOM 1245 CA GLU A 82 17.556 -0.309 -3.388 1.00 0.17 C ATOM 1246 C GLU A 82 16.339 -0.665 -2.517 1.00 0.18 C ATOM 1247 O GLU A 82 16.183 -1.791 -2.063 1.00 0.30 O ATOM 1248 CB GLU A 82 17.659 -1.256 -4.600 1.00 0.19 C ATOM 1249 CG GLU A 82 18.664 -0.827 -5.686 1.00 0.26 C ATOM 1250 CD GLU A 82 18.362 -1.451 -7.036 1.00 0.86 C ATOM 1251 OE1 GLU A 82 17.352 -1.058 -7.659 1.00 0.78 O ATOM 1252 OE2 GLU A 82 19.135 -2.330 -7.473 1.00 1.75 O ATOM 0 H GLU A 82 19.063 -1.238 -2.227 1.00 0.20 H new ATOM 0 HA GLU A 82 17.413 0.706 -3.760 1.00 0.17 H new ATOM 0 HB2 GLU A 82 17.936 -2.248 -4.243 1.00 0.19 H new ATOM 0 HB3 GLU A 82 16.673 -1.345 -5.056 1.00 0.19 H new ATOM 0 HG2 GLU A 82 18.651 0.259 -5.780 1.00 0.26 H new ATOM 0 HG3 GLU A 82 19.671 -1.108 -5.376 1.00 0.26 H new ATOM 1259 N TYR A 83 15.460 0.324 -2.297 1.00 0.08 N ATOM 1260 CA TYR A 83 14.251 0.134 -1.475 1.00 0.08 C ATOM 1261 C TYR A 83 13.007 0.027 -2.353 1.00 0.08 C ATOM 1262 O TYR A 83 12.758 0.874 -3.202 1.00 0.12 O ATOM 1263 CB TYR A 83 14.084 1.275 -0.461 1.00 0.10 C ATOM 1264 CG TYR A 83 15.149 1.277 0.638 1.00 0.11 C ATOM 1265 CD1 TYR A 83 16.413 1.830 0.428 1.00 0.16 C ATOM 1266 CD2 TYR A 83 14.884 0.730 1.894 1.00 0.17 C ATOM 1267 CE1 TYR A 83 17.362 1.836 1.428 1.00 0.18 C ATOM 1268 CE2 TYR A 83 15.829 0.737 2.893 1.00 0.19 C ATOM 1269 CZ TYR A 83 17.104 1.268 2.617 1.00 0.16 C ATOM 1270 OH TYR A 83 18.008 1.306 3.648 1.00 0.21 O ATOM 0 H TYR A 83 15.562 1.265 -2.676 1.00 0.08 H new ATOM 0 HA TYR A 83 14.372 -0.799 -0.925 1.00 0.08 H new ATOM 0 HB2 TYR A 83 14.117 2.228 -0.990 1.00 0.10 H new ATOM 0 HB3 TYR A 83 13.099 1.200 -0.001 1.00 0.10 H new ATOM 0 HD1 TYR A 83 16.652 2.260 -0.533 1.00 0.16 H new ATOM 0 HD2 TYR A 83 13.916 0.292 2.086 1.00 0.17 H new ATOM 0 HE1 TYR A 83 18.321 2.301 1.254 1.00 0.18 H new ATOM 0 HE2 TYR A 83 15.598 0.343 3.871 1.00 0.19 H new ATOM 0 HH TYR A 83 17.636 0.840 4.426 1.00 0.21 H new ATOM 1280 N VAL A 84 12.224 -1.028 -2.129 1.00 0.08 N ATOM 1281 CA VAL A 84 11.012 -1.284 -2.947 1.00 0.10 C ATOM 1282 C VAL A 84 9.736 -1.057 -2.106 1.00 0.10 C ATOM 1283 O VAL A 84 9.490 -1.726 -1.096 1.00 0.10 O ATOM 1284 CB VAL A 84 10.963 -2.734 -3.658 1.00 0.11 C ATOM 1285 CG1 VAL A 84 10.141 -2.723 -4.975 1.00 0.13 C ATOM 1286 CG2 VAL A 84 12.349 -3.314 -4.005 1.00 0.20 C ATOM 0 H VAL A 84 12.394 -1.720 -1.399 1.00 0.08 H new ATOM 0 HA VAL A 84 11.062 -0.564 -3.764 1.00 0.10 H new ATOM 0 HB VAL A 84 10.488 -3.362 -2.905 1.00 0.11 H new ATOM 0 HG11 VAL A 84 10.140 -3.722 -5.412 1.00 0.13 H new ATOM 0 HG12 VAL A 84 9.116 -2.419 -4.762 1.00 0.13 H new ATOM 0 HG13 VAL A 84 10.589 -2.020 -5.678 1.00 0.13 H new ATOM 0 HG21 VAL A 84 12.228 -4.288 -4.479 1.00 0.20 H new ATOM 0 HG22 VAL A 84 12.865 -2.640 -4.689 1.00 0.20 H new ATOM 0 HG23 VAL A 84 12.936 -3.425 -3.093 1.00 0.20 H new ATOM 1296 N LEU A 85 8.938 -0.097 -2.585 1.00 0.12 N ATOM 1297 CA LEU A 85 7.670 0.274 -1.965 1.00 0.15 C ATOM 1298 C LEU A 85 6.499 -0.232 -2.835 1.00 0.16 C ATOM 1299 O LEU A 85 6.194 0.322 -3.898 1.00 0.21 O ATOM 1300 CB LEU A 85 7.648 1.813 -1.762 1.00 0.25 C ATOM 1301 CG LEU A 85 6.452 2.425 -0.971 1.00 0.43 C ATOM 1302 CD1 LEU A 85 6.928 3.426 0.078 1.00 0.78 C ATOM 1303 CD2 LEU A 85 5.460 3.129 -1.900 1.00 0.61 C ATOM 0 H LEU A 85 9.159 0.446 -3.420 1.00 0.12 H new ATOM 0 HA LEU A 85 7.560 -0.193 -0.986 1.00 0.15 H new ATOM 0 HB2 LEU A 85 8.568 2.097 -1.251 1.00 0.25 H new ATOM 0 HB3 LEU A 85 7.673 2.281 -2.746 1.00 0.25 H new ATOM 0 HG LEU A 85 5.954 1.590 -0.478 1.00 0.43 H new ATOM 0 HD11 LEU A 85 6.068 3.832 0.610 1.00 0.78 H new ATOM 0 HD12 LEU A 85 7.589 2.925 0.786 1.00 0.78 H new ATOM 0 HD13 LEU A 85 7.468 4.237 -0.411 1.00 0.78 H new ATOM 0 HD21 LEU A 85 4.641 3.542 -1.312 1.00 0.61 H new ATOM 0 HD22 LEU A 85 5.968 3.934 -2.431 1.00 0.61 H new ATOM 0 HD23 LEU A 85 5.064 2.412 -2.620 1.00 0.61 H new ATOM 1315 N VAL A 86 5.873 -1.314 -2.346 1.00 0.17 N ATOM 1316 CA VAL A 86 4.727 -1.975 -3.026 1.00 0.21 C ATOM 1317 C VAL A 86 3.451 -1.757 -2.169 1.00 0.21 C ATOM 1318 O VAL A 86 3.423 -2.069 -0.972 1.00 0.27 O ATOM 1319 CB VAL A 86 4.914 -3.557 -3.308 1.00 0.25 C ATOM 1320 CG1 VAL A 86 4.157 -4.021 -4.579 1.00 0.44 C ATOM 1321 CG2 VAL A 86 6.385 -4.039 -3.448 1.00 0.32 C ATOM 0 H VAL A 86 6.140 -1.762 -1.469 1.00 0.17 H new ATOM 0 HA VAL A 86 4.651 -1.512 -4.010 1.00 0.21 H new ATOM 0 HB VAL A 86 4.495 -4.008 -2.408 1.00 0.25 H new ATOM 0 HG11 VAL A 86 4.313 -5.090 -4.726 1.00 0.44 H new ATOM 0 HG12 VAL A 86 3.092 -3.823 -4.461 1.00 0.44 H new ATOM 0 HG13 VAL A 86 4.533 -3.477 -5.445 1.00 0.44 H new ATOM 0 HG21 VAL A 86 6.400 -5.113 -3.635 1.00 0.32 H new ATOM 0 HG22 VAL A 86 6.861 -3.519 -4.280 1.00 0.32 H new ATOM 0 HG23 VAL A 86 6.928 -3.824 -2.528 1.00 0.32 H new ATOM 1331 N LEU A 87 2.408 -1.226 -2.812 1.00 0.20 N ATOM 1332 CA LEU A 87 1.127 -0.961 -2.123 1.00 0.22 C ATOM 1333 C LEU A 87 -0.070 -1.557 -2.867 1.00 0.22 C ATOM 1334 O LEU A 87 -0.186 -1.429 -4.099 1.00 0.26 O ATOM 1335 CB LEU A 87 0.852 0.569 -1.905 1.00 0.31 C ATOM 1336 CG LEU A 87 1.723 1.615 -2.676 1.00 0.50 C ATOM 1337 CD1 LEU A 87 1.401 1.671 -4.172 1.00 1.25 C ATOM 1338 CD2 LEU A 87 1.547 3.012 -2.081 1.00 0.88 C ATOM 0 H LEU A 87 2.417 -0.971 -3.799 1.00 0.20 H new ATOM 0 HA LEU A 87 1.236 -1.445 -1.153 1.00 0.22 H new ATOM 0 HB2 LEU A 87 -0.191 0.756 -2.163 1.00 0.31 H new ATOM 0 HB3 LEU A 87 0.959 0.774 -0.840 1.00 0.31 H new ATOM 0 HG LEU A 87 2.756 1.285 -2.565 1.00 0.50 H new ATOM 0 HD11 LEU A 87 2.037 2.414 -4.653 1.00 1.25 H new ATOM 0 HD12 LEU A 87 1.582 0.694 -4.620 1.00 1.25 H new ATOM 0 HD13 LEU A 87 0.355 1.945 -4.309 1.00 1.25 H new ATOM 0 HD21 LEU A 87 2.162 3.723 -2.633 1.00 0.88 H new ATOM 0 HD22 LEU A 87 0.500 3.308 -2.150 1.00 0.88 H new ATOM 0 HD23 LEU A 87 1.853 3.003 -1.035 1.00 0.88 H new ATOM 1350 N LYS A 88 -0.980 -2.205 -2.101 1.00 0.23 N ATOM 1351 CA LYS A 88 -2.216 -2.768 -2.695 1.00 0.26 C ATOM 1352 C LYS A 88 -3.417 -1.848 -2.416 1.00 0.27 C ATOM 1353 O LYS A 88 -3.803 -1.624 -1.265 1.00 0.29 O ATOM 1354 CB LYS A 88 -2.544 -4.192 -2.177 1.00 0.31 C ATOM 1355 CG LYS A 88 -3.393 -5.069 -3.139 1.00 0.46 C ATOM 1356 CD LYS A 88 -2.545 -5.822 -4.203 1.00 1.53 C ATOM 1357 CE LYS A 88 -2.017 -7.183 -3.725 1.00 2.13 C ATOM 1358 NZ LYS A 88 -1.345 -7.925 -4.828 1.00 2.52 N ATOM 0 H LYS A 88 -0.886 -2.349 -1.096 1.00 0.23 H new ATOM 0 HA LYS A 88 -2.031 -2.837 -3.767 1.00 0.26 H new ATOM 0 HB2 LYS A 88 -1.608 -4.710 -1.970 1.00 0.31 H new ATOM 0 HB3 LYS A 88 -3.075 -4.103 -1.229 1.00 0.31 H new ATOM 0 HG2 LYS A 88 -3.956 -5.796 -2.554 1.00 0.46 H new ATOM 0 HG3 LYS A 88 -4.121 -4.437 -3.647 1.00 0.46 H new ATOM 0 HD2 LYS A 88 -3.150 -5.971 -5.097 1.00 1.53 H new ATOM 0 HD3 LYS A 88 -1.700 -5.196 -4.491 1.00 1.53 H new ATOM 0 HE2 LYS A 88 -1.315 -7.034 -2.904 1.00 2.13 H new ATOM 0 HE3 LYS A 88 -2.843 -7.778 -3.335 1.00 2.13 H new ATOM 0 HZ1 LYS A 88 -1.030 -8.853 -4.481 1.00 2.52 H new ATOM 0 HZ2 LYS A 88 -2.013 -8.058 -5.614 1.00 2.52 H new ATOM 0 HZ3 LYS A 88 -0.522 -7.383 -5.160 1.00 2.52 H new ATOM 1372 N PHE A 89 -4.009 -1.339 -3.500 1.00 0.27 N ATOM 1373 CA PHE A 89 -5.174 -0.445 -3.416 1.00 0.29 C ATOM 1374 C PHE A 89 -6.465 -1.194 -3.826 1.00 0.31 C ATOM 1375 O PHE A 89 -6.490 -1.922 -4.830 1.00 0.32 O ATOM 1376 CB PHE A 89 -4.973 0.762 -4.356 1.00 0.30 C ATOM 1377 CG PHE A 89 -4.212 1.955 -3.770 1.00 0.28 C ATOM 1378 CD1 PHE A 89 -4.735 2.652 -2.682 1.00 0.36 C ATOM 1379 CD2 PHE A 89 -3.000 2.410 -4.321 1.00 0.25 C ATOM 1380 CE1 PHE A 89 -4.090 3.760 -2.165 1.00 0.40 C ATOM 1381 CE2 PHE A 89 -2.355 3.513 -3.793 1.00 0.26 C ATOM 1382 CZ PHE A 89 -2.899 4.189 -2.724 1.00 0.31 C ATOM 0 H PHE A 89 -3.700 -1.531 -4.453 1.00 0.27 H new ATOM 0 HA PHE A 89 -5.272 -0.103 -2.386 1.00 0.29 H new ATOM 0 HB2 PHE A 89 -4.442 0.420 -5.244 1.00 0.30 H new ATOM 0 HB3 PHE A 89 -5.953 1.108 -4.684 1.00 0.30 H new ATOM 0 HD1 PHE A 89 -5.661 2.320 -2.235 1.00 0.36 H new ATOM 0 HD2 PHE A 89 -2.569 1.892 -5.165 1.00 0.25 H new ATOM 0 HE1 PHE A 89 -4.515 4.290 -1.326 1.00 0.40 H new ATOM 0 HE2 PHE A 89 -1.421 3.846 -4.221 1.00 0.26 H new ATOM 0 HZ PHE A 89 -2.395 5.055 -2.321 1.00 0.31 H new ATOM 1392 N ALA A 90 -7.545 -1.014 -3.023 1.00 0.33 N ATOM 1393 CA ALA A 90 -8.859 -1.698 -3.267 1.00 0.36 C ATOM 1394 C ALA A 90 -10.079 -0.773 -2.940 1.00 0.39 C ATOM 1395 O ALA A 90 -9.987 0.143 -2.102 1.00 0.37 O ATOM 1396 CB ALA A 90 -8.960 -3.028 -2.446 1.00 0.41 C ATOM 0 H ALA A 90 -7.541 -0.406 -2.204 1.00 0.33 H new ATOM 0 HA ALA A 90 -8.896 -1.932 -4.331 1.00 0.36 H new ATOM 0 HB1 ALA A 90 -9.921 -3.504 -2.641 1.00 0.41 H new ATOM 0 HB2 ALA A 90 -8.155 -3.701 -2.743 1.00 0.41 H new ATOM 0 HB3 ALA A 90 -8.874 -2.806 -1.382 1.00 0.41 H new ATOM 1402 N GLU A 91 -11.219 -1.008 -3.640 1.00 0.46 N ATOM 1403 CA GLU A 91 -12.474 -0.254 -3.419 1.00 0.53 C ATOM 1404 C GLU A 91 -13.711 -1.148 -3.681 1.00 0.63 C ATOM 1405 O GLU A 91 -13.765 -1.874 -4.684 1.00 1.23 O ATOM 1406 CB GLU A 91 -12.537 1.031 -4.295 1.00 0.78 C ATOM 1407 CG GLU A 91 -12.587 0.788 -5.814 1.00 1.80 C ATOM 1408 CD GLU A 91 -12.766 2.072 -6.606 1.00 2.04 C ATOM 1409 OE1 GLU A 91 -13.284 3.057 -6.039 1.00 1.94 O ATOM 1410 OE2 GLU A 91 -12.389 2.093 -7.795 1.00 2.61 O ATOM 0 H GLU A 91 -11.291 -1.720 -4.367 1.00 0.46 H new ATOM 0 HA GLU A 91 -12.484 0.055 -2.374 1.00 0.53 H new ATOM 0 HB2 GLU A 91 -13.417 1.605 -4.006 1.00 0.78 H new ATOM 0 HB3 GLU A 91 -11.666 1.647 -4.070 1.00 0.78 H new ATOM 0 HG2 GLU A 91 -11.667 0.296 -6.130 1.00 1.80 H new ATOM 0 HG3 GLU A 91 -13.407 0.107 -6.042 1.00 1.80 H new ATOM 1417 N VAL A 92 -14.710 -1.083 -2.780 1.00 0.60 N ATOM 1418 CA VAL A 92 -15.932 -1.904 -2.924 1.00 0.76 C ATOM 1419 C VAL A 92 -17.215 -1.157 -2.363 1.00 0.66 C ATOM 1420 O VAL A 92 -17.598 -1.314 -1.199 1.00 1.19 O ATOM 1421 CB VAL A 92 -15.668 -3.425 -2.385 1.00 1.42 C ATOM 1422 CG1 VAL A 92 -15.483 -3.603 -0.842 1.00 2.13 C ATOM 1423 CG2 VAL A 92 -16.710 -4.445 -2.907 1.00 2.00 C ATOM 0 H VAL A 92 -14.699 -0.481 -1.956 1.00 0.60 H new ATOM 0 HA VAL A 92 -16.174 -2.033 -3.979 1.00 0.76 H new ATOM 0 HB VAL A 92 -14.692 -3.640 -2.821 1.00 1.42 H new ATOM 0 HG11 VAL A 92 -15.315 -4.656 -0.615 1.00 2.13 H new ATOM 0 HG12 VAL A 92 -14.625 -3.019 -0.509 1.00 2.13 H new ATOM 0 HG13 VAL A 92 -16.379 -3.259 -0.326 1.00 2.13 H new ATOM 0 HG21 VAL A 92 -16.479 -5.435 -2.513 1.00 2.00 H new ATOM 0 HG22 VAL A 92 -17.706 -4.148 -2.579 1.00 2.00 H new ATOM 0 HG23 VAL A 92 -16.679 -4.471 -3.996 1.00 2.00 H new ATOM 1433 N TYR A 93 -17.844 -0.340 -3.237 1.00 0.76 N ATOM 1434 CA TYR A 93 -19.080 0.421 -2.905 1.00 0.80 C ATOM 1435 C TYR A 93 -19.645 1.177 -4.129 1.00 0.86 C ATOM 1436 O TYR A 93 -20.850 1.112 -4.391 1.00 1.46 O ATOM 1437 CB TYR A 93 -18.855 1.425 -1.747 1.00 1.23 C ATOM 1438 CG TYR A 93 -20.000 1.461 -0.720 1.00 0.97 C ATOM 1439 CD1 TYR A 93 -20.051 0.541 0.333 1.00 1.14 C ATOM 1440 CD2 TYR A 93 -21.039 2.397 -0.812 1.00 1.01 C ATOM 1441 CE1 TYR A 93 -21.090 0.555 1.250 1.00 1.47 C ATOM 1442 CE2 TYR A 93 -22.075 2.410 0.108 1.00 1.43 C ATOM 1443 CZ TYR A 93 -22.095 1.488 1.131 1.00 1.67 C ATOM 1444 OH TYR A 93 -23.127 1.497 2.041 1.00 2.27 O ATOM 0 H TYR A 93 -17.515 -0.187 -4.190 1.00 0.76 H new ATOM 0 HA TYR A 93 -19.807 -0.326 -2.586 1.00 0.80 H new ATOM 0 HB2 TYR A 93 -17.928 1.170 -1.234 1.00 1.23 H new ATOM 0 HB3 TYR A 93 -18.724 2.423 -2.165 1.00 1.23 H new ATOM 0 HD1 TYR A 93 -19.266 -0.194 0.433 1.00 1.14 H new ATOM 0 HD2 TYR A 93 -21.032 3.121 -1.614 1.00 1.01 H new ATOM 0 HE1 TYR A 93 -21.111 -0.164 2.056 1.00 1.47 H new ATOM 0 HE2 TYR A 93 -22.865 3.141 0.023 1.00 1.43 H new ATOM 0 HH TYR A 93 -23.753 2.217 1.818 1.00 2.27 H new ATOM 1454 N PHE A 94 -18.769 1.893 -4.875 1.00 0.78 N ATOM 1455 CA PHE A 94 -19.176 2.669 -6.062 1.00 0.82 C ATOM 1456 C PHE A 94 -18.543 2.120 -7.356 1.00 0.76 C ATOM 1457 O PHE A 94 -17.364 1.742 -7.383 1.00 0.79 O ATOM 1458 CB PHE A 94 -18.775 4.148 -5.901 1.00 1.01 C ATOM 1459 CG PHE A 94 -19.497 4.888 -4.778 1.00 1.11 C ATOM 1460 CD1 PHE A 94 -20.797 5.377 -4.950 1.00 1.31 C ATOM 1461 CD2 PHE A 94 -18.875 5.091 -3.547 1.00 1.13 C ATOM 1462 CE1 PHE A 94 -21.448 6.042 -3.922 1.00 1.46 C ATOM 1463 CE2 PHE A 94 -19.526 5.758 -2.520 1.00 1.23 C ATOM 1464 CZ PHE A 94 -20.829 6.257 -2.736 1.00 1.37 C ATOM 0 H PHE A 94 -17.771 1.946 -4.670 1.00 0.78 H new ATOM 0 HA PHE A 94 -20.259 2.580 -6.142 1.00 0.82 H new ATOM 0 HB2 PHE A 94 -17.701 4.201 -5.721 1.00 1.01 H new ATOM 0 HB3 PHE A 94 -18.967 4.666 -6.841 1.00 1.01 H new ATOM 0 HD1 PHE A 94 -21.299 5.235 -5.895 1.00 1.31 H new ATOM 0 HD2 PHE A 94 -17.872 4.723 -3.391 1.00 1.13 H new ATOM 0 HE1 PHE A 94 -22.459 6.392 -4.068 1.00 1.46 H new ATOM 0 HE2 PHE A 94 -19.041 5.894 -1.565 1.00 1.23 H new ATOM 0 HZ PHE A 94 -21.332 6.810 -1.956 1.00 1.37 H new ATOM 1474 N ALA A 95 -19.352 2.089 -8.445 1.00 0.73 N ATOM 1475 CA ALA A 95 -18.899 1.599 -9.767 1.00 0.73 C ATOM 1476 C ALA A 95 -18.849 2.761 -10.807 1.00 0.72 C ATOM 1477 O ALA A 95 -19.877 3.211 -11.350 1.00 0.84 O ATOM 1478 CB ALA A 95 -19.791 0.418 -10.247 1.00 0.82 C ATOM 0 H ALA A 95 -20.324 2.399 -8.431 1.00 0.73 H new ATOM 0 HA ALA A 95 -17.882 1.219 -9.668 1.00 0.73 H new ATOM 0 HB1 ALA A 95 -19.443 0.071 -11.220 1.00 0.82 H new ATOM 0 HB2 ALA A 95 -19.731 -0.399 -9.528 1.00 0.82 H new ATOM 0 HB3 ALA A 95 -20.825 0.753 -10.330 1.00 0.82 H new ATOM 1484 N GLN A 96 -17.626 3.285 -11.028 1.00 0.65 N ATOM 1485 CA GLN A 96 -17.399 4.393 -11.984 1.00 0.66 C ATOM 1486 C GLN A 96 -15.929 4.469 -12.456 1.00 0.58 C ATOM 1487 O GLN A 96 -14.989 4.281 -11.674 1.00 0.53 O ATOM 1488 CB GLN A 96 -17.810 5.746 -11.348 1.00 0.72 C ATOM 1489 CG GLN A 96 -18.441 6.767 -12.322 1.00 1.40 C ATOM 1490 CD GLN A 96 -19.848 6.386 -12.756 1.00 1.85 C ATOM 1491 OE1 GLN A 96 -20.034 5.697 -13.760 1.00 2.38 O ATOM 1492 NE2 GLN A 96 -20.843 6.835 -12.000 1.00 2.45 N ATOM 0 H GLN A 96 -16.780 2.961 -10.559 1.00 0.65 H new ATOM 0 HA GLN A 96 -18.019 4.191 -12.857 1.00 0.66 H new ATOM 0 HB2 GLN A 96 -18.518 5.550 -10.543 1.00 0.72 H new ATOM 0 HB3 GLN A 96 -16.928 6.198 -10.894 1.00 0.72 H new ATOM 0 HG2 GLN A 96 -18.467 7.747 -11.845 1.00 1.40 H new ATOM 0 HG3 GLN A 96 -17.807 6.858 -13.204 1.00 1.40 H new ATOM 0 HE21 GLN A 96 -20.642 7.403 -11.177 1.00 2.45 H new ATOM 0 HE22 GLN A 96 -21.808 6.612 -12.242 1.00 2.45 H new ATOM 1501 N SER A 97 -15.756 4.771 -13.759 1.00 0.64 N ATOM 1502 CA SER A 97 -14.431 4.897 -14.400 1.00 0.62 C ATOM 1503 C SER A 97 -14.208 6.300 -15.011 1.00 0.81 C ATOM 1504 O SER A 97 -15.060 6.811 -15.748 1.00 1.66 O ATOM 1505 CB SER A 97 -14.277 3.836 -15.496 1.00 0.68 C ATOM 1506 OG SER A 97 -13.910 2.578 -14.954 1.00 0.73 O ATOM 0 H SER A 97 -16.534 4.935 -14.398 1.00 0.64 H new ATOM 0 HA SER A 97 -13.681 4.748 -13.623 1.00 0.62 H new ATOM 0 HB2 SER A 97 -15.215 3.738 -16.043 1.00 0.68 H new ATOM 0 HB3 SER A 97 -13.522 4.159 -16.213 1.00 0.68 H new ATOM 0 HG SER A 97 -13.821 1.923 -15.678 1.00 0.73 H new ATOM 1512 N GLN A 98 -13.030 6.911 -14.679 1.00 0.55 N ATOM 1513 CA GLN A 98 -12.581 8.287 -15.139 1.00 0.54 C ATOM 1514 C GLN A 98 -13.205 9.478 -14.332 1.00 0.56 C ATOM 1515 O GLN A 98 -13.063 10.641 -14.728 1.00 0.67 O ATOM 1516 CB GLN A 98 -12.820 8.502 -16.661 1.00 0.62 C ATOM 1517 CG GLN A 98 -11.987 7.587 -17.583 1.00 1.06 C ATOM 1518 CD GLN A 98 -10.524 7.999 -17.663 1.00 1.14 C ATOM 1519 OE1 GLN A 98 -9.696 7.543 -16.876 1.00 1.89 O ATOM 1520 NE2 GLN A 98 -10.202 8.863 -18.619 1.00 1.60 N ATOM 0 H GLN A 98 -12.344 6.461 -14.072 1.00 0.55 H new ATOM 0 HA GLN A 98 -11.510 8.298 -14.936 1.00 0.54 H new ATOM 0 HB2 GLN A 98 -13.877 8.343 -16.874 1.00 0.62 H new ATOM 0 HB3 GLN A 98 -12.598 9.541 -16.906 1.00 0.62 H new ATOM 0 HG2 GLN A 98 -12.051 6.561 -17.221 1.00 1.06 H new ATOM 0 HG3 GLN A 98 -12.418 7.600 -18.584 1.00 1.06 H new ATOM 0 HE21 GLN A 98 -10.921 9.216 -19.251 1.00 1.60 H new ATOM 0 HE22 GLN A 98 -9.236 9.173 -18.722 1.00 1.60 H new ATOM 1529 N GLN A 99 -13.881 9.170 -13.203 1.00 0.53 N ATOM 1530 CA GLN A 99 -14.511 10.180 -12.320 1.00 0.58 C ATOM 1531 C GLN A 99 -13.892 10.185 -10.898 1.00 0.57 C ATOM 1532 O GLN A 99 -13.931 11.207 -10.208 1.00 0.62 O ATOM 1533 CB GLN A 99 -16.028 9.932 -12.222 1.00 0.61 C ATOM 1534 CG GLN A 99 -16.851 10.460 -13.416 1.00 1.18 C ATOM 1535 CD GLN A 99 -16.992 11.975 -13.413 1.00 1.71 C ATOM 1536 OE1 GLN A 99 -16.173 12.687 -13.995 1.00 2.56 O ATOM 1537 NE2 GLN A 99 -18.031 12.475 -12.752 1.00 2.02 N ATOM 0 H GLN A 99 -14.006 8.212 -12.877 1.00 0.53 H new ATOM 0 HA GLN A 99 -14.324 11.156 -12.768 1.00 0.58 H new ATOM 0 HB2 GLN A 99 -16.201 8.860 -12.126 1.00 0.61 H new ATOM 0 HB3 GLN A 99 -16.399 10.398 -11.309 1.00 0.61 H new ATOM 0 HG2 GLN A 99 -16.376 10.146 -14.346 1.00 1.18 H new ATOM 0 HG3 GLN A 99 -17.843 10.008 -13.396 1.00 1.18 H new ATOM 0 HE21 GLN A 99 -18.686 11.849 -12.283 1.00 2.02 H new ATOM 0 HE22 GLN A 99 -18.173 13.484 -12.713 1.00 2.02 H new ATOM 1546 N LYS A 100 -13.321 9.028 -10.473 1.00 0.53 N ATOM 1547 CA LYS A 100 -12.656 8.881 -9.163 1.00 0.55 C ATOM 1548 C LYS A 100 -11.128 8.810 -9.369 1.00 0.48 C ATOM 1549 O LYS A 100 -10.521 7.735 -9.340 1.00 0.49 O ATOM 1550 CB LYS A 100 -13.156 7.612 -8.445 1.00 0.64 C ATOM 1551 CG LYS A 100 -14.678 7.586 -8.170 1.00 1.11 C ATOM 1552 CD LYS A 100 -15.133 6.357 -7.339 1.00 1.52 C ATOM 1553 CE LYS A 100 -14.885 5.011 -8.048 1.00 2.14 C ATOM 1554 NZ LYS A 100 -15.607 3.900 -7.374 1.00 2.76 N ATOM 0 H LYS A 100 -13.312 8.175 -11.032 1.00 0.53 H new ATOM 0 HA LYS A 100 -12.897 9.743 -8.541 1.00 0.55 H new ATOM 0 HB2 LYS A 100 -12.894 6.742 -9.047 1.00 0.64 H new ATOM 0 HB3 LYS A 100 -12.627 7.514 -7.497 1.00 0.64 H new ATOM 0 HG2 LYS A 100 -14.960 8.497 -7.642 1.00 1.11 H new ATOM 0 HG3 LYS A 100 -15.212 7.590 -9.120 1.00 1.11 H new ATOM 0 HD2 LYS A 100 -14.607 6.358 -6.384 1.00 1.52 H new ATOM 0 HD3 LYS A 100 -16.196 6.452 -7.117 1.00 1.52 H new ATOM 0 HE2 LYS A 100 -15.209 5.080 -9.086 1.00 2.14 H new ATOM 0 HE3 LYS A 100 -13.816 4.797 -8.061 1.00 2.14 H new ATOM 0 HZ1 LYS A 100 -15.044 3.028 -7.442 1.00 2.76 H new ATOM 0 HZ2 LYS A 100 -15.755 4.139 -6.373 1.00 2.76 H new ATOM 0 HZ3 LYS A 100 -16.528 3.754 -7.835 1.00 2.76 H new ATOM 1568 N VAL A 101 -10.526 9.995 -9.567 1.00 0.45 N ATOM 1569 CA VAL A 101 -9.086 10.140 -9.843 1.00 0.40 C ATOM 1570 C VAL A 101 -8.361 10.791 -8.606 1.00 0.41 C ATOM 1571 O VAL A 101 -8.757 11.856 -8.112 1.00 0.47 O ATOM 1572 CB VAL A 101 -8.949 10.864 -11.286 1.00 0.38 C ATOM 1573 CG1 VAL A 101 -8.061 12.135 -11.413 1.00 0.69 C ATOM 1574 CG2 VAL A 101 -8.514 9.860 -12.372 1.00 0.68 C ATOM 0 H VAL A 101 -11.027 10.883 -9.540 1.00 0.45 H new ATOM 0 HA VAL A 101 -8.550 9.196 -9.945 1.00 0.40 H new ATOM 0 HB VAL A 101 -9.964 11.235 -11.424 1.00 0.38 H new ATOM 0 HG11 VAL A 101 -8.080 12.491 -12.443 1.00 0.69 H new ATOM 0 HG12 VAL A 101 -8.444 12.914 -10.753 1.00 0.69 H new ATOM 0 HG13 VAL A 101 -7.036 11.892 -11.132 1.00 0.69 H new ATOM 0 HG21 VAL A 101 -8.430 10.374 -13.330 1.00 0.68 H new ATOM 0 HG22 VAL A 101 -7.548 9.431 -12.105 1.00 0.68 H new ATOM 0 HG23 VAL A 101 -9.255 9.065 -12.450 1.00 0.68 H new ATOM 1584 N PHE A 102 -7.306 10.105 -8.139 1.00 0.39 N ATOM 1585 CA PHE A 102 -6.537 10.530 -6.943 1.00 0.40 C ATOM 1586 C PHE A 102 -5.044 10.841 -7.212 1.00 0.38 C ATOM 1587 O PHE A 102 -4.550 10.646 -8.310 1.00 0.41 O ATOM 1588 CB PHE A 102 -6.616 9.382 -5.930 1.00 0.42 C ATOM 1589 CG PHE A 102 -8.046 9.028 -5.514 1.00 0.49 C ATOM 1590 CD1 PHE A 102 -8.832 9.952 -4.835 1.00 0.60 C ATOM 1591 CD2 PHE A 102 -8.619 7.794 -5.843 1.00 0.60 C ATOM 1592 CE1 PHE A 102 -10.141 9.663 -4.495 1.00 0.67 C ATOM 1593 CE2 PHE A 102 -9.926 7.501 -5.495 1.00 0.70 C ATOM 1594 CZ PHE A 102 -10.688 8.436 -4.824 1.00 0.69 C ATOM 0 H PHE A 102 -6.959 9.248 -8.570 1.00 0.39 H new ATOM 0 HA PHE A 102 -6.977 11.461 -6.587 1.00 0.40 H new ATOM 0 HB2 PHE A 102 -6.142 8.498 -6.357 1.00 0.42 H new ATOM 0 HB3 PHE A 102 -6.045 9.652 -5.042 1.00 0.42 H new ATOM 0 HD1 PHE A 102 -8.413 10.911 -4.569 1.00 0.60 H new ATOM 0 HD2 PHE A 102 -8.033 7.060 -6.376 1.00 0.60 H new ATOM 0 HE1 PHE A 102 -10.737 10.396 -3.972 1.00 0.67 H new ATOM 0 HE2 PHE A 102 -10.350 6.541 -5.749 1.00 0.70 H new ATOM 0 HZ PHE A 102 -11.710 8.210 -4.556 1.00 0.69 H new ATOM 1604 N ASP A 103 -4.323 11.347 -6.181 1.00 0.36 N ATOM 1605 CA ASP A 103 -2.863 11.636 -6.317 1.00 0.34 C ATOM 1606 C ASP A 103 -2.039 10.853 -5.271 1.00 0.32 C ATOM 1607 O ASP A 103 -2.400 10.793 -4.090 1.00 0.34 O ATOM 1608 CB ASP A 103 -2.530 13.139 -6.213 1.00 0.37 C ATOM 1609 CG ASP A 103 -2.920 13.954 -7.447 1.00 0.85 C ATOM 1610 OD1 ASP A 103 -4.134 14.134 -7.679 1.00 1.30 O ATOM 1611 OD2 ASP A 103 -2.011 14.410 -8.173 1.00 1.33 O ATOM 0 H ASP A 103 -4.713 11.562 -5.263 1.00 0.36 H new ATOM 0 HA ASP A 103 -2.590 11.307 -7.320 1.00 0.34 H new ATOM 0 HB2 ASP A 103 -3.039 13.553 -5.342 1.00 0.37 H new ATOM 0 HB3 ASP A 103 -1.460 13.252 -6.040 1.00 0.37 H new ATOM 1616 N VAL A 104 -0.907 10.268 -5.722 1.00 0.29 N ATOM 1617 CA VAL A 104 -0.021 9.429 -4.856 1.00 0.28 C ATOM 1618 C VAL A 104 1.455 9.985 -4.892 1.00 0.26 C ATOM 1619 O VAL A 104 2.085 10.047 -5.966 1.00 0.25 O ATOM 1620 CB VAL A 104 -0.145 7.856 -5.269 1.00 0.33 C ATOM 1621 CG1 VAL A 104 0.887 6.905 -4.598 1.00 0.31 C ATOM 1622 CG2 VAL A 104 -1.518 7.276 -4.909 1.00 0.48 C ATOM 0 H VAL A 104 -0.577 10.357 -6.683 1.00 0.29 H new ATOM 0 HA VAL A 104 -0.346 9.491 -3.817 1.00 0.28 H new ATOM 0 HB VAL A 104 0.037 7.885 -6.343 1.00 0.33 H new ATOM 0 HG11 VAL A 104 0.717 5.884 -4.940 1.00 0.31 H new ATOM 0 HG12 VAL A 104 1.897 7.215 -4.868 1.00 0.31 H new ATOM 0 HG13 VAL A 104 0.771 6.949 -3.515 1.00 0.31 H new ATOM 0 HG21 VAL A 104 -1.558 6.227 -5.201 1.00 0.48 H new ATOM 0 HG22 VAL A 104 -1.678 7.360 -3.834 1.00 0.48 H new ATOM 0 HG23 VAL A 104 -2.296 7.829 -5.436 1.00 0.48 H new ATOM 1632 N ARG A 105 1.987 10.301 -3.672 1.00 0.26 N ATOM 1633 CA ARG A 105 3.354 10.868 -3.493 1.00 0.26 C ATOM 1634 C ARG A 105 4.297 10.016 -2.600 1.00 0.23 C ATOM 1635 O ARG A 105 3.865 9.386 -1.626 1.00 0.26 O ATOM 1636 CB ARG A 105 3.287 12.269 -2.841 1.00 0.33 C ATOM 1637 CG ARG A 105 2.182 13.202 -3.370 1.00 0.53 C ATOM 1638 CD ARG A 105 2.342 14.641 -2.856 1.00 0.51 C ATOM 1639 NE ARG A 105 1.181 15.457 -3.183 1.00 0.92 N ATOM 1640 CZ ARG A 105 1.198 16.789 -3.232 1.00 1.25 C ATOM 1641 NH1 ARG A 105 2.299 17.461 -2.919 1.00 1.15 N ATOM 1642 NH2 ARG A 105 0.107 17.455 -3.584 1.00 1.69 N ATOM 0 H ARG A 105 1.483 10.170 -2.795 1.00 0.26 H new ATOM 0 HA ARG A 105 3.761 10.895 -4.504 1.00 0.26 H new ATOM 0 HB2 ARG A 105 3.147 12.143 -1.767 1.00 0.33 H new ATOM 0 HB3 ARG A 105 4.250 12.761 -2.981 1.00 0.33 H new ATOM 0 HG2 ARG A 105 2.201 13.203 -4.460 1.00 0.53 H new ATOM 0 HG3 ARG A 105 1.208 12.816 -3.068 1.00 0.53 H new ATOM 0 HD2 ARG A 105 2.487 14.629 -1.776 1.00 0.51 H new ATOM 0 HD3 ARG A 105 3.236 15.087 -3.292 1.00 0.51 H new ATOM 0 HE ARG A 105 0.302 14.981 -3.387 1.00 0.92 H new ATOM 0 HH11 ARG A 105 3.141 16.958 -2.638 1.00 1.15 H new ATOM 0 HH12 ARG A 105 2.303 18.480 -2.959 1.00 1.15 H new ATOM 0 HH21 ARG A 105 -0.747 16.948 -3.818 1.00 1.69 H new ATOM 0 HH22 ARG A 105 0.121 18.474 -3.621 1.00 1.69 H new ATOM 1656 N VAL A 106 5.615 10.061 -2.948 1.00 0.23 N ATOM 1657 CA VAL A 106 6.717 9.349 -2.214 1.00 0.23 C ATOM 1658 C VAL A 106 7.871 10.399 -1.943 1.00 0.22 C ATOM 1659 O VAL A 106 8.556 10.846 -2.872 1.00 0.23 O ATOM 1660 CB VAL A 106 7.261 8.031 -2.995 1.00 0.29 C ATOM 1661 CG1 VAL A 106 8.360 7.241 -2.234 1.00 0.57 C ATOM 1662 CG2 VAL A 106 6.148 7.003 -3.309 1.00 0.60 C ATOM 0 H VAL A 106 5.951 10.594 -3.750 1.00 0.23 H new ATOM 0 HA VAL A 106 6.327 8.964 -1.272 1.00 0.23 H new ATOM 0 HB VAL A 106 7.673 8.462 -3.908 1.00 0.29 H new ATOM 0 HG11 VAL A 106 8.665 6.378 -2.827 1.00 0.57 H new ATOM 0 HG12 VAL A 106 9.221 7.887 -2.065 1.00 0.57 H new ATOM 0 HG13 VAL A 106 7.967 6.902 -1.276 1.00 0.57 H new ATOM 0 HG21 VAL A 106 6.579 6.148 -3.830 1.00 0.60 H new ATOM 0 HG22 VAL A 106 5.690 6.667 -2.379 1.00 0.60 H new ATOM 0 HG23 VAL A 106 5.390 7.468 -3.939 1.00 0.60 H new ATOM 1672 N ASN A 107 8.035 10.780 -0.631 1.00 0.23 N ATOM 1673 CA ASN A 107 9.042 11.783 -0.088 1.00 0.23 C ATOM 1674 C ASN A 107 8.866 13.242 -0.631 1.00 0.24 C ATOM 1675 O ASN A 107 9.829 14.016 -0.683 1.00 0.25 O ATOM 1676 CB ASN A 107 10.504 11.307 -0.304 1.00 0.23 C ATOM 1677 CG ASN A 107 11.404 11.495 0.921 1.00 0.27 C ATOM 1678 OD1 ASN A 107 12.309 10.703 1.172 1.00 1.05 O ATOM 1679 ND2 ASN A 107 11.172 12.567 1.669 1.00 1.12 N ATOM 0 H ASN A 107 7.453 10.388 0.109 1.00 0.23 H new ATOM 0 HA ASN A 107 8.830 11.827 0.980 1.00 0.23 H new ATOM 0 HB2 ASN A 107 10.496 10.252 -0.578 1.00 0.23 H new ATOM 0 HB3 ASN A 107 10.933 11.852 -1.145 1.00 0.23 H new ATOM 0 HD21 ASN A 107 11.755 12.756 2.484 1.00 1.12 H new ATOM 0 HD22 ASN A 107 10.411 13.202 1.428 1.00 1.12 H new ATOM 1686 N GLY A 108 7.627 13.596 -1.018 1.00 0.25 N ATOM 1687 CA GLY A 108 7.354 14.916 -1.566 1.00 0.29 C ATOM 1688 C GLY A 108 7.137 14.944 -3.098 1.00 0.29 C ATOM 1689 O GLY A 108 6.558 15.899 -3.621 1.00 0.32 O ATOM 0 H GLY A 108 6.812 12.985 -0.958 1.00 0.25 H new ATOM 0 HA2 GLY A 108 6.467 15.321 -1.079 1.00 0.29 H new ATOM 0 HA3 GLY A 108 8.184 15.577 -1.317 1.00 0.29 H new ATOM 1693 N HIS A 109 7.613 13.881 -3.808 1.00 0.27 N ATOM 1694 CA HIS A 109 7.517 13.736 -5.258 1.00 0.28 C ATOM 1695 C HIS A 109 6.235 12.992 -5.719 1.00 0.30 C ATOM 1696 O HIS A 109 5.680 12.189 -4.971 1.00 0.57 O ATOM 1697 CB HIS A 109 8.725 12.897 -5.658 1.00 0.29 C ATOM 1698 CG HIS A 109 10.064 13.514 -5.377 1.00 0.31 C ATOM 1699 ND1 HIS A 109 10.672 14.406 -6.232 1.00 0.43 N ATOM 1700 CD2 HIS A 109 10.925 13.328 -4.348 1.00 0.27 C ATOM 1701 CE1 HIS A 109 11.850 14.744 -5.747 1.00 0.46 C ATOM 1702 NE2 HIS A 109 12.028 14.106 -4.601 1.00 0.36 N ATOM 0 H HIS A 109 8.082 13.093 -3.361 1.00 0.27 H new ATOM 0 HA HIS A 109 7.483 14.724 -5.718 1.00 0.28 H new ATOM 0 HB2 HIS A 109 8.669 11.941 -5.138 1.00 0.29 H new ATOM 0 HB3 HIS A 109 8.660 12.684 -6.725 1.00 0.29 H new ATOM 0 HD1 HIS A 109 10.273 14.751 -7.105 1.00 0.43 H new ATOM 0 HD2 HIS A 109 10.773 12.689 -3.491 1.00 0.27 H new ATOM 0 HE1 HIS A 109 12.551 15.425 -6.206 1.00 0.46 H new ATOM 1711 N THR A 110 5.771 13.245 -6.964 1.00 0.31 N ATOM 1712 CA THR A 110 4.567 12.537 -7.495 1.00 0.32 C ATOM 1713 C THR A 110 4.953 11.424 -8.479 1.00 0.35 C ATOM 1714 O THR A 110 5.688 11.643 -9.450 1.00 0.47 O ATOM 1715 CB THR A 110 3.482 13.430 -8.190 1.00 0.43 C ATOM 1716 OG1 THR A 110 4.070 14.484 -8.980 1.00 0.55 O ATOM 1717 CG2 THR A 110 2.487 14.035 -7.188 1.00 0.47 C ATOM 0 H THR A 110 6.192 13.913 -7.610 1.00 0.31 H new ATOM 0 HA THR A 110 4.112 12.141 -6.587 1.00 0.32 H new ATOM 0 HB THR A 110 2.935 12.759 -8.853 1.00 0.43 H new ATOM 0 HG1 THR A 110 4.829 14.128 -9.488 1.00 0.55 H new ATOM 0 HG21 THR A 110 1.758 14.644 -7.722 1.00 0.47 H new ATOM 0 HG22 THR A 110 1.972 13.234 -6.658 1.00 0.47 H new ATOM 0 HG23 THR A 110 3.024 14.657 -6.472 1.00 0.47 H new ATOM 1725 N VAL A 111 4.420 10.233 -8.206 1.00 0.29 N ATOM 1726 CA VAL A 111 4.687 9.031 -9.031 1.00 0.35 C ATOM 1727 C VAL A 111 3.381 8.549 -9.722 1.00 0.35 C ATOM 1728 O VAL A 111 3.384 8.333 -10.938 1.00 0.39 O ATOM 1729 CB VAL A 111 5.374 7.801 -8.255 1.00 0.38 C ATOM 1730 CG1 VAL A 111 6.359 7.038 -9.176 1.00 1.06 C ATOM 1731 CG2 VAL A 111 6.153 8.189 -6.974 1.00 1.00 C ATOM 0 H VAL A 111 3.796 10.064 -7.417 1.00 0.29 H new ATOM 0 HA VAL A 111 5.422 9.358 -9.767 1.00 0.35 H new ATOM 0 HB VAL A 111 4.529 7.180 -7.958 1.00 0.38 H new ATOM 0 HG11 VAL A 111 6.808 6.212 -8.624 1.00 1.06 H new ATOM 0 HG12 VAL A 111 5.821 6.647 -10.040 1.00 1.06 H new ATOM 0 HG13 VAL A 111 7.142 7.717 -9.513 1.00 1.06 H new ATOM 0 HG21 VAL A 111 6.579 7.293 -6.522 1.00 1.00 H new ATOM 0 HG22 VAL A 111 6.954 8.882 -7.231 1.00 1.00 H new ATOM 0 HG23 VAL A 111 5.475 8.665 -6.266 1.00 1.00 H new ATOM 1741 N VAL A 112 2.275 8.379 -8.954 1.00 0.33 N ATOM 1742 CA VAL A 112 1.004 7.924 -9.573 1.00 0.35 C ATOM 1743 C VAL A 112 -0.107 8.973 -9.345 1.00 0.34 C ATOM 1744 O VAL A 112 -0.859 8.908 -8.371 1.00 0.32 O ATOM 1745 CB VAL A 112 0.459 6.459 -9.148 1.00 0.37 C ATOM 1746 CG1 VAL A 112 0.085 5.619 -10.393 1.00 0.44 C ATOM 1747 CG2 VAL A 112 1.419 5.603 -8.278 1.00 0.40 C ATOM 0 H VAL A 112 2.234 8.542 -7.948 1.00 0.33 H new ATOM 0 HA VAL A 112 1.259 7.821 -10.628 1.00 0.35 H new ATOM 0 HB VAL A 112 -0.409 6.690 -8.531 1.00 0.37 H new ATOM 0 HG11 VAL A 112 -0.277 4.641 -10.077 1.00 0.44 H new ATOM 0 HG12 VAL A 112 -0.696 6.131 -10.956 1.00 0.44 H new ATOM 0 HG13 VAL A 112 0.964 5.493 -11.025 1.00 0.44 H new ATOM 0 HG21 VAL A 112 0.950 4.645 -8.054 1.00 0.40 H new ATOM 0 HG22 VAL A 112 2.349 5.434 -8.821 1.00 0.40 H new ATOM 0 HG23 VAL A 112 1.632 6.128 -7.347 1.00 0.40 H new ATOM 1757 N LYS A 113 -0.192 9.928 -10.295 1.00 0.36 N ATOM 1758 CA LYS A 113 -1.219 10.973 -10.284 1.00 0.38 C ATOM 1759 C LYS A 113 -2.264 10.697 -11.376 1.00 0.43 C ATOM 1760 O LYS A 113 -1.969 10.634 -12.574 1.00 0.70 O ATOM 1761 CB LYS A 113 -0.616 12.391 -10.400 1.00 0.42 C ATOM 1762 CG LYS A 113 0.240 12.651 -11.666 1.00 1.12 C ATOM 1763 CD LYS A 113 0.386 14.160 -11.989 1.00 1.27 C ATOM 1764 CE LYS A 113 1.196 14.934 -10.935 1.00 1.50 C ATOM 1765 NZ LYS A 113 1.442 16.340 -11.360 1.00 2.30 N ATOM 0 H LYS A 113 0.450 9.990 -11.085 1.00 0.36 H new ATOM 0 HA LYS A 113 -1.720 10.943 -9.317 1.00 0.38 H new ATOM 0 HB2 LYS A 113 -1.430 13.116 -10.378 1.00 0.42 H new ATOM 0 HB3 LYS A 113 0.001 12.577 -9.521 1.00 0.42 H new ATOM 0 HG2 LYS A 113 1.230 12.216 -11.526 1.00 1.12 H new ATOM 0 HG3 LYS A 113 -0.214 12.144 -12.517 1.00 1.12 H new ATOM 0 HD2 LYS A 113 0.868 14.271 -12.960 1.00 1.27 H new ATOM 0 HD3 LYS A 113 -0.606 14.604 -12.072 1.00 1.27 H new ATOM 0 HE2 LYS A 113 0.660 14.928 -9.986 1.00 1.50 H new ATOM 0 HE3 LYS A 113 2.149 14.432 -10.766 1.00 1.50 H new ATOM 0 HZ1 LYS A 113 1.990 16.833 -10.627 1.00 2.30 H new ATOM 0 HZ2 LYS A 113 1.975 16.345 -12.253 1.00 2.30 H new ATOM 0 HZ3 LYS A 113 0.533 16.825 -11.497 1.00 2.30 H new ATOM 1779 N ASP A 114 -3.492 10.526 -10.867 1.00 0.37 N ATOM 1780 CA ASP A 114 -4.749 10.150 -11.581 1.00 0.42 C ATOM 1781 C ASP A 114 -5.021 8.657 -11.293 1.00 0.38 C ATOM 1782 O ASP A 114 -5.071 7.834 -12.216 1.00 0.40 O ATOM 1783 CB ASP A 114 -4.786 10.412 -13.125 1.00 0.50 C ATOM 1784 CG ASP A 114 -4.973 11.880 -13.514 1.00 1.70 C ATOM 1785 OD1 ASP A 114 -4.263 12.739 -12.951 1.00 2.09 O ATOM 1786 OD2 ASP A 114 -5.830 12.163 -14.379 1.00 2.48 O ATOM 0 H ASP A 114 -3.660 10.654 -9.869 1.00 0.37 H new ATOM 0 HA ASP A 114 -5.524 10.811 -11.193 1.00 0.42 H new ATOM 0 HB2 ASP A 114 -3.858 10.048 -13.565 1.00 0.50 H new ATOM 0 HB3 ASP A 114 -5.596 9.827 -13.561 1.00 0.50 H new ATOM 1791 N LEU A 115 -5.188 8.304 -9.977 1.00 0.36 N ATOM 1792 CA LEU A 115 -5.426 6.913 -9.574 1.00 0.36 C ATOM 1793 C LEU A 115 -6.919 6.542 -9.573 1.00 0.38 C ATOM 1794 O LEU A 115 -7.665 6.864 -8.645 1.00 0.42 O ATOM 1795 CB LEU A 115 -4.807 6.532 -8.202 1.00 0.38 C ATOM 1796 CG LEU A 115 -3.919 5.221 -8.131 1.00 0.35 C ATOM 1797 CD1 LEU A 115 -3.807 4.739 -6.711 1.00 1.13 C ATOM 1798 CD2 LEU A 115 -4.403 4.029 -8.976 1.00 1.06 C ATOM 0 H LEU A 115 -5.159 8.967 -9.202 1.00 0.36 H new ATOM 0 HA LEU A 115 -4.911 6.333 -10.340 1.00 0.36 H new ATOM 0 HB2 LEU A 115 -4.195 7.369 -7.866 1.00 0.38 H new ATOM 0 HB3 LEU A 115 -5.621 6.424 -7.485 1.00 0.38 H new ATOM 0 HG LEU A 115 -2.964 5.541 -8.549 1.00 0.35 H new ATOM 0 HD11 LEU A 115 -3.194 3.838 -6.680 1.00 1.13 H new ATOM 0 HD12 LEU A 115 -3.345 5.514 -6.099 1.00 1.13 H new ATOM 0 HD13 LEU A 115 -4.801 4.515 -6.323 1.00 1.13 H new ATOM 0 HD21 LEU A 115 -3.718 3.191 -8.848 1.00 1.06 H new ATOM 0 HD22 LEU A 115 -5.401 3.735 -8.652 1.00 1.06 H new ATOM 0 HD23 LEU A 115 -4.433 4.316 -10.027 1.00 1.06 H new ATOM 1810 N ASP A 116 -7.320 5.924 -10.692 1.00 0.39 N ATOM 1811 CA ASP A 116 -8.662 5.385 -10.896 1.00 0.43 C ATOM 1812 C ASP A 116 -8.556 3.838 -10.837 1.00 0.42 C ATOM 1813 O ASP A 116 -8.213 3.177 -11.830 1.00 0.43 O ATOM 1814 CB ASP A 116 -9.218 5.886 -12.245 1.00 0.46 C ATOM 1815 CG ASP A 116 -10.730 6.100 -12.247 1.00 1.55 C ATOM 1816 OD1 ASP A 116 -11.474 5.098 -12.204 1.00 2.35 O ATOM 1817 OD2 ASP A 116 -11.162 7.270 -12.289 1.00 1.83 O ATOM 0 H ASP A 116 -6.705 5.784 -11.494 1.00 0.39 H new ATOM 0 HA ASP A 116 -9.356 5.720 -10.125 1.00 0.43 H new ATOM 0 HB2 ASP A 116 -8.727 6.824 -12.504 1.00 0.46 H new ATOM 0 HB3 ASP A 116 -8.961 5.167 -13.023 1.00 0.46 H new ATOM 1822 N ILE A 117 -8.877 3.287 -9.640 1.00 0.42 N ATOM 1823 CA ILE A 117 -8.777 1.827 -9.322 1.00 0.42 C ATOM 1824 C ILE A 117 -9.817 0.916 -10.105 1.00 0.44 C ATOM 1825 O ILE A 117 -9.497 -0.235 -10.424 1.00 0.44 O ATOM 1826 CB ILE A 117 -8.867 1.587 -7.744 1.00 0.43 C ATOM 1827 CG1 ILE A 117 -8.257 2.787 -6.945 1.00 0.55 C ATOM 1828 CG2 ILE A 117 -8.141 0.275 -7.291 1.00 0.49 C ATOM 1829 CD1 ILE A 117 -9.241 3.571 -6.079 1.00 0.68 C ATOM 0 H ILE A 117 -9.217 3.843 -8.855 1.00 0.42 H new ATOM 0 HA ILE A 117 -7.797 1.510 -9.677 1.00 0.42 H new ATOM 0 HB ILE A 117 -9.931 1.494 -7.525 1.00 0.43 H new ATOM 0 HG12 ILE A 117 -7.460 2.407 -6.305 1.00 0.55 H new ATOM 0 HG13 ILE A 117 -7.796 3.475 -7.653 1.00 0.55 H new ATOM 0 HG21 ILE A 117 -8.234 0.162 -6.211 1.00 0.49 H new ATOM 0 HG22 ILE A 117 -8.597 -0.583 -7.786 1.00 0.49 H new ATOM 0 HG23 ILE A 117 -7.086 0.331 -7.561 1.00 0.49 H new ATOM 0 HD11 ILE A 117 -8.715 4.378 -5.570 1.00 0.68 H new ATOM 0 HD12 ILE A 117 -10.026 3.990 -6.709 1.00 0.68 H new ATOM 0 HD13 ILE A 117 -9.685 2.905 -5.339 1.00 0.68 H new ATOM 1841 N PHE A 118 -11.024 1.464 -10.451 1.00 0.48 N ATOM 1842 CA PHE A 118 -12.078 0.725 -11.221 1.00 0.51 C ATOM 1843 C PHE A 118 -11.705 0.568 -12.736 1.00 0.53 C ATOM 1844 O PHE A 118 -11.892 -0.502 -13.316 1.00 0.56 O ATOM 1845 CB PHE A 118 -13.438 1.447 -11.094 1.00 0.56 C ATOM 1846 CG PHE A 118 -14.650 0.570 -11.422 1.00 0.62 C ATOM 1847 CD1 PHE A 118 -15.209 -0.281 -10.462 1.00 0.65 C ATOM 1848 CD2 PHE A 118 -15.236 0.611 -12.687 1.00 0.68 C ATOM 1849 CE1 PHE A 118 -16.313 -1.062 -10.761 1.00 0.72 C ATOM 1850 CE2 PHE A 118 -16.340 -0.172 -12.985 1.00 0.75 C ATOM 1851 CZ PHE A 118 -16.846 -1.053 -12.020 1.00 0.77 C ATOM 0 H PHE A 118 -11.291 2.418 -10.208 1.00 0.48 H new ATOM 0 HA PHE A 118 -12.148 -0.274 -10.790 1.00 0.51 H new ATOM 0 HB2 PHE A 118 -13.542 1.825 -10.077 1.00 0.56 H new ATOM 0 HB3 PHE A 118 -13.440 2.312 -11.757 1.00 0.56 H new ATOM 0 HD1 PHE A 118 -14.774 -0.329 -9.475 1.00 0.65 H new ATOM 0 HD2 PHE A 118 -14.824 1.262 -13.444 1.00 0.68 H new ATOM 0 HE1 PHE A 118 -16.755 -1.682 -9.995 1.00 0.72 H new ATOM 0 HE2 PHE A 118 -16.808 -0.103 -13.956 1.00 0.75 H new ATOM 0 HZ PHE A 118 -17.655 -1.723 -12.270 1.00 0.77 H new ATOM 1861 N ASP A 119 -11.154 1.662 -13.346 1.00 0.52 N ATOM 1862 CA ASP A 119 -10.673 1.691 -14.763 1.00 0.54 C ATOM 1863 C ASP A 119 -9.337 0.883 -14.992 1.00 0.53 C ATOM 1864 O ASP A 119 -9.084 0.423 -16.109 1.00 0.57 O ATOM 1865 CB ASP A 119 -10.490 3.166 -15.206 1.00 0.55 C ATOM 1866 CG ASP A 119 -10.863 3.450 -16.668 1.00 0.57 C ATOM 1867 OD1 ASP A 119 -11.701 2.716 -17.232 1.00 0.72 O ATOM 1868 OD2 ASP A 119 -10.303 4.409 -17.243 1.00 0.91 O ATOM 0 H ASP A 119 -11.031 2.553 -12.865 1.00 0.52 H new ATOM 0 HA ASP A 119 -11.431 1.197 -15.371 1.00 0.54 H new ATOM 0 HB2 ASP A 119 -11.096 3.802 -14.561 1.00 0.55 H new ATOM 0 HB3 ASP A 119 -9.450 3.451 -15.049 1.00 0.55 H new ATOM 1873 N ARG A 120 -8.498 0.726 -13.923 1.00 0.49 N ATOM 1874 CA ARG A 120 -7.216 -0.029 -13.990 1.00 0.48 C ATOM 1875 C ARG A 120 -7.395 -1.577 -13.912 1.00 0.50 C ATOM 1876 O ARG A 120 -6.967 -2.279 -14.832 1.00 0.54 O ATOM 1877 CB ARG A 120 -6.265 0.436 -12.870 1.00 0.46 C ATOM 1878 CG ARG A 120 -5.613 1.828 -13.088 1.00 0.45 C ATOM 1879 CD ARG A 120 -4.381 1.788 -14.012 1.00 0.52 C ATOM 1880 NE ARG A 120 -3.805 3.118 -14.200 1.00 1.23 N ATOM 1881 CZ ARG A 120 -2.748 3.365 -14.967 1.00 1.49 C ATOM 1882 NH1 ARG A 120 -2.150 2.376 -15.619 1.00 1.03 N ATOM 1883 NH2 ARG A 120 -2.286 4.603 -15.084 1.00 2.43 N ATOM 0 H ARG A 120 -8.693 1.117 -13.001 1.00 0.49 H new ATOM 0 HA ARG A 120 -6.789 0.190 -14.969 1.00 0.48 H new ATOM 0 HB2 ARG A 120 -6.818 0.455 -11.931 1.00 0.46 H new ATOM 0 HB3 ARG A 120 -5.473 -0.304 -12.758 1.00 0.46 H new ATOM 0 HG2 ARG A 120 -6.354 2.506 -13.512 1.00 0.45 H new ATOM 0 HG3 ARG A 120 -5.320 2.239 -12.122 1.00 0.45 H new ATOM 0 HD2 ARG A 120 -3.629 1.122 -13.588 1.00 0.52 H new ATOM 0 HD3 ARG A 120 -4.665 1.374 -14.980 1.00 0.52 H new ATOM 0 HE ARG A 120 -4.240 3.903 -13.714 1.00 1.23 H new ATOM 0 HH11 ARG A 120 -2.501 1.422 -15.533 1.00 1.03 H new ATOM 0 HH12 ARG A 120 -1.339 2.569 -16.207 1.00 1.03 H new ATOM 0 HH21 ARG A 120 -2.742 5.367 -14.585 1.00 2.43 H new ATOM 0 HH22 ARG A 120 -1.475 4.791 -15.673 1.00 2.43 H new ATOM 1897 N VAL A 121 -8.025 -2.111 -12.824 1.00 0.48 N ATOM 1898 CA VAL A 121 -8.255 -3.598 -12.706 1.00 0.51 C ATOM 1899 C VAL A 121 -9.654 -4.087 -13.238 1.00 0.56 C ATOM 1900 O VAL A 121 -9.728 -5.161 -13.842 1.00 0.62 O ATOM 1901 CB VAL A 121 -7.979 -4.239 -11.259 1.00 0.53 C ATOM 1902 CG1 VAL A 121 -6.495 -4.622 -11.096 1.00 0.92 C ATOM 1903 CG2 VAL A 121 -8.406 -3.367 -10.040 1.00 0.93 C ATOM 0 H VAL A 121 -8.375 -1.563 -12.038 1.00 0.48 H new ATOM 0 HA VAL A 121 -7.480 -3.977 -13.372 1.00 0.51 H new ATOM 0 HB VAL A 121 -8.621 -5.120 -11.243 1.00 0.53 H new ATOM 0 HG11 VAL A 121 -6.337 -5.053 -10.108 1.00 0.92 H new ATOM 0 HG12 VAL A 121 -6.222 -5.352 -11.858 1.00 0.92 H new ATOM 0 HG13 VAL A 121 -5.875 -3.732 -11.207 1.00 0.92 H new ATOM 0 HG21 VAL A 121 -8.174 -3.896 -9.115 1.00 0.93 H new ATOM 0 HG22 VAL A 121 -7.865 -2.421 -10.062 1.00 0.93 H new ATOM 0 HG23 VAL A 121 -9.478 -3.174 -10.088 1.00 0.93 H new ATOM 1913 N GLY A 122 -10.735 -3.303 -13.014 1.00 0.57 N ATOM 1914 CA GLY A 122 -12.071 -3.697 -13.482 1.00 0.63 C ATOM 1915 C GLY A 122 -13.142 -3.620 -12.394 1.00 0.66 C ATOM 1916 O GLY A 122 -13.455 -2.534 -11.899 1.00 0.85 O ATOM 0 H GLY A 122 -10.704 -2.411 -12.521 1.00 0.57 H new ATOM 0 HA2 GLY A 122 -12.361 -3.054 -14.313 1.00 0.63 H new ATOM 0 HA3 GLY A 122 -12.027 -4.716 -13.867 1.00 0.63 H new ATOM 1920 N HIS A 123 -13.709 -4.787 -12.029 1.00 0.72 N ATOM 1921 CA HIS A 123 -14.745 -4.869 -10.982 1.00 0.87 C ATOM 1922 C HIS A 123 -14.224 -5.669 -9.771 1.00 0.73 C ATOM 1923 O HIS A 123 -14.069 -6.895 -9.837 1.00 1.34 O ATOM 1924 CB HIS A 123 -16.023 -5.516 -11.553 1.00 1.38 C ATOM 1925 CG HIS A 123 -17.300 -5.102 -10.868 1.00 1.76 C ATOM 1926 ND1 HIS A 123 -18.182 -4.193 -11.416 1.00 2.62 N ATOM 1927 CD2 HIS A 123 -17.839 -5.477 -9.683 1.00 2.27 C ATOM 1928 CE1 HIS A 123 -19.205 -4.028 -10.595 1.00 3.18 C ATOM 1929 NE2 HIS A 123 -19.021 -4.794 -9.538 1.00 3.01 N ATOM 0 H HIS A 123 -13.466 -5.686 -12.445 1.00 0.72 H new ATOM 0 HA HIS A 123 -14.986 -3.861 -10.645 1.00 0.87 H new ATOM 0 HB2 HIS A 123 -16.098 -5.267 -12.612 1.00 1.38 H new ATOM 0 HB3 HIS A 123 -15.926 -6.600 -11.486 1.00 1.38 H new ATOM 0 HD2 HIS A 123 -17.417 -6.182 -8.982 1.00 2.27 H new ATOM 0 HE1 HIS A 123 -20.049 -3.376 -10.762 1.00 3.18 H new ATOM 0 HE2 HIS A 123 -19.654 -4.867 -8.742 1.00 3.01 H new ATOM 1938 N SER A 124 -13.955 -4.929 -8.654 1.00 0.86 N ATOM 1939 CA SER A 124 -13.411 -5.469 -7.359 1.00 0.70 C ATOM 1940 C SER A 124 -11.893 -5.847 -7.476 1.00 0.99 C ATOM 1941 O SER A 124 -11.090 -4.993 -7.866 1.00 2.08 O ATOM 1942 CB SER A 124 -14.269 -6.643 -6.812 1.00 0.73 C ATOM 1943 OG SER A 124 -15.547 -6.195 -6.385 1.00 1.20 O ATOM 0 H SER A 124 -14.111 -3.922 -8.623 1.00 0.86 H new ATOM 0 HA SER A 124 -13.479 -4.666 -6.625 1.00 0.70 H new ATOM 0 HB2 SER A 124 -14.387 -7.401 -7.586 1.00 0.73 H new ATOM 0 HB3 SER A 124 -13.751 -7.117 -5.979 1.00 0.73 H new ATOM 0 HG SER A 124 -16.064 -6.956 -6.048 1.00 1.20 H new ATOM 1949 N THR A 125 -11.509 -7.122 -7.112 1.00 0.56 N ATOM 1950 CA THR A 125 -10.092 -7.700 -7.208 1.00 0.51 C ATOM 1951 C THR A 125 -8.980 -6.900 -6.419 1.00 0.48 C ATOM 1952 O THR A 125 -9.286 -6.068 -5.555 1.00 0.51 O ATOM 1953 CB THR A 125 -9.620 -7.968 -8.722 1.00 0.55 C ATOM 1954 OG1 THR A 125 -9.567 -6.760 -9.506 1.00 0.62 O ATOM 1955 CG2 THR A 125 -10.499 -8.994 -9.483 1.00 0.62 C ATOM 0 H THR A 125 -12.177 -7.795 -6.737 1.00 0.56 H new ATOM 0 HA THR A 125 -10.189 -8.659 -6.700 1.00 0.51 H new ATOM 0 HB THR A 125 -8.619 -8.385 -8.608 1.00 0.55 H new ATOM 0 HG1 THR A 125 -9.982 -6.027 -9.005 1.00 0.62 H new ATOM 0 HG21 THR A 125 -10.117 -9.120 -10.496 1.00 0.62 H new ATOM 0 HG22 THR A 125 -10.473 -9.952 -8.963 1.00 0.62 H new ATOM 0 HG23 THR A 125 -11.526 -8.632 -9.525 1.00 0.62 H new ATOM 1963 N ALA A 126 -7.685 -7.193 -6.717 1.00 0.46 N ATOM 1964 CA ALA A 126 -6.536 -6.523 -6.072 1.00 0.43 C ATOM 1965 C ALA A 126 -5.708 -5.654 -7.070 1.00 0.38 C ATOM 1966 O ALA A 126 -5.305 -6.120 -8.152 1.00 0.41 O ATOM 1967 CB ALA A 126 -5.624 -7.585 -5.399 1.00 0.46 C ATOM 0 H ALA A 126 -7.416 -7.895 -7.406 1.00 0.46 H new ATOM 0 HA ALA A 126 -6.935 -5.843 -5.319 1.00 0.43 H new ATOM 0 HB1 ALA A 126 -4.777 -7.089 -4.924 1.00 0.46 H new ATOM 0 HB2 ALA A 126 -6.194 -8.130 -4.647 1.00 0.46 H new ATOM 0 HB3 ALA A 126 -5.259 -8.282 -6.153 1.00 0.46 H new ATOM 1973 N HIS A 127 -5.483 -4.362 -6.706 1.00 0.34 N ATOM 1974 CA HIS A 127 -4.653 -3.432 -7.519 1.00 0.32 C ATOM 1975 C HIS A 127 -3.265 -3.265 -6.855 1.00 0.31 C ATOM 1976 O HIS A 127 -3.167 -3.135 -5.635 1.00 0.35 O ATOM 1977 CB HIS A 127 -5.336 -2.056 -7.678 1.00 0.32 C ATOM 1978 CG HIS A 127 -4.669 -1.144 -8.685 1.00 0.33 C ATOM 1979 ND1 HIS A 127 -4.224 -1.575 -9.919 1.00 0.35 N ATOM 1980 CD2 HIS A 127 -4.336 0.169 -8.612 1.00 0.36 C ATOM 1981 CE1 HIS A 127 -3.644 -0.572 -10.552 1.00 0.38 C ATOM 1982 NE2 HIS A 127 -3.701 0.495 -9.783 1.00 0.38 N ATOM 0 H HIS A 127 -5.864 -3.943 -5.858 1.00 0.34 H new ATOM 0 HA HIS A 127 -4.535 -3.859 -8.515 1.00 0.32 H new ATOM 0 HB2 HIS A 127 -6.373 -2.210 -7.976 1.00 0.32 H new ATOM 0 HB3 HIS A 127 -5.353 -1.557 -6.709 1.00 0.32 H new ATOM 0 HD1 HIS A 127 -4.327 -2.522 -10.285 1.00 0.35 H new ATOM 0 HD2 HIS A 127 -4.534 0.834 -7.785 1.00 0.36 H new ATOM 0 HE1 HIS A 127 -3.198 -0.619 -11.535 1.00 0.38 H new ATOM 1991 N ASP A 128 -2.198 -3.245 -7.660 1.00 0.32 N ATOM 1992 CA ASP A 128 -0.836 -3.163 -7.110 1.00 0.33 C ATOM 1993 C ASP A 128 0.132 -2.332 -7.971 1.00 0.30 C ATOM 1994 O ASP A 128 0.262 -2.543 -9.182 1.00 0.42 O ATOM 1995 CB ASP A 128 -0.282 -4.598 -6.947 1.00 0.45 C ATOM 1996 CG ASP A 128 0.445 -4.875 -5.628 1.00 1.70 C ATOM 1997 OD1 ASP A 128 0.602 -3.926 -4.831 1.00 2.50 O ATOM 1998 OD2 ASP A 128 0.847 -6.030 -5.390 1.00 2.10 O ATOM 0 H ASP A 128 -2.245 -3.284 -8.678 1.00 0.32 H new ATOM 0 HA ASP A 128 -0.907 -2.649 -6.151 1.00 0.33 H new ATOM 0 HB2 ASP A 128 -1.109 -5.302 -7.041 1.00 0.45 H new ATOM 0 HB3 ASP A 128 0.404 -4.800 -7.770 1.00 0.45 H new ATOM 2003 N GLU A 129 0.815 -1.388 -7.299 1.00 0.25 N ATOM 2004 CA GLU A 129 1.844 -0.553 -7.938 1.00 0.30 C ATOM 2005 C GLU A 129 3.233 -0.793 -7.291 1.00 0.27 C ATOM 2006 O GLU A 129 3.390 -0.761 -6.052 1.00 0.25 O ATOM 2007 CB GLU A 129 1.459 0.941 -7.890 1.00 0.43 C ATOM 2008 CG GLU A 129 0.370 1.357 -8.901 1.00 0.91 C ATOM 2009 CD GLU A 129 0.888 1.438 -10.329 1.00 0.76 C ATOM 2010 OE1 GLU A 129 1.527 2.455 -10.674 1.00 1.56 O ATOM 2011 OE2 GLU A 129 0.655 0.483 -11.101 1.00 1.12 O ATOM 0 H GLU A 129 0.671 -1.185 -6.310 1.00 0.25 H new ATOM 0 HA GLU A 129 1.907 -0.845 -8.986 1.00 0.30 H new ATOM 0 HB2 GLU A 129 1.114 1.181 -6.885 1.00 0.43 H new ATOM 0 HB3 GLU A 129 2.352 1.539 -8.072 1.00 0.43 H new ATOM 0 HG2 GLU A 129 -0.451 0.642 -8.858 1.00 0.91 H new ATOM 0 HG3 GLU A 129 -0.036 2.326 -8.612 1.00 0.91 H new ATOM 2018 N ILE A 130 4.229 -1.041 -8.175 1.00 0.28 N ATOM 2019 CA ILE A 130 5.639 -1.336 -7.797 1.00 0.28 C ATOM 2020 C ILE A 130 6.556 -0.118 -8.105 1.00 0.29 C ATOM 2021 O ILE A 130 6.798 0.219 -9.270 1.00 0.39 O ATOM 2022 CB ILE A 130 6.202 -2.630 -8.545 1.00 0.31 C ATOM 2023 CG1 ILE A 130 5.065 -3.530 -9.130 1.00 0.37 C ATOM 2024 CG2 ILE A 130 7.106 -3.499 -7.616 1.00 0.37 C ATOM 2025 CD1 ILE A 130 4.761 -3.317 -10.615 1.00 0.45 C ATOM 0 H ILE A 130 4.078 -1.043 -9.184 1.00 0.28 H new ATOM 0 HA ILE A 130 5.644 -1.535 -6.725 1.00 0.28 H new ATOM 0 HB ILE A 130 6.801 -2.244 -9.370 1.00 0.31 H new ATOM 0 HG12 ILE A 130 5.336 -4.575 -8.978 1.00 0.37 H new ATOM 0 HG13 ILE A 130 4.153 -3.351 -8.560 1.00 0.37 H new ATOM 0 HG21 ILE A 130 7.466 -4.368 -8.167 1.00 0.37 H new ATOM 0 HG22 ILE A 130 7.956 -2.906 -7.278 1.00 0.37 H new ATOM 0 HG23 ILE A 130 6.528 -3.831 -6.753 1.00 0.37 H new ATOM 0 HD11 ILE A 130 3.959 -3.988 -10.922 1.00 0.45 H new ATOM 0 HD12 ILE A 130 4.453 -2.284 -10.779 1.00 0.45 H new ATOM 0 HD13 ILE A 130 5.655 -3.527 -11.203 1.00 0.45 H new ATOM 2037 N ILE A 131 7.061 0.520 -7.028 1.00 0.21 N ATOM 2038 CA ILE A 131 7.926 1.719 -7.130 1.00 0.26 C ATOM 2039 C ILE A 131 9.373 1.414 -6.569 1.00 0.18 C ATOM 2040 O ILE A 131 9.583 1.542 -5.356 1.00 0.18 O ATOM 2041 CB ILE A 131 7.278 2.959 -6.335 1.00 0.34 C ATOM 2042 CG1 ILE A 131 5.706 3.114 -6.583 1.00 0.30 C ATOM 2043 CG2 ILE A 131 8.028 4.334 -6.564 1.00 0.62 C ATOM 2044 CD1 ILE A 131 5.176 3.223 -8.039 1.00 0.84 C ATOM 0 H ILE A 131 6.883 0.223 -6.069 1.00 0.21 H new ATOM 0 HA ILE A 131 8.008 1.985 -8.184 1.00 0.26 H new ATOM 0 HB ILE A 131 7.419 2.701 -5.285 1.00 0.34 H new ATOM 0 HG12 ILE A 131 5.215 2.259 -6.118 1.00 0.30 H new ATOM 0 HG13 ILE A 131 5.375 4.003 -6.046 1.00 0.30 H new ATOM 0 HG21 ILE A 131 7.530 5.119 -5.995 1.00 0.62 H new ATOM 0 HG22 ILE A 131 9.062 4.244 -6.231 1.00 0.62 H new ATOM 0 HG23 ILE A 131 8.009 4.587 -7.624 1.00 0.62 H new ATOM 0 HD11 ILE A 131 4.091 3.322 -8.025 1.00 0.84 H new ATOM 0 HD12 ILE A 131 5.614 4.097 -8.521 1.00 0.84 H new ATOM 0 HD13 ILE A 131 5.451 2.326 -8.594 1.00 0.84 H new ATOM 2056 N PRO A 132 10.387 0.973 -7.414 1.00 0.13 N ATOM 2057 CA PRO A 132 11.803 0.777 -6.946 1.00 0.09 C ATOM 2058 C PRO A 132 12.585 2.110 -6.802 1.00 0.08 C ATOM 2059 O PRO A 132 12.653 2.912 -7.738 1.00 0.16 O ATOM 2060 CB PRO A 132 12.445 -0.092 -8.050 1.00 0.13 C ATOM 2061 CG PRO A 132 11.277 -0.644 -8.814 1.00 0.16 C ATOM 2062 CD PRO A 132 10.247 0.475 -8.802 1.00 0.16 C ATOM 0 HA PRO A 132 11.826 0.324 -5.955 1.00 0.09 H new ATOM 0 HB2 PRO A 132 13.097 0.499 -8.693 1.00 0.13 H new ATOM 0 HB3 PRO A 132 13.055 -0.889 -7.625 1.00 0.13 H new ATOM 0 HG2 PRO A 132 11.560 -0.911 -9.832 1.00 0.16 H new ATOM 0 HG3 PRO A 132 10.887 -1.547 -8.344 1.00 0.16 H new ATOM 0 HD2 PRO A 132 10.467 1.246 -9.541 1.00 0.16 H new ATOM 0 HD3 PRO A 132 9.241 0.112 -9.010 1.00 0.16 H new ATOM 2070 N ILE A 133 13.158 2.311 -5.606 1.00 0.07 N ATOM 2071 CA ILE A 133 13.908 3.534 -5.243 1.00 0.08 C ATOM 2072 C ILE A 133 15.427 3.222 -5.038 1.00 0.08 C ATOM 2073 O ILE A 133 15.808 2.110 -4.656 1.00 0.10 O ATOM 2074 CB ILE A 133 13.281 4.196 -3.927 1.00 0.15 C ATOM 2075 CG1 ILE A 133 11.725 3.971 -3.862 1.00 0.23 C ATOM 2076 CG2 ILE A 133 13.593 5.728 -3.826 1.00 0.30 C ATOM 2077 CD1 ILE A 133 11.145 3.652 -2.476 1.00 0.38 C ATOM 0 H ILE A 133 13.116 1.625 -4.852 1.00 0.07 H new ATOM 0 HA ILE A 133 13.824 4.245 -6.065 1.00 0.08 H new ATOM 0 HB ILE A 133 13.752 3.698 -3.080 1.00 0.15 H new ATOM 0 HG12 ILE A 133 11.233 4.866 -4.242 1.00 0.23 H new ATOM 0 HG13 ILE A 133 11.468 3.155 -4.537 1.00 0.23 H new ATOM 0 HG21 ILE A 133 13.147 6.131 -2.917 1.00 0.30 H new ATOM 0 HG22 ILE A 133 14.672 5.878 -3.798 1.00 0.30 H new ATOM 0 HG23 ILE A 133 13.177 6.242 -4.693 1.00 0.30 H new ATOM 0 HD11 ILE A 133 10.066 3.517 -2.555 1.00 0.38 H new ATOM 0 HD12 ILE A 133 11.598 2.737 -2.094 1.00 0.38 H new ATOM 0 HD13 ILE A 133 11.359 4.475 -1.794 1.00 0.38 H new ATOM 2089 N SER A 134 16.275 4.230 -5.308 1.00 0.10 N ATOM 2090 CA SER A 134 17.726 4.087 -5.140 1.00 0.12 C ATOM 2091 C SER A 134 18.350 5.329 -4.466 1.00 0.13 C ATOM 2092 O SER A 134 18.293 6.448 -4.992 1.00 0.15 O ATOM 2093 CB SER A 134 18.394 3.794 -6.499 1.00 0.15 C ATOM 2094 OG SER A 134 19.649 3.137 -6.347 1.00 1.31 O ATOM 0 H SER A 134 15.979 5.147 -5.642 1.00 0.10 H new ATOM 0 HA SER A 134 17.906 3.242 -4.476 1.00 0.12 H new ATOM 0 HB2 SER A 134 17.731 3.174 -7.102 1.00 0.15 H new ATOM 0 HB3 SER A 134 18.538 4.729 -7.041 1.00 0.15 H new ATOM 0 HG SER A 134 20.039 2.968 -7.230 1.00 1.31 H new ATOM 2100 N ILE A 135 18.940 5.090 -3.279 1.00 0.13 N ATOM 2101 CA ILE A 135 19.632 6.122 -2.479 1.00 0.15 C ATOM 2102 C ILE A 135 21.143 5.727 -2.361 1.00 0.18 C ATOM 2103 O ILE A 135 21.476 4.611 -1.941 1.00 0.18 O ATOM 2104 CB ILE A 135 18.945 6.319 -1.040 1.00 0.16 C ATOM 2105 CG1 ILE A 135 17.406 6.497 -1.162 1.00 0.13 C ATOM 2106 CG2 ILE A 135 19.539 7.515 -0.211 1.00 0.25 C ATOM 2107 CD1 ILE A 135 16.581 5.638 -0.192 1.00 0.15 C ATOM 0 H ILE A 135 18.950 4.168 -2.844 1.00 0.13 H new ATOM 0 HA ILE A 135 19.552 7.087 -2.980 1.00 0.15 H new ATOM 0 HB ILE A 135 19.170 5.402 -0.496 1.00 0.16 H new ATOM 0 HG12 ILE A 135 17.161 7.546 -0.995 1.00 0.13 H new ATOM 0 HG13 ILE A 135 17.106 6.258 -2.182 1.00 0.13 H new ATOM 0 HG21 ILE A 135 19.025 7.584 0.748 1.00 0.25 H new ATOM 0 HG22 ILE A 135 20.602 7.347 -0.041 1.00 0.25 H new ATOM 0 HG23 ILE A 135 19.402 8.444 -0.764 1.00 0.25 H new ATOM 0 HD11 ILE A 135 15.519 5.829 -0.350 1.00 0.15 H new ATOM 0 HD12 ILE A 135 16.791 4.584 -0.371 1.00 0.15 H new ATOM 0 HD13 ILE A 135 16.846 5.891 0.834 1.00 0.15 H new ATOM 2119 N LYS A 136 22.024 6.671 -2.747 1.00 0.20 N ATOM 2120 CA LYS A 136 23.487 6.480 -2.703 1.00 0.23 C ATOM 2121 C LYS A 136 24.187 7.750 -2.212 1.00 0.28 C ATOM 2122 O LYS A 136 23.989 8.843 -2.764 1.00 0.29 O ATOM 2123 CB LYS A 136 24.017 6.078 -4.091 1.00 0.22 C ATOM 2124 CG LYS A 136 23.667 4.628 -4.478 1.00 0.25 C ATOM 2125 CD LYS A 136 23.862 4.343 -5.984 1.00 0.94 C ATOM 2126 CE LYS A 136 23.615 2.869 -6.342 1.00 1.23 C ATOM 2127 NZ LYS A 136 23.733 2.632 -7.806 1.00 2.05 N ATOM 0 H LYS A 136 21.742 7.586 -3.098 1.00 0.20 H new ATOM 0 HA LYS A 136 23.705 5.677 -2.000 1.00 0.23 H new ATOM 0 HB2 LYS A 136 23.607 6.756 -4.840 1.00 0.22 H new ATOM 0 HB3 LYS A 136 25.100 6.201 -4.109 1.00 0.22 H new ATOM 0 HG2 LYS A 136 24.288 3.943 -3.901 1.00 0.25 H new ATOM 0 HG3 LYS A 136 22.631 4.425 -4.206 1.00 0.25 H new ATOM 0 HD2 LYS A 136 23.183 4.972 -6.560 1.00 0.94 H new ATOM 0 HD3 LYS A 136 24.876 4.619 -6.274 1.00 0.94 H new ATOM 0 HE2 LYS A 136 24.331 2.241 -5.813 1.00 1.23 H new ATOM 0 HE3 LYS A 136 22.622 2.574 -6.004 1.00 1.23 H new ATOM 0 HZ1 LYS A 136 23.560 1.627 -8.010 1.00 2.05 H new ATOM 0 HZ2 LYS A 136 23.032 3.213 -8.309 1.00 2.05 H new ATOM 0 HZ3 LYS A 136 24.689 2.890 -8.124 1.00 2.05 H new ATOM 2141 N LYS A 137 24.976 7.597 -1.102 1.00 0.33 N ATOM 2142 CA LYS A 137 25.752 8.707 -0.419 1.00 0.40 C ATOM 2143 C LYS A 137 24.857 9.788 0.282 1.00 0.39 C ATOM 2144 O LYS A 137 25.331 10.877 0.622 1.00 0.42 O ATOM 2145 CB LYS A 137 26.723 9.397 -1.410 1.00 0.44 C ATOM 2146 CG LYS A 137 27.879 8.490 -1.895 1.00 0.99 C ATOM 2147 CD LYS A 137 28.709 9.122 -3.047 1.00 1.59 C ATOM 2148 CE LYS A 137 28.075 8.912 -4.434 1.00 2.70 C ATOM 2149 NZ LYS A 137 28.859 9.594 -5.502 1.00 3.55 N ATOM 0 H LYS A 137 25.098 6.693 -0.645 1.00 0.33 H new ATOM 0 HA LYS A 137 26.313 8.211 0.373 1.00 0.40 H new ATOM 0 HB2 LYS A 137 26.158 9.741 -2.276 1.00 0.44 H new ATOM 0 HB3 LYS A 137 27.145 10.281 -0.933 1.00 0.44 H new ATOM 0 HG2 LYS A 137 28.540 8.274 -1.056 1.00 0.99 H new ATOM 0 HG3 LYS A 137 27.469 7.538 -2.231 1.00 0.99 H new ATOM 0 HD2 LYS A 137 28.820 10.191 -2.863 1.00 1.59 H new ATOM 0 HD3 LYS A 137 29.711 8.692 -3.043 1.00 1.59 H new ATOM 0 HE2 LYS A 137 28.015 7.845 -4.650 1.00 2.70 H new ATOM 0 HE3 LYS A 137 27.054 9.294 -4.430 1.00 2.70 H new ATOM 0 HZ1 LYS A 137 28.404 9.432 -6.423 1.00 3.55 H new ATOM 0 HZ2 LYS A 137 28.895 10.615 -5.308 1.00 3.55 H new ATOM 0 HZ3 LYS A 137 29.826 9.211 -5.521 1.00 3.55 H new ATOM 2163 N GLY A 138 23.564 9.445 0.494 1.00 0.35 N ATOM 2164 CA GLY A 138 22.581 10.350 1.102 1.00 0.36 C ATOM 2165 C GLY A 138 21.680 11.098 0.091 1.00 0.33 C ATOM 2166 O GLY A 138 21.039 12.084 0.466 1.00 0.37 O ATOM 0 H GLY A 138 23.182 8.533 0.246 1.00 0.35 H new ATOM 0 HA2 GLY A 138 21.947 9.775 1.777 1.00 0.36 H new ATOM 0 HA3 GLY A 138 23.110 11.084 1.709 1.00 0.36 H new ATOM 2170 N LYS A 139 21.630 10.634 -1.190 1.00 0.29 N ATOM 2171 CA LYS A 139 20.789 11.281 -2.220 1.00 0.29 C ATOM 2172 C LYS A 139 19.772 10.294 -2.831 1.00 0.26 C ATOM 2173 O LYS A 139 20.085 9.125 -3.062 1.00 0.25 O ATOM 2174 CB LYS A 139 21.641 11.892 -3.341 1.00 0.33 C ATOM 2175 CG LYS A 139 22.898 12.661 -2.868 1.00 0.65 C ATOM 2176 CD LYS A 139 23.776 13.187 -4.037 1.00 0.67 C ATOM 2177 CE LYS A 139 23.202 14.439 -4.727 1.00 1.00 C ATOM 2178 NZ LYS A 139 24.106 14.931 -5.804 1.00 1.56 N ATOM 0 H LYS A 139 22.156 9.826 -1.523 1.00 0.29 H new ATOM 0 HA LYS A 139 20.243 12.078 -1.715 1.00 0.29 H new ATOM 0 HB2 LYS A 139 21.955 11.094 -4.014 1.00 0.33 H new ATOM 0 HB3 LYS A 139 21.016 12.571 -3.922 1.00 0.33 H new ATOM 0 HG2 LYS A 139 22.588 13.503 -2.249 1.00 0.65 H new ATOM 0 HG3 LYS A 139 23.500 12.006 -2.238 1.00 0.65 H new ATOM 0 HD2 LYS A 139 24.772 13.416 -3.657 1.00 0.67 H new ATOM 0 HD3 LYS A 139 23.892 12.396 -4.778 1.00 0.67 H new ATOM 0 HE2 LYS A 139 22.224 14.207 -5.149 1.00 1.00 H new ATOM 0 HE3 LYS A 139 23.052 15.226 -3.988 1.00 1.00 H new ATOM 0 HZ1 LYS A 139 23.690 15.774 -6.248 1.00 1.56 H new ATOM 0 HZ2 LYS A 139 25.031 15.175 -5.396 1.00 1.56 H new ATOM 0 HZ3 LYS A 139 24.229 14.187 -6.521 1.00 1.56 H new ATOM 2192 N LEU A 140 18.575 10.806 -3.173 1.00 0.25 N ATOM 2193 CA LEU A 140 17.468 9.973 -3.688 1.00 0.24 C ATOM 2194 C LEU A 140 17.237 10.059 -5.216 1.00 0.26 C ATOM 2195 O LEU A 140 17.500 11.076 -5.864 1.00 0.34 O ATOM 2196 CB LEU A 140 16.170 10.398 -2.961 1.00 0.24 C ATOM 2197 CG LEU A 140 15.077 9.316 -2.717 1.00 0.22 C ATOM 2198 CD1 LEU A 140 14.551 9.369 -1.292 1.00 0.22 C ATOM 2199 CD2 LEU A 140 13.907 9.475 -3.671 1.00 0.25 C ATOM 0 H LEU A 140 18.347 11.798 -3.102 1.00 0.25 H new ATOM 0 HA LEU A 140 17.745 8.937 -3.492 1.00 0.24 H new ATOM 0 HB2 LEU A 140 16.451 10.812 -1.993 1.00 0.24 H new ATOM 0 HB3 LEU A 140 15.716 11.207 -3.534 1.00 0.24 H new ATOM 0 HG LEU A 140 15.556 8.353 -2.893 1.00 0.22 H new ATOM 0 HD11 LEU A 140 13.790 8.601 -1.156 1.00 0.22 H new ATOM 0 HD12 LEU A 140 15.371 9.195 -0.595 1.00 0.22 H new ATOM 0 HD13 LEU A 140 14.115 10.350 -1.101 1.00 0.22 H new ATOM 0 HD21 LEU A 140 13.166 8.702 -3.469 1.00 0.25 H new ATOM 0 HD22 LEU A 140 13.455 10.457 -3.532 1.00 0.25 H new ATOM 0 HD23 LEU A 140 14.260 9.381 -4.698 1.00 0.25 H new ATOM 2211 N SER A 141 16.725 8.940 -5.753 1.00 0.21 N ATOM 2212 CA SER A 141 16.363 8.808 -7.169 1.00 0.22 C ATOM 2213 C SER A 141 15.032 8.027 -7.287 1.00 0.19 C ATOM 2214 O SER A 141 14.983 6.814 -7.017 1.00 0.16 O ATOM 2215 CB SER A 141 17.479 8.089 -7.947 1.00 0.25 C ATOM 2216 OG SER A 141 17.662 8.659 -9.236 1.00 0.64 O ATOM 0 H SER A 141 16.550 8.095 -5.209 1.00 0.21 H new ATOM 0 HA SER A 141 16.237 9.801 -7.600 1.00 0.22 H new ATOM 0 HB2 SER A 141 18.412 8.147 -7.386 1.00 0.25 H new ATOM 0 HB3 SER A 141 17.232 7.032 -8.046 1.00 0.25 H new ATOM 0 HG SER A 141 18.378 8.183 -9.706 1.00 0.64 H new ATOM 2222 N VAL A 142 13.955 8.745 -7.686 1.00 0.21 N ATOM 2223 CA VAL A 142 12.602 8.154 -7.842 1.00 0.22 C ATOM 2224 C VAL A 142 12.187 8.102 -9.376 1.00 0.25 C ATOM 2225 O VAL A 142 11.697 9.086 -9.939 1.00 0.26 O ATOM 2226 CB VAL A 142 11.521 8.867 -6.828 1.00 0.27 C ATOM 2227 CG1 VAL A 142 11.149 10.347 -7.138 1.00 0.46 C ATOM 2228 CG2 VAL A 142 10.222 8.037 -6.657 1.00 0.41 C ATOM 0 H VAL A 142 13.997 9.740 -7.907 1.00 0.21 H new ATOM 0 HA VAL A 142 12.611 7.111 -7.525 1.00 0.22 H new ATOM 0 HB VAL A 142 12.078 8.891 -5.891 1.00 0.27 H new ATOM 0 HG11 VAL A 142 10.430 10.704 -6.401 1.00 0.46 H new ATOM 0 HG12 VAL A 142 12.047 10.964 -7.097 1.00 0.46 H new ATOM 0 HG13 VAL A 142 10.710 10.411 -8.134 1.00 0.46 H new ATOM 0 HG21 VAL A 142 9.546 8.556 -5.978 1.00 0.41 H new ATOM 0 HG22 VAL A 142 9.739 7.914 -7.626 1.00 0.41 H new ATOM 0 HG23 VAL A 142 10.467 7.057 -6.247 1.00 0.41 H new ATOM 2238 N GLN A 143 12.439 6.921 -10.026 1.00 0.31 N ATOM 2239 CA GLN A 143 12.125 6.635 -11.479 1.00 0.39 C ATOM 2240 C GLN A 143 12.989 7.459 -12.484 1.00 0.41 C ATOM 2241 O GLN A 143 14.019 6.980 -12.966 1.00 0.46 O ATOM 2242 CB GLN A 143 10.607 6.811 -11.783 1.00 0.44 C ATOM 2243 CG GLN A 143 9.678 5.875 -11.002 1.00 0.65 C ATOM 2244 CD GLN A 143 9.740 4.433 -11.478 1.00 0.87 C ATOM 2245 OE1 GLN A 143 8.993 4.027 -12.369 1.00 1.56 O ATOM 2246 NE2 GLN A 143 10.633 3.653 -10.882 1.00 1.12 N ATOM 0 H GLN A 143 12.872 6.127 -9.555 1.00 0.31 H new ATOM 0 HA GLN A 143 12.394 5.590 -11.631 1.00 0.39 H new ATOM 0 HB2 GLN A 143 10.325 7.842 -11.567 1.00 0.44 H new ATOM 0 HB3 GLN A 143 10.445 6.653 -12.849 1.00 0.44 H new ATOM 0 HG2 GLN A 143 9.940 5.913 -9.945 1.00 0.65 H new ATOM 0 HG3 GLN A 143 8.653 6.236 -11.089 1.00 0.65 H new ATOM 0 HE21 GLN A 143 11.232 4.032 -10.148 1.00 1.12 H new ATOM 0 HE22 GLN A 143 10.721 2.675 -11.158 1.00 1.12 H new ATOM 2255 N GLY A 144 12.539 8.698 -12.773 1.00 0.40 N ATOM 2256 CA GLY A 144 13.261 9.614 -13.662 1.00 0.45 C ATOM 2257 C GLY A 144 13.521 10.999 -13.030 1.00 0.42 C ATOM 2258 O GLY A 144 13.689 11.987 -13.748 1.00 0.49 O ATOM 0 H GLY A 144 11.672 9.083 -12.397 1.00 0.40 H new ATOM 0 HA2 GLY A 144 14.214 9.164 -13.940 1.00 0.45 H new ATOM 0 HA3 GLY A 144 12.690 9.743 -14.581 1.00 0.45 H new ATOM 2262 N GLU A 145 13.552 11.053 -11.674 1.00 0.33 N ATOM 2263 CA GLU A 145 13.796 12.287 -10.911 1.00 0.32 C ATOM 2264 C GLU A 145 14.961 12.120 -9.922 1.00 0.27 C ATOM 2265 O GLU A 145 15.182 11.039 -9.361 1.00 0.36 O ATOM 2266 CB GLU A 145 12.528 12.688 -10.137 1.00 0.37 C ATOM 2267 CG GLU A 145 11.491 13.457 -10.962 1.00 0.80 C ATOM 2268 CD GLU A 145 10.215 13.721 -10.186 1.00 1.16 C ATOM 2269 OE1 GLU A 145 10.174 14.716 -9.433 1.00 1.82 O ATOM 2270 OE2 GLU A 145 9.257 12.932 -10.332 1.00 1.53 O ATOM 0 H GLU A 145 13.407 10.234 -11.084 1.00 0.33 H new ATOM 0 HA GLU A 145 14.060 13.068 -11.625 1.00 0.32 H new ATOM 0 HB2 GLU A 145 12.061 11.787 -9.740 1.00 0.37 H new ATOM 0 HB3 GLU A 145 12.818 13.299 -9.283 1.00 0.37 H new ATOM 0 HG2 GLU A 145 11.919 14.406 -11.285 1.00 0.80 H new ATOM 0 HG3 GLU A 145 11.255 12.890 -11.863 1.00 0.80 H new ATOM 2277 N VAL A 146 15.695 13.215 -9.705 1.00 0.30 N ATOM 2278 CA VAL A 146 16.849 13.214 -8.788 1.00 0.27 C ATOM 2279 C VAL A 146 16.750 14.406 -7.754 1.00 0.28 C ATOM 2280 O VAL A 146 16.590 15.576 -8.126 1.00 0.32 O ATOM 2281 CB VAL A 146 18.246 13.092 -9.617 1.00 0.31 C ATOM 2282 CG1 VAL A 146 18.730 14.375 -10.369 1.00 1.02 C ATOM 2283 CG2 VAL A 146 19.406 12.523 -8.757 1.00 0.72 C ATOM 0 H VAL A 146 15.514 14.115 -10.149 1.00 0.30 H new ATOM 0 HA VAL A 146 16.833 12.322 -8.162 1.00 0.27 H new ATOM 0 HB VAL A 146 17.978 12.382 -10.399 1.00 0.31 H new ATOM 0 HG11 VAL A 146 19.669 14.164 -10.881 1.00 1.02 H new ATOM 0 HG12 VAL A 146 17.978 14.674 -11.099 1.00 1.02 H new ATOM 0 HG13 VAL A 146 18.881 15.182 -9.652 1.00 1.02 H new ATOM 0 HG21 VAL A 146 20.312 12.464 -9.361 1.00 0.72 H new ATOM 0 HG22 VAL A 146 19.581 13.178 -7.903 1.00 0.72 H new ATOM 0 HG23 VAL A 146 19.141 11.527 -8.402 1.00 0.72 H new ATOM 2293 N SER A 147 16.833 14.051 -6.462 1.00 0.27 N ATOM 2294 CA SER A 147 16.771 15.014 -5.351 1.00 0.29 C ATOM 2295 C SER A 147 17.610 14.508 -4.164 1.00 0.29 C ATOM 2296 O SER A 147 18.309 13.493 -4.268 1.00 0.30 O ATOM 2297 CB SER A 147 15.314 15.238 -4.910 1.00 0.31 C ATOM 2298 OG SER A 147 14.702 16.280 -5.656 1.00 0.56 O ATOM 0 H SER A 147 16.945 13.084 -6.157 1.00 0.27 H new ATOM 0 HA SER A 147 17.179 15.964 -5.695 1.00 0.29 H new ATOM 0 HB2 SER A 147 14.748 14.316 -5.038 1.00 0.31 H new ATOM 0 HB3 SER A 147 15.287 15.484 -3.848 1.00 0.31 H new ATOM 0 HG SER A 147 15.105 16.324 -6.548 1.00 0.56 H new ATOM 2304 N THR A 148 17.583 15.236 -3.037 1.00 0.30 N ATOM 2305 CA THR A 148 18.346 14.814 -1.835 1.00 0.31 C ATOM 2306 C THR A 148 17.442 14.188 -0.730 1.00 0.27 C ATOM 2307 O THR A 148 16.351 14.694 -0.441 1.00 0.32 O ATOM 2308 CB THR A 148 19.242 15.953 -1.207 1.00 0.44 C ATOM 2309 OG1 THR A 148 18.475 17.140 -0.919 1.00 1.25 O ATOM 2310 CG2 THR A 148 20.443 16.347 -2.100 1.00 0.99 C ATOM 0 H THR A 148 17.056 16.102 -2.925 1.00 0.30 H new ATOM 0 HA THR A 148 19.018 14.044 -2.214 1.00 0.31 H new ATOM 0 HB THR A 148 19.628 15.527 -0.281 1.00 0.44 H new ATOM 0 HG1 THR A 148 19.061 17.822 -0.530 1.00 1.25 H new ATOM 0 HG21 THR A 148 21.017 17.134 -1.611 1.00 0.99 H new ATOM 0 HG22 THR A 148 21.080 15.477 -2.257 1.00 0.99 H new ATOM 0 HG23 THR A 148 20.078 16.708 -3.062 1.00 0.99 H new ATOM 2318 N PHE A 149 17.934 13.087 -0.109 1.00 0.26 N ATOM 2319 CA PHE A 149 17.225 12.378 1.004 1.00 0.24 C ATOM 2320 C PHE A 149 17.552 13.022 2.373 1.00 0.24 C ATOM 2321 O PHE A 149 18.726 13.121 2.757 1.00 0.29 O ATOM 2322 CB PHE A 149 17.626 10.870 1.028 1.00 0.23 C ATOM 2323 CG PHE A 149 17.065 10.063 2.221 1.00 0.22 C ATOM 2324 CD1 PHE A 149 15.688 9.826 2.354 1.00 0.22 C ATOM 2325 CD2 PHE A 149 17.910 9.571 3.226 1.00 0.24 C ATOM 2326 CE1 PHE A 149 15.185 9.132 3.441 1.00 0.24 C ATOM 2327 CE2 PHE A 149 17.401 8.873 4.308 1.00 0.26 C ATOM 2328 CZ PHE A 149 16.040 8.657 4.416 1.00 0.25 C ATOM 0 H PHE A 149 18.827 12.662 -0.358 1.00 0.26 H new ATOM 0 HA PHE A 149 16.153 12.466 0.825 1.00 0.24 H new ATOM 0 HB2 PHE A 149 17.287 10.405 0.103 1.00 0.23 H new ATOM 0 HB3 PHE A 149 18.714 10.799 1.040 1.00 0.23 H new ATOM 0 HD1 PHE A 149 15.010 10.191 1.596 1.00 0.22 H new ATOM 0 HD2 PHE A 149 18.974 9.739 3.155 1.00 0.24 H new ATOM 0 HE1 PHE A 149 14.122 8.962 3.527 1.00 0.24 H new ATOM 0 HE2 PHE A 149 18.069 8.497 5.069 1.00 0.26 H new ATOM 0 HZ PHE A 149 15.645 8.116 5.263 1.00 0.25 H new ATOM 2338 N THR A 150 16.505 13.441 3.101 1.00 0.25 N ATOM 2339 CA THR A 150 16.720 14.068 4.423 1.00 0.30 C ATOM 2340 C THR A 150 15.842 13.423 5.549 1.00 0.40 C ATOM 2341 O THR A 150 14.709 13.842 5.804 1.00 1.15 O ATOM 2342 CB THR A 150 16.635 15.685 4.356 1.00 0.66 C ATOM 2343 OG1 THR A 150 16.872 16.275 5.648 1.00 1.42 O ATOM 2344 CG2 THR A 150 15.312 16.290 3.776 1.00 1.18 C ATOM 0 H THR A 150 15.530 13.363 2.813 1.00 0.25 H new ATOM 0 HA THR A 150 17.747 13.848 4.716 1.00 0.30 H new ATOM 0 HB THR A 150 17.421 15.938 3.644 1.00 0.66 H new ATOM 0 HG1 THR A 150 16.816 17.251 5.577 1.00 1.42 H new ATOM 0 HG21 THR A 150 15.376 17.378 3.783 1.00 1.18 H new ATOM 0 HG22 THR A 150 15.170 15.941 2.753 1.00 1.18 H new ATOM 0 HG23 THR A 150 14.468 15.972 4.388 1.00 1.18 H new ATOM 2352 N GLY A 151 16.427 12.391 6.212 1.00 0.32 N ATOM 2353 CA GLY A 151 15.803 11.687 7.359 1.00 0.18 C ATOM 2354 C GLY A 151 14.673 10.673 7.090 1.00 0.20 C ATOM 2355 O GLY A 151 14.837 9.487 7.383 1.00 0.42 O ATOM 0 H GLY A 151 17.346 12.025 5.964 1.00 0.32 H new ATOM 0 HA2 GLY A 151 16.595 11.162 7.893 1.00 0.18 H new ATOM 0 HA3 GLY A 151 15.410 12.445 8.036 1.00 0.18 H new ATOM 2359 N LYS A 152 13.535 11.140 6.543 1.00 0.16 N ATOM 2360 CA LYS A 152 12.366 10.272 6.326 1.00 0.13 C ATOM 2361 C LYS A 152 11.765 10.358 4.902 1.00 0.13 C ATOM 2362 O LYS A 152 11.914 11.344 4.177 1.00 0.16 O ATOM 2363 CB LYS A 152 11.306 10.608 7.449 1.00 0.22 C ATOM 2364 CG LYS A 152 9.800 10.325 7.140 1.00 0.41 C ATOM 2365 CD LYS A 152 8.934 11.610 7.004 1.00 0.56 C ATOM 2366 CE LYS A 152 9.311 12.486 5.799 1.00 0.69 C ATOM 2367 NZ LYS A 152 8.385 13.642 5.651 1.00 1.10 N ATOM 0 H LYS A 152 13.402 12.107 6.246 1.00 0.16 H new ATOM 0 HA LYS A 152 12.687 9.233 6.401 1.00 0.13 H new ATOM 0 HB2 LYS A 152 11.576 10.045 8.343 1.00 0.22 H new ATOM 0 HB3 LYS A 152 11.404 11.665 7.696 1.00 0.22 H new ATOM 0 HG2 LYS A 152 9.730 9.752 6.216 1.00 0.41 H new ATOM 0 HG3 LYS A 152 9.387 9.702 7.933 1.00 0.41 H new ATOM 0 HD2 LYS A 152 7.886 11.323 6.919 1.00 0.56 H new ATOM 0 HD3 LYS A 152 9.031 12.200 7.915 1.00 0.56 H new ATOM 0 HE2 LYS A 152 10.332 12.850 5.918 1.00 0.69 H new ATOM 0 HE3 LYS A 152 9.291 11.884 4.890 1.00 0.69 H new ATOM 0 HZ1 LYS A 152 8.669 14.211 4.828 1.00 1.10 H new ATOM 0 HZ2 LYS A 152 7.415 13.294 5.513 1.00 1.10 H new ATOM 0 HZ3 LYS A 152 8.423 14.229 6.508 1.00 1.10 H new ATOM 2381 N LEU A 153 11.057 9.262 4.567 1.00 0.12 N ATOM 2382 CA LEU A 153 10.314 9.068 3.293 1.00 0.13 C ATOM 2383 C LEU A 153 8.796 9.245 3.550 1.00 0.13 C ATOM 2384 O LEU A 153 8.297 8.789 4.588 1.00 0.18 O ATOM 2385 CB LEU A 153 10.577 7.643 2.784 1.00 0.15 C ATOM 2386 CG LEU A 153 10.388 7.353 1.273 1.00 0.34 C ATOM 2387 CD1 LEU A 153 11.692 7.506 0.505 1.00 0.43 C ATOM 2388 CD2 LEU A 153 9.842 5.946 1.055 1.00 0.67 C ATOM 0 H LEU A 153 10.980 8.459 5.191 1.00 0.12 H new ATOM 0 HA LEU A 153 10.644 9.798 2.554 1.00 0.13 H new ATOM 0 HB2 LEU A 153 11.602 7.381 3.047 1.00 0.15 H new ATOM 0 HB3 LEU A 153 9.923 6.967 3.336 1.00 0.15 H new ATOM 0 HG LEU A 153 9.673 8.084 0.897 1.00 0.34 H new ATOM 0 HD11 LEU A 153 11.520 7.295 -0.550 1.00 0.43 H new ATOM 0 HD12 LEU A 153 12.062 8.525 0.615 1.00 0.43 H new ATOM 0 HD13 LEU A 153 12.430 6.808 0.899 1.00 0.43 H new ATOM 0 HD21 LEU A 153 9.718 5.765 -0.013 1.00 0.67 H new ATOM 0 HD22 LEU A 153 10.540 5.217 1.468 1.00 0.67 H new ATOM 0 HD23 LEU A 153 8.878 5.848 1.554 1.00 0.67 H new ATOM 2400 N SER A 154 8.041 9.885 2.631 1.00 0.14 N ATOM 2401 CA SER A 154 6.601 10.088 2.904 1.00 0.16 C ATOM 2402 C SER A 154 5.650 9.506 1.841 1.00 0.19 C ATOM 2403 O SER A 154 5.921 9.514 0.652 1.00 0.36 O ATOM 2404 CB SER A 154 6.299 11.596 3.074 1.00 0.21 C ATOM 2405 OG SER A 154 5.103 11.835 3.814 1.00 0.24 O ATOM 0 H SER A 154 8.379 10.252 1.741 1.00 0.14 H new ATOM 0 HA SER A 154 6.408 9.535 3.823 1.00 0.16 H new ATOM 0 HB2 SER A 154 7.137 12.076 3.580 1.00 0.21 H new ATOM 0 HB3 SER A 154 6.212 12.059 2.091 1.00 0.21 H new ATOM 0 HG SER A 154 4.643 12.620 3.448 1.00 0.24 H new ATOM 2411 N VAL A 155 4.510 8.996 2.317 1.00 0.16 N ATOM 2412 CA VAL A 155 3.446 8.471 1.421 1.00 0.19 C ATOM 2413 C VAL A 155 2.164 9.285 1.686 1.00 0.25 C ATOM 2414 O VAL A 155 1.411 8.984 2.613 1.00 0.30 O ATOM 2415 CB VAL A 155 3.095 6.908 1.522 1.00 0.28 C ATOM 2416 CG1 VAL A 155 3.334 6.197 0.171 1.00 0.39 C ATOM 2417 CG2 VAL A 155 3.848 6.120 2.623 1.00 0.74 C ATOM 0 H VAL A 155 4.290 8.931 3.311 1.00 0.16 H new ATOM 0 HA VAL A 155 3.848 8.582 0.414 1.00 0.19 H new ATOM 0 HB VAL A 155 2.041 6.902 1.800 1.00 0.28 H new ATOM 0 HG11 VAL A 155 3.088 5.139 0.268 1.00 0.39 H new ATOM 0 HG12 VAL A 155 2.702 6.648 -0.594 1.00 0.39 H new ATOM 0 HG13 VAL A 155 4.381 6.302 -0.115 1.00 0.39 H new ATOM 0 HG21 VAL A 155 3.535 5.076 2.602 1.00 0.74 H new ATOM 0 HG22 VAL A 155 4.922 6.181 2.444 1.00 0.74 H new ATOM 0 HG23 VAL A 155 3.618 6.548 3.599 1.00 0.74 H new ATOM 2427 N GLU A 156 1.929 10.307 0.849 1.00 0.28 N ATOM 2428 CA GLU A 156 0.771 11.192 1.019 1.00 0.36 C ATOM 2429 C GLU A 156 -0.169 11.158 -0.176 1.00 0.34 C ATOM 2430 O GLU A 156 0.236 11.426 -1.316 1.00 0.38 O ATOM 2431 CB GLU A 156 1.237 12.642 1.257 1.00 0.53 C ATOM 2432 CG GLU A 156 1.744 12.930 2.674 1.00 0.73 C ATOM 2433 CD GLU A 156 2.335 14.320 2.806 1.00 1.26 C ATOM 2434 OE1 GLU A 156 3.533 14.489 2.493 1.00 1.66 O ATOM 2435 OE2 GLU A 156 1.601 15.242 3.223 1.00 1.67 O ATOM 0 H GLU A 156 2.523 10.539 0.053 1.00 0.28 H new ATOM 0 HA GLU A 156 0.222 10.826 1.886 1.00 0.36 H new ATOM 0 HB2 GLU A 156 2.031 12.874 0.548 1.00 0.53 H new ATOM 0 HB3 GLU A 156 0.408 13.315 1.039 1.00 0.53 H new ATOM 0 HG2 GLU A 156 0.921 12.820 3.381 1.00 0.73 H new ATOM 0 HG3 GLU A 156 2.498 12.191 2.944 1.00 0.73 H new ATOM 2442 N PHE A 157 -1.442 10.831 0.100 1.00 0.35 N ATOM 2443 CA PHE A 157 -2.453 10.799 -0.956 1.00 0.40 C ATOM 2444 C PHE A 157 -3.534 11.872 -0.732 1.00 0.41 C ATOM 2445 O PHE A 157 -4.104 12.028 0.375 1.00 0.43 O ATOM 2446 CB PHE A 157 -3.044 9.380 -1.179 1.00 0.51 C ATOM 2447 CG PHE A 157 -3.602 8.682 0.057 1.00 0.60 C ATOM 2448 CD1 PHE A 157 -4.918 8.897 0.472 1.00 1.03 C ATOM 2449 CD2 PHE A 157 -2.802 7.835 0.821 1.00 0.99 C ATOM 2450 CE1 PHE A 157 -5.410 8.288 1.612 1.00 1.60 C ATOM 2451 CE2 PHE A 157 -3.297 7.223 1.957 1.00 1.55 C ATOM 2452 CZ PHE A 157 -4.642 7.356 2.282 1.00 1.80 C ATOM 0 H PHE A 157 -1.786 10.590 1.029 1.00 0.35 H new ATOM 0 HA PHE A 157 -1.949 11.050 -1.889 1.00 0.40 H new ATOM 0 HB2 PHE A 157 -3.840 9.453 -1.920 1.00 0.51 H new ATOM 0 HB3 PHE A 157 -2.266 8.748 -1.608 1.00 0.51 H new ATOM 0 HD1 PHE A 157 -5.560 9.547 -0.105 1.00 1.03 H new ATOM 0 HD2 PHE A 157 -1.780 7.654 0.521 1.00 0.99 H new ATOM 0 HE1 PHE A 157 -6.394 8.541 1.978 1.00 1.60 H new ATOM 0 HE2 PHE A 157 -2.641 6.644 2.590 1.00 1.55 H new ATOM 0 HZ PHE A 157 -5.082 6.737 3.050 1.00 1.80 H new ATOM 2462 N VAL A 158 -3.771 12.610 -1.834 1.00 0.43 N ATOM 2463 CA VAL A 158 -4.721 13.758 -1.890 1.00 0.46 C ATOM 2464 C VAL A 158 -6.044 13.352 -2.623 1.00 0.48 C ATOM 2465 O VAL A 158 -6.045 12.582 -3.598 1.00 0.47 O ATOM 2466 CB VAL A 158 -4.110 15.099 -2.572 1.00 0.50 C ATOM 2467 CG1 VAL A 158 -4.691 16.397 -1.951 1.00 0.58 C ATOM 2468 CG2 VAL A 158 -2.564 15.228 -2.502 1.00 0.58 C ATOM 0 H VAL A 158 -3.307 12.431 -2.725 1.00 0.43 H new ATOM 0 HA VAL A 158 -4.927 14.007 -0.849 1.00 0.46 H new ATOM 0 HB VAL A 158 -4.405 14.986 -3.615 1.00 0.50 H new ATOM 0 HG11 VAL A 158 -4.250 17.264 -2.442 1.00 0.58 H new ATOM 0 HG12 VAL A 158 -5.772 16.413 -2.088 1.00 0.58 H new ATOM 0 HG13 VAL A 158 -4.459 16.426 -0.886 1.00 0.58 H new ATOM 0 HG21 VAL A 158 -2.254 16.155 -2.984 1.00 0.58 H new ATOM 0 HG22 VAL A 158 -2.246 15.237 -1.459 1.00 0.58 H new ATOM 0 HG23 VAL A 158 -2.105 14.382 -3.014 1.00 0.58 H new ATOM 2478 N LYS A 159 -7.152 13.937 -2.120 1.00 0.52 N ATOM 2479 CA LYS A 159 -8.536 13.711 -2.610 1.00 0.56 C ATOM 2480 C LYS A 159 -8.939 14.594 -3.825 1.00 0.66 C ATOM 2481 O LYS A 159 -8.463 15.725 -3.985 1.00 0.81 O ATOM 2482 CB LYS A 159 -9.535 13.947 -1.441 1.00 0.72 C ATOM 2483 CG LYS A 159 -9.417 15.336 -0.740 1.00 1.06 C ATOM 2484 CD LYS A 159 -10.349 16.413 -1.351 1.00 1.48 C ATOM 2485 CE LYS A 159 -10.106 17.811 -0.755 1.00 1.63 C ATOM 2486 NZ LYS A 159 -11.055 18.817 -1.308 1.00 2.18 N ATOM 0 H LYS A 159 -7.112 14.596 -1.343 1.00 0.52 H new ATOM 0 HA LYS A 159 -8.572 12.681 -2.965 1.00 0.56 H new ATOM 0 HB2 LYS A 159 -10.550 13.835 -1.823 1.00 0.72 H new ATOM 0 HB3 LYS A 159 -9.387 13.167 -0.694 1.00 0.72 H new ATOM 0 HG2 LYS A 159 -9.650 15.222 0.319 1.00 1.06 H new ATOM 0 HG3 LYS A 159 -8.385 15.681 -0.803 1.00 1.06 H new ATOM 0 HD2 LYS A 159 -10.197 16.450 -2.430 1.00 1.48 H new ATOM 0 HD3 LYS A 159 -11.387 16.126 -1.185 1.00 1.48 H new ATOM 0 HE2 LYS A 159 -10.212 17.768 0.329 1.00 1.63 H new ATOM 0 HE3 LYS A 159 -9.083 18.123 -0.963 1.00 1.63 H new ATOM 0 HZ1 LYS A 159 -10.862 19.747 -0.884 1.00 2.18 H new ATOM 0 HZ2 LYS A 159 -10.937 18.876 -2.340 1.00 2.18 H new ATOM 0 HZ3 LYS A 159 -12.031 18.532 -1.087 1.00 2.18 H new ATOM 2500 N GLY A 160 -9.842 14.045 -4.661 1.00 0.74 N ATOM 2501 CA GLY A 160 -10.342 14.753 -5.853 1.00 0.93 C ATOM 2502 C GLY A 160 -11.732 15.391 -5.666 1.00 0.96 C ATOM 2503 O GLY A 160 -11.888 16.596 -5.879 1.00 1.02 O ATOM 0 H GLY A 160 -10.239 13.114 -4.532 1.00 0.74 H new ATOM 0 HA2 GLY A 160 -9.630 15.532 -6.126 1.00 0.93 H new ATOM 0 HA3 GLY A 160 -10.384 14.053 -6.688 1.00 0.93 H new ATOM 2507 N TYR A 161 -12.733 14.576 -5.271 1.00 0.96 N ATOM 2508 CA TYR A 161 -14.113 15.067 -5.045 1.00 1.02 C ATOM 2509 C TYR A 161 -14.646 14.646 -3.650 1.00 1.05 C ATOM 2510 O TYR A 161 -14.536 15.412 -2.689 1.00 1.11 O ATOM 2511 CB TYR A 161 -15.060 14.575 -6.167 1.00 1.14 C ATOM 2512 CG TYR A 161 -14.757 15.160 -7.555 1.00 1.34 C ATOM 2513 CD1 TYR A 161 -15.203 16.437 -7.925 1.00 1.81 C ATOM 2514 CD2 TYR A 161 -14.025 14.432 -8.499 1.00 1.63 C ATOM 2515 CE1 TYR A 161 -14.926 16.957 -9.180 1.00 2.26 C ATOM 2516 CE2 TYR A 161 -13.750 14.955 -9.753 1.00 2.07 C ATOM 2517 CZ TYR A 161 -14.213 16.238 -10.076 1.00 2.29 C ATOM 2518 OH TYR A 161 -13.927 16.732 -11.330 1.00 2.86 O ATOM 0 H TYR A 161 -12.614 13.577 -5.102 1.00 0.96 H new ATOM 0 HA TYR A 161 -14.085 16.156 -5.071 1.00 1.02 H new ATOM 0 HB2 TYR A 161 -15.002 13.488 -6.224 1.00 1.14 H new ATOM 0 HB3 TYR A 161 -16.086 14.826 -5.896 1.00 1.14 H new ATOM 0 HD1 TYR A 161 -15.772 17.025 -7.220 1.00 1.81 H new ATOM 0 HD2 TYR A 161 -13.668 13.445 -8.246 1.00 1.63 H new ATOM 0 HE1 TYR A 161 -15.282 17.942 -9.443 1.00 2.26 H new ATOM 0 HE2 TYR A 161 -13.186 14.381 -10.473 1.00 2.07 H new ATOM 0 HH TYR A 161 -13.404 16.071 -11.831 1.00 2.86 H new ATOM 2528 N TYR A 162 -15.222 13.427 -3.555 1.00 1.09 N ATOM 2529 CA TYR A 162 -15.764 12.878 -2.291 1.00 1.17 C ATOM 2530 C TYR A 162 -15.295 11.427 -2.111 1.00 1.10 C ATOM 2531 O TYR A 162 -15.573 10.575 -2.965 1.00 1.71 O ATOM 2532 CB TYR A 162 -17.305 12.933 -2.283 1.00 1.54 C ATOM 2533 CG TYR A 162 -17.889 14.334 -2.042 1.00 1.88 C ATOM 2534 CD1 TYR A 162 -18.031 14.839 -0.745 1.00 2.00 C ATOM 2535 CD2 TYR A 162 -18.295 15.151 -3.105 1.00 2.57 C ATOM 2536 CE1 TYR A 162 -18.556 16.103 -0.521 1.00 2.64 C ATOM 2537 CE2 TYR A 162 -18.820 16.414 -2.878 1.00 3.18 C ATOM 2538 CZ TYR A 162 -18.946 16.881 -1.588 1.00 3.16 C ATOM 2539 OH TYR A 162 -19.466 18.135 -1.365 1.00 3.91 O ATOM 0 H TYR A 162 -15.324 12.797 -4.350 1.00 1.09 H new ATOM 0 HA TYR A 162 -15.394 13.486 -1.466 1.00 1.17 H new ATOM 0 HB2 TYR A 162 -17.675 12.558 -3.237 1.00 1.54 H new ATOM 0 HB3 TYR A 162 -17.676 12.260 -1.510 1.00 1.54 H new ATOM 0 HD1 TYR A 162 -17.727 14.234 0.096 1.00 2.00 H new ATOM 0 HD2 TYR A 162 -18.197 14.791 -4.119 1.00 2.57 H new ATOM 0 HE1 TYR A 162 -18.659 16.476 0.487 1.00 2.64 H new ATOM 0 HE2 TYR A 162 -19.129 17.030 -3.710 1.00 3.18 H new ATOM 0 HH TYR A 162 -19.690 18.553 -2.222 1.00 3.91 H new ATOM 2549 N ASP A 163 -14.562 11.155 -0.982 1.00 1.04 N ATOM 2550 CA ASP A 163 -13.962 9.805 -0.643 1.00 0.99 C ATOM 2551 C ASP A 163 -12.566 9.647 -1.259 1.00 1.06 C ATOM 2552 O ASP A 163 -12.329 9.981 -2.424 1.00 1.74 O ATOM 2553 CB ASP A 163 -14.855 8.605 -1.054 1.00 1.11 C ATOM 2554 CG ASP A 163 -15.821 8.175 0.043 1.00 1.19 C ATOM 2555 OD1 ASP A 163 -16.940 8.729 0.100 1.00 1.34 O ATOM 2556 OD2 ASP A 163 -15.457 7.285 0.839 1.00 1.27 O ATOM 0 H ASP A 163 -14.367 11.864 -0.275 1.00 1.04 H new ATOM 0 HA ASP A 163 -13.887 9.788 0.444 1.00 0.99 H new ATOM 0 HB2 ASP A 163 -15.423 8.871 -1.946 1.00 1.11 H new ATOM 0 HB3 ASP A 163 -14.219 7.761 -1.321 1.00 1.11 H new ATOM 2561 N ASN A 164 -11.655 9.107 -0.443 1.00 0.83 N ATOM 2562 CA ASN A 164 -10.247 8.845 -0.827 1.00 0.83 C ATOM 2563 C ASN A 164 -10.115 7.421 -1.498 1.00 1.01 C ATOM 2564 O ASN A 164 -11.154 6.839 -1.854 1.00 1.68 O ATOM 2565 CB ASN A 164 -9.420 9.010 0.470 1.00 1.02 C ATOM 2566 CG ASN A 164 -8.400 10.149 0.397 1.00 0.88 C ATOM 2567 OD1 ASN A 164 -7.706 10.319 -0.606 1.00 1.57 O ATOM 2568 ND2 ASN A 164 -8.322 10.954 1.456 1.00 0.82 N ATOM 0 H ASN A 164 -11.868 8.833 0.516 1.00 0.83 H new ATOM 0 HA ASN A 164 -9.875 9.538 -1.581 1.00 0.83 H new ATOM 0 HB2 ASN A 164 -10.098 9.191 1.304 1.00 1.02 H new ATOM 0 HB3 ASN A 164 -8.898 8.077 0.681 1.00 1.02 H new ATOM 0 HD21 ASN A 164 -7.672 11.740 1.452 1.00 0.82 H new ATOM 0 HD22 ASN A 164 -8.912 10.784 2.270 1.00 0.82 H new ATOM 2575 N PRO A 165 -8.884 6.810 -1.748 1.00 0.87 N ATOM 2576 CA PRO A 165 -8.765 5.421 -2.360 1.00 1.06 C ATOM 2577 C PRO A 165 -9.429 4.270 -1.549 1.00 0.93 C ATOM 2578 O PRO A 165 -9.642 3.174 -2.071 1.00 1.76 O ATOM 2579 CB PRO A 165 -7.249 5.201 -2.438 1.00 1.45 C ATOM 2580 CG PRO A 165 -6.693 6.590 -2.550 1.00 2.06 C ATOM 2581 CD PRO A 165 -7.536 7.412 -1.595 1.00 1.41 C ATOM 0 HA PRO A 165 -9.293 5.389 -3.313 1.00 1.06 H new ATOM 0 HB2 PRO A 165 -6.873 4.689 -1.552 1.00 1.45 H new ATOM 0 HB3 PRO A 165 -6.977 4.590 -3.299 1.00 1.45 H new ATOM 0 HG2 PRO A 165 -5.639 6.619 -2.275 1.00 2.06 H new ATOM 0 HG3 PRO A 165 -6.767 6.967 -3.570 1.00 2.06 H new ATOM 0 HD2 PRO A 165 -7.174 7.339 -0.570 1.00 1.41 H new ATOM 0 HD3 PRO A 165 -7.532 8.469 -1.859 1.00 1.41 H new ATOM 2589 N LYS A 166 -9.741 4.575 -0.253 1.00 0.54 N ATOM 2590 CA LYS A 166 -10.451 3.691 0.721 1.00 0.47 C ATOM 2591 C LYS A 166 -9.540 2.606 1.386 1.00 0.42 C ATOM 2592 O LYS A 166 -9.323 2.656 2.599 1.00 0.47 O ATOM 2593 CB LYS A 166 -11.734 3.086 0.083 1.00 0.82 C ATOM 2594 CG LYS A 166 -12.776 2.544 1.089 1.00 1.30 C ATOM 2595 CD LYS A 166 -14.028 1.969 0.387 1.00 1.83 C ATOM 2596 CE LYS A 166 -15.057 1.409 1.383 1.00 2.33 C ATOM 2597 NZ LYS A 166 -16.268 0.896 0.692 1.00 3.00 N ATOM 0 H LYS A 166 -9.495 5.477 0.156 1.00 0.54 H new ATOM 0 HA LYS A 166 -10.753 4.330 1.550 1.00 0.47 H new ATOM 0 HB2 LYS A 166 -12.210 3.850 -0.532 1.00 0.82 H new ATOM 0 HB3 LYS A 166 -11.441 2.276 -0.585 1.00 0.82 H new ATOM 0 HG2 LYS A 166 -12.317 1.768 1.701 1.00 1.30 H new ATOM 0 HG3 LYS A 166 -13.077 3.345 1.764 1.00 1.30 H new ATOM 0 HD2 LYS A 166 -14.495 2.750 -0.212 1.00 1.83 H new ATOM 0 HD3 LYS A 166 -13.725 1.179 -0.300 1.00 1.83 H new ATOM 0 HE2 LYS A 166 -14.602 0.607 1.964 1.00 2.33 H new ATOM 0 HE3 LYS A 166 -15.343 2.190 2.088 1.00 2.33 H new ATOM 0 HZ1 LYS A 166 -17.119 1.267 1.161 1.00 3.00 H new ATOM 0 HZ2 LYS A 166 -16.258 1.204 -0.301 1.00 3.00 H new ATOM 0 HZ3 LYS A 166 -16.276 -0.143 0.732 1.00 3.00 H new ATOM 2611 N VAL A 167 -9.009 1.635 0.587 1.00 0.39 N ATOM 2612 CA VAL A 167 -8.113 0.556 1.124 1.00 0.38 C ATOM 2613 C VAL A 167 -6.636 0.825 0.682 1.00 0.34 C ATOM 2614 O VAL A 167 -6.348 0.997 -0.515 1.00 0.33 O ATOM 2615 CB VAL A 167 -8.588 -0.933 0.676 1.00 0.45 C ATOM 2616 CG1 VAL A 167 -7.765 -2.091 1.315 1.00 0.80 C ATOM 2617 CG2 VAL A 167 -10.073 -1.232 0.999 1.00 0.58 C ATOM 0 H VAL A 167 -9.180 1.573 -0.417 1.00 0.39 H new ATOM 0 HA VAL A 167 -8.178 0.586 2.212 1.00 0.38 H new ATOM 0 HB VAL A 167 -8.421 -0.908 -0.401 1.00 0.45 H new ATOM 0 HG11 VAL A 167 -8.149 -3.048 0.962 1.00 0.80 H new ATOM 0 HG12 VAL A 167 -6.717 -1.993 1.030 1.00 0.80 H new ATOM 0 HG13 VAL A 167 -7.852 -2.043 2.400 1.00 0.80 H new ATOM 0 HG21 VAL A 167 -10.320 -2.242 0.673 1.00 0.58 H new ATOM 0 HG22 VAL A 167 -10.236 -1.148 2.073 1.00 0.58 H new ATOM 0 HG23 VAL A 167 -10.710 -0.517 0.478 1.00 0.58 H new ATOM 2627 N CYS A 168 -5.724 0.727 1.683 1.00 0.35 N ATOM 2628 CA CYS A 168 -4.279 0.943 1.485 1.00 0.35 C ATOM 2629 C CYS A 168 -3.450 -0.141 2.214 1.00 0.36 C ATOM 2630 O CYS A 168 -3.510 -0.276 3.439 1.00 0.48 O ATOM 2631 CB CYS A 168 -3.902 2.332 1.994 1.00 0.37 C ATOM 2632 SG CYS A 168 -2.412 3.029 1.241 1.00 0.87 S ATOM 0 H CYS A 168 -5.975 0.497 2.644 1.00 0.35 H new ATOM 0 HA CYS A 168 -4.055 0.872 0.421 1.00 0.35 H new ATOM 0 HB2 CYS A 168 -4.736 3.010 1.813 1.00 0.37 H new ATOM 0 HB3 CYS A 168 -3.759 2.283 3.073 1.00 0.37 H new ATOM 0 HG CYS A 168 -2.676 3.407 0.026 1.00 0.87 H new ATOM 2638 N ALA A 169 -2.644 -0.882 1.420 1.00 0.29 N ATOM 2639 CA ALA A 169 -1.813 -2.036 1.879 1.00 0.29 C ATOM 2640 C ALA A 169 -0.259 -1.857 1.775 1.00 0.25 C ATOM 2641 O ALA A 169 0.435 -2.630 1.071 1.00 0.26 O ATOM 2642 CB ALA A 169 -2.285 -3.374 1.297 1.00 0.34 C ATOM 0 H ALA A 169 -2.546 -0.697 0.422 1.00 0.29 H new ATOM 0 HA ALA A 169 -1.995 -2.056 2.954 1.00 0.29 H new ATOM 0 HB1 ALA A 169 -1.645 -4.176 1.664 1.00 0.34 H new ATOM 0 HB2 ALA A 169 -3.314 -3.561 1.604 1.00 0.34 H new ATOM 0 HB3 ALA A 169 -2.232 -3.337 0.209 1.00 0.34 H new ATOM 2648 N LEU A 170 0.261 -0.705 2.289 1.00 0.22 N ATOM 2649 CA LEU A 170 1.730 -0.343 2.330 1.00 0.21 C ATOM 2650 C LEU A 170 2.705 -1.485 2.743 1.00 0.19 C ATOM 2651 O LEU A 170 2.474 -2.204 3.718 1.00 0.34 O ATOM 2652 CB LEU A 170 1.936 0.790 3.354 1.00 0.31 C ATOM 2653 CG LEU A 170 2.355 2.206 2.836 1.00 0.38 C ATOM 2654 CD1 LEU A 170 3.605 2.176 1.935 1.00 0.50 C ATOM 2655 CD2 LEU A 170 1.198 2.900 2.108 1.00 0.70 C ATOM 0 H LEU A 170 -0.331 0.019 2.697 1.00 0.22 H new ATOM 0 HA LEU A 170 1.970 -0.073 1.302 1.00 0.21 H new ATOM 0 HB2 LEU A 170 1.006 0.904 3.912 1.00 0.31 H new ATOM 0 HB3 LEU A 170 2.695 0.460 4.063 1.00 0.31 H new ATOM 0 HG LEU A 170 2.613 2.782 3.725 1.00 0.38 H new ATOM 0 HD11 LEU A 170 3.843 3.189 1.609 1.00 0.50 H new ATOM 0 HD12 LEU A 170 4.447 1.767 2.494 1.00 0.50 H new ATOM 0 HD13 LEU A 170 3.410 1.551 1.064 1.00 0.50 H new ATOM 0 HD21 LEU A 170 1.523 3.881 1.761 1.00 0.70 H new ATOM 0 HD22 LEU A 170 0.891 2.296 1.254 1.00 0.70 H new ATOM 0 HD23 LEU A 170 0.356 3.017 2.791 1.00 0.70 H new ATOM 2667 N PHE A 171 3.773 -1.635 1.960 1.00 0.16 N ATOM 2668 CA PHE A 171 4.780 -2.668 2.194 1.00 0.14 C ATOM 2669 C PHE A 171 6.164 -2.200 1.689 1.00 0.14 C ATOM 2670 O PHE A 171 6.434 -2.261 0.485 1.00 0.19 O ATOM 2671 CB PHE A 171 4.315 -3.973 1.467 1.00 0.17 C ATOM 2672 CG PHE A 171 5.327 -5.121 1.352 1.00 0.16 C ATOM 2673 CD1 PHE A 171 6.277 -5.361 2.346 1.00 0.15 C ATOM 2674 CD2 PHE A 171 5.322 -5.961 0.234 1.00 0.20 C ATOM 2675 CE1 PHE A 171 7.182 -6.388 2.225 1.00 0.15 C ATOM 2676 CE2 PHE A 171 6.232 -6.995 0.119 1.00 0.21 C ATOM 2677 CZ PHE A 171 7.162 -7.205 1.117 1.00 0.17 C ATOM 0 H PHE A 171 3.964 -1.046 1.149 1.00 0.16 H new ATOM 0 HA PHE A 171 4.882 -2.865 3.261 1.00 0.14 H new ATOM 0 HB2 PHE A 171 3.435 -4.352 1.987 1.00 0.17 H new ATOM 0 HB3 PHE A 171 3.998 -3.702 0.460 1.00 0.17 H new ATOM 0 HD1 PHE A 171 6.301 -4.731 3.223 1.00 0.15 H new ATOM 0 HD2 PHE A 171 4.597 -5.800 -0.550 1.00 0.20 H new ATOM 0 HE1 PHE A 171 7.912 -6.555 3.003 1.00 0.15 H new ATOM 0 HE2 PHE A 171 6.215 -7.637 -0.749 1.00 0.21 H new ATOM 0 HZ PHE A 171 7.875 -8.011 1.029 1.00 0.17 H new ATOM 2687 N ILE A 172 7.047 -1.731 2.606 1.00 0.10 N ATOM 2688 CA ILE A 172 8.408 -1.351 2.187 1.00 0.10 C ATOM 2689 C ILE A 172 9.483 -2.358 2.743 1.00 0.08 C ATOM 2690 O ILE A 172 9.636 -2.572 3.981 1.00 0.08 O ATOM 2691 CB ILE A 172 8.820 0.200 2.379 1.00 0.13 C ATOM 2692 CG1 ILE A 172 10.079 0.505 1.432 1.00 0.14 C ATOM 2693 CG2 ILE A 172 9.028 0.629 3.877 1.00 0.22 C ATOM 2694 CD1 ILE A 172 10.563 1.969 1.288 1.00 0.31 C ATOM 0 H ILE A 172 6.848 -1.612 3.599 1.00 0.10 H new ATOM 0 HA ILE A 172 8.387 -1.440 1.101 1.00 0.10 H new ATOM 0 HB ILE A 172 7.984 0.827 2.071 1.00 0.13 H new ATOM 0 HG12 ILE A 172 10.919 -0.086 1.797 1.00 0.14 H new ATOM 0 HG13 ILE A 172 9.840 0.136 0.435 1.00 0.14 H new ATOM 0 HG21 ILE A 172 9.302 1.683 3.919 1.00 0.22 H new ATOM 0 HG22 ILE A 172 8.103 0.472 4.432 1.00 0.22 H new ATOM 0 HG23 ILE A 172 9.823 0.029 4.320 1.00 0.22 H new ATOM 0 HD11 ILE A 172 11.420 2.004 0.615 1.00 0.31 H new ATOM 0 HD12 ILE A 172 9.757 2.580 0.882 1.00 0.31 H new ATOM 0 HD13 ILE A 172 10.853 2.354 2.266 1.00 0.31 H new ATOM 2706 N MET A 173 10.214 -2.941 1.791 1.00 0.09 N ATOM 2707 CA MET A 173 11.277 -3.912 2.083 1.00 0.11 C ATOM 2708 C MET A 173 12.635 -3.461 1.480 1.00 0.13 C ATOM 2709 O MET A 173 12.681 -2.718 0.490 1.00 0.21 O ATOM 2710 CB MET A 173 10.860 -5.336 1.632 1.00 0.15 C ATOM 2711 CG MET A 173 10.240 -5.419 0.218 1.00 0.17 C ATOM 2712 SD MET A 173 11.456 -5.315 -1.114 1.00 0.44 S ATOM 2713 CE MET A 173 12.490 -6.738 -0.783 1.00 0.26 C ATOM 0 H MET A 173 10.088 -2.755 0.796 1.00 0.09 H new ATOM 0 HA MET A 173 11.422 -3.953 3.163 1.00 0.11 H new ATOM 0 HB2 MET A 173 11.737 -5.983 1.666 1.00 0.15 H new ATOM 0 HB3 MET A 173 10.143 -5.733 2.351 1.00 0.15 H new ATOM 0 HG2 MET A 173 9.692 -6.357 0.126 1.00 0.17 H new ATOM 0 HG3 MET A 173 9.515 -4.613 0.101 1.00 0.17 H new ATOM 0 HE1 MET A 173 12.972 -7.060 -1.706 1.00 0.26 H new ATOM 0 HE2 MET A 173 13.252 -6.472 -0.050 1.00 0.26 H new ATOM 0 HE3 MET A 173 11.877 -7.550 -0.391 1.00 0.26 H new ATOM 2723 N LYS A 174 13.742 -3.938 2.076 1.00 0.12 N ATOM 2724 CA LYS A 174 15.078 -3.508 1.716 1.00 0.19 C ATOM 2725 C LYS A 174 15.986 -4.461 0.870 1.00 0.16 C ATOM 2726 O LYS A 174 15.943 -5.692 0.939 1.00 0.17 O ATOM 2727 CB LYS A 174 15.740 -3.226 3.079 1.00 0.38 C ATOM 2728 CG LYS A 174 17.188 -2.758 3.035 1.00 0.54 C ATOM 2729 CD LYS A 174 17.778 -2.562 4.446 1.00 0.57 C ATOM 2730 CE LYS A 174 19.098 -1.812 4.378 1.00 0.49 C ATOM 2731 NZ LYS A 174 20.170 -2.631 3.746 1.00 1.26 N ATOM 0 H LYS A 174 13.721 -4.634 2.821 1.00 0.12 H new ATOM 0 HA LYS A 174 14.976 -2.668 1.028 1.00 0.19 H new ATOM 0 HB2 LYS A 174 15.150 -2.470 3.597 1.00 0.38 H new ATOM 0 HB3 LYS A 174 15.691 -4.135 3.679 1.00 0.38 H new ATOM 0 HG2 LYS A 174 17.788 -3.487 2.490 1.00 0.54 H new ATOM 0 HG3 LYS A 174 17.249 -1.820 2.484 1.00 0.54 H new ATOM 0 HD2 LYS A 174 17.072 -2.010 5.067 1.00 0.57 H new ATOM 0 HD3 LYS A 174 17.929 -3.532 4.920 1.00 0.57 H new ATOM 0 HE2 LYS A 174 18.963 -0.891 3.811 1.00 0.49 H new ATOM 0 HE3 LYS A 174 19.405 -1.526 5.384 1.00 0.49 H new ATOM 0 HZ1 LYS A 174 21.054 -2.084 3.718 1.00 1.26 H new ATOM 0 HZ2 LYS A 174 20.317 -3.498 4.301 1.00 1.26 H new ATOM 0 HZ3 LYS A 174 19.889 -2.883 2.777 1.00 1.26 H new ATOM 2745 N GLY A 175 16.802 -3.747 0.080 1.00 0.14 N ATOM 2746 CA GLY A 175 17.918 -4.249 -0.741 1.00 0.15 C ATOM 2747 C GLY A 175 17.774 -4.369 -2.271 1.00 0.13 C ATOM 2748 O GLY A 175 18.661 -3.816 -2.942 1.00 0.17 O ATOM 0 H GLY A 175 16.694 -2.737 -0.009 1.00 0.14 H new ATOM 0 HA2 GLY A 175 18.774 -3.603 -0.549 1.00 0.15 H new ATOM 0 HA3 GLY A 175 18.174 -5.239 -0.364 1.00 0.15 H new ATOM 2752 N THR A 176 16.622 -4.861 -2.842 1.00 0.11 N ATOM 2753 CA THR A 176 16.459 -5.018 -4.346 1.00 0.10 C ATOM 2754 C THR A 176 15.062 -5.537 -4.761 1.00 0.10 C ATOM 2755 O THR A 176 14.351 -6.182 -3.981 1.00 0.13 O ATOM 2756 CB THR A 176 17.491 -6.002 -5.049 1.00 0.12 C ATOM 2757 OG1 THR A 176 18.075 -6.950 -4.132 1.00 0.15 O ATOM 2758 CG2 THR A 176 18.616 -5.269 -5.819 1.00 0.15 C ATOM 0 H THR A 176 15.806 -5.152 -2.303 1.00 0.11 H new ATOM 0 HA THR A 176 16.635 -3.996 -4.680 1.00 0.10 H new ATOM 0 HB THR A 176 16.887 -6.547 -5.775 1.00 0.12 H new ATOM 0 HG1 THR A 176 18.699 -7.531 -4.615 1.00 0.15 H new ATOM 0 HG21 THR A 176 19.283 -6.002 -6.273 1.00 0.15 H new ATOM 0 HG22 THR A 176 18.177 -4.646 -6.598 1.00 0.15 H new ATOM 0 HG23 THR A 176 19.181 -4.643 -5.129 1.00 0.15 H new ATOM 2766 N ALA A 177 14.693 -5.252 -6.057 1.00 0.10 N ATOM 2767 CA ALA A 177 13.416 -5.702 -6.705 1.00 0.11 C ATOM 2768 C ALA A 177 13.406 -7.221 -7.145 1.00 0.15 C ATOM 2769 O ALA A 177 12.341 -7.785 -7.446 1.00 0.17 O ATOM 2770 CB ALA A 177 13.117 -4.777 -7.908 1.00 0.15 C ATOM 0 H ALA A 177 15.281 -4.700 -6.681 1.00 0.10 H new ATOM 0 HA ALA A 177 12.631 -5.626 -5.952 1.00 0.11 H new ATOM 0 HB1 ALA A 177 12.191 -5.093 -8.389 1.00 0.15 H new ATOM 0 HB2 ALA A 177 13.013 -3.749 -7.560 1.00 0.15 H new ATOM 0 HB3 ALA A 177 13.936 -4.836 -8.625 1.00 0.15 H new ATOM 2776 N ASP A 178 14.600 -7.883 -7.156 1.00 0.19 N ATOM 2777 CA ASP A 178 14.742 -9.331 -7.500 1.00 0.24 C ATOM 2778 C ASP A 178 14.574 -10.299 -6.271 1.00 0.26 C ATOM 2779 O ASP A 178 14.704 -11.518 -6.418 1.00 0.31 O ATOM 2780 CB ASP A 178 16.110 -9.577 -8.159 1.00 0.31 C ATOM 2781 CG ASP A 178 16.048 -9.570 -9.683 1.00 0.42 C ATOM 2782 OD1 ASP A 178 16.196 -8.481 -10.279 1.00 0.51 O ATOM 2783 OD2 ASP A 178 15.853 -10.652 -10.275 1.00 0.55 O ATOM 0 H ASP A 178 15.486 -7.431 -6.928 1.00 0.19 H new ATOM 0 HA ASP A 178 13.929 -9.560 -8.189 1.00 0.24 H new ATOM 0 HB2 ASP A 178 16.810 -8.811 -7.826 1.00 0.31 H new ATOM 0 HB3 ASP A 178 16.502 -10.536 -7.821 1.00 0.31 H new ATOM 2788 N ASP A 179 14.275 -9.733 -5.074 1.00 0.24 N ATOM 2789 CA ASP A 179 14.078 -10.506 -3.817 1.00 0.31 C ATOM 2790 C ASP A 179 12.587 -10.584 -3.357 1.00 0.32 C ATOM 2791 O ASP A 179 12.281 -11.272 -2.381 1.00 0.44 O ATOM 2792 CB ASP A 179 14.916 -9.885 -2.689 1.00 0.37 C ATOM 2793 CG ASP A 179 16.316 -10.483 -2.571 1.00 0.48 C ATOM 2794 OD1 ASP A 179 17.232 -9.993 -3.266 1.00 0.52 O ATOM 2795 OD2 ASP A 179 16.488 -11.438 -1.785 1.00 0.60 O ATOM 0 H ASP A 179 14.163 -8.727 -4.951 1.00 0.24 H new ATOM 0 HA ASP A 179 14.401 -11.525 -4.032 1.00 0.31 H new ATOM 0 HB2 ASP A 179 15.001 -8.812 -2.859 1.00 0.37 H new ATOM 0 HB3 ASP A 179 14.392 -10.017 -1.742 1.00 0.37 H new ATOM 2800 N VAL A 180 11.679 -9.858 -4.062 1.00 0.24 N ATOM 2801 CA VAL A 180 10.201 -9.839 -3.774 1.00 0.29 C ATOM 2802 C VAL A 180 9.423 -10.920 -4.618 1.00 0.50 C ATOM 2803 O VAL A 180 9.043 -10.640 -5.761 1.00 0.95 O ATOM 2804 CB VAL A 180 9.458 -8.424 -4.006 1.00 0.27 C ATOM 2805 CG1 VAL A 180 8.981 -7.818 -2.677 1.00 0.48 C ATOM 2806 CG2 VAL A 180 10.267 -7.337 -4.769 1.00 0.50 C ATOM 0 H VAL A 180 11.942 -9.265 -4.849 1.00 0.24 H new ATOM 0 HA VAL A 180 10.167 -10.057 -2.707 1.00 0.29 H new ATOM 0 HB VAL A 180 8.623 -8.695 -4.652 1.00 0.27 H new ATOM 0 HG11 VAL A 180 8.485 -6.866 -2.868 1.00 0.48 H new ATOM 0 HG12 VAL A 180 8.281 -8.501 -2.196 1.00 0.48 H new ATOM 0 HG13 VAL A 180 9.838 -7.656 -2.023 1.00 0.48 H new ATOM 0 HG21 VAL A 180 9.664 -6.434 -4.863 1.00 0.50 H new ATOM 0 HG22 VAL A 180 11.179 -7.109 -4.218 1.00 0.50 H new ATOM 0 HG23 VAL A 180 10.525 -7.706 -5.762 1.00 0.50 H new ATOM 2816 N PRO A 181 9.183 -12.175 -4.079 1.00 0.59 N ATOM 2817 CA PRO A 181 8.440 -13.238 -4.806 1.00 0.75 C ATOM 2818 C PRO A 181 6.917 -13.262 -4.531 1.00 1.31 C ATOM 2819 O PRO A 181 6.466 -12.896 -3.441 1.00 1.80 O ATOM 2820 CB PRO A 181 9.109 -14.517 -4.279 1.00 1.20 C ATOM 2821 CG PRO A 181 9.473 -14.198 -2.846 1.00 1.57 C ATOM 2822 CD PRO A 181 9.671 -12.682 -2.769 1.00 1.05 C ATOM 0 HA PRO A 181 8.492 -13.096 -5.885 1.00 0.75 H new ATOM 0 HB2 PRO A 181 8.432 -15.370 -4.335 1.00 1.20 H new ATOM 0 HB3 PRO A 181 9.992 -14.772 -4.865 1.00 1.20 H new ATOM 0 HG2 PRO A 181 8.685 -14.520 -2.166 1.00 1.57 H new ATOM 0 HG3 PRO A 181 10.382 -14.722 -2.552 1.00 1.57 H new ATOM 0 HD2 PRO A 181 9.108 -12.250 -1.942 1.00 1.05 H new ATOM 0 HD3 PRO A 181 10.719 -12.426 -2.610 1.00 1.05 H new ATOM 2830 N MET A 182 6.147 -13.696 -5.544 1.00 1.54 N ATOM 2831 CA MET A 182 4.679 -13.774 -5.449 1.00 2.26 C ATOM 2832 C MET A 182 4.151 -15.098 -6.031 1.00 2.40 C ATOM 2833 O MET A 182 4.344 -15.394 -7.219 1.00 2.49 O ATOM 2834 CB MET A 182 4.040 -12.577 -6.189 1.00 2.82 C ATOM 2835 CG MET A 182 2.634 -12.187 -5.695 1.00 3.46 C ATOM 2836 SD MET A 182 2.658 -11.468 -4.039 1.00 4.01 S ATOM 2837 CE MET A 182 0.911 -11.197 -3.746 1.00 4.96 C ATOM 0 H MET A 182 6.520 -14.000 -6.443 1.00 1.54 H new ATOM 0 HA MET A 182 4.404 -13.737 -4.395 1.00 2.26 H new ATOM 0 HB2 MET A 182 4.697 -11.713 -6.089 1.00 2.82 H new ATOM 0 HB3 MET A 182 3.984 -12.813 -7.252 1.00 2.82 H new ATOM 0 HG2 MET A 182 2.193 -11.474 -6.391 1.00 3.46 H new ATOM 0 HG3 MET A 182 1.994 -13.070 -5.695 1.00 3.46 H new ATOM 0 HE1 MET A 182 0.772 -10.756 -2.759 1.00 4.96 H new ATOM 0 HE2 MET A 182 0.515 -10.522 -4.504 1.00 4.96 H new ATOM 0 HE3 MET A 182 0.382 -12.149 -3.796 1.00 4.96 H new ATOM 2847 N LEU A 183 3.471 -15.882 -5.177 1.00 2.65 N ATOM 2848 CA LEU A 183 2.898 -17.185 -5.578 1.00 2.86 C ATOM 2849 C LEU A 183 1.414 -17.329 -5.180 1.00 3.61 C ATOM 2850 O LEU A 183 0.881 -16.582 -4.347 1.00 4.00 O ATOM 2851 CB LEU A 183 3.703 -18.350 -4.946 1.00 2.51 C ATOM 2852 CG LEU A 183 5.155 -18.552 -5.470 1.00 2.24 C ATOM 2853 CD1 LEU A 183 6.063 -19.116 -4.378 1.00 2.43 C ATOM 2854 CD2 LEU A 183 5.194 -19.473 -6.695 1.00 2.58 C ATOM 0 H LEU A 183 3.303 -15.638 -4.201 1.00 2.65 H new ATOM 0 HA LEU A 183 2.962 -17.227 -6.665 1.00 2.86 H new ATOM 0 HB2 LEU A 183 3.748 -18.190 -3.869 1.00 2.51 H new ATOM 0 HB3 LEU A 183 3.150 -19.275 -5.108 1.00 2.51 H new ATOM 0 HG LEU A 183 5.521 -17.569 -5.765 1.00 2.24 H new ATOM 0 HD11 LEU A 183 7.070 -19.246 -4.774 1.00 2.43 H new ATOM 0 HD12 LEU A 183 6.091 -18.425 -3.535 1.00 2.43 H new ATOM 0 HD13 LEU A 183 5.677 -20.079 -4.045 1.00 2.43 H new ATOM 0 HD21 LEU A 183 6.225 -19.589 -7.030 1.00 2.58 H new ATOM 0 HD22 LEU A 183 4.787 -20.449 -6.430 1.00 2.58 H new ATOM 0 HD23 LEU A 183 4.598 -19.037 -7.497 1.00 2.58 H new ATOM 2866 N GLN A 184 0.763 -18.328 -5.797 1.00 3.87 N ATOM 2867 CA GLN A 184 -0.659 -18.658 -5.549 1.00 4.58 C ATOM 2868 C GLN A 184 -0.788 -19.979 -4.721 1.00 4.68 C ATOM 2869 O GLN A 184 0.174 -20.761 -4.675 1.00 4.25 O ATOM 2870 CB GLN A 184 -1.401 -18.777 -6.913 1.00 4.95 C ATOM 2871 CG GLN A 184 -0.759 -19.749 -7.920 1.00 5.32 C ATOM 2872 CD GLN A 184 -1.514 -19.804 -9.234 1.00 5.82 C ATOM 2873 OE1 GLN A 184 -2.420 -20.619 -9.408 1.00 6.06 O ATOM 2874 NE2 GLN A 184 -1.146 -18.932 -10.166 1.00 6.27 N ATOM 0 H GLN A 184 1.206 -18.935 -6.486 1.00 3.87 H new ATOM 0 HA GLN A 184 -1.117 -17.862 -4.962 1.00 4.58 H new ATOM 0 HB2 GLN A 184 -2.426 -19.097 -6.725 1.00 4.95 H new ATOM 0 HB3 GLN A 184 -1.454 -17.788 -7.368 1.00 4.95 H new ATOM 0 HG2 GLN A 184 0.271 -19.445 -8.108 1.00 5.32 H new ATOM 0 HG3 GLN A 184 -0.722 -20.747 -7.484 1.00 5.32 H new ATOM 0 HE21 GLN A 184 -0.389 -18.274 -9.979 1.00 6.27 H new ATOM 0 HE22 GLN A 184 -1.620 -18.920 -11.069 1.00 6.27 H new ATOM 2883 N PRO A 185 -1.967 -20.277 -4.036 1.00 5.36 N ATOM 2884 CA PRO A 185 -2.143 -21.542 -3.234 1.00 5.62 C ATOM 2885 C PRO A 185 -2.160 -22.836 -4.068 1.00 5.52 C ATOM 2886 O PRO A 185 -2.979 -22.995 -4.980 1.00 5.77 O ATOM 2887 CB PRO A 185 -3.527 -21.393 -2.583 1.00 6.42 C ATOM 2888 CG PRO A 185 -3.847 -19.927 -2.665 1.00 6.59 C ATOM 2889 CD PRO A 185 -3.180 -19.424 -3.934 1.00 5.99 C ATOM 0 HA PRO A 185 -1.303 -21.643 -2.547 1.00 5.62 H new ATOM 0 HB2 PRO A 185 -4.274 -21.989 -3.107 1.00 6.42 H new ATOM 0 HB3 PRO A 185 -3.514 -21.736 -1.548 1.00 6.42 H new ATOM 0 HG2 PRO A 185 -4.924 -19.764 -2.699 1.00 6.59 H new ATOM 0 HG3 PRO A 185 -3.472 -19.396 -1.790 1.00 6.59 H new ATOM 0 HD2 PRO A 185 -3.828 -19.539 -4.803 1.00 5.99 H new ATOM 0 HD3 PRO A 185 -2.925 -18.367 -3.864 1.00 5.99 H new ATOM 2897 N HIS A 186 -1.233 -23.740 -3.739 1.00 5.25 N ATOM 2898 CA HIS A 186 -1.119 -25.014 -4.438 1.00 5.19 C ATOM 2899 C HIS A 186 -0.920 -26.196 -3.433 1.00 5.51 C ATOM 2900 O HIS A 186 -0.082 -26.100 -2.527 1.00 5.51 O ATOM 2901 CB HIS A 186 0.045 -24.949 -5.466 1.00 4.55 C ATOM 2902 CG HIS A 186 -0.018 -26.009 -6.549 1.00 4.63 C ATOM 2903 ND1 HIS A 186 -0.004 -27.362 -6.276 1.00 4.77 N ATOM 2904 CD2 HIS A 186 -0.164 -25.910 -7.895 1.00 4.82 C ATOM 2905 CE1 HIS A 186 -0.147 -28.045 -7.387 1.00 4.89 C ATOM 2906 NE2 HIS A 186 -0.242 -27.192 -8.391 1.00 4.96 N ATOM 0 H HIS A 186 -0.552 -23.609 -2.991 1.00 5.25 H new ATOM 0 HA HIS A 186 -2.049 -25.201 -4.975 1.00 5.19 H new ATOM 0 HB2 HIS A 186 0.044 -23.966 -5.936 1.00 4.55 H new ATOM 0 HB3 HIS A 186 0.991 -25.047 -4.933 1.00 4.55 H new ATOM 0 HD1 HIS A 186 0.102 -27.771 -5.347 1.00 4.77 H new ATOM 0 HD2 HIS A 186 -0.210 -24.997 -8.469 1.00 4.82 H new ATOM 0 HE1 HIS A 186 -0.181 -29.121 -7.467 1.00 4.89 H new ATOM 2915 N PRO A 187 -1.677 -27.350 -3.584 1.00 5.90 N ATOM 2916 CA PRO A 187 -1.539 -28.554 -2.691 1.00 6.31 C ATOM 2917 C PRO A 187 -0.415 -29.544 -3.127 1.00 6.06 C ATOM 2918 O PRO A 187 0.537 -29.152 -3.806 1.00 5.96 O ATOM 2919 CB PRO A 187 -2.919 -29.214 -2.882 1.00 6.77 C ATOM 2920 CG PRO A 187 -3.173 -29.016 -4.343 1.00 6.43 C ATOM 2921 CD PRO A 187 -2.792 -27.564 -4.569 1.00 6.09 C ATOM 0 HA PRO A 187 -1.266 -28.285 -1.671 1.00 6.31 H new ATOM 0 HB2 PRO A 187 -2.905 -30.270 -2.612 1.00 6.77 H new ATOM 0 HB3 PRO A 187 -3.685 -28.739 -2.269 1.00 6.77 H new ATOM 0 HG2 PRO A 187 -2.570 -29.690 -4.951 1.00 6.43 H new ATOM 0 HG3 PRO A 187 -4.216 -29.203 -4.599 1.00 6.43 H new ATOM 0 HD2 PRO A 187 -2.465 -27.387 -5.594 1.00 6.09 H new ATOM 0 HD3 PRO A 187 -3.630 -26.893 -4.382 1.00 6.09 H new ATOM 2929 N GLY A 188 -0.546 -30.813 -2.714 1.00 6.19 N ATOM 2930 CA GLY A 188 0.415 -31.828 -3.098 1.00 6.09 C ATOM 2931 C GLY A 188 0.242 -33.135 -2.336 1.00 6.57 C ATOM 2932 O GLY A 188 0.618 -33.231 -1.163 1.00 7.02 O ATOM 0 H GLY A 188 -1.304 -31.148 -2.120 1.00 6.19 H new ATOM 0 HA2 GLY A 188 0.321 -32.022 -4.166 1.00 6.09 H new ATOM 0 HA3 GLY A 188 1.423 -31.448 -2.930 1.00 6.09 H new ATOM 2936 N LEU A 189 -0.324 -34.148 -3.019 1.00 6.77 N ATOM 2937 CA LEU A 189 -0.559 -35.476 -2.419 1.00 7.51 C ATOM 2938 C LEU A 189 0.215 -36.582 -3.159 1.00 7.90 C ATOM 2939 O LEU A 189 -0.112 -36.936 -4.299 1.00 7.97 O ATOM 2940 CB LEU A 189 -2.069 -35.804 -2.420 1.00 7.96 C ATOM 2941 CG LEU A 189 -2.960 -34.974 -1.452 1.00 8.35 C ATOM 2942 CD1 LEU A 189 -4.366 -34.786 -2.020 1.00 8.85 C ATOM 2943 CD2 LEU A 189 -3.051 -35.626 -0.069 1.00 8.99 C ATOM 0 H LEU A 189 -0.628 -34.072 -3.990 1.00 6.77 H new ATOM 0 HA LEU A 189 -0.194 -35.440 -1.392 1.00 7.51 H new ATOM 0 HB2 LEU A 189 -2.447 -35.668 -3.433 1.00 7.96 H new ATOM 0 HB3 LEU A 189 -2.189 -36.859 -2.174 1.00 7.96 H new ATOM 0 HG LEU A 189 -2.485 -33.998 -1.346 1.00 8.35 H new ATOM 0 HD11 LEU A 189 -4.966 -34.202 -1.321 1.00 8.85 H new ATOM 0 HD12 LEU A 189 -4.306 -34.261 -2.973 1.00 8.85 H new ATOM 0 HD13 LEU A 189 -4.831 -35.760 -2.171 1.00 8.85 H new ATOM 0 HD21 LEU A 189 -3.682 -35.018 0.579 1.00 8.99 H new ATOM 0 HD22 LEU A 189 -3.483 -36.622 -0.164 1.00 8.99 H new ATOM 0 HD23 LEU A 189 -2.053 -35.703 0.363 1.00 8.99 H new ATOM 2955 N GLU A 190 1.248 -37.121 -2.487 1.00 8.45 N ATOM 2956 CA GLU A 190 2.092 -38.188 -3.049 1.00 9.15 C ATOM 2957 C GLU A 190 2.320 -39.307 -2.024 1.00 10.12 C ATOM 2958 O GLU A 190 3.253 -39.176 -1.202 1.00 10.56 O ATOM 2959 CB GLU A 190 3.454 -37.622 -3.505 1.00 9.15 C ATOM 2960 CG GLU A 190 3.399 -36.751 -4.768 1.00 8.88 C ATOM 2961 CD GLU A 190 4.746 -36.144 -5.111 1.00 9.20 C ATOM 2962 OE1 GLU A 190 5.569 -36.839 -5.743 1.00 9.27 O ATOM 2963 OE2 GLU A 190 4.977 -34.970 -4.750 1.00 9.58 O ATOM 2964 OXT GLU A 190 1.564 -40.301 -2.056 1.00 10.60 O ATOM 0 H GLU A 190 1.519 -36.832 -1.547 1.00 8.45 H new ATOM 0 HA GLU A 190 1.569 -38.602 -3.911 1.00 9.15 H new ATOM 0 HB2 GLU A 190 3.877 -37.032 -2.692 1.00 9.15 H new ATOM 0 HB3 GLU A 190 4.136 -38.454 -3.684 1.00 9.15 H new ATOM 0 HG2 GLU A 190 3.051 -37.354 -5.607 1.00 8.88 H new ATOM 0 HG3 GLU A 190 2.670 -35.953 -4.625 1.00 8.88 H new TER 2971 GLU A 190 HETATM 2972 C1 GLC A 191 -20.025 5.838 2.933 1.00 1.34 C HETATM 2973 C2 GLC A 191 -18.655 5.782 2.144 1.00 1.55 C HETATM 2974 C3 GLC A 191 -18.267 4.265 1.831 1.00 1.62 C HETATM 2975 C4 GLC A 191 -18.361 3.319 3.114 1.00 1.59 C HETATM 2976 C5 GLC A 191 -19.794 3.465 3.789 1.00 1.39 C HETATM 2977 C6 GLC A 191 -19.967 2.728 5.154 1.00 1.49 C HETATM 2978 O2 GLC A 191 -18.798 6.450 0.888 1.00 1.64 O HETATM 2979 O3 GLC A 191 -16.931 4.236 1.333 1.00 1.88 O HETATM 2980 O4 GLC A 191 -18.121 1.963 2.727 1.00 1.73 O HETATM 2981 O5 GLC A 191 -19.925 4.918 4.097 1.00 1.36 O HETATM 2982 O6 GLC A 191 -20.681 3.442 6.155 1.00 1.50 O HETATM 0 HO6 GLC A 191 -20.695 4.396 5.930 1.00 1.50 H new HETATM 0 HO4 GLC A 191 -18.780 1.693 2.054 1.00 1.73 H new HETATM 0 HO3 GLC A 191 -16.751 5.058 0.831 1.00 1.88 H new HETATM 0 HO2 GLC A 191 -18.160 7.192 0.837 1.00 1.64 H new HETATM 0 H62 GLC A 191 -20.479 1.783 4.973 1.00 1.49 H new HETATM 0 H61 GLC A 191 -18.978 2.485 5.543 1.00 1.49 H new HETATM 0 H5 GLC A 191 -20.526 3.037 3.104 1.00 1.39 H new HETATM 0 H4 GLC A 191 -17.606 3.615 3.842 1.00 1.59 H new HETATM 0 H3 GLC A 191 -18.981 3.886 1.100 1.00 1.62 H new HETATM 0 H2 GLC A 191 -17.887 6.257 2.755 1.00 1.55 H new HETATM 2994 C2 BGC A 192 -24.102 7.855 0.997 1.00 1.56 C HETATM 2995 C3 BGC A 192 -22.710 7.094 0.939 1.00 1.44 C HETATM 2996 C4 BGC A 192 -22.405 6.249 2.266 1.00 1.26 C HETATM 2997 C5 BGC A 192 -23.643 5.274 2.550 1.00 1.30 C HETATM 2998 C6 BGC A 192 -23.558 4.476 3.886 1.00 1.26 C HETATM 2999 C1 BGC A 192 -25.215 6.859 1.452 1.00 1.63 C HETATM 3000 O1 BGC A 192 -26.408 7.520 1.719 1.00 1.86 O HETATM 3001 O2 BGC A 192 -24.425 8.387 -0.289 1.00 1.78 O HETATM 3002 O3 BGC A 192 -21.674 8.055 0.753 1.00 1.54 O HETATM 3003 O4 BGC A 192 -21.149 5.479 2.097 1.00 1.27 O HETATM 3004 O5 BGC A 192 -24.821 6.173 2.700 1.00 1.47 O HETATM 3005 O6 BGC A 192 -24.758 4.408 4.647 1.00 1.46 O HETATM 0 H6C2 BGC A 192 -23.236 3.459 3.660 1.00 1.26 H new HETATM 0 H6C1 BGC A 192 -22.782 4.925 4.506 1.00 1.26 H new HETATM 0 HC BGC A 192 -20.803 7.606 0.774 1.00 1.54 H new HETATM 0 HB BGC A 192 -25.286 8.853 -0.243 1.00 1.78 H new HETATM 0 HA BGC A 192 -27.086 6.871 2.001 1.00 1.86 H new HETATM 0 H6 BGC A 192 -25.394 5.075 4.315 1.00 1.46 H new HETATM 0 H5 BGC A 192 -23.681 4.546 1.739 1.00 1.30 H new HETATM 0 H4 BGC A 192 -22.275 6.918 3.117 1.00 1.26 H new HETATM 0 H3 BGC A 192 -22.756 6.387 0.111 1.00 1.44 H new HETATM 0 H2 BGC A 192 -24.033 8.677 1.709 1.00 1.56 H new HETATM 0 H1 BGC A 192 -25.348 6.148 0.636 1.00 1.63 H new