Browse entries in the PDBbind-CN Database
HEADER 6FEX_COMPLEX COMPND 6FEX_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 35 ARG VAL ASP PHE PRO ARG SER ARG LEU ARG PHE LYS GLU SEQRES 2 A 35 LYS LEU GLY GLU GLY GLN PHE GLY GLU VAL HIS LEU CYS SEQRES 3 A 35 GLU VAL ASP SER PRO GLN ASP LEU VAL SEQRES 1 A 81 PHE PRO LEU ASN VAL ARG LYS GLY HIS PRO LEU LEU VAL SEQRES 2 A 81 ALA VAL LYS ILE LEU ARG PRO ASP ALA THR LYS ASN ALA SEQRES 3 A 81 ARG ASN ASP PHE LEU LYS GLU VAL LYS ILE MET SER ARG SEQRES 4 A 81 LEU LYS ASP PRO ASN ILE ILE ARG LEU LEU GLY VAL CYS SEQRES 5 A 81 VAL GLN ASP ASP PRO LEU CYS MET ILE THR ASP TYR MET SEQRES 6 A 81 GLU ASN GLY ASP LEU ASN GLN PHE LEU SER ALA HIS GLN SEQRES 7 A 81 LEU GLU ASP SEQRES 1 A 173 PRO THR ILE SER TYR PRO MET LEU LEU HIS VAL ALA ALA SEQRES 2 A 173 GLN ILE ALA SER GLY MET ARG TYR LEU ALA THR LEU ASN SEQRES 3 A 173 PHE VAL HIS ARG ASP LEU ALA THR ARG ASN CYS LEU VAL SEQRES 4 A 173 GLY GLU ASN PHE THR ILE LYS ILE ALA ASP PHE GLY MET SEQRES 5 A 173 SER ARG ASN LEU TYR ALA GLY ASP TYR TYR ARG VAL GLN SEQRES 6 A 173 GLY ARG ALA VAL LEU PRO ILE ARG TRP MET ALA TRP GLU SEQRES 7 A 173 CYS ILE LEU MET GLY LYS PHE THR THR ALA SER ASP VAL SEQRES 8 A 173 TRP ALA PHE GLY VAL THR LEU TRP GLU VAL LEU MET LEU SEQRES 9 A 173 CYS ARG ALA GLN PRO PHE GLY GLN LEU THR ASP GLU GLN SEQRES 10 A 173 VAL ILE GLU ASN ALA GLY GLU PHE PHE ARG ASP GLN GLY SEQRES 11 A 173 ARG GLN VAL TYR LEU SER ARG PRO PRO ALA CYS PRO GLN SEQRES 12 A 173 GLY LEU TYR GLU LEU MET LEU ARG CYS TRP SER ARG GLU SEQRES 13 A 173 SER GLU GLN ARG PRO PRO PHE SER GLN LEU HIS ARG PHE SEQRES 14 A 173 LEU ALA GLU ASP HET D A 6Z 56 ATOM 1 N ARG A 602 -11.940 -22.228 -1.089 1.00 56.20 N ATOM 2 CA ARG A 602 -12.881 -22.696 -2.105 1.00 55.54 C ATOM 3 C ARG A 602 -14.332 -22.508 -1.654 1.00 51.19 C ATOM 4 O ARG A 602 -15.251 -23.078 -2.243 1.00 51.07 O ATOM 5 CB ARG A 602 -12.611 -24.167 -2.451 1.00 58.97 C ATOM 6 CG ARG A 602 -12.323 -25.071 -1.249 1.00 62.35 C ATOM 7 CD ARG A 602 -11.399 -26.235 -1.620 1.00 65.90 C ATOM 8 NE ARG A 602 -10.361 -26.434 -0.607 1.00 69.18 N ATOM 9 CZ ARG A 602 -9.147 -26.930 -0.844 1.00 71.80 C ATOM 10 NH1 ARG A 602 -8.782 -27.282 -2.071 1.00 72.93 N ATOM 11 NH2 ARG A 602 -8.285 -27.067 0.155 1.00 72.33 N ATOM 12 HE ARG A 602 -10.588 -26.168 0.372 1.00 0.00 H ATOM 13 HH12 ARG A 602 -7.831 -27.668 -2.240 1.00 0.00 H ATOM 14 HH11 ARG A 602 -9.447 -27.172 -2.863 1.00 0.00 H ATOM 15 HH22 ARG A 602 -7.337 -27.454 -0.026 1.00 0.00 H ATOM 16 HH21 ARG A 602 -8.558 -26.788 1.119 1.00 0.00 H ATOM 17 HN3 ARG A 602 -12.085 -22.765 -0.210 1.00 0.00 H ATOM 18 HN2 ARG A 602 -12.101 -21.216 -0.909 1.00 0.00 H ATOM 19 HN1 ARG A 602 -10.967 -22.370 -1.428 1.00 0.00 H ATOM 20 N VAL A 603 -14.534 -21.702 -0.615 1.00 46.72 N ATOM 21 CA VAL A 603 -15.858 -21.479 -0.045 1.00 43.20 C ATOM 22 C VAL A 603 -16.321 -20.075 -0.400 1.00 34.01 C ATOM 23 O VAL A 603 -15.509 -19.160 -0.587 1.00 32.45 O ATOM 24 CB VAL A 603 -15.885 -21.703 1.484 1.00 48.45 C ATOM 25 CG1 VAL A 603 -15.403 -23.113 1.823 1.00 53.11 C ATOM 26 CG2 VAL A 603 -15.048 -20.658 2.206 1.00 50.42 C ATOM 27 H VAL A 603 -13.718 -21.213 -0.194 1.00 0.00 H ATOM 28 N ASP A 604 -17.643 -19.908 -0.490 1.00 25.88 N ATOM 29 CA ASP A 604 -18.212 -18.602 -0.802 1.00 20.17 C ATOM 30 C ASP A 604 -17.866 -17.594 0.284 1.00 18.56 C ATOM 31 O ASP A 604 -17.855 -17.910 1.480 1.00 19.98 O ATOM 32 CB ASP A 604 -19.733 -18.677 -0.880 1.00 19.73 C ATOM 33 CG ASP A 604 -20.249 -19.119 -2.244 1.00 20.25 C ATOM 34 OD1 ASP A 604 -19.457 -19.284 -3.205 1.00 19.64 O ATOM 35 OD2 ASP A 604 -21.486 -19.274 -2.350 1.00 21.21 O ATOM 36 H ASP A 604 -18.275 -20.720 -0.336 1.00 0.00 H ATOM 37 N PHE A 605 -17.607 -16.375 -0.154 1.00 18.09 N ATOM 38 CA PHE A 605 -17.619 -15.228 0.730 1.00 18.91 C ATOM 39 C PHE A 605 -18.994 -15.133 1.383 1.00 19.84 C ATOM 40 O PHE A 605 -20.003 -15.449 0.743 1.00 19.81 O ATOM 41 CB PHE A 605 -17.385 -13.983 -0.127 1.00 18.91 C ATOM 42 CG PHE A 605 -17.192 -12.713 0.663 1.00 20.57 C ATOM 43 CD1 PHE A 605 -18.280 -11.949 1.050 1.00 19.71 C ATOM 44 CD2 PHE A 605 -15.924 -12.269 0.988 1.00 22.27 C ATOM 45 CE1 PHE A 605 -18.105 -10.778 1.776 1.00 22.06 C ATOM 46 CE2 PHE A 605 -15.743 -11.093 1.702 1.00 23.23 C ATOM 47 CZ PHE A 605 -16.834 -10.349 2.094 1.00 23.28 C ATOM 48 H PHE A 605 -17.389 -16.235 -1.161 1.00 0.00 H ATOM 49 N PRO A 606 -19.078 -14.734 2.658 1.00 21.69 N ATOM 50 CA PRO A 606 -20.395 -14.614 3.297 1.00 22.04 C ATOM 51 C PRO A 606 -21.204 -13.444 2.745 1.00 21.06 C ATOM 52 O PRO A 606 -20.963 -12.277 3.069 1.00 19.81 O ATOM 53 CB PRO A 606 -20.058 -14.451 4.785 1.00 23.02 C ATOM 54 CG PRO A 606 -18.690 -13.897 4.794 1.00 23.28 C ATOM 55 CD PRO A 606 -17.985 -14.455 3.593 1.00 22.86 C ATOM 56 N ARG A 607 -22.188 -13.778 1.911 1.00 21.18 N ATOM 57 CA ARG A 607 -23.022 -12.782 1.249 1.00 22.47 C ATOM 58 C ARG A 607 -23.693 -11.843 2.248 1.00 21.94 C ATOM 59 O ARG A 607 -23.909 -10.657 1.954 1.00 20.67 O ATOM 60 CB ARG A 607 -24.051 -13.552 0.433 1.00 24.82 C ATOM 61 CG ARG A 607 -25.049 -12.766 -0.325 1.00 26.31 C ATOM 62 CD ARG A 607 -26.206 -13.707 -0.660 1.00 25.86 C ATOM 63 NE ARG A 607 -25.806 -14.863 -1.473 1.00 23.16 N ATOM 64 CZ ARG A 607 -25.460 -14.765 -2.753 1.00 21.18 C ATOM 65 NH1 ARG A 607 -25.426 -13.584 -3.326 1.00 22.15 N ATOM 66 NH2 ARG A 607 -25.139 -15.834 -3.459 1.00 19.50 N ATOM 67 HE ARG A 607 -25.793 -15.802 -1.027 1.00 0.00 H ATOM 68 HH12 ARG A 607 -25.156 -13.499 -4.327 1.00 0.00 H ATOM 69 HH11 ARG A 607 -25.669 -12.733 -2.779 1.00 0.00 H ATOM 70 HH22 ARG A 607 -24.871 -15.736 -4.459 1.00 0.00 H ATOM 71 HH21 ARG A 607 -25.154 -16.774 -3.015 1.00 0.00 H ATOM 72 H ARG A 607 -22.368 -14.785 1.726 1.00 0.00 H ATOM 73 N SER A 608 -24.017 -12.341 3.440 1.00 23.72 N ATOM 74 CA SER A 608 -24.729 -11.517 4.408 1.00 23.96 C ATOM 75 C SER A 608 -23.888 -10.365 4.951 1.00 22.74 C ATOM 76 O SER A 608 -24.453 -9.441 5.542 1.00 24.43 O ATOM 77 CB SER A 608 -25.200 -12.397 5.557 1.00 26.75 C ATOM 78 OG SER A 608 -24.095 -13.055 6.140 1.00 28.02 O ATOM 79 HG SER A 608 -23.650 -13.617 5.458 1.00 0.00 H ATOM 80 H SER A 608 -23.761 -13.320 3.680 1.00 0.00 H ATOM 81 N ARG A 609 -22.566 -10.408 4.797 1.00 19.53 N ATOM 82 CA ARG A 609 -21.689 -9.332 5.248 1.00 19.90 C ATOM 83 C ARG A 609 -21.546 -8.203 4.226 1.00 18.80 C ATOM 84 O ARG A 609 -20.870 -7.207 4.515 1.00 19.55 O ATOM 85 CB ARG A 609 -20.298 -9.900 5.572 1.00 20.24 C ATOM 86 CG ARG A 609 -20.288 -10.913 6.729 1.00 22.42 C ATOM 87 CD ARG A 609 -20.623 -10.252 8.061 1.00 24.81 C ATOM 88 NE ARG A 609 -20.318 -11.127 9.196 1.00 27.54 N ATOM 89 CZ ARG A 609 -19.145 -11.182 9.824 1.00 29.16 C ATOM 90 NH1 ARG A 609 -18.132 -10.416 9.444 1.00 28.04 N ATOM 91 NH2 ARG A 609 -18.983 -12.017 10.849 1.00 31.72 N ATOM 92 HE ARG A 609 -21.075 -11.753 9.537 1.00 0.00 H ATOM 93 HH12 ARG A 609 -17.222 -10.471 9.945 1.00 0.00 H ATOM 94 HH11 ARG A 609 -18.247 -9.760 8.645 1.00 0.00 H ATOM 95 HH22 ARG A 609 -18.069 -12.063 11.342 1.00 0.00 H ATOM 96 HH21 ARG A 609 -19.771 -12.623 11.156 1.00 0.00 H ATOM 97 H ARG A 609 -22.142 -11.240 4.338 1.00 0.00 H ATOM 98 N LEU A 610 -22.143 -8.333 3.038 1.00 17.17 N ATOM 99 CA LEU A 610 -22.075 -7.296 2.008 1.00 17.07 C ATOM 100 C LEU A 610 -23.220 -6.308 2.206 1.00 19.48 C ATOM 101 O LEU A 610 -24.385 -6.631 1.949 1.00 22.49 O ATOM 102 CB LEU A 610 -22.142 -7.925 0.617 1.00 16.89 C ATOM 103 CG LEU A 610 -20.970 -8.834 0.243 1.00 16.51 C ATOM 104 CD1 LEU A 610 -21.251 -9.499 -1.065 1.00 16.15 C ATOM 105 CD2 LEU A 610 -19.689 -8.056 0.138 1.00 17.70 C ATOM 106 H LEU A 610 -22.676 -9.203 2.838 1.00 0.00 H ATOM 107 N ARG A 611 -22.897 -5.099 2.648 1.00 17.96 N ATOM 108 CA ARG A 611 -23.908 -4.095 2.955 1.00 18.73 C ATOM 109 C ARG A 611 -23.955 -3.074 1.821 1.00 17.97 C ATOM 110 O ARG A 611 -22.974 -2.358 1.579 1.00 16.69 O ATOM 111 CB ARG A 611 -23.576 -3.426 4.283 1.00 20.48 C ATOM 112 CG ARG A 611 -24.573 -2.374 4.734 1.00 22.41 C ATOM 113 CD ARG A 611 -24.304 -1.936 6.178 1.00 25.20 C ATOM 114 NE ARG A 611 -24.457 -3.062 7.111 1.00 26.99 N ATOM 115 CZ ARG A 611 -25.616 -3.487 7.603 1.00 28.83 C ATOM 116 NH1 ARG A 611 -26.745 -2.866 7.283 1.00 30.32 N ATOM 117 NH2 ARG A 611 -25.647 -4.531 8.425 1.00 28.67 N ATOM 118 HE ARG A 611 -23.595 -3.563 7.408 1.00 0.00 H ATOM 119 HH12 ARG A 611 -27.650 -3.201 7.670 1.00 0.00 H ATOM 120 HH11 ARG A 611 -26.724 -2.044 6.646 1.00 0.00 H ATOM 121 HH22 ARG A 611 -26.554 -4.863 8.810 1.00 0.00 H ATOM 122 HH21 ARG A 611 -24.764 -5.016 8.683 1.00 0.00 H ATOM 123 H ARG A 611 -21.893 -4.861 2.779 1.00 0.00 H ATOM 124 N PHE A 612 -25.104 -2.994 1.154 1.00 18.67 N ATOM 125 CA PHE A 612 -25.263 -2.095 0.014 1.00 17.86 C ATOM 126 C PHE A 612 -25.053 -0.638 0.420 1.00 18.65 C ATOM 127 O PHE A 612 -25.539 -0.186 1.457 1.00 19.41 O ATOM 128 CB PHE A 612 -26.670 -2.262 -0.571 1.00 17.99 C ATOM 129 CG PHE A 612 -26.989 -1.300 -1.698 1.00 18.30 C ATOM 130 CD1 PHE A 612 -26.568 -1.568 -2.984 1.00 19.12 C ATOM 131 CD2 PHE A 612 -27.723 -0.148 -1.466 1.00 19.47 C ATOM 132 CE1 PHE A 612 -26.856 -0.714 -4.003 1.00 19.79 C ATOM 133 CE2 PHE A 612 -28.007 0.714 -2.494 1.00 20.03 C ATOM 134 CZ PHE A 612 -27.579 0.436 -3.756 1.00 19.50 C ATOM 135 H PHE A 612 -25.907 -3.585 1.451 1.00 0.00 H ATOM 136 N LYS A 613 -24.337 0.104 -0.421 1.00 18.53 N ATOM 137 CA LYS A 613 -24.184 1.547 -0.264 1.00 20.98 C ATOM 138 C LYS A 613 -24.725 2.315 -1.457 1.00 21.01 C ATOM 139 O LYS A 613 -25.539 3.227 -1.274 1.00 22.54 O ATOM 140 CB LYS A 613 -22.711 1.915 -0.012 1.00 25.52 C ATOM 141 CG LYS A 613 -22.066 1.169 1.155 1.00 30.49 C ATOM 142 CD LYS A 613 -22.689 1.493 2.515 1.00 35.29 C ATOM 143 CE LYS A 613 -22.310 2.894 2.993 1.00 38.44 C ATOM 144 NZ LYS A 613 -22.670 3.143 4.424 1.00 41.05 N ATOM 145 HZ1 LYS A 613 -23.697 3.035 4.546 1.00 0.00 H ATOM 146 HZ2 LYS A 613 -22.174 2.458 5.029 1.00 0.00 H ATOM 147 HZ3 LYS A 613 -22.388 4.109 4.688 1.00 0.00 H ATOM 148 H LYS A 613 -23.867 -0.363 -1.223 1.00 0.00 H ATOM 149 N GLU A 614 -24.296 1.983 -2.678 1.00 20.05 N ATOM 150 CA GLU A 614 -24.843 2.615 -3.874 1.00 21.24 C ATOM 151 C GLU A 614 -24.561 1.746 -5.091 1.00 18.81 C ATOM 152 O GLU A 614 -23.712 0.849 -5.063 1.00 17.78 O ATOM 153 CB GLU A 614 -24.332 4.048 -4.086 1.00 25.88 C ATOM 154 CG GLU A 614 -22.833 4.248 -4.103 1.00 30.17 C ATOM 155 CD GLU A 614 -22.444 5.754 -4.098 1.00 34.44 C ATOM 156 OE1 GLU A 614 -22.852 6.490 -5.027 1.00 35.80 O ATOM 157 OE2 GLU A 614 -21.755 6.208 -3.149 1.00 35.49 O ATOM 158 H GLU A 614 -23.556 1.259 -2.778 1.00 0.00 H ATOM 159 N LYS A 615 -25.303 2.028 -6.159 1.00 17.70 N ATOM 160 CA LYS A 615 -25.117 1.365 -7.441 1.00 18.79 C ATOM 161 C LYS A 615 -23.969 2.032 -8.188 1.00 17.88 C ATOM 162 O LYS A 615 -23.958 3.256 -8.354 1.00 19.67 O ATOM 163 CB LYS A 615 -26.405 1.507 -8.247 1.00 22.82 C ATOM 164 CG LYS A 615 -26.791 0.320 -9.068 1.00 29.10 C ATOM 165 CD LYS A 615 -28.219 0.506 -9.645 1.00 31.96 C ATOM 166 CE LYS A 615 -29.320 0.096 -8.649 1.00 34.20 C ATOM 167 NZ LYS A 615 -30.584 -0.265 -9.358 1.00 36.20 N ATOM 168 HZ1 LYS A 615 -30.919 0.554 -9.905 1.00 0.00 H ATOM 169 HZ2 LYS A 615 -30.404 -1.063 -10.001 1.00 0.00 H ATOM 170 HZ3 LYS A 615 -31.306 -0.536 -8.660 1.00 0.00 H ATOM 171 H LYS A 615 -26.046 2.751 -6.074 1.00 0.00 H ATOM 172 N LEU A 616 -22.991 1.227 -8.611 1.00 15.14 N ATOM 173 CA LEU A 616 -21.896 1.704 -9.460 1.00 14.58 C ATOM 174 C LEU A 616 -22.158 1.529 -10.950 1.00 15.23 C ATOM 175 O LEU A 616 -21.545 2.238 -11.765 1.00 16.22 O ATOM 176 CB LEU A 616 -20.599 0.956 -9.119 1.00 14.07 C ATOM 177 CG LEU A 616 -20.060 1.243 -7.715 1.00 15.74 C ATOM 178 CD1 LEU A 616 -18.909 0.324 -7.377 1.00 15.46 C ATOM 179 CD2 LEU A 616 -19.654 2.725 -7.560 1.00 17.17 C ATOM 180 H LEU A 616 -23.007 0.226 -8.328 1.00 0.00 H ATOM 181 N GLY A 617 -23.018 0.584 -11.324 1.00 14.67 N ATOM 182 CA GLY A 617 -23.301 0.327 -12.721 1.00 14.98 C ATOM 183 C GLY A 617 -24.548 -0.507 -12.914 1.00 15.58 C ATOM 184 O GLY A 617 -24.919 -1.295 -12.040 1.00 15.02 O ATOM 185 H GLY A 617 -23.498 0.017 -10.596 1.00 0.00 H ATOM 186 N GLU A 618 -25.208 -0.303 -14.055 1.00 17.90 N ATOM 187 CA GLU A 618 -26.390 -1.048 -14.480 1.00 18.38 C ATOM 188 C GLU A 618 -26.002 -1.793 -15.742 1.00 17.40 C ATOM 189 O GLU A 618 -25.652 -1.164 -16.743 1.00 19.23 O ATOM 190 CB GLU A 618 -27.533 -0.095 -14.875 1.00 23.27 C ATOM 191 CG GLU A 618 -28.313 0.515 -13.736 1.00 27.57 C ATOM 192 CD GLU A 618 -29.408 -0.380 -13.223 1.00 29.52 C ATOM 193 OE1 GLU A 618 -29.587 -1.494 -13.765 1.00 29.85 O ATOM 194 OE2 GLU A 618 -30.099 0.050 -12.274 1.00 32.02 O ATOM 195 H GLU A 618 -24.855 0.442 -14.689 1.00 0.00 H ATOM 196 N GLY A 619 -26.100 -3.115 -15.716 1.00 16.15 N ATOM 197 CA GLY A 619 -25.795 -3.936 -16.864 1.00 14.34 C ATOM 198 C GLY A 619 -27.048 -4.564 -17.450 1.00 13.35 C ATOM 199 O GLY A 619 -28.131 -4.488 -16.897 1.00 14.35 O ATOM 200 H GLY A 619 -26.408 -3.577 -14.837 1.00 0.00 H ATOM 201 N GLN A 620 -26.864 -5.208 -18.603 1.00 13.28 N ATOM 202 CA GLN A 620 -27.980 -5.875 -19.261 1.00 12.44 C ATOM 203 C GLN A 620 -28.552 -6.999 -18.398 1.00 12.49 C ATOM 204 O GLN A 620 -29.783 -7.180 -18.323 1.00 12.77 O ATOM 205 CB GLN A 620 -27.534 -6.389 -20.629 1.00 13.93 C ATOM 206 CG GLN A 620 -28.587 -7.201 -21.320 1.00 15.29 C ATOM 207 CD GLN A 620 -28.247 -7.540 -22.768 1.00 16.53 C ATOM 208 OE1 GLN A 620 -27.086 -7.470 -23.214 1.00 17.51 O ATOM 209 NE2 GLN A 620 -29.263 -7.950 -23.498 1.00 16.64 N ATOM 210 HE22 GLN A 620 -30.216 -7.993 -23.085 1.00 0.00 H ATOM 211 HE21 GLN A 620 -29.112 -8.231 -24.488 1.00 0.00 H ATOM 212 H GLN A 620 -25.918 -5.234 -19.035 1.00 0.00 H ATOM 213 N PHE A 621 -27.678 -7.768 -17.744 1.00 11.31 N ATOM 214 CA PHE A 621 -28.091 -8.934 -16.963 1.00 11.40 C ATOM 215 C PHE A 621 -27.757 -8.837 -15.486 1.00 12.35 C ATOM 216 O PHE A 621 -27.942 -9.818 -14.763 1.00 12.34 O ATOM 217 CB PHE A 621 -27.486 -10.212 -17.560 1.00 12.31 C ATOM 218 CG PHE A 621 -27.840 -10.423 -18.997 1.00 13.66 C ATOM 219 CD1 PHE A 621 -29.143 -10.718 -19.372 1.00 15.33 C ATOM 220 CD2 PHE A 621 -26.875 -10.325 -19.971 1.00 14.12 C ATOM 221 CE1 PHE A 621 -29.482 -10.908 -20.691 1.00 16.45 C ATOM 222 CE2 PHE A 621 -27.205 -10.515 -21.316 1.00 16.06 C ATOM 223 CZ PHE A 621 -28.516 -10.804 -21.669 1.00 15.98 C ATOM 224 H PHE A 621 -26.667 -7.529 -17.792 1.00 0.00 H ATOM 225 N GLY A 622 -27.297 -7.691 -15.017 1.00 12.08 N ATOM 226 CA GLY A 622 -26.935 -7.575 -13.629 1.00 14.07 C ATOM 227 C GLY A 622 -26.597 -6.143 -13.281 1.00 12.98 C ATOM 228 O GLY A 622 -26.914 -5.214 -14.024 1.00 13.47 O ATOM 229 H GLY A 622 -27.196 -6.873 -15.651 1.00 0.00 H ATOM 230 N GLU A 623 -25.938 -5.979 -12.137 1.00 12.72 N ATOM 231 CA GLU A 623 -25.585 -4.669 -11.617 1.00 13.91 C ATOM 232 C GLU A 623 -24.251 -4.794 -10.904 1.00 12.84 C ATOM 233 O GLU A 623 -23.826 -5.891 -10.519 1.00 13.06 O ATOM 234 CB GLU A 623 -26.638 -4.137 -10.614 1.00 15.63 C ATOM 235 CG GLU A 623 -28.024 -3.948 -11.188 1.00 18.55 C ATOM 236 CD GLU A 623 -29.081 -3.630 -10.132 1.00 22.11 C ATOM 237 OE1 GLU A 623 -28.749 -3.310 -8.962 1.00 24.71 O ATOM 238 OE2 GLU A 623 -30.271 -3.705 -10.493 1.00 25.79 O ATOM 239 H GLU A 623 -25.665 -6.822 -11.593 1.00 0.00 H ATOM 240 N VAL A 624 -23.597 -3.653 -10.712 1.00 11.82 N ATOM 241 CA VAL A 624 -22.404 -3.564 -9.887 1.00 12.75 C ATOM 242 C VAL A 624 -22.740 -2.646 -8.733 1.00 12.92 C ATOM 243 O VAL A 624 -23.228 -1.535 -8.943 1.00 13.12 O ATOM 244 CB VAL A 624 -21.196 -3.044 -10.683 1.00 12.96 C ATOM 245 CG1 VAL A 624 -19.964 -2.955 -9.789 1.00 13.81 C ATOM 246 CG2 VAL A 624 -20.953 -3.958 -11.890 1.00 13.45 C ATOM 247 H VAL A 624 -23.953 -2.790 -11.170 1.00 0.00 H ATOM 248 N HIS A 625 -22.514 -3.121 -7.526 1.00 12.50 N ATOM 249 CA HIS A 625 -22.797 -2.350 -6.331 1.00 13.56 C ATOM 250 C HIS A 625 -21.514 -2.014 -5.580 1.00 13.94 C ATOM 251 O HIS A 625 -20.567 -2.803 -5.536 1.00 15.29 O ATOM 252 CB HIS A 625 -23.665 -3.148 -5.371 1.00 15.65 C ATOM 253 CG HIS A 625 -25.050 -3.393 -5.872 1.00 17.34 C ATOM 254 ND1 HIS A 625 -25.989 -4.086 -5.144 1.00 18.09 N ATOM 255 CD2 HIS A 625 -25.659 -3.037 -7.027 1.00 18.55 C ATOM 256 CE1 HIS A 625 -27.113 -4.158 -5.833 1.00 19.01 C ATOM 257 NE2 HIS A 625 -26.945 -3.516 -6.973 1.00 19.33 N ATOM 258 H HIS A 625 -22.120 -4.079 -7.427 1.00 0.00 H ATOM 259 N LEU A 626 -21.520 -0.839 -4.965 1.00 14.07 N ATOM 260 CA LEU A 626 -20.568 -0.493 -3.920 1.00 13.85 C ATOM 261 C LEU A 626 -21.152 -0.996 -2.611 1.00 13.64 C ATOM 262 O LEU A 626 -22.276 -0.628 -2.257 1.00 15.13 O ATOM 263 CB LEU A 626 -20.403 1.025 -3.855 1.00 15.67 C ATOM 264 CG LEU A 626 -19.537 1.588 -2.739 1.00 16.63 C ATOM 265 CD1 LEU A 626 -18.172 0.992 -2.826 1.00 17.18 C ATOM 266 CD2 LEU A 626 -19.469 3.111 -2.812 1.00 17.18 C ATOM 267 H LEU A 626 -22.235 -0.136 -5.241 1.00 0.00 H ATOM 268 N CYS A 627 -20.408 -1.849 -1.912 1.00 13.71 N ATOM 269 CA CYS A 627 -20.831 -2.350 -0.619 1.00 15.17 C ATOM 270 C CYS A 627 -19.745 -2.091 0.410 1.00 17.49 C ATOM 271 O CYS A 627 -18.563 -1.961 0.082 1.00 16.69 O ATOM 272 CB CYS A 627 -21.088 -3.850 -0.656 1.00 16.07 C ATOM 273 SG CYS A 627 -22.424 -4.356 -1.753 1.00 19.19 S ATOM 274 H CYS A 627 -19.498 -2.165 -2.304 1.00 0.00 H ATOM 275 N GLU A 628 -20.171 -2.011 1.664 1.00 17.82 N ATOM 276 CA GLU A 628 -19.285 -2.134 2.812 1.00 19.70 C ATOM 277 C GLU A 628 -19.313 -3.581 3.282 1.00 18.62 C ATOM 278 O GLU A 628 -20.308 -4.286 3.102 1.00 22.00 O ATOM 279 CB GLU A 628 -19.757 -1.240 3.967 1.00 25.13 C ATOM 280 CG GLU A 628 -19.580 0.223 3.742 1.00 30.17 C ATOM 281 CD GLU A 628 -20.179 1.051 4.874 1.00 33.38 C ATOM 282 OE1 GLU A 628 -21.231 0.654 5.423 1.00 34.78 O ATOM 283 OE2 GLU A 628 -19.596 2.087 5.221 1.00 35.89 O ATOM 284 H GLU A 628 -21.185 -1.853 1.834 1.00 0.00 H ATOM 285 N VAL A 629 -18.213 -4.029 3.866 1.00 17.19 N ATOM 286 CA VAL A 629 -18.139 -5.358 4.463 1.00 16.51 C ATOM 287 C VAL A 629 -18.316 -5.195 5.965 1.00 15.73 C ATOM 288 O VAL A 629 -17.500 -4.536 6.617 1.00 17.51 O ATOM 289 CB VAL A 629 -16.800 -6.043 4.158 1.00 16.98 C ATOM 290 CG1 VAL A 629 -16.730 -7.381 4.859 1.00 17.57 C ATOM 291 CG2 VAL A 629 -16.601 -6.230 2.663 1.00 17.21 C ATOM 292 H VAL A 629 -17.375 -3.414 3.900 1.00 0.00 H ATOM 293 N ASP A 630 -19.362 -5.805 6.518 1.00 16.89 N ATOM 294 CA ASP A 630 -19.596 -5.736 7.959 1.00 17.35 C ATOM 295 C ASP A 630 -18.546 -6.552 8.706 1.00 18.05 C ATOM 296 O ASP A 630 -18.227 -7.673 8.318 1.00 18.79 O ATOM 297 CB ASP A 630 -20.969 -6.315 8.309 1.00 18.46 C ATOM 298 CG ASP A 630 -22.136 -5.447 7.860 1.00 20.98 C ATOM 299 OD1 ASP A 630 -21.951 -4.240 7.554 1.00 21.56 O ATOM 300 OD2 ASP A 630 -23.271 -5.999 7.835 1.00 23.08 O ATOM 301 H ASP A 630 -20.022 -6.338 5.916 1.00 0.00 H ATOM 302 N SER A 631 -18.030 -5.998 9.800 1.00 18.82 N ATOM 303 CA SER A 631 -17.122 -6.706 10.696 1.00 23.52 C ATOM 304 C SER A 631 -16.009 -7.432 9.935 1.00 26.83 C ATOM 305 O SER A 631 -15.816 -8.645 10.103 1.00 26.23 O ATOM 306 CB SER A 631 -17.902 -7.668 11.582 1.00 24.82 C ATOM 307 OG SER A 631 -17.113 -8.187 12.646 1.00 26.96 O ATOM 308 HG SER A 631 -16.337 -8.676 12.272 1.00 0.00 H ATOM 309 H SER A 631 -18.285 -5.016 10.027 1.00 0.00 H ATOM 310 N PRO A 632 -15.242 -6.717 9.109 1.00 29.80 N ATOM 311 CA PRO A 632 -14.351 -7.402 8.153 1.00 33.11 C ATOM 312 C PRO A 632 -13.188 -8.155 8.787 1.00 37.71 C ATOM 313 O PRO A 632 -12.711 -9.134 8.199 1.00 36.04 O ATOM 314 CB PRO A 632 -13.866 -6.257 7.251 1.00 31.95 C ATOM 315 CG PRO A 632 -13.954 -5.042 8.123 1.00 31.03 C ATOM 316 CD PRO A 632 -15.163 -5.250 8.998 1.00 30.09 C ATOM 317 N GLN A 633 -12.699 -7.729 9.956 1.00 42.79 N ATOM 318 CA GLN A 633 -11.581 -8.430 10.578 1.00 48.49 C ATOM 319 C GLN A 633 -11.882 -9.905 10.826 1.00 49.05 C ATOM 320 O GLN A 633 -10.947 -10.705 10.950 1.00 49.81 O ATOM 321 CB GLN A 633 -11.176 -7.735 11.878 1.00 53.36 C ATOM 322 CG GLN A 633 -10.551 -6.364 11.668 1.00 57.94 C ATOM 323 CD GLN A 633 -10.218 -5.683 12.976 1.00 61.91 C ATOM 324 OE1 GLN A 633 -10.785 -6.014 14.021 1.00 63.47 O ATOM 325 NE2 GLN A 633 -9.290 -4.729 12.932 1.00 63.32 N ATOM 326 HE22 GLN A 633 -8.839 -4.484 12.028 1.00 0.00 H ATOM 327 HE21 GLN A 633 -9.016 -4.229 13.802 1.00 0.00 H ATOM 328 H GLN A 633 -13.116 -6.898 10.422 1.00 0.00 H ATOM 329 N ASP A 634 -13.159 -10.289 10.888 1.00 49.13 N ATOM 330 CA ASP A 634 -13.513 -11.698 11.014 1.00 49.73 C ATOM 331 C ASP A 634 -13.170 -12.505 9.769 1.00 51.10 C ATOM 332 O ASP A 634 -13.051 -13.729 9.866 1.00 51.52 O ATOM 333 CB ASP A 634 -15.014 -11.852 11.251 1.00 49.71 C ATOM 334 CG ASP A 634 -15.497 -11.061 12.429 1.00 49.76 C ATOM 335 OD1 ASP A 634 -14.641 -10.505 13.147 1.00 50.69 O ATOM 336 OD2 ASP A 634 -16.727 -10.992 12.632 1.00 49.13 O ATOM 337 H ASP A 634 -13.912 -9.573 10.846 1.00 0.00 H ATOM 338 N LEU A 635 -13.024 -11.862 8.606 1.00 51.83 N ATOM 339 CA LEU A 635 -12.884 -12.593 7.351 1.00 52.90 C ATOM 340 C LEU A 635 -11.459 -12.648 6.807 1.00 55.59 C ATOM 341 O LEU A 635 -11.138 -13.587 6.070 1.00 56.22 O ATOM 342 CB LEU A 635 -13.799 -11.995 6.271 1.00 51.29 C ATOM 343 CG LEU A 635 -15.189 -11.491 6.674 1.00 50.03 C ATOM 344 CD1 LEU A 635 -15.963 -11.103 5.425 1.00 49.37 C ATOM 345 CD2 LEU A 635 -15.975 -12.509 7.481 1.00 49.64 C ATOM 346 H LEU A 635 -13.010 -10.822 8.596 1.00 0.00 H ATOM 347 N VAL A 636 -10.596 -11.681 7.126 1.00 57.48 N ATOM 348 CA VAL A 636 -9.255 -11.631 6.523 1.00 59.18 C ATOM 349 C VAL A 636 -8.507 -12.954 6.700 1.00 59.36 C ATOM 350 O VAL A 636 -8.580 -13.590 7.753 1.00 59.63 O ATOM 351 CB VAL A 636 -8.417 -10.428 7.051 1.00 60.18 C ATOM 352 CG1 VAL A 636 -6.961 -10.516 6.564 1.00 60.58 C ATOM 353 CG2 VAL A 636 -9.023 -9.118 6.587 1.00 60.45 C ATOM 354 H VAL A 636 -10.876 -10.951 7.812 1.00 0.00 H TER 355 VAL A 636 ATOM 356 N PHE A 640 -9.812 -14.638 2.406 1.00 63.08 N ATOM 357 CA PHE A 640 -10.346 -13.406 1.831 1.00 62.72 C ATOM 358 C PHE A 640 -9.342 -12.255 2.026 1.00 63.47 C ATOM 359 O PHE A 640 -9.203 -11.729 3.137 1.00 64.16 O ATOM 360 CB PHE A 640 -11.706 -13.082 2.445 1.00 61.20 C ATOM 361 CG PHE A 640 -12.714 -14.180 2.261 1.00 60.05 C ATOM 362 CD1 PHE A 640 -13.155 -14.528 0.989 1.00 59.62 C ATOM 363 CD2 PHE A 640 -13.208 -14.881 3.354 1.00 59.51 C ATOM 364 CE1 PHE A 640 -14.075 -15.550 0.811 1.00 59.18 C ATOM 365 CE2 PHE A 640 -14.133 -15.903 3.182 1.00 59.38 C ATOM 366 CZ PHE A 640 -14.562 -16.240 1.910 1.00 59.15 C ATOM 367 HN3 PHE A 640 -9.643 -14.500 3.423 1.00 0.00 H ATOM 368 HN2 PHE A 640 -8.917 -14.880 1.934 1.00 0.00 H ATOM 369 HN1 PHE A 640 -10.497 -15.408 2.269 1.00 0.00 H ATOM 370 N PRO A 641 -8.633 -11.873 0.936 1.00 62.91 N ATOM 371 CA PRO A 641 -7.503 -10.932 1.063 1.00 62.23 C ATOM 372 C PRO A 641 -7.890 -9.481 1.322 1.00 61.68 C ATOM 373 O PRO A 641 -7.387 -8.576 0.644 1.00 61.54 O ATOM 374 CB PRO A 641 -6.786 -11.072 -0.290 1.00 62.35 C ATOM 375 CG PRO A 641 -7.844 -11.552 -1.239 1.00 62.32 C ATOM 376 CD PRO A 641 -8.748 -12.423 -0.429 1.00 62.50 C ATOM 377 N LEU A 642 -8.749 -9.232 2.308 1.00 61.16 N ATOM 378 CA LEU A 642 -9.253 -7.881 2.521 1.00 60.13 C ATOM 379 C LEU A 642 -8.180 -6.990 3.142 1.00 60.46 C ATOM 380 O LEU A 642 -7.471 -7.391 4.071 1.00 60.30 O ATOM 381 CB LEU A 642 -10.492 -7.901 3.418 1.00 58.59 C ATOM 382 CG LEU A 642 -11.587 -8.918 3.085 1.00 57.09 C ATOM 383 CD1 LEU A 642 -12.697 -8.824 4.120 1.00 56.58 C ATOM 384 CD2 LEU A 642 -12.141 -8.702 1.684 1.00 56.33 C ATOM 385 H LEU A 642 -9.062 -10.005 2.929 1.00 0.00 H ATOM 386 N ASN A 643 -8.079 -5.766 2.627 1.00 60.75 N ATOM 387 CA ASN A 643 -7.084 -4.790 3.071 1.00 61.11 C ATOM 388 C ASN A 643 -7.787 -3.794 3.990 1.00 60.04 C ATOM 389 O ASN A 643 -8.229 -2.725 3.562 1.00 59.43 O ATOM 390 CB ASN A 643 -6.469 -4.095 1.864 1.00 62.48 C ATOM 391 CG ASN A 643 -5.413 -3.089 2.252 1.00 64.32 C ATOM 392 OD1 ASN A 643 -4.498 -3.397 3.018 1.00 64.87 O ATOM 393 ND2 ASN A 643 -5.542 -1.868 1.738 1.00 64.93 N ATOM 394 HD22 ASN A 643 -6.331 -1.655 1.095 1.00 0.00 H ATOM 395 HD21 ASN A 643 -4.853 -1.127 1.979 1.00 0.00 H ATOM 396 H ASN A 643 -8.740 -5.491 1.872 1.00 0.00 H ATOM 397 N VAL A 644 -7.880 -4.145 5.271 1.00 59.45 N ATOM 398 CA VAL A 644 -8.677 -3.393 6.235 1.00 59.16 C ATOM 399 C VAL A 644 -7.773 -2.439 6.997 1.00 59.89 C ATOM 400 O VAL A 644 -6.774 -2.864 7.593 1.00 59.58 O ATOM 401 CB VAL A 644 -9.396 -4.331 7.219 1.00 58.37 C ATOM 402 CG1 VAL A 644 -10.451 -3.560 7.988 1.00 57.87 C ATOM 403 CG2 VAL A 644 -10.015 -5.514 6.499 1.00 58.08 C ATOM 404 H VAL A 644 -7.365 -4.988 5.597 1.00 0.00 H ATOM 405 N ARG A 645 -8.125 -1.154 6.989 1.00 61.26 N ATOM 406 CA ARG A 645 -7.568 -0.202 7.940 1.00 62.86 C ATOM 407 C ARG A 645 -8.486 -0.172 9.158 1.00 62.11 C ATOM 408 O ARG A 645 -9.654 0.221 9.053 1.00 61.57 O ATOM 409 CB ARG A 645 -7.410 1.191 7.328 1.00 65.36 C ATOM 410 CG ARG A 645 -6.647 2.145 8.248 1.00 68.22 C ATOM 411 CD ARG A 645 -6.046 3.345 7.518 1.00 70.62 C ATOM 412 NE ARG A 645 -6.396 4.607 8.171 1.00 72.63 N ATOM 413 CZ ARG A 645 -5.825 5.075 9.283 1.00 74.10 C ATOM 414 NH1 ARG A 645 -6.226 6.235 9.794 1.00 74.44 N ATOM 415 NH2 ARG A 645 -4.859 4.393 9.894 1.00 74.60 N ATOM 416 HE ARG A 645 -7.146 5.182 7.736 1.00 0.00 H ATOM 417 HH12 ARG A 645 -5.783 6.602 10.660 1.00 0.00 H ATOM 418 HH11 ARG A 645 -6.983 6.775 9.327 1.00 0.00 H ATOM 419 HH22 ARG A 645 -4.424 4.770 10.760 1.00 0.00 H ATOM 420 HH21 ARG A 645 -4.540 3.483 9.506 1.00 0.00 H ATOM 421 H ARG A 645 -8.815 -0.822 6.285 1.00 0.00 H ATOM 422 N LYS A 646 -7.954 -0.596 10.305 1.00 61.66 N ATOM 423 CA LYS A 646 -8.762 -0.865 11.490 1.00 61.16 C ATOM 424 C LYS A 646 -9.748 0.262 11.776 1.00 57.81 C ATOM 425 O LYS A 646 -9.374 1.437 11.832 1.00 57.54 O ATOM 426 CB LYS A 646 -7.837 -1.062 12.693 1.00 64.04 C ATOM 427 CG LYS A 646 -8.557 -1.430 13.981 1.00 66.49 C ATOM 428 CD LYS A 646 -7.568 -1.679 15.114 1.00 68.61 C ATOM 429 CE LYS A 646 -8.281 -2.037 16.415 1.00 70.10 C ATOM 430 NZ LYS A 646 -7.318 -2.282 17.529 1.00 71.00 N ATOM 431 HZ1 LYS A 646 -6.689 -3.070 17.275 1.00 0.00 H ATOM 432 HZ2 LYS A 646 -6.753 -1.424 17.692 1.00 0.00 H ATOM 433 HZ3 LYS A 646 -7.844 -2.522 18.394 1.00 0.00 H ATOM 434 H LYS A 646 -6.925 -0.740 10.357 1.00 0.00 H ATOM 435 N GLY A 647 -11.014 -0.112 11.965 1.00 54.88 N ATOM 436 CA GLY A 647 -12.052 0.850 12.279 1.00 51.56 C ATOM 437 C GLY A 647 -12.418 1.790 11.154 1.00 48.55 C ATOM 438 O GLY A 647 -13.038 2.825 11.408 1.00 48.06 O ATOM 439 H GLY A 647 -11.263 -1.119 11.885 1.00 0.00 H ATOM 440 N HIS A 648 -12.033 1.475 9.916 1.00 46.52 N ATOM 441 CA HIS A 648 -12.451 2.240 8.751 1.00 44.81 C ATOM 442 C HIS A 648 -13.283 1.357 7.834 1.00 39.36 C ATOM 443 O HIS A 648 -13.132 0.129 7.848 1.00 39.46 O ATOM 444 CB HIS A 648 -11.250 2.772 7.958 1.00 48.15 C ATOM 445 CG HIS A 648 -10.454 3.799 8.696 1.00 50.91 C ATOM 446 ND1 HIS A 648 -9.751 3.509 9.847 1.00 52.10 N ATOM 447 CD2 HIS A 648 -10.264 5.119 8.461 1.00 52.01 C ATOM 448 CE1 HIS A 648 -9.154 4.603 10.282 1.00 52.84 C ATOM 449 NE2 HIS A 648 -9.448 5.595 9.459 1.00 53.02 N ATOM 450 H HIS A 648 -11.411 0.653 9.779 1.00 0.00 H ATOM 451 N PRO A 649 -14.159 1.945 7.020 1.00 34.83 N ATOM 452 CA PRO A 649 -15.004 1.126 6.142 1.00 31.37 C ATOM 453 C PRO A 649 -14.172 0.376 5.112 1.00 27.55 C ATOM 454 O PRO A 649 -13.316 0.954 4.433 1.00 27.62 O ATOM 455 CB PRO A 649 -15.925 2.155 5.473 1.00 32.48 C ATOM 456 CG PRO A 649 -15.797 3.400 6.307 1.00 33.36 C ATOM 457 CD PRO A 649 -14.411 3.380 6.821 1.00 33.74 C ATOM 458 N LEU A 650 -14.417 -0.923 5.005 1.00 25.82 N ATOM 459 CA LEU A 650 -13.859 -1.711 3.916 1.00 24.48 C ATOM 460 C LEU A 650 -14.872 -1.681 2.783 1.00 21.60 C ATOM 461 O LEU A 650 -15.942 -2.289 2.878 1.00 21.75 O ATOM 462 CB LEU A 650 -13.536 -3.144 4.336 1.00 26.08 C ATOM 463 CG LEU A 650 -12.815 -3.854 3.177 1.00 29.75 C ATOM 464 CD1 LEU A 650 -11.329 -3.509 3.213 1.00 30.32 C ATOM 465 CD2 LEU A 650 -13.035 -5.338 3.188 1.00 31.55 C ATOM 466 H LEU A 650 -15.020 -1.388 5.713 1.00 0.00 H ATOM 467 N LEU A 651 -14.544 -0.959 1.722 1.00 20.37 N ATOM 468 CA LEU A 651 -15.413 -0.821 0.563 1.00 18.89 C ATOM 469 C LEU A 651 -14.993 -1.800 -0.518 1.00 18.32 C ATOM 470 O LEU A 651 -13.799 -1.961 -0.803 1.00 19.01 O ATOM 471 CB LEU A 651 -15.344 0.603 0.014 1.00 19.91 C ATOM 472 CG LEU A 651 -15.872 1.662 0.985 1.00 23.17 C ATOM 473 CD1 LEU A 651 -15.679 3.058 0.401 1.00 24.45 C ATOM 474 CD2 LEU A 651 -17.340 1.406 1.269 1.00 23.56 C ATOM 475 H LEU A 651 -13.626 -0.470 1.717 1.00 0.00 H ATOM 476 N VAL A 652 -15.988 -2.442 -1.125 1.00 15.09 N ATOM 477 CA VAL A 652 -15.772 -3.382 -2.210 1.00 14.25 C ATOM 478 C VAL A 652 -16.786 -3.117 -3.309 1.00 12.36 C ATOM 479 O VAL A 652 -17.875 -2.581 -3.071 1.00 13.62 O ATOM 480 CB VAL A 652 -15.888 -4.838 -1.724 1.00 14.42 C ATOM 481 CG1 VAL A 652 -14.814 -5.145 -0.703 1.00 15.57 C ATOM 482 CG2 VAL A 652 -17.301 -5.129 -1.156 1.00 14.54 C ATOM 483 H VAL A 652 -16.962 -2.263 -0.809 1.00 0.00 H ATOM 484 N ALA A 653 -16.418 -3.494 -4.521 1.00 12.31 N ATOM 485 CA ALA A 653 -17.333 -3.485 -5.653 1.00 12.64 C ATOM 486 C ALA A 653 -17.780 -4.911 -5.928 1.00 11.72 C ATOM 487 O ALA A 653 -16.978 -5.840 -5.883 1.00 13.14 O ATOM 488 CB ALA A 653 -16.663 -2.891 -6.891 1.00 13.92 C ATOM 489 H ALA A 653 -15.438 -3.809 -4.672 1.00 0.00 H ATOM 490 N VAL A 654 -19.071 -5.090 -6.161 1.00 11.13 N ATOM 491 CA VAL A 654 -19.650 -6.419 -6.315 1.00 11.68 C ATOM 492 C VAL A 654 -20.416 -6.472 -7.630 1.00 12.11 C ATOM 493 O VAL A 654 -21.370 -5.709 -7.828 1.00 12.41 O ATOM 494 CB VAL A 654 -20.573 -6.756 -5.130 1.00 12.75 C ATOM 495 CG1 VAL A 654 -21.063 -8.186 -5.213 1.00 14.49 C ATOM 496 CG2 VAL A 654 -19.877 -6.443 -3.781 1.00 13.29 C ATOM 497 H VAL A 654 -19.690 -4.258 -6.236 1.00 0.00 H ATOM 498 N LYS A 655 -19.992 -7.354 -8.529 1.00 11.13 N ATOM 499 CA LYS A 655 -20.701 -7.595 -9.782 1.00 10.53 C ATOM 500 C LYS A 655 -21.669 -8.755 -9.569 1.00 10.14 C ATOM 501 O LYS A 655 -21.248 -9.844 -9.171 1.00 11.15 O ATOM 502 CB LYS A 655 -19.712 -7.902 -10.902 1.00 12.40 C ATOM 503 CG LYS A 655 -20.402 -8.224 -12.220 1.00 13.07 C ATOM 504 CD LYS A 655 -19.435 -8.339 -13.390 1.00 13.39 C ATOM 505 CE LYS A 655 -20.204 -8.566 -14.679 1.00 15.75 C ATOM 506 NZ LYS A 655 -19.303 -8.594 -15.871 1.00 17.34 N ATOM 507 HZ1 LYS A 655 -18.802 -7.686 -15.947 1.00 0.00 H ATOM 508 HZ2 LYS A 655 -18.613 -9.364 -15.764 1.00 0.00 H ATOM 509 HZ3 LYS A 655 -19.870 -8.751 -16.729 1.00 0.00 H ATOM 510 H LYS A 655 -19.124 -7.892 -8.333 1.00 0.00 H ATOM 511 N ILE A 656 -22.960 -8.506 -9.803 1.00 10.68 N ATOM 512 CA ILE A 656 -24.053 -9.392 -9.412 1.00 11.24 C ATOM 513 C ILE A 656 -24.862 -9.726 -10.657 1.00 12.96 C ATOM 514 O ILE A 656 -25.229 -8.834 -11.435 1.00 15.19 O ATOM 515 CB ILE A 656 -24.978 -8.710 -8.376 1.00 13.35 C ATOM 516 CG1 ILE A 656 -24.195 -8.174 -7.173 1.00 15.78 C ATOM 517 CG2 ILE A 656 -26.023 -9.681 -7.904 1.00 13.87 C ATOM 518 CD1 ILE A 656 -24.962 -7.136 -6.369 1.00 17.32 C ATOM 519 H ILE A 656 -23.203 -7.623 -10.296 1.00 0.00 H ATOM 520 N LEU A 657 -25.189 -10.999 -10.809 1.00 12.16 N ATOM 521 CA LEU A 657 -26.038 -11.475 -11.897 1.00 10.86 C ATOM 522 C LEU A 657 -27.477 -11.519 -11.403 1.00 11.66 C ATOM 523 O LEU A 657 -27.758 -12.123 -10.367 1.00 12.48 O ATOM 524 CB LEU A 657 -25.605 -12.876 -12.315 1.00 12.46 C ATOM 525 CG LEU A 657 -26.436 -13.541 -13.415 1.00 12.92 C ATOM 526 CD1 LEU A 657 -26.207 -12.898 -14.769 1.00 13.76 C ATOM 527 CD2 LEU A 657 -26.181 -15.050 -13.475 1.00 13.82 C ATOM 528 H LEU A 657 -24.825 -11.691 -10.123 1.00 0.00 H ATOM 529 N ARG A 658 -28.378 -10.866 -12.110 1.00 12.85 N ATOM 530 CA ARG A 658 -29.783 -10.937 -11.731 1.00 14.22 C ATOM 531 C ARG A 658 -30.217 -12.401 -11.653 1.00 14.53 C ATOM 532 O ARG A 658 -29.934 -13.174 -12.580 1.00 15.84 O ATOM 533 CB ARG A 658 -30.657 -10.216 -12.753 1.00 16.40 C ATOM 534 CG ARG A 658 -30.799 -8.739 -12.528 1.00 18.48 C ATOM 535 CD ARG A 658 -31.927 -8.160 -13.377 1.00 20.18 C ATOM 536 NE ARG A 658 -31.578 -8.118 -14.795 1.00 19.41 N ATOM 537 CZ ARG A 658 -32.040 -8.945 -15.730 1.00 18.83 C ATOM 538 NH1 ARG A 658 -32.884 -9.926 -15.420 1.00 19.54 N ATOM 539 NH2 ARG A 658 -31.659 -8.775 -16.993 1.00 17.04 N ATOM 540 HE ARG A 658 -30.912 -7.379 -15.100 1.00 0.00 H ATOM 541 HH12 ARG A 658 -33.236 -10.564 -16.163 1.00 0.00 H ATOM 542 HH11 ARG A 658 -33.192 -10.055 -14.435 1.00 0.00 H ATOM 543 HH22 ARG A 658 -32.013 -9.414 -17.733 1.00 0.00 H ATOM 544 HH21 ARG A 658 -31.008 -8.003 -17.240 1.00 0.00 H ATOM 545 H ARG A 658 -28.087 -10.303 -12.934 1.00 0.00 H ATOM 546 N PRO A 659 -30.903 -12.818 -10.581 1.00 16.72 N ATOM 547 CA PRO A 659 -31.323 -14.227 -10.485 1.00 19.14 C ATOM 548 C PRO A 659 -32.234 -14.677 -11.606 1.00 19.90 C ATOM 549 O PRO A 659 -32.285 -15.879 -11.906 1.00 22.54 O ATOM 550 CB PRO A 659 -32.053 -14.289 -9.138 1.00 21.00 C ATOM 551 CG PRO A 659 -31.526 -13.168 -8.370 1.00 21.56 C ATOM 552 CD PRO A 659 -31.170 -12.084 -9.334 1.00 19.31 C ATOM 553 N ASP A 660 -32.990 -13.763 -12.210 1.00 19.21 N ATOM 554 CA ASP A 660 -33.872 -14.110 -13.317 1.00 19.27 C ATOM 555 C ASP A 660 -33.244 -13.821 -14.674 1.00 19.32 C ATOM 556 O ASP A 660 -33.945 -13.832 -15.686 1.00 20.19 O ATOM 557 CB ASP A 660 -35.227 -13.413 -13.177 1.00 20.27 C ATOM 558 CG ASP A 660 -35.107 -11.905 -13.116 1.00 21.50 C ATOM 559 OD1 ASP A 660 -33.961 -11.397 -13.132 1.00 23.89 O ATOM 560 OD2 ASP A 660 -36.171 -11.224 -13.041 1.00 23.07 O ATOM 561 H ASP A 660 -32.950 -12.776 -11.884 1.00 0.00 H ATOM 562 N ALA A 661 -31.937 -13.599 -14.728 1.00 17.86 N ATOM 563 CA ALA A 661 -31.296 -13.433 -16.024 1.00 18.59 C ATOM 564 C ALA A 661 -31.409 -14.737 -16.811 1.00 17.30 C ATOM 565 O ALA A 661 -31.602 -15.818 -16.246 1.00 18.10 O ATOM 566 CB ALA A 661 -29.827 -13.028 -15.842 1.00 17.97 C ATOM 567 H ALA A 661 -31.377 -13.544 -13.854 1.00 0.00 H ATOM 568 N THR A 662 -31.304 -14.627 -18.134 1.00 16.72 N ATOM 569 CA THR A 662 -31.426 -15.790 -19.004 1.00 17.40 C ATOM 570 C THR A 662 -30.364 -16.836 -18.681 1.00 16.32 C ATOM 571 O THR A 662 -29.306 -16.544 -18.111 1.00 14.62 O ATOM 572 CB THR A 662 -31.239 -15.408 -20.472 1.00 18.88 C ATOM 573 OG1 THR A 662 -29.907 -14.927 -20.684 1.00 19.04 O ATOM 574 CG2 THR A 662 -32.241 -14.341 -20.893 1.00 19.64 C ATOM 575 HG1 THR A 662 -29.794 -14.682 -21.636 1.00 0.00 H ATOM 576 H THR A 662 -31.131 -13.692 -18.555 1.00 0.00 H ATOM 577 N LYS A 663 -30.648 -18.070 -19.112 1.00 17.67 N ATOM 578 CA LYS A 663 -29.687 -19.149 -18.952 1.00 21.51 C ATOM 579 C LYS A 663 -28.376 -18.812 -19.646 1.00 15.66 C ATOM 580 O LYS A 663 -27.301 -19.114 -19.125 1.00 14.47 O ATOM 581 CB LYS A 663 -30.281 -20.463 -19.469 1.00 32.74 C ATOM 582 CG LYS A 663 -31.505 -20.928 -18.653 1.00 46.28 C ATOM 583 CD LYS A 663 -32.104 -22.237 -19.163 1.00 58.94 C ATOM 584 CE LYS A 663 -33.497 -22.481 -18.570 1.00 70.70 C ATOM 585 NZ LYS A 663 -34.249 -23.565 -19.274 1.00 77.30 N ATOM 586 HZ1 LYS A 663 -34.371 -23.307 -20.274 1.00 0.00 H ATOM 587 HZ2 LYS A 663 -33.716 -24.455 -19.207 1.00 0.00 H ATOM 588 HZ3 LYS A 663 -35.181 -23.684 -18.829 1.00 0.00 H ATOM 589 H LYS A 663 -31.565 -18.259 -19.566 1.00 0.00 H ATOM 590 N ASN A 664 -28.441 -18.154 -20.812 1.00 12.93 N ATOM 591 CA ASN A 664 -27.215 -17.796 -21.513 1.00 13.28 C ATOM 592 C ASN A 664 -26.400 -16.781 -20.724 1.00 12.50 C ATOM 593 O ASN A 664 -25.166 -16.859 -20.680 1.00 12.57 O ATOM 594 CB ASN A 664 -27.556 -17.244 -22.893 1.00 15.37 C ATOM 595 CG ASN A 664 -28.210 -18.281 -23.781 1.00 18.84 C ATOM 596 OD1 ASN A 664 -28.252 -19.474 -23.435 1.00 20.07 O ATOM 597 ND2 ASN A 664 -28.683 -17.850 -24.955 1.00 20.76 N ATOM 598 HD22 ASN A 664 -28.625 -16.841 -25.200 1.00 0.00 H ATOM 599 HD21 ASN A 664 -29.109 -18.524 -25.623 1.00 0.00 H ATOM 600 H ASN A 664 -29.365 -17.899 -21.216 1.00 0.00 H ATOM 601 N ALA A 665 -27.067 -15.804 -20.126 1.00 12.00 N ATOM 602 CA ALA A 665 -26.370 -14.837 -19.283 1.00 12.82 C ATOM 603 C ALA A 665 -25.713 -15.505 -18.076 1.00 12.04 C ATOM 604 O ALA A 665 -24.594 -15.138 -17.684 1.00 11.53 O ATOM 605 CB ALA A 665 -27.337 -13.737 -18.858 1.00 14.26 C ATOM 606 H ALA A 665 -28.096 -15.726 -20.258 1.00 0.00 H ATOM 607 N ARG A 666 -26.386 -16.489 -17.477 1.00 10.81 N ATOM 608 CA ARG A 666 -25.783 -17.205 -16.356 1.00 10.87 C ATOM 609 C ARG A 666 -24.565 -18.007 -16.814 1.00 10.17 C ATOM 610 O ARG A 666 -23.524 -18.020 -16.141 1.00 10.81 O ATOM 611 CB ARG A 666 -26.813 -18.133 -15.717 1.00 11.72 C ATOM 612 CG ARG A 666 -26.283 -18.822 -14.474 1.00 13.76 C ATOM 613 CD ARG A 666 -27.280 -19.777 -13.855 1.00 15.66 C ATOM 614 NE ARG A 666 -26.649 -20.565 -12.791 1.00 19.75 N ATOM 615 CZ ARG A 666 -26.699 -20.268 -11.498 1.00 19.77 C ATOM 616 NH1 ARG A 666 -27.378 -19.193 -11.071 1.00 19.00 N ATOM 617 NH2 ARG A 666 -26.083 -21.064 -10.615 1.00 18.36 N ATOM 618 HE ARG A 666 -26.124 -21.419 -13.070 1.00 0.00 H ATOM 619 HH12 ARG A 666 -27.411 -18.968 -10.056 1.00 0.00 H ATOM 620 HH11 ARG A 666 -27.871 -18.584 -11.755 1.00 0.00 H ATOM 621 HH22 ARG A 666 -26.117 -20.839 -9.600 1.00 0.00 H ATOM 622 HH21 ARG A 666 -25.571 -21.907 -10.944 1.00 0.00 H ATOM 623 H ARG A 666 -27.338 -16.746 -17.808 1.00 0.00 H ATOM 624 N ASN A 667 -24.683 -18.688 -17.954 1.00 9.29 N ATOM 625 CA ASN A 667 -23.550 -19.405 -18.514 1.00 10.13 C ATOM 626 C ASN A 667 -22.354 -18.475 -18.715 1.00 9.30 C ATOM 627 O ASN A 667 -21.203 -18.831 -18.400 1.00 10.20 O ATOM 628 CB ASN A 667 -23.987 -20.038 -19.841 1.00 9.81 C ATOM 629 CG ASN A 667 -22.864 -20.729 -20.534 1.00 10.99 C ATOM 630 OD1 ASN A 667 -22.445 -20.369 -21.667 1.00 13.83 O ATOM 631 ND2 ASN A 667 -22.370 -21.748 -19.891 1.00 9.79 N ATOM 632 HD22 ASN A 667 -22.749 -22.007 -18.958 1.00 0.00 H ATOM 633 HD21 ASN A 667 -21.597 -22.303 -20.311 1.00 0.00 H ATOM 634 H ASN A 667 -25.598 -18.706 -18.449 1.00 0.00 H ATOM 635 N ASP A 668 -22.588 -17.296 -19.301 1.00 9.57 N ATOM 636 CA ASP A 668 -21.482 -16.369 -19.526 1.00 10.31 C ATOM 637 C ASP A 668 -20.885 -15.886 -18.199 1.00 10.04 C ATOM 638 O ASP A 668 -19.661 -15.705 -18.079 1.00 11.34 O ATOM 639 CB ASP A 668 -21.949 -15.200 -20.389 1.00 12.53 C ATOM 640 CG ASP A 668 -22.120 -15.583 -21.876 1.00 17.28 C ATOM 641 OD1 ASP A 668 -21.656 -16.666 -22.285 1.00 19.57 O ATOM 642 OD2 ASP A 668 -22.716 -14.800 -22.646 1.00 20.85 O ATOM 643 H ASP A 668 -23.552 -17.041 -19.595 1.00 0.00 H ATOM 644 N PHE A 669 -21.732 -15.687 -17.185 1.00 9.49 N ATOM 645 CA PHE A 669 -21.230 -15.249 -15.887 1.00 9.51 C ATOM 646 C PHE A 669 -20.346 -16.323 -15.256 1.00 10.67 C ATOM 647 O PHE A 669 -19.292 -16.012 -14.683 1.00 11.06 O ATOM 648 CB PHE A 669 -22.410 -14.890 -14.986 1.00 9.95 C ATOM 649 CG PHE A 669 -22.036 -14.053 -13.796 1.00 10.80 C ATOM 650 CD1 PHE A 669 -21.579 -14.636 -12.630 1.00 12.15 C ATOM 651 CD2 PHE A 669 -22.153 -12.664 -13.830 1.00 11.68 C ATOM 652 CE1 PHE A 669 -21.269 -13.847 -11.506 1.00 13.23 C ATOM 653 CE2 PHE A 669 -21.847 -11.900 -12.728 1.00 12.82 C ATOM 654 CZ PHE A 669 -21.402 -12.506 -11.564 1.00 13.37 C ATOM 655 H PHE A 669 -22.751 -15.845 -17.321 1.00 0.00 H ATOM 656 N LEU A 670 -20.760 -17.593 -15.345 1.00 9.48 N ATOM 657 CA LEU A 670 -19.950 -18.676 -14.791 1.00 10.00 C ATOM 658 C LEU A 670 -18.596 -18.751 -15.480 1.00 9.58 C ATOM 659 O LEU A 670 -17.591 -19.046 -14.841 1.00 10.46 O ATOM 660 CB LEU A 670 -20.683 -20.014 -14.895 1.00 12.13 C ATOM 661 CG LEU A 670 -21.858 -20.213 -13.934 1.00 14.44 C ATOM 662 CD1 LEU A 670 -22.580 -21.540 -14.239 1.00 17.78 C ATOM 663 CD2 LEU A 670 -21.427 -20.153 -12.457 1.00 15.86 C ATOM 664 H LEU A 670 -21.664 -17.810 -15.811 1.00 0.00 H ATOM 665 N LYS A 671 -18.547 -18.517 -16.802 1.00 9.34 N ATOM 666 CA LYS A 671 -17.254 -18.504 -17.481 1.00 9.95 C ATOM 667 C LYS A 671 -16.410 -17.321 -17.023 1.00 10.83 C ATOM 668 O LYS A 671 -15.185 -17.438 -16.894 1.00 10.52 O ATOM 669 CB LYS A 671 -17.439 -18.496 -19.001 1.00 8.91 C ATOM 670 CG LYS A 671 -18.030 -19.804 -19.502 1.00 10.81 C ATOM 671 CD LYS A 671 -17.946 -19.999 -20.996 1.00 10.56 C ATOM 672 CE LYS A 671 -18.813 -19.018 -21.733 1.00 10.19 C ATOM 673 NZ LYS A 671 -18.830 -19.375 -23.192 1.00 11.16 N ATOM 674 HZ1 LYS A 671 -17.861 -19.338 -23.568 1.00 0.00 H ATOM 675 HZ2 LYS A 671 -19.211 -20.336 -23.308 1.00 0.00 H ATOM 676 HZ3 LYS A 671 -19.429 -18.698 -23.706 1.00 0.00 H ATOM 677 H LYS A 671 -19.422 -18.347 -17.337 1.00 0.00 H ATOM 678 N GLU A 672 -17.044 -16.166 -16.792 1.00 10.60 N ATOM 679 CA GLU A 672 -16.301 -15.021 -16.280 1.00 11.59 C ATOM 680 C GLU A 672 -15.694 -15.313 -14.910 1.00 9.94 C ATOM 681 O GLU A 672 -14.558 -14.923 -14.636 1.00 11.02 O ATOM 682 CB GLU A 672 -17.169 -13.766 -16.221 1.00 13.22 C ATOM 683 CG GLU A 672 -16.317 -12.512 -15.929 1.00 16.81 C ATOM 684 CD GLU A 672 -17.051 -11.209 -16.092 1.00 20.74 C ATOM 685 OE1 GLU A 672 -18.290 -11.195 -15.959 1.00 22.38 O ATOM 686 OE2 GLU A 672 -16.372 -10.182 -16.348 1.00 21.71 O ATOM 687 H GLU A 672 -18.064 -16.085 -16.977 1.00 0.00 H ATOM 688 N VAL A 673 -16.423 -16.018 -14.042 1.00 10.54 N ATOM 689 CA VAL A 673 -15.856 -16.412 -12.755 1.00 11.63 C ATOM 690 C VAL A 673 -14.592 -17.234 -12.965 1.00 12.00 C ATOM 691 O VAL A 673 -13.587 -17.031 -12.286 1.00 12.13 O ATOM 692 CB VAL A 673 -16.889 -17.172 -11.898 1.00 11.74 C ATOM 693 CG1 VAL A 673 -16.229 -17.716 -10.603 1.00 13.23 C ATOM 694 CG2 VAL A 673 -18.081 -16.262 -11.549 1.00 13.06 C ATOM 695 H VAL A 673 -17.398 -16.288 -14.283 1.00 0.00 H ATOM 696 N LYS A 674 -14.634 -18.193 -13.905 1.00 11.09 N ATOM 697 CA LYS A 674 -13.467 -19.035 -14.180 1.00 12.99 C ATOM 698 C LYS A 674 -12.277 -18.206 -14.635 1.00 12.60 C ATOM 699 O LYS A 674 -11.135 -18.473 -14.243 1.00 13.04 O ATOM 700 CB LYS A 674 -13.785 -20.048 -15.281 1.00 14.62 C ATOM 701 CG LYS A 674 -14.723 -21.142 -14.924 1.00 16.62 C ATOM 702 CD LYS A 674 -14.909 -22.078 -16.114 1.00 19.09 C ATOM 703 CE LYS A 674 -15.899 -23.145 -15.800 1.00 21.64 C ATOM 704 NZ LYS A 674 -15.300 -24.085 -14.800 1.00 23.43 N ATOM 705 HZ1 LYS A 674 -14.439 -24.510 -15.199 1.00 0.00 H ATOM 706 HZ2 LYS A 674 -15.061 -23.561 -13.934 1.00 0.00 H ATOM 707 HZ3 LYS A 674 -15.986 -24.834 -14.575 1.00 0.00 H ATOM 708 H LYS A 674 -15.510 -18.340 -14.447 1.00 0.00 H ATOM 709 N ILE A 675 -12.516 -17.255 -15.533 1.00 11.45 N ATOM 710 CA ILE A 675 -11.445 -16.382 -15.999 1.00 12.20 C ATOM 711 C ILE A 675 -10.914 -15.536 -14.850 1.00 12.00 C ATOM 712 O ILE A 675 -9.700 -15.459 -14.609 1.00 13.11 O ATOM 713 CB ILE A 675 -11.941 -15.507 -17.162 1.00 14.50 C ATOM 714 CG1 ILE A 675 -12.261 -16.371 -18.388 1.00 16.48 C ATOM 715 CG2 ILE A 675 -10.906 -14.431 -17.462 1.00 17.06 C ATOM 716 CD1 ILE A 675 -13.125 -15.682 -19.421 1.00 17.66 C ATOM 717 H ILE A 675 -13.478 -17.132 -15.908 1.00 0.00 H ATOM 718 N MET A 676 -11.818 -14.853 -14.149 1.00 12.15 N ATOM 719 CA MET A 676 -11.402 -13.945 -13.083 1.00 12.20 C ATOM 720 C MET A 676 -10.650 -14.661 -11.972 1.00 12.51 C ATOM 721 O MET A 676 -9.775 -14.062 -11.338 1.00 12.64 O ATOM 722 CB MET A 676 -12.615 -13.247 -12.488 1.00 11.93 C ATOM 723 CG MET A 676 -13.292 -12.283 -13.426 1.00 13.38 C ATOM 724 SD MET A 676 -12.213 -10.973 -14.009 1.00 16.13 S ATOM 725 CE MET A 676 -11.631 -10.318 -12.472 1.00 17.22 C ATOM 726 H MET A 676 -12.829 -14.967 -14.363 1.00 0.00 H ATOM 727 N SER A 677 -10.970 -15.937 -11.728 1.00 13.40 N ATOM 728 CA SER A 677 -10.320 -16.710 -10.672 1.00 14.54 C ATOM 729 C SER A 677 -8.820 -16.885 -10.893 1.00 14.77 C ATOM 730 O SER A 677 -8.105 -17.264 -9.960 1.00 16.47 O ATOM 731 CB SER A 677 -10.945 -18.103 -10.595 1.00 15.09 C ATOM 732 OG SER A 677 -10.472 -18.925 -11.647 1.00 15.06 O ATOM 733 HG SER A 677 -10.710 -18.516 -12.516 1.00 0.00 H ATOM 734 H SER A 677 -11.704 -16.393 -12.308 1.00 0.00 H ATOM 735 N ARG A 678 -8.334 -16.675 -12.112 1.00 13.38 N ATOM 736 CA ARG A 678 -6.911 -16.781 -12.398 1.00 14.08 C ATOM 737 C ARG A 678 -6.143 -15.487 -12.192 1.00 14.97 C ATOM 738 O ARG A 678 -4.914 -15.525 -12.189 1.00 17.47 O ATOM 739 CB ARG A 678 -6.709 -17.131 -13.876 1.00 15.18 C ATOM 740 CG ARG A 678 -7.347 -18.440 -14.291 1.00 16.73 C ATOM 741 CD ARG A 678 -7.217 -18.620 -15.802 1.00 18.70 C ATOM 742 NE ARG A 678 -5.806 -18.735 -16.177 1.00 18.78 N ATOM 743 CZ ARG A 678 -5.314 -18.460 -17.380 1.00 18.42 C ATOM 744 NH1 ARG A 678 -6.106 -18.002 -18.341 1.00 19.05 N ATOM 745 NH2 ARG A 678 -4.021 -18.632 -17.618 1.00 18.49 N ATOM 746 HE ARG A 678 -5.139 -19.056 -15.447 1.00 0.00 H ATOM 747 HH12 ARG A 678 -5.714 -17.789 -19.280 1.00 0.00 H ATOM 748 HH11 ARG A 678 -7.119 -17.856 -18.155 1.00 0.00 H ATOM 749 HH22 ARG A 678 -3.632 -18.418 -18.559 1.00 0.00 H ATOM 750 HH21 ARG A 678 -3.395 -18.981 -16.864 1.00 0.00 H ATOM 751 H ARG A 678 -8.988 -16.428 -12.882 1.00 0.00 H ATOM 752 N LEU A 679 -6.808 -14.337 -12.150 1.00 14.35 N ATOM 753 CA LEU A 679 -6.128 -13.052 -12.307 1.00 14.22 C ATOM 754 C LEU A 679 -5.639 -12.529 -10.963 1.00 14.78 C ATOM 755 O LEU A 679 -6.429 -12.103 -10.112 1.00 16.19 O ATOM 756 CB LEU A 679 -7.035 -12.044 -12.996 1.00 14.89 C ATOM 757 CG LEU A 679 -7.590 -12.517 -14.335 1.00 14.53 C ATOM 758 CD1 LEU A 679 -8.482 -11.439 -14.934 1.00 16.00 C ATOM 759 CD2 LEU A 679 -6.472 -12.893 -15.305 1.00 16.00 C ATOM 760 H LEU A 679 -7.837 -14.351 -12.002 1.00 0.00 H ATOM 761 N LYS A 680 -4.319 -12.519 -10.791 1.00 13.18 N ATOM 762 CA LYS A 680 -3.712 -12.159 -9.516 1.00 15.48 C ATOM 763 C LYS A 680 -2.529 -11.240 -9.805 1.00 15.39 C ATOM 764 O LYS A 680 -1.363 -11.661 -9.828 1.00 16.98 O ATOM 765 CB LYS A 680 -3.309 -13.424 -8.756 1.00 18.69 C ATOM 766 CG LYS A 680 -4.476 -14.376 -8.540 1.00 22.66 C ATOM 767 CD LYS A 680 -4.022 -15.657 -7.883 1.00 26.51 C ATOM 768 CE LYS A 680 -5.185 -16.622 -7.674 1.00 29.94 C ATOM 769 NZ LYS A 680 -4.779 -17.806 -6.859 1.00 33.44 N ATOM 770 HZ1 LYS A 680 -4.014 -18.315 -7.346 1.00 0.00 H ATOM 771 HZ2 LYS A 680 -4.446 -17.486 -5.927 1.00 0.00 H ATOM 772 HZ3 LYS A 680 -5.596 -18.439 -6.738 1.00 0.00 H ATOM 773 H LYS A 680 -3.704 -12.775 -11.589 1.00 0.00 H ATOM 774 N ASP A 681 -2.848 -9.969 -10.048 1.00 14.17 N ATOM 775 CA ASP A 681 -1.835 -8.969 -10.334 1.00 13.18 C ATOM 776 C ASP A 681 -2.287 -7.619 -9.798 1.00 13.10 C ATOM 777 O ASP A 681 -3.489 -7.312 -9.847 1.00 13.44 O ATOM 778 CB ASP A 681 -1.614 -8.868 -11.844 1.00 13.06 C ATOM 779 CG ASP A 681 -0.492 -7.933 -12.205 1.00 12.39 C ATOM 780 OD1 ASP A 681 0.673 -8.373 -12.142 1.00 14.46 O ATOM 781 OD2 ASP A 681 -0.777 -6.771 -12.570 1.00 13.62 O ATOM 782 H ASP A 681 -3.849 -9.686 -10.032 1.00 0.00 H ATOM 783 N PRO A 682 -1.357 -6.795 -9.312 1.00 13.79 N ATOM 784 CA PRO A 682 -1.751 -5.504 -8.723 1.00 15.19 C ATOM 785 C PRO A 682 -2.398 -4.542 -9.697 1.00 13.49 C ATOM 786 O PRO A 682 -3.044 -3.581 -9.253 1.00 14.35 O ATOM 787 CB PRO A 682 -0.426 -4.929 -8.205 1.00 17.37 C ATOM 788 CG PRO A 682 0.518 -6.046 -8.164 1.00 18.98 C ATOM 789 CD PRO A 682 0.083 -7.068 -9.145 1.00 16.81 C ATOM 790 N ASN A 683 -2.219 -4.729 -11.007 1.00 11.55 N ATOM 791 CA ASN A 683 -2.762 -3.797 -11.984 1.00 10.79 C ATOM 792 C ASN A 683 -3.871 -4.415 -12.833 1.00 10.85 C ATOM 793 O ASN A 683 -4.214 -3.869 -13.882 1.00 10.62 O ATOM 794 CB ASN A 683 -1.646 -3.213 -12.848 1.00 11.33 C ATOM 795 CG ASN A 683 -0.669 -2.387 -12.038 1.00 12.21 C ATOM 796 OD1 ASN A 683 0.507 -2.745 -11.895 1.00 13.61 O ATOM 797 ND2 ASN A 683 -1.161 -1.299 -11.458 1.00 13.13 N ATOM 798 HD22 ASN A 683 -2.156 -1.036 -11.606 1.00 0.00 H ATOM 799 HD21 ASN A 683 -0.551 -0.710 -10.856 1.00 0.00 H ATOM 800 H ASN A 683 -1.681 -5.556 -11.335 1.00 0.00 H ATOM 801 N ILE A 684 -4.462 -5.519 -12.363 1.00 10.93 N ATOM 802 CA ILE A 684 -5.648 -6.139 -12.946 1.00 11.55 C ATOM 803 C ILE A 684 -6.655 -6.311 -11.816 1.00 11.83 C ATOM 804 O ILE A 684 -6.273 -6.598 -10.678 1.00 12.84 O ATOM 805 CB ILE A 684 -5.321 -7.523 -13.559 1.00 11.44 C ATOM 806 CG1 ILE A 684 -4.194 -7.436 -14.604 1.00 13.40 C ATOM 807 CG2 ILE A 684 -6.551 -8.181 -14.135 1.00 12.98 C ATOM 808 CD1 ILE A 684 -4.519 -6.640 -15.868 1.00 14.39 C ATOM 809 H ILE A 684 -4.047 -5.968 -11.522 1.00 0.00 H ATOM 810 N ILE A 685 -7.940 -6.130 -12.122 1.00 11.90 N ATOM 811 CA ILE A 685 -8.993 -6.503 -11.169 1.00 12.26 C ATOM 812 C ILE A 685 -8.719 -7.891 -10.595 1.00 13.25 C ATOM 813 O ILE A 685 -8.485 -8.856 -11.333 1.00 13.42 O ATOM 814 CB ILE A 685 -10.377 -6.419 -11.851 1.00 13.66 C ATOM 815 CG1 ILE A 685 -10.668 -4.977 -12.263 1.00 16.64 C ATOM 816 CG2 ILE A 685 -11.475 -6.956 -10.960 1.00 15.69 C ATOM 817 CD1 ILE A 685 -10.735 -4.033 -11.128 1.00 17.96 C ATOM 818 H ILE A 685 -8.199 -5.721 -13.043 1.00 0.00 H ATOM 819 N ARG A 686 -8.800 -8.004 -9.268 1.00 15.47 N ATOM 820 CA ARG A 686 -8.573 -9.254 -8.559 1.00 17.04 C ATOM 821 C ARG A 686 -9.824 -9.614 -7.769 1.00 16.01 C ATOM 822 O ARG A 686 -10.459 -8.745 -7.168 1.00 19.25 O ATOM 823 CB ARG A 686 -7.406 -9.044 -7.584 1.00 21.04 C ATOM 824 CG ARG A 686 -7.085 -10.184 -6.619 1.00 25.09 C ATOM 825 CD ARG A 686 -6.272 -9.686 -5.394 1.00 28.58 C ATOM 826 NE ARG A 686 -6.764 -8.417 -4.854 1.00 31.61 N ATOM 827 CZ ARG A 686 -6.118 -7.662 -3.970 1.00 33.12 C ATOM 828 NH1 ARG A 686 -4.931 -8.023 -3.501 1.00 33.20 N ATOM 829 NH2 ARG A 686 -6.663 -6.536 -3.562 1.00 33.89 N ATOM 830 HE ARG A 686 -7.690 -8.080 -5.187 1.00 0.00 H ATOM 831 HH12 ARG A 686 -4.440 -7.421 -2.810 1.00 0.00 H ATOM 832 HH11 ARG A 686 -4.492 -8.908 -3.824 1.00 0.00 H ATOM 833 HH22 ARG A 686 -6.166 -5.938 -2.871 1.00 0.00 H ATOM 834 HH21 ARG A 686 -7.591 -6.244 -3.931 1.00 0.00 H ATOM 835 H ARG A 686 -9.037 -7.157 -8.713 1.00 0.00 H ATOM 836 N LEU A 687 -10.184 -10.887 -7.762 1.00 14.49 N ATOM 837 CA LEU A 687 -11.314 -11.313 -6.943 1.00 16.54 C ATOM 838 C LEU A 687 -10.916 -11.388 -5.478 1.00 16.84 C ATOM 839 O LEU A 687 -9.939 -12.050 -5.113 1.00 18.87 O ATOM 840 CB LEU A 687 -11.804 -12.685 -7.364 1.00 19.11 C ATOM 841 CG LEU A 687 -12.475 -12.848 -8.706 1.00 21.54 C ATOM 842 CD1 LEU A 687 -12.930 -14.309 -8.827 1.00 23.56 C ATOM 843 CD2 LEU A 687 -13.634 -11.894 -8.829 1.00 20.81 C ATOM 844 H LEU A 687 -9.664 -11.580 -8.337 1.00 0.00 H ATOM 845 N LEU A 688 -11.679 -10.715 -4.636 1.00 15.63 N ATOM 846 CA LEU A 688 -11.533 -10.902 -3.203 1.00 15.47 C ATOM 847 C LEU A 688 -12.324 -12.099 -2.723 1.00 16.75 C ATOM 848 O LEU A 688 -11.990 -12.680 -1.680 1.00 18.83 O ATOM 849 CB LEU A 688 -12.004 -9.658 -2.444 1.00 17.27 C ATOM 850 CG LEU A 688 -11.237 -8.360 -2.738 1.00 19.51 C ATOM 851 CD1 LEU A 688 -11.958 -7.179 -2.127 1.00 19.60 C ATOM 852 CD2 LEU A 688 -9.813 -8.438 -2.184 1.00 21.44 C ATOM 853 H LEU A 688 -12.388 -10.048 -5.001 1.00 0.00 H ATOM 854 N GLY A 689 -13.342 -12.485 -3.481 1.00 15.40 N ATOM 855 CA GLY A 689 -14.230 -13.566 -3.107 1.00 14.81 C ATOM 856 C GLY A 689 -15.351 -13.652 -4.112 1.00 14.39 C ATOM 857 O GLY A 689 -15.513 -12.791 -4.985 1.00 15.06 O ATOM 858 H GLY A 689 -13.509 -11.991 -4.381 1.00 0.00 H ATOM 859 N VAL A 690 -16.116 -14.733 -4.003 1.00 15.07 N ATOM 860 CA VAL A 690 -17.280 -14.938 -4.846 1.00 14.50 C ATOM 861 C VAL A 690 -18.416 -15.461 -3.987 1.00 13.62 C ATOM 862 O VAL A 690 -18.200 -16.020 -2.911 1.00 13.38 O ATOM 863 CB VAL A 690 -17.012 -15.930 -5.995 1.00 16.94 C ATOM 864 CG1 VAL A 690 -15.861 -15.423 -6.850 1.00 16.11 C ATOM 865 CG2 VAL A 690 -16.739 -17.351 -5.448 1.00 17.43 C ATOM 866 H VAL A 690 -15.874 -15.453 -3.293 1.00 0.00 H ATOM 867 N CYS A 691 -19.635 -15.309 -4.494 1.00 14.25 N ATOM 868 CA CYS A 691 -20.803 -15.957 -3.902 1.00 15.53 C ATOM 869 C CYS A 691 -21.485 -16.675 -5.058 1.00 15.02 C ATOM 870 O CYS A 691 -22.229 -16.042 -5.809 1.00 14.52 O ATOM 871 CB CYS A 691 -21.764 -14.954 -3.257 1.00 17.08 C ATOM 872 SG CYS A 691 -21.043 -13.809 -2.065 1.00 18.91 S ATOM 873 H CYS A 691 -19.761 -14.712 -5.336 1.00 0.00 H ATOM 874 N VAL A 692 -21.237 -17.980 -5.207 1.00 15.92 N ATOM 875 CA VAL A 692 -21.739 -18.707 -6.368 1.00 16.58 C ATOM 876 C VAL A 692 -22.447 -20.008 -6.009 1.00 17.97 C ATOM 877 O VAL A 692 -23.014 -20.665 -6.887 1.00 17.97 O ATOM 878 CB VAL A 692 -20.612 -18.970 -7.382 1.00 17.86 C ATOM 879 CG1 VAL A 692 -20.112 -17.659 -7.961 1.00 18.94 C ATOM 880 CG2 VAL A 692 -19.472 -19.777 -6.751 1.00 18.73 C ATOM 881 H VAL A 692 -20.680 -18.483 -4.487 1.00 0.00 H ATOM 882 N GLN A 693 -22.415 -20.417 -4.744 1.00 19.84 N ATOM 883 CA GLN A 693 -23.107 -21.653 -4.404 1.00 22.67 C ATOM 884 C GLN A 693 -24.617 -21.475 -4.381 1.00 23.49 C ATOM 885 O GLN A 693 -25.352 -22.459 -4.552 1.00 25.38 O ATOM 886 CB GLN A 693 -22.623 -22.190 -3.055 1.00 26.80 C ATOM 887 CG GLN A 693 -21.116 -22.409 -2.975 1.00 32.36 C ATOM 888 CD GLN A 693 -20.590 -23.454 -3.948 1.00 37.33 C ATOM 889 OE1 GLN A 693 -21.307 -24.381 -4.346 1.00 39.52 O ATOM 890 NE2 GLN A 693 -19.318 -23.322 -4.325 1.00 38.43 N ATOM 891 HE22 GLN A 693 -18.749 -22.528 -3.967 1.00 0.00 H ATOM 892 HE21 GLN A 693 -18.894 -24.013 -4.977 1.00 0.00 H ATOM 893 H GLN A 693 -21.910 -19.870 -4.018 1.00 0.00 H ATOM 894 N ASP A 694 -25.086 -20.247 -4.174 1.00 21.94 N ATOM 895 CA ASP A 694 -26.491 -19.893 -4.285 1.00 21.91 C ATOM 896 C ASP A 694 -26.577 -18.571 -5.041 1.00 19.50 C ATOM 897 O ASP A 694 -25.560 -18.001 -5.434 1.00 17.90 O ATOM 898 CB ASP A 694 -27.179 -19.853 -2.912 1.00 23.63 C ATOM 899 CG ASP A 694 -26.425 -19.007 -1.883 1.00 26.35 C ATOM 900 OD1 ASP A 694 -25.523 -18.225 -2.253 1.00 27.65 O ATOM 901 OD2 ASP A 694 -26.742 -19.123 -0.681 1.00 28.91 O ATOM 902 H ASP A 694 -24.410 -19.499 -3.919 1.00 0.00 H ATOM 903 N ASP A 695 -27.803 -18.084 -5.250 1.00 19.37 N ATOM 904 CA ASP A 695 -28.043 -16.890 -6.040 1.00 18.70 C ATOM 905 C ASP A 695 -28.317 -15.707 -5.134 1.00 17.81 C ATOM 906 O ASP A 695 -28.776 -15.867 -3.997 1.00 20.22 O ATOM 907 CB ASP A 695 -29.258 -17.089 -6.942 1.00 21.84 C ATOM 908 CG ASP A 695 -28.965 -17.950 -8.139 1.00 24.82 C ATOM 909 OD1 ASP A 695 -27.791 -18.352 -8.324 1.00 23.03 O ATOM 910 OD2 ASP A 695 -29.927 -18.230 -8.898 1.00 27.36 O ATOM 911 H ASP A 695 -28.616 -18.579 -4.831 1.00 0.00 H ATOM 912 N PRO A 696 -28.076 -14.485 -5.623 1.00 16.93 N ATOM 913 CA PRO A 696 -27.523 -14.157 -6.939 1.00 16.58 C ATOM 914 C PRO A 696 -26.027 -14.417 -7.005 1.00 14.96 C ATOM 915 O PRO A 696 -25.311 -14.212 -6.022 1.00 15.74 O ATOM 916 CB PRO A 696 -27.788 -12.658 -7.056 1.00 19.33 C ATOM 917 CG PRO A 696 -27.837 -12.177 -5.667 1.00 20.32 C ATOM 918 CD PRO A 696 -28.393 -13.282 -4.838 1.00 18.67 C ATOM 919 N LEU A 697 -25.548 -14.866 -8.157 1.00 13.28 N ATOM 920 CA LEU A 697 -24.112 -15.028 -8.327 1.00 12.25 C ATOM 921 C LEU A 697 -23.440 -13.679 -8.225 1.00 12.93 C ATOM 922 O LEU A 697 -23.903 -12.697 -8.821 1.00 12.20 O ATOM 923 CB LEU A 697 -23.787 -15.623 -9.695 1.00 12.48 C ATOM 924 CG LEU A 697 -24.473 -16.944 -10.025 1.00 14.10 C ATOM 925 CD1 LEU A 697 -23.945 -17.447 -11.359 1.00 15.72 C ATOM 926 CD2 LEU A 697 -24.297 -18.003 -8.938 1.00 14.91 C ATOM 927 H LEU A 697 -26.196 -15.101 -8.936 1.00 0.00 H ATOM 928 N CYS A 698 -22.307 -13.635 -7.528 1.00 12.82 N ATOM 929 CA CYS A 698 -21.579 -12.380 -7.373 1.00 13.79 C ATOM 930 C CYS A 698 -20.079 -12.603 -7.373 1.00 13.47 C ATOM 931 O CYS A 698 -19.590 -13.650 -6.931 1.00 12.79 O ATOM 932 CB CYS A 698 -21.747 -11.729 -5.977 1.00 15.12 C ATOM 933 SG CYS A 698 -23.359 -11.560 -5.229 1.00 16.28 S ATOM 934 H CYS A 698 -21.937 -14.503 -7.090 1.00 0.00 H ATOM 935 N MET A 699 -19.362 -11.588 -7.839 1.00 11.44 N ATOM 936 CA MET A 699 -17.909 -11.496 -7.775 1.00 9.92 C ATOM 937 C MET A 699 -17.553 -10.192 -7.071 1.00 12.11 C ATOM 938 O MET A 699 -18.107 -9.133 -7.397 1.00 12.88 O ATOM 939 CB MET A 699 -17.329 -11.501 -9.195 1.00 11.21 C ATOM 940 CG MET A 699 -17.408 -12.817 -9.929 1.00 11.96 C ATOM 941 SD MET A 699 -16.577 -12.735 -11.544 1.00 13.48 S ATOM 942 CE MET A 699 -17.778 -11.848 -12.493 1.00 17.22 C ATOM 943 H MET A 699 -19.875 -10.800 -8.283 1.00 0.00 H ATOM 944 N ILE A 700 -16.628 -10.275 -6.120 1.00 10.43 N ATOM 945 CA ILE A 700 -16.273 -9.168 -5.240 1.00 10.79 C ATOM 946 C ILE A 700 -14.848 -8.729 -5.548 1.00 12.52 C ATOM 947 O ILE A 700 -13.951 -9.566 -5.650 1.00 12.99 O ATOM 948 CB ILE A 700 -16.357 -9.625 -3.768 1.00 12.52 C ATOM 949 CG1 ILE A 700 -17.736 -10.185 -3.446 1.00 14.26 C ATOM 950 CG2 ILE A 700 -16.063 -8.469 -2.829 1.00 14.30 C ATOM 951 CD1 ILE A 700 -17.728 -11.123 -2.275 1.00 17.53 C ATOM 952 H ILE A 700 -16.130 -11.180 -5.997 1.00 0.00 H ATOM 953 N THR A 701 -14.623 -7.421 -5.626 1.00 12.13 N ATOM 954 CA THR A 701 -13.284 -6.886 -5.863 1.00 12.68 C ATOM 955 C THR A 701 -13.104 -5.590 -5.074 1.00 12.83 C ATOM 956 O THR A 701 -14.053 -5.031 -4.514 1.00 13.47 O ATOM 957 CB THR A 701 -13.016 -6.673 -7.365 1.00 14.40 C ATOM 958 OG1 THR A 701 -11.619 -6.398 -7.589 1.00 16.02 O ATOM 959 CG2 THR A 701 -13.847 -5.521 -7.911 1.00 16.30 C ATOM 960 HG1 THR A 701 -11.078 -7.163 -7.269 1.00 0.00 H ATOM 961 H THR A 701 -15.420 -6.762 -5.516 1.00 0.00 H ATOM 962 N ASP A 702 -11.861 -5.120 -5.023 1.00 14.18 N ATOM 963 CA ASP A 702 -11.541 -3.882 -4.327 1.00 16.63 C ATOM 964 C ASP A 702 -12.249 -2.708 -4.980 1.00 15.90 C ATOM 965 O ASP A 702 -12.350 -2.621 -6.207 1.00 17.45 O ATOM 966 CB ASP A 702 -10.029 -3.625 -4.392 1.00 20.84 C ATOM 967 CG ASP A 702 -9.211 -4.872 -4.128 1.00 26.66 C ATOM 968 OD1 ASP A 702 -9.064 -5.735 -5.049 1.00 29.43 O ATOM 969 OD2 ASP A 702 -8.727 -4.995 -2.981 1.00 28.45 O ATOM 970 H ASP A 702 -11.099 -5.650 -5.492 1.00 0.00 H ATOM 971 N TYR A 703 -12.725 -1.784 -4.154 1.00 14.51 N ATOM 972 CA TYR A 703 -13.283 -0.539 -4.662 1.00 15.21 C ATOM 973 C TYR A 703 -12.163 0.397 -5.094 1.00 15.07 C ATOM 974 O TYR A 703 -11.200 0.620 -4.353 1.00 17.51 O ATOM 975 CB TYR A 703 -14.127 0.127 -3.585 1.00 15.81 C ATOM 976 CG TYR A 703 -14.743 1.435 -3.996 1.00 16.96 C ATOM 977 CD1 TYR A 703 -15.520 1.532 -5.136 1.00 18.47 C ATOM 978 CD2 TYR A 703 -14.581 2.557 -3.211 1.00 17.62 C ATOM 979 CE1 TYR A 703 -16.107 2.712 -5.489 1.00 20.14 C ATOM 980 CE2 TYR A 703 -15.155 3.755 -3.554 1.00 19.88 C ATOM 981 CZ TYR A 703 -15.927 3.829 -4.697 1.00 21.31 C ATOM 982 OH TYR A 703 -16.513 5.027 -5.041 1.00 22.97 O ATOM 983 HH TYR A 703 -17.028 4.913 -5.879 1.00 0.00 H ATOM 984 H TYR A 703 -12.699 -1.952 -3.128 1.00 0.00 H ATOM 985 N MET A 704 -12.314 0.956 -6.297 1.00 15.39 N ATOM 986 CA MET A 704 -11.404 1.934 -6.883 1.00 16.02 C ATOM 987 C MET A 704 -12.145 3.268 -6.914 1.00 17.08 C ATOM 988 O MET A 704 -13.034 3.476 -7.749 1.00 18.09 O ATOM 989 CB MET A 704 -11.010 1.494 -8.289 1.00 17.78 C ATOM 990 CG MET A 704 -10.359 0.128 -8.333 1.00 19.59 C ATOM 991 SD MET A 704 -8.716 0.193 -7.607 1.00 22.74 S ATOM 992 CE MET A 704 -7.790 0.860 -8.986 1.00 23.32 C ATOM 993 H MET A 704 -13.142 0.673 -6.858 1.00 0.00 H ATOM 994 N GLU A 705 -11.767 4.174 -6.013 1.00 16.77 N ATOM 995 CA GLU A 705 -12.649 5.286 -5.675 1.00 19.53 C ATOM 996 C GLU A 705 -12.740 6.366 -6.749 1.00 19.00 C ATOM 997 O GLU A 705 -13.638 7.214 -6.660 1.00 20.51 O ATOM 998 CB GLU A 705 -12.238 5.905 -4.339 1.00 23.72 C ATOM 999 CG GLU A 705 -10.878 6.571 -4.348 1.00 29.65 C ATOM 1000 CD GLU A 705 -10.473 7.083 -2.968 1.00 34.98 C ATOM 1001 OE1 GLU A 705 -10.910 6.477 -1.961 1.00 37.84 O ATOM 1002 OE2 GLU A 705 -9.728 8.092 -2.881 1.00 36.07 O ATOM 1003 H GLU A 705 -10.840 4.088 -5.549 1.00 0.00 H ATOM 1004 N ASN A 706 -11.866 6.371 -7.755 1.00 17.28 N ATOM 1005 CA ASN A 706 -11.923 7.419 -8.763 1.00 16.83 C ATOM 1006 C ASN A 706 -12.515 6.965 -10.095 1.00 16.37 C ATOM 1007 O ASN A 706 -12.402 7.695 -11.083 1.00 17.58 O ATOM 1008 CB ASN A 706 -10.544 8.052 -8.953 1.00 17.56 C ATOM 1009 CG ASN A 706 -10.180 8.966 -7.819 1.00 21.34 C ATOM 1010 OD1 ASN A 706 -10.910 9.903 -7.518 1.00 23.76 O ATOM 1011 ND2 ASN A 706 -9.056 8.690 -7.163 1.00 22.09 N ATOM 1012 HD22 ASN A 706 -8.468 7.883 -7.455 1.00 0.00 H ATOM 1013 HD21 ASN A 706 -8.765 9.281 -6.358 1.00 0.00 H ATOM 1014 H ASN A 706 -11.143 5.626 -7.820 1.00 0.00 H ATOM 1015 N GLY A 707 -13.160 5.793 -10.147 1.00 15.23 N ATOM 1016 CA GLY A 707 -13.914 5.415 -11.330 1.00 14.34 C ATOM 1017 C GLY A 707 -13.034 5.105 -12.537 1.00 12.37 C ATOM 1018 O GLY A 707 -11.856 4.778 -12.414 1.00 13.39 O ATOM 1019 H GLY A 707 -13.121 5.147 -9.333 1.00 0.00 H ATOM 1020 N ASP A 708 -13.630 5.214 -13.726 1.00 11.53 N ATOM 1021 CA ASP A 708 -12.921 4.823 -14.928 1.00 12.17 C ATOM 1022 C ASP A 708 -11.927 5.903 -15.330 1.00 11.63 C ATOM 1023 O ASP A 708 -12.090 7.090 -15.019 1.00 12.11 O ATOM 1024 CB ASP A 708 -13.864 4.313 -16.048 1.00 12.32 C ATOM 1025 CG ASP A 708 -14.354 5.382 -17.015 1.00 13.19 C ATOM 1026 OD1 ASP A 708 -13.567 6.235 -17.436 1.00 14.46 O ATOM 1027 OD2 ASP A 708 -15.542 5.290 -17.440 1.00 14.60 O ATOM 1028 H ASP A 708 -14.602 5.579 -13.790 1.00 0.00 H ATOM 1029 N LEU A 709 -10.841 5.450 -15.959 1.00 10.35 N ATOM 1030 CA LEU A 709 -9.717 6.336 -16.226 1.00 10.59 C ATOM 1031 C LEU A 709 -10.075 7.415 -17.247 1.00 10.46 C ATOM 1032 O LEU A 709 -9.498 8.508 -17.218 1.00 11.88 O ATOM 1033 CB LEU A 709 -8.519 5.516 -16.696 1.00 10.48 C ATOM 1034 CG LEU A 709 -7.271 6.250 -17.197 1.00 10.52 C ATOM 1035 CD1 LEU A 709 -6.657 7.121 -16.126 1.00 11.71 C ATOM 1036 CD2 LEU A 709 -6.239 5.229 -17.695 1.00 12.05 C ATOM 1037 H LEU A 709 -10.797 4.456 -16.261 1.00 0.00 H ATOM 1038 N ASN A 710 -10.964 7.113 -18.191 1.00 11.05 N ATOM 1039 CA ASN A 710 -11.312 8.101 -19.198 1.00 10.40 C ATOM 1040 C ASN A 710 -11.996 9.298 -18.559 1.00 12.32 C ATOM 1041 O ASN A 710 -11.626 10.462 -18.810 1.00 13.06 O ATOM 1042 CB ASN A 710 -12.179 7.466 -20.285 1.00 11.07 C ATOM 1043 CG ASN A 710 -12.420 8.413 -21.449 1.00 13.59 C ATOM 1044 OD1 ASN A 710 -13.234 9.335 -21.356 1.00 16.67 O ATOM 1045 ND2 ASN A 710 -11.673 8.226 -22.518 1.00 15.58 N ATOM 1046 HD22 ASN A 710 -11.000 7.434 -22.550 1.00 0.00 H ATOM 1047 HD21 ASN A 710 -11.756 8.871 -23.330 1.00 0.00 H ATOM 1048 H ASN A 710 -11.408 6.173 -18.208 1.00 0.00 H ATOM 1049 N GLN A 711 -12.988 9.038 -17.714 1.00 13.66 N ATOM 1050 CA GLN A 711 -13.685 10.146 -17.076 1.00 14.02 C ATOM 1051 C GLN A 711 -12.774 10.856 -16.075 1.00 14.32 C ATOM 1052 O GLN A 711 -12.810 12.086 -15.954 1.00 17.32 O ATOM 1053 CB GLN A 711 -14.997 9.676 -16.439 1.00 18.77 C ATOM 1054 CG GLN A 711 -14.865 8.680 -15.324 1.00 22.47 C ATOM 1055 CD GLN A 711 -14.650 9.293 -13.932 1.00 24.72 C ATOM 1056 OE1 GLN A 711 -15.287 10.293 -13.546 1.00 28.51 O ATOM 1057 NE2 GLN A 711 -13.771 8.664 -13.158 1.00 23.13 N ATOM 1058 HE22 GLN A 711 -13.261 7.833 -13.520 1.00 0.00 H ATOM 1059 HE21 GLN A 711 -13.594 9.003 -12.191 1.00 0.00 H ATOM 1060 H GLN A 711 -13.263 8.056 -17.511 1.00 0.00 H ATOM 1061 N PHE A 712 -11.911 10.105 -15.393 1.00 14.23 N ATOM 1062 CA PHE A 712 -11.006 10.704 -14.410 1.00 15.08 C ATOM 1063 C PHE A 712 -10.012 11.625 -15.089 1.00 14.88 C ATOM 1064 O PHE A 712 -9.836 12.782 -14.691 1.00 15.22 O ATOM 1065 CB PHE A 712 -10.250 9.592 -13.675 1.00 16.89 C ATOM 1066 CG PHE A 712 -9.137 10.079 -12.767 1.00 19.17 C ATOM 1067 CD1 PHE A 712 -9.415 10.595 -11.527 1.00 21.34 C ATOM 1068 CD2 PHE A 712 -7.809 9.988 -13.168 1.00 19.70 C ATOM 1069 CE1 PHE A 712 -8.390 11.009 -10.683 1.00 22.24 C ATOM 1070 CE2 PHE A 712 -6.779 10.406 -12.347 1.00 21.32 C ATOM 1071 CZ PHE A 712 -7.067 10.920 -11.103 1.00 21.90 C ATOM 1072 H PHE A 712 -11.879 9.079 -15.561 1.00 0.00 H ATOM 1073 N LEU A 713 -9.364 11.135 -16.135 1.00 12.97 N ATOM 1074 CA LEU A 713 -8.284 11.909 -16.706 1.00 12.74 C ATOM 1075 C LEU A 713 -8.805 13.102 -17.486 1.00 12.17 C ATOM 1076 O LEU A 713 -8.157 14.148 -17.489 1.00 12.32 O ATOM 1077 CB LEU A 713 -7.407 11.014 -17.553 1.00 15.01 C ATOM 1078 CG LEU A 713 -6.077 11.566 -17.976 1.00 17.81 C ATOM 1079 CD1 LEU A 713 -5.290 12.025 -16.764 1.00 19.06 C ATOM 1080 CD2 LEU A 713 -5.364 10.425 -18.704 1.00 18.49 C ATOM 1081 H LEU A 713 -9.626 10.213 -16.537 1.00 0.00 H ATOM 1082 N SER A 714 -9.999 13.008 -18.075 1.00 13.30 N ATOM 1083 CA SER A 714 -10.449 14.094 -18.950 1.00 15.63 C ATOM 1084 C SER A 714 -10.742 15.372 -18.179 1.00 18.22 C ATOM 1085 O SER A 714 -10.782 16.453 -18.775 1.00 18.82 O ATOM 1086 CB SER A 714 -11.652 13.673 -19.797 1.00 18.11 C ATOM 1087 OG SER A 714 -12.675 13.172 -19.001 1.00 18.65 O ATOM 1088 HG SER A 714 -12.347 12.382 -18.502 1.00 0.00 H ATOM 1089 H SER A 714 -10.602 12.176 -17.915 1.00 0.00 H ATOM 1090 N ALA A 715 -10.923 15.275 -16.867 1.00 19.31 N ATOM 1091 CA ALA A 715 -11.072 16.467 -16.052 1.00 21.62 C ATOM 1092 C ALA A 715 -9.759 17.230 -15.876 1.00 21.67 C ATOM 1093 O ALA A 715 -9.792 18.414 -15.501 1.00 23.64 O ATOM 1094 CB ALA A 715 -11.638 16.055 -14.697 1.00 23.45 C ATOM 1095 H ALA A 715 -10.958 14.337 -16.419 1.00 0.00 H ATOM 1096 N HIS A 716 -8.615 16.592 -16.135 1.00 20.55 N ATOM 1097 CA HIS A 716 -7.301 17.177 -15.899 1.00 20.35 C ATOM 1098 C HIS A 716 -6.727 17.800 -17.169 1.00 20.16 C ATOM 1099 O HIS A 716 -7.071 17.418 -18.288 1.00 20.55 O ATOM 1100 CB HIS A 716 -6.311 16.106 -15.429 1.00 21.64 C ATOM 1101 CG HIS A 716 -6.650 15.469 -14.115 1.00 22.51 C ATOM 1102 ND1 HIS A 716 -7.679 14.563 -13.961 1.00 23.85 N ATOM 1103 CD2 HIS A 716 -6.051 15.567 -12.902 1.00 24.08 C ATOM 1104 CE1 HIS A 716 -7.716 14.151 -12.705 1.00 23.44 C ATOM 1105 NE2 HIS A 716 -6.742 14.749 -12.041 1.00 24.05 N ATOM 1106 H HIS A 716 -8.664 15.629 -16.525 1.00 0.00 H ATOM 1107 N GLN A 717 -5.830 18.775 -16.976 1.00 19.71 N ATOM 1108 CA GLN A 717 -4.980 19.276 -18.046 1.00 21.60 C ATOM 1109 C GLN A 717 -3.532 19.013 -17.665 1.00 19.62 C ATOM 1110 O GLN A 717 -3.198 18.831 -16.493 1.00 18.01 O ATOM 1111 CB GLN A 717 -5.166 20.781 -18.299 1.00 27.10 C ATOM 1112 CG GLN A 717 -6.557 21.188 -18.759 1.00 33.54 C ATOM 1113 CD GLN A 717 -6.777 22.696 -18.642 1.00 37.84 C ATOM 1114 OE1 GLN A 717 -5.985 23.477 -19.146 1.00 38.85 O ATOM 1115 NE2 GLN A 717 -7.844 23.099 -17.953 1.00 40.18 N ATOM 1116 HE22 GLN A 717 -8.492 22.398 -17.541 1.00 0.00 H ATOM 1117 HE21 GLN A 717 -8.029 24.115 -17.827 1.00 0.00 H ATOM 1118 H GLN A 717 -5.737 19.190 -16.027 1.00 0.00 H ATOM 1119 N LEU A 718 -2.664 18.976 -18.663 1.00 19.45 N ATOM 1120 CA LEU A 718 -1.243 18.832 -18.373 1.00 18.91 C ATOM 1121 C LEU A 718 -0.755 20.042 -17.575 1.00 19.93 C ATOM 1122 O LEU A 718 -1.091 21.187 -17.895 1.00 19.43 O ATOM 1123 CB LEU A 718 -0.476 18.725 -19.689 1.00 19.97 C ATOM 1124 CG LEU A 718 1.029 18.514 -19.551 1.00 19.86 C ATOM 1125 CD1 LEU A 718 1.280 17.114 -19.011 1.00 20.66 C ATOM 1126 CD2 LEU A 718 1.736 18.735 -20.892 1.00 19.77 C ATOM 1127 H LEU A 718 -2.993 19.049 -19.647 1.00 0.00 H ATOM 1128 N GLU A 719 0.007 19.794 -16.516 1.00 20.69 N ATOM 1129 CA GLU A 719 0.520 20.884 -15.699 1.00 23.13 C ATOM 1130 C GLU A 719 1.350 21.841 -16.545 1.00 23.68 C ATOM 1131 O GLU A 719 2.088 21.419 -17.438 1.00 23.62 O ATOM 1132 CB GLU A 719 1.399 20.263 -14.607 1.00 25.07 C ATOM 1133 CG GLU A 719 2.241 21.223 -13.797 1.00 27.26 C ATOM 1134 CD GLU A 719 3.190 20.498 -12.865 1.00 30.19 C ATOM 1135 OE1 GLU A 719 2.844 19.386 -12.403 1.00 31.80 O ATOM 1136 OE2 GLU A 719 4.287 21.034 -12.603 1.00 30.62 O ATOM 1137 H GLU A 719 0.240 18.811 -16.268 1.00 0.00 H ATOM 1138 N ASP A 720 1.227 23.134 -16.250 1.00 24.94 N ATOM 1139 CA ASP A 720 1.956 24.188 -16.950 1.00 28.20 C ATOM 1140 C ASP A 720 3.304 24.413 -16.291 1.00 29.01 C ATOM 1141 O ASP A 720 3.357 24.841 -15.147 1.00 30.09 O ATOM 1142 CB ASP A 720 1.138 25.486 -16.924 1.00 29.99 C ATOM 1143 CG ASP A 720 1.803 26.631 -17.682 1.00 32.79 C ATOM 1144 OD1 ASP A 720 2.934 26.451 -18.194 1.00 33.19 O ATOM 1145 OD2 ASP A 720 1.182 27.716 -17.773 1.00 33.08 O ATOM 1146 H ASP A 720 0.580 23.406 -15.483 1.00 0.00 H TER 1147 ASP A 720 ATOM 1148 N PRO A 736 -7.391 21.154 -11.559 1.00 36.87 N ATOM 1149 CA PRO A 736 -6.951 19.761 -11.691 1.00 34.76 C ATOM 1150 C PRO A 736 -5.926 19.582 -12.807 1.00 30.62 C ATOM 1151 O PRO A 736 -6.256 19.670 -13.994 1.00 30.34 O ATOM 1152 CB PRO A 736 -8.247 19.007 -12.029 1.00 36.91 C ATOM 1153 CG PRO A 736 -9.328 20.075 -12.214 1.00 37.48 C ATOM 1154 CD PRO A 736 -8.622 21.390 -12.325 1.00 37.85 C ATOM 1155 HN2 PRO A 736 -6.643 21.783 -11.914 1.00 0.00 H ATOM 1156 HN1 PRO A 736 -7.569 21.361 -10.556 1.00 0.00 H ATOM 1157 N THR A 737 -4.675 19.353 -12.434 1.00 27.16 N ATOM 1158 CA THR A 737 -3.624 19.141 -13.413 1.00 25.48 C ATOM 1159 C THR A 737 -2.911 17.838 -13.091 1.00 23.38 C ATOM 1160 O THR A 737 -3.049 17.258 -12.006 1.00 23.42 O ATOM 1161 CB THR A 737 -2.613 20.302 -13.476 1.00 26.78 C ATOM 1162 OG1 THR A 737 -2.006 20.495 -12.200 1.00 27.59 O ATOM 1163 CG2 THR A 737 -3.286 21.603 -13.913 1.00 27.17 C ATOM 1164 HG1 THR A 737 -1.534 19.667 -11.932 1.00 0.00 H ATOM 1165 H THR A 737 -4.442 19.325 -11.421 1.00 0.00 H ATOM 1166 N ILE A 738 -2.157 17.370 -14.063 1.00 21.03 N ATOM 1167 CA ILE A 738 -1.375 16.158 -13.903 1.00 18.40 C ATOM 1168 C ILE A 738 -0.057 16.387 -14.619 1.00 18.10 C ATOM 1169 O ILE A 738 -0.019 17.040 -15.671 1.00 18.89 O ATOM 1170 CB ILE A 738 -2.153 14.938 -14.451 1.00 18.36 C ATOM 1171 CG1 ILE A 738 -1.389 13.638 -14.161 1.00 18.03 C ATOM 1172 CG2 ILE A 738 -2.444 15.108 -15.930 1.00 19.15 C ATOM 1173 CD1 ILE A 738 -2.188 12.401 -14.518 1.00 19.37 C ATOM 1174 H ILE A 738 -2.121 17.881 -14.968 1.00 0.00 H ATOM 1175 N SER A 739 1.021 15.864 -14.045 1.00 17.29 N ATOM 1176 CA SER A 739 2.338 16.046 -14.614 1.00 16.87 C ATOM 1177 C SER A 739 2.598 14.991 -15.679 1.00 15.32 C ATOM 1178 O SER A 739 1.956 13.937 -15.729 1.00 15.18 O ATOM 1179 CB SER A 739 3.400 15.928 -13.522 1.00 18.15 C ATOM 1180 OG SER A 739 3.509 14.578 -13.098 1.00 19.49 O ATOM 1181 HG SER A 739 3.767 14.011 -13.868 1.00 0.00 H ATOM 1182 H SER A 739 0.916 15.313 -13.169 1.00 0.00 H ATOM 1183 N TYR A 740 3.579 15.282 -16.525 1.00 16.81 N ATOM 1184 CA TYR A 740 4.016 14.294 -17.505 1.00 16.48 C ATOM 1185 C TYR A 740 4.532 13.017 -16.851 1.00 15.41 C ATOM 1186 O TYR A 740 4.120 11.926 -17.279 1.00 14.63 O ATOM 1187 CB TYR A 740 5.012 14.930 -18.475 1.00 17.43 C ATOM 1188 CG TYR A 740 5.597 13.955 -19.475 1.00 17.20 C ATOM 1189 CD1 TYR A 740 4.843 13.484 -20.542 1.00 17.91 C ATOM 1190 CD2 TYR A 740 6.914 13.521 -19.372 1.00 18.54 C ATOM 1191 CE1 TYR A 740 5.364 12.584 -21.446 1.00 18.63 C ATOM 1192 CE2 TYR A 740 7.443 12.625 -20.285 1.00 18.23 C ATOM 1193 CZ TYR A 740 6.669 12.167 -21.319 1.00 19.16 C ATOM 1194 OH TYR A 740 7.203 11.274 -22.212 1.00 20.87 O ATOM 1195 HH TYR A 740 7.989 11.682 -22.655 1.00 0.00 H ATOM 1196 H TYR A 740 4.036 16.215 -16.489 1.00 0.00 H ATOM 1197 N PRO A 741 5.397 13.062 -15.830 1.00 15.74 N ATOM 1198 CA PRO A 741 5.821 11.800 -15.199 1.00 15.35 C ATOM 1199 C PRO A 741 4.661 10.982 -14.670 1.00 15.21 C ATOM 1200 O PRO A 741 4.704 9.749 -14.720 1.00 15.44 O ATOM 1201 CB PRO A 741 6.759 12.262 -14.084 1.00 16.84 C ATOM 1202 CG PRO A 741 7.352 13.495 -14.626 1.00 17.86 C ATOM 1203 CD PRO A 741 6.217 14.193 -15.356 1.00 15.61 C ATOM 1204 N MET A 742 3.618 11.641 -14.165 1.00 14.07 N ATOM 1205 CA MET A 742 2.453 10.918 -13.666 1.00 14.65 C ATOM 1206 C MET A 742 1.677 10.264 -14.800 1.00 13.24 C ATOM 1207 O MET A 742 1.167 9.148 -14.638 1.00 12.93 O ATOM 1208 CB MET A 742 1.560 11.846 -12.842 1.00 16.56 C ATOM 1209 CG MET A 742 0.518 11.084 -12.054 1.00 19.87 C ATOM 1210 SD MET A 742 1.214 9.945 -10.804 1.00 23.76 S ATOM 1211 CE MET A 742 1.688 11.090 -9.516 1.00 26.50 C ATOM 1212 H MET A 742 3.635 12.680 -14.126 1.00 0.00 H ATOM 1213 N LEU A 743 1.587 10.921 -15.967 1.00 12.42 N ATOM 1214 CA LEU A 743 0.980 10.256 -17.123 1.00 11.87 C ATOM 1215 C LEU A 743 1.741 8.987 -17.487 1.00 11.41 C ATOM 1216 O LEU A 743 1.138 7.948 -17.803 1.00 11.31 O ATOM 1217 CB LEU A 743 0.918 11.201 -18.322 1.00 13.55 C ATOM 1218 CG LEU A 743 -0.036 12.381 -18.195 1.00 14.34 C ATOM 1219 CD1 LEU A 743 0.163 13.294 -19.380 1.00 14.75 C ATOM 1220 CD2 LEU A 743 -1.474 11.927 -18.103 1.00 13.51 C ATOM 1221 H LEU A 743 1.945 11.894 -16.050 1.00 0.00 H ATOM 1222 N LEU A 744 3.074 9.056 -17.461 1.00 10.83 N ATOM 1223 CA LEU A 744 3.879 7.874 -17.752 1.00 12.00 C ATOM 1224 C LEU A 744 3.684 6.796 -16.699 1.00 12.71 C ATOM 1225 O LEU A 744 3.698 5.605 -17.024 1.00 13.55 O ATOM 1226 CB LEU A 744 5.354 8.234 -17.861 1.00 13.40 C ATOM 1227 CG LEU A 744 5.763 9.150 -19.017 1.00 14.40 C ATOM 1228 CD1 LEU A 744 7.268 9.296 -19.005 1.00 15.63 C ATOM 1229 CD2 LEU A 744 5.292 8.633 -20.387 1.00 17.06 C ATOM 1230 H LEU A 744 3.541 9.957 -17.232 1.00 0.00 H ATOM 1231 N HIS A 745 3.518 7.192 -15.430 1.00 12.71 N ATOM 1232 CA HIS A 745 3.261 6.224 -14.376 1.00 14.21 C ATOM 1233 C HIS A 745 1.921 5.522 -14.580 1.00 12.60 C ATOM 1234 O HIS A 745 1.805 4.309 -14.356 1.00 14.15 O ATOM 1235 CB HIS A 745 3.314 6.934 -13.024 1.00 16.03 C ATOM 1236 CG HIS A 745 2.959 6.069 -11.863 1.00 19.02 C ATOM 1237 ND1 HIS A 745 3.655 4.923 -11.552 1.00 20.72 N ATOM 1238 CD2 HIS A 745 2.008 6.205 -10.913 1.00 20.74 C ATOM 1239 CE1 HIS A 745 3.134 4.378 -10.468 1.00 20.83 C ATOM 1240 NE2 HIS A 745 2.138 5.140 -10.054 1.00 21.08 N ATOM 1241 H HIS A 745 3.574 8.204 -15.196 1.00 0.00 H ATOM 1242 N VAL A 746 0.899 6.262 -15.006 1.00 10.86 N ATOM 1243 CA VAL A 746 -0.377 5.646 -15.357 1.00 11.13 C ATOM 1244 C VAL A 746 -0.178 4.627 -16.472 1.00 10.21 C ATOM 1245 O VAL A 746 -0.643 3.482 -16.390 1.00 10.87 O ATOM 1246 CB VAL A 746 -1.396 6.743 -15.741 1.00 12.11 C ATOM 1247 CG1 VAL A 746 -2.643 6.159 -16.423 1.00 12.04 C ATOM 1248 CG2 VAL A 746 -1.770 7.546 -14.513 1.00 13.21 C ATOM 1249 H VAL A 746 1.011 7.293 -15.090 1.00 0.00 H ATOM 1250 N ALA A 747 0.532 5.029 -17.529 1.00 10.05 N ATOM 1251 CA ALA A 747 0.717 4.149 -18.681 1.00 10.00 C ATOM 1252 C ALA A 747 1.560 2.938 -18.314 1.00 9.67 C ATOM 1253 O ALA A 747 1.309 1.827 -18.815 1.00 10.40 O ATOM 1254 CB ALA A 747 1.370 4.926 -19.829 1.00 12.57 C ATOM 1255 H ALA A 747 0.958 5.978 -17.532 1.00 0.00 H ATOM 1256 N ALA A 748 2.574 3.136 -17.471 1.00 9.82 N ATOM 1257 CA ALA A 748 3.425 2.020 -17.056 1.00 9.71 C ATOM 1258 C ALA A 748 2.627 0.972 -16.297 1.00 9.64 C ATOM 1259 O ALA A 748 2.844 -0.231 -16.473 1.00 11.33 O ATOM 1260 CB ALA A 748 4.571 2.546 -16.202 1.00 11.23 C ATOM 1261 H ALA A 748 2.762 4.091 -17.105 1.00 0.00 H ATOM 1262 N GLN A 749 1.705 1.407 -15.446 1.00 10.40 N ATOM 1263 CA GLN A 749 0.870 0.457 -14.720 1.00 10.01 C ATOM 1264 C GLN A 749 -0.012 -0.344 -15.672 1.00 8.64 C ATOM 1265 O GLN A 749 -0.225 -1.542 -15.477 1.00 10.54 O ATOM 1266 CB GLN A 749 -0.003 1.203 -13.723 1.00 11.86 C ATOM 1267 CG GLN A 749 0.741 1.720 -12.506 1.00 11.27 C ATOM 1268 CD GLN A 749 -0.175 2.521 -11.638 1.00 13.63 C ATOM 1269 OE1 GLN A 749 -0.899 1.972 -10.800 1.00 14.23 O ATOM 1270 NE2 GLN A 749 -0.190 3.823 -11.860 1.00 14.37 N ATOM 1271 HE22 GLN A 749 0.440 4.235 -12.577 1.00 0.00 H ATOM 1272 HE21 GLN A 749 -0.832 4.436 -11.317 1.00 0.00 H ATOM 1273 H GLN A 749 1.578 2.428 -15.297 1.00 0.00 H ATOM 1274 N ILE A 750 -0.577 0.308 -16.682 1.00 8.44 N ATOM 1275 CA ILE A 750 -1.359 -0.427 -17.669 1.00 8.57 C ATOM 1276 C ILE A 750 -0.473 -1.458 -18.363 1.00 8.75 C ATOM 1277 O ILE A 750 -0.856 -2.621 -18.535 1.00 9.28 O ATOM 1278 CB ILE A 750 -2.017 0.546 -18.657 1.00 9.82 C ATOM 1279 CG1 ILE A 750 -3.017 1.444 -17.939 1.00 9.15 C ATOM 1280 CG2 ILE A 750 -2.734 -0.198 -19.793 1.00 9.87 C ATOM 1281 CD1 ILE A 750 -3.561 2.542 -18.816 1.00 10.78 C ATOM 1282 H ILE A 750 -0.462 1.338 -16.768 1.00 0.00 H ATOM 1283 N ALA A 751 0.734 -1.052 -18.751 1.00 8.66 N ATOM 1284 CA ALA A 751 1.635 -1.984 -19.416 1.00 9.29 C ATOM 1285 C ALA A 751 1.987 -3.151 -18.506 1.00 9.01 C ATOM 1286 O ALA A 751 2.123 -4.291 -18.970 1.00 10.66 O ATOM 1287 CB ALA A 751 2.894 -1.268 -19.867 1.00 9.31 C ATOM 1288 H ALA A 751 1.033 -0.071 -18.580 1.00 0.00 H ATOM 1289 N SER A 752 2.137 -2.885 -17.208 1.00 9.67 N ATOM 1290 CA SER A 752 2.462 -3.940 -16.268 1.00 9.96 C ATOM 1291 C SER A 752 1.317 -4.936 -16.156 1.00 9.08 C ATOM 1292 O SER A 752 1.540 -6.153 -16.108 1.00 10.65 O ATOM 1293 CB SER A 752 2.785 -3.338 -14.900 1.00 12.07 C ATOM 1294 OG SER A 752 3.303 -4.336 -14.043 1.00 12.94 O ATOM 1295 HG SER A 752 2.632 -5.055 -13.933 1.00 0.00 H ATOM 1296 H SER A 752 2.020 -1.910 -16.866 1.00 0.00 H ATOM 1297 N GLY A 753 0.082 -4.436 -16.105 1.00 8.65 N ATOM 1298 CA GLY A 753 -1.054 -5.332 -16.075 1.00 9.98 C ATOM 1299 C GLY A 753 -1.131 -6.174 -17.334 1.00 9.24 C ATOM 1300 O GLY A 753 -1.398 -7.377 -17.279 1.00 10.31 O ATOM 1301 H GLY A 753 -0.064 -3.406 -16.087 1.00 0.00 H ATOM 1302 N MET A 754 -0.907 -5.549 -18.496 1.00 9.10 N ATOM 1303 CA MET A 754 -0.988 -6.291 -19.752 1.00 8.08 C ATOM 1304 C MET A 754 0.143 -7.305 -19.848 1.00 9.03 C ATOM 1305 O MET A 754 -0.034 -8.376 -20.426 1.00 9.97 O ATOM 1306 CB MET A 754 -0.945 -5.340 -20.948 1.00 9.12 C ATOM 1307 CG MET A 754 -2.159 -4.447 -20.999 1.00 9.35 C ATOM 1308 SD MET A 754 -3.708 -5.350 -21.136 1.00 11.01 S ATOM 1309 CE MET A 754 -3.518 -6.120 -22.719 1.00 13.21 C ATOM 1310 H MET A 754 -0.675 -4.535 -18.505 1.00 0.00 H ATOM 1311 N ARG A 755 1.325 -6.945 -19.337 1.00 10.31 N ATOM 1312 CA ARG A 755 2.446 -7.879 -19.269 1.00 10.40 C ATOM 1313 C ARG A 755 2.032 -9.142 -18.530 1.00 9.91 C ATOM 1314 O ARG A 755 2.319 -10.270 -18.971 1.00 11.17 O ATOM 1315 CB ARG A 755 3.635 -7.199 -18.580 1.00 11.36 C ATOM 1316 CG ARG A 755 4.915 -8.021 -18.552 1.00 11.25 C ATOM 1317 CD ARG A 755 5.994 -7.358 -17.700 1.00 10.97 C ATOM 1318 NE ARG A 755 5.598 -7.422 -16.304 1.00 12.51 N ATOM 1319 CZ ARG A 755 6.058 -6.637 -15.346 1.00 14.46 C ATOM 1320 NH1 ARG A 755 6.988 -5.731 -15.604 1.00 15.72 N ATOM 1321 NH2 ARG A 755 5.604 -6.791 -14.117 1.00 15.82 N ATOM 1322 HE ARG A 755 4.897 -8.143 -16.038 1.00 0.00 H ATOM 1323 HH12 ARG A 755 7.343 -5.118 -14.842 1.00 0.00 H ATOM 1324 HH11 ARG A 755 7.364 -5.632 -16.569 1.00 0.00 H ATOM 1325 HH22 ARG A 755 5.956 -6.181 -13.352 1.00 0.00 H ATOM 1326 HH21 ARG A 755 4.894 -7.523 -13.913 1.00 0.00 H ATOM 1327 H ARG A 755 1.449 -5.976 -18.979 1.00 0.00 H ATOM 1328 N TYR A 756 1.326 -8.970 -17.413 1.00 10.65 N ATOM 1329 CA TYR A 756 0.817 -10.106 -16.654 1.00 11.70 C ATOM 1330 C TYR A 756 -0.160 -10.932 -17.486 1.00 10.79 C ATOM 1331 O TYR A 756 -0.058 -12.163 -17.535 1.00 11.41 O ATOM 1332 CB TYR A 756 0.150 -9.596 -15.394 1.00 11.82 C ATOM 1333 CG TYR A 756 -0.509 -10.705 -14.642 1.00 11.73 C ATOM 1334 CD1 TYR A 756 0.249 -11.614 -13.907 1.00 12.81 C ATOM 1335 CD2 TYR A 756 -1.893 -10.857 -14.660 1.00 13.51 C ATOM 1336 CE1 TYR A 756 -0.354 -12.642 -13.198 1.00 14.18 C ATOM 1337 CE2 TYR A 756 -2.502 -11.876 -13.965 1.00 13.07 C ATOM 1338 CZ TYR A 756 -1.741 -12.776 -13.237 1.00 14.08 C ATOM 1339 OH TYR A 756 -2.382 -13.789 -12.548 1.00 16.81 O ATOM 1340 HH TYR A 756 -1.710 -14.345 -12.080 1.00 0.00 H ATOM 1341 H TYR A 756 1.134 -8.005 -17.076 1.00 0.00 H ATOM 1342 N LEU A 757 -1.147 -10.282 -18.107 1.00 11.56 N ATOM 1343 CA LEU A 757 -2.099 -11.022 -18.942 1.00 10.26 C ATOM 1344 C LEU A 757 -1.367 -11.809 -20.027 1.00 10.86 C ATOM 1345 O LEU A 757 -1.727 -12.953 -20.336 1.00 11.08 O ATOM 1346 CB LEU A 757 -3.126 -10.057 -19.550 1.00 9.62 C ATOM 1347 CG LEU A 757 -4.065 -9.405 -18.527 1.00 11.29 C ATOM 1348 CD1 LEU A 757 -5.114 -8.581 -19.246 1.00 11.59 C ATOM 1349 CD2 LEU A 757 -4.768 -10.429 -17.607 1.00 12.62 C ATOM 1350 H LEU A 757 -1.241 -9.252 -17.999 1.00 0.00 H ATOM 1351 N ALA A 758 -0.315 -11.223 -20.600 1.00 10.40 N ATOM 1352 CA ALA A 758 0.428 -11.928 -21.645 1.00 11.48 C ATOM 1353 C ALA A 758 1.082 -13.198 -21.104 1.00 12.28 C ATOM 1354 O ALA A 758 1.170 -14.200 -21.825 1.00 13.17 O ATOM 1355 CB ALA A 758 1.467 -11.004 -22.277 1.00 12.15 C ATOM 1356 H ALA A 758 -0.024 -10.269 -20.305 1.00 0.00 H ATOM 1357 N THR A 759 1.569 -13.172 -19.844 1.00 12.55 N ATOM 1358 CA THR A 759 2.139 -14.385 -19.253 1.00 13.99 C ATOM 1359 C THR A 759 1.103 -15.481 -19.115 1.00 13.39 C ATOM 1360 O THR A 759 1.467 -16.664 -19.096 1.00 16.29 O ATOM 1361 CB THR A 759 2.785 -14.173 -17.873 1.00 16.54 C ATOM 1362 OG1 THR A 759 1.790 -13.939 -16.862 1.00 17.63 O ATOM 1363 CG2 THR A 759 3.803 -13.054 -17.881 1.00 16.68 C ATOM 1364 HG1 THR A 759 1.269 -13.130 -17.094 1.00 0.00 H ATOM 1365 H THR A 759 1.539 -12.290 -19.293 1.00 0.00 H ATOM 1366 N LEU A 760 -0.178 -15.110 -18.967 1.00 12.41 N ATOM 1367 CA LEU A 760 -1.274 -16.066 -18.860 1.00 13.09 C ATOM 1368 C LEU A 760 -1.812 -16.471 -20.221 1.00 13.58 C ATOM 1369 O LEU A 760 -2.750 -17.278 -20.290 1.00 14.24 O ATOM 1370 CB LEU A 760 -2.405 -15.458 -18.041 1.00 13.94 C ATOM 1371 CG LEU A 760 -2.156 -15.114 -16.579 1.00 16.76 C ATOM 1372 CD1 LEU A 760 -3.467 -14.718 -15.899 1.00 16.16 C ATOM 1373 CD2 LEU A 760 -1.524 -16.274 -15.867 1.00 18.04 C ATOM 1374 H LEU A 760 -0.399 -14.095 -18.927 1.00 0.00 H ATOM 1375 N ASN A 761 -1.254 -15.919 -21.303 1.00 13.68 N ATOM 1376 CA ASN A 761 -1.789 -16.133 -22.650 1.00 14.32 C ATOM 1377 C ASN A 761 -3.248 -15.715 -22.732 1.00 12.99 C ATOM 1378 O ASN A 761 -4.056 -16.315 -23.444 1.00 14.98 O ATOM 1379 CB ASN A 761 -1.612 -17.576 -23.096 1.00 17.70 C ATOM 1380 CG ASN A 761 -0.184 -17.999 -23.035 1.00 23.17 C ATOM 1381 OD1 ASN A 761 0.690 -17.326 -23.577 1.00 25.43 O ATOM 1382 ND2 ASN A 761 0.080 -19.080 -22.325 1.00 25.59 N ATOM 1383 HD22 ASN A 761 -0.696 -19.616 -21.886 1.00 0.00 H ATOM 1384 HD21 ASN A 761 1.064 -19.396 -22.205 1.00 0.00 H ATOM 1385 H ASN A 761 -0.413 -15.318 -21.185 1.00 0.00 H ATOM 1386 N PHE A 762 -3.577 -14.639 -22.033 1.00 12.30 N ATOM 1387 CA PHE A 762 -4.932 -14.124 -21.981 1.00 11.39 C ATOM 1388 C PHE A 762 -4.977 -12.854 -22.816 1.00 10.45 C ATOM 1389 O PHE A 762 -4.194 -11.928 -22.585 1.00 10.23 O ATOM 1390 CB PHE A 762 -5.357 -13.820 -20.550 1.00 13.32 C ATOM 1391 CG PHE A 762 -6.743 -13.312 -20.458 1.00 14.92 C ATOM 1392 CD1 PHE A 762 -7.805 -14.195 -20.447 1.00 17.24 C ATOM 1393 CD2 PHE A 762 -6.997 -11.956 -20.458 1.00 16.14 C ATOM 1394 CE1 PHE A 762 -9.104 -13.724 -20.403 1.00 17.79 C ATOM 1395 CE2 PHE A 762 -8.294 -11.474 -20.404 1.00 19.05 C ATOM 1396 CZ PHE A 762 -9.346 -12.355 -20.385 1.00 19.18 C ATOM 1397 H PHE A 762 -2.834 -14.144 -21.500 1.00 0.00 H ATOM 1398 N VAL A 763 -5.867 -12.837 -23.795 1.00 10.05 N ATOM 1399 CA VAL A 763 -6.033 -11.711 -24.694 1.00 9.81 C ATOM 1400 C VAL A 763 -7.241 -10.903 -24.228 1.00 9.26 C ATOM 1401 O VAL A 763 -8.358 -11.428 -24.123 1.00 10.66 O ATOM 1402 CB VAL A 763 -6.206 -12.189 -26.146 1.00 9.90 C ATOM 1403 CG1 VAL A 763 -6.435 -11.030 -27.081 1.00 10.00 C ATOM 1404 CG2 VAL A 763 -4.987 -13.004 -26.586 1.00 11.66 C ATOM 1405 H VAL A 763 -6.476 -13.670 -23.926 1.00 0.00 H ATOM 1406 N HIS A 764 -7.020 -9.626 -23.937 1.00 8.58 N ATOM 1407 CA HIS A 764 -8.074 -8.782 -23.370 1.00 9.04 C ATOM 1408 C HIS A 764 -9.168 -8.476 -24.391 1.00 9.04 C ATOM 1409 O HIS A 764 -10.364 -8.579 -24.088 1.00 10.43 O ATOM 1410 CB HIS A 764 -7.439 -7.512 -22.821 1.00 8.35 C ATOM 1411 CG HIS A 764 -8.394 -6.659 -22.060 1.00 9.99 C ATOM 1412 ND1 HIS A 764 -9.397 -5.948 -22.683 1.00 10.53 N ATOM 1413 CD2 HIS A 764 -8.516 -6.417 -20.733 1.00 9.31 C ATOM 1414 CE1 HIS A 764 -10.083 -5.281 -21.770 1.00 10.93 C ATOM 1415 NE2 HIS A 764 -9.575 -5.557 -20.579 1.00 9.89 N ATOM 1416 H HIS A 764 -6.080 -9.218 -24.115 1.00 0.00 H ATOM 1417 N ARG A 765 -8.776 -8.046 -25.592 1.00 8.77 N ATOM 1418 CA ARG A 765 -9.611 -7.757 -26.756 1.00 7.95 C ATOM 1419 C ARG A 765 -10.254 -6.369 -26.710 1.00 8.61 C ATOM 1420 O ARG A 765 -10.771 -5.929 -27.728 1.00 9.12 O ATOM 1421 CB ARG A 765 -10.733 -8.783 -27.005 1.00 9.91 C ATOM 1422 CG ARG A 765 -10.280 -10.234 -27.051 1.00 9.65 C ATOM 1423 CD ARG A 765 -11.460 -11.197 -27.176 1.00 11.91 C ATOM 1424 NE ARG A 765 -12.243 -11.018 -28.406 1.00 13.74 N ATOM 1425 CZ ARG A 765 -12.079 -11.730 -29.516 1.00 13.75 C ATOM 1426 NH1 ARG A 765 -12.860 -11.505 -30.562 1.00 14.04 N ATOM 1427 NH2 ARG A 765 -11.153 -12.687 -29.578 1.00 15.05 N ATOM 1428 HE ARG A 765 -12.978 -10.282 -28.408 1.00 0.00 H ATOM 1429 HH12 ARG A 765 -12.735 -12.060 -31.433 1.00 0.00 H ATOM 1430 HH11 ARG A 765 -13.598 -10.774 -30.512 1.00 0.00 H ATOM 1431 HH22 ARG A 765 -11.033 -13.238 -30.452 1.00 0.00 H ATOM 1432 HH21 ARG A 765 -10.551 -12.882 -28.753 1.00 0.00 H ATOM 1433 H ARG A 765 -7.754 -7.899 -25.714 1.00 0.00 H ATOM 1434 N ASP A 766 -10.270 -5.678 -25.570 1.00 8.24 N ATOM 1435 CA ASP A 766 -10.939 -4.377 -25.491 1.00 9.21 C ATOM 1436 C ASP A 766 -10.173 -3.422 -24.580 1.00 7.67 C ATOM 1437 O ASP A 766 -10.766 -2.680 -23.775 1.00 8.53 O ATOM 1438 CB ASP A 766 -12.404 -4.519 -25.057 1.00 9.17 C ATOM 1439 CG ASP A 766 -13.234 -3.251 -25.283 1.00 9.68 C ATOM 1440 OD1 ASP A 766 -12.812 -2.354 -26.044 1.00 9.32 O ATOM 1441 OD2 ASP A 766 -14.370 -3.201 -24.767 1.00 11.28 O ATOM 1442 H ASP A 766 -9.802 -6.067 -24.727 1.00 0.00 H ATOM 1443 N LEU A 767 -8.847 -3.383 -24.712 1.00 7.51 N ATOM 1444 CA LEU A 767 -8.090 -2.430 -23.919 1.00 7.81 C ATOM 1445 C LEU A 767 -8.328 -1.005 -24.420 1.00 7.92 C ATOM 1446 O LEU A 767 -8.271 -0.726 -25.629 1.00 8.79 O ATOM 1447 CB LEU A 767 -6.614 -2.770 -23.934 1.00 8.10 C ATOM 1448 CG LEU A 767 -5.731 -1.834 -23.096 1.00 8.89 C ATOM 1449 CD1 LEU A 767 -6.082 -1.885 -21.623 1.00 9.92 C ATOM 1450 CD2 LEU A 767 -4.246 -2.132 -23.326 1.00 10.20 C ATOM 1451 H LEU A 767 -8.362 -4.024 -25.372 1.00 0.00 H ATOM 1452 N ALA A 768 -8.637 -0.117 -23.479 1.00 8.56 N ATOM 1453 CA ALA A 768 -8.924 1.297 -23.720 1.00 8.21 C ATOM 1454 C ALA A 768 -9.016 1.961 -22.354 1.00 7.97 C ATOM 1455 O ALA A 768 -9.234 1.279 -21.343 1.00 9.33 O ATOM 1456 CB ALA A 768 -10.252 1.468 -24.453 1.00 8.90 C ATOM 1457 H ALA A 768 -8.678 -0.454 -22.496 1.00 0.00 H ATOM 1458 N THR A 769 -8.850 3.292 -22.308 1.00 7.11 N ATOM 1459 CA THR A 769 -8.907 3.941 -20.995 1.00 7.96 C ATOM 1460 C THR A 769 -10.270 3.775 -20.328 1.00 8.83 C ATOM 1461 O THR A 769 -10.347 3.739 -19.092 1.00 9.96 O ATOM 1462 CB THR A 769 -8.547 5.428 -21.036 1.00 8.04 C ATOM 1463 OG1 THR A 769 -9.460 6.156 -21.867 1.00 9.91 O ATOM 1464 CG2 THR A 769 -7.104 5.640 -21.496 1.00 7.29 C ATOM 1465 HG1 THR A 769 -9.425 5.795 -22.788 1.00 0.00 H ATOM 1466 H THR A 769 -8.687 3.844 -23.174 1.00 0.00 H ATOM 1467 N ARG A 770 -11.342 3.692 -21.108 1.00 8.48 N ATOM 1468 CA ARG A 770 -12.660 3.486 -20.518 1.00 8.63 C ATOM 1469 C ARG A 770 -12.751 2.179 -19.741 1.00 9.12 C ATOM 1470 O ARG A 770 -13.682 2.025 -18.932 1.00 9.67 O ATOM 1471 CB ARG A 770 -13.743 3.500 -21.602 1.00 9.06 C ATOM 1472 CG ARG A 770 -13.589 2.413 -22.637 1.00 9.71 C ATOM 1473 CD ARG A 770 -14.689 2.425 -23.744 1.00 9.77 C ATOM 1474 NE ARG A 770 -14.353 1.374 -24.688 1.00 10.61 N ATOM 1475 CZ ARG A 770 -13.498 1.524 -25.685 1.00 10.48 C ATOM 1476 NH1 ARG A 770 -12.986 2.722 -25.959 1.00 11.37 N ATOM 1477 NH2 ARG A 770 -13.160 0.481 -26.418 1.00 11.33 N ATOM 1478 HE ARG A 770 -14.812 0.448 -24.573 1.00 0.00 H ATOM 1479 HH12 ARG A 770 -12.314 2.833 -26.745 1.00 0.00 H ATOM 1480 HH11 ARG A 770 -13.258 3.547 -25.387 1.00 0.00 H ATOM 1481 HH22 ARG A 770 -12.488 0.593 -27.204 1.00 0.00 H ATOM 1482 HH21 ARG A 770 -13.566 -0.454 -26.210 1.00 0.00 H ATOM 1483 H ARG A 770 -11.242 3.774 -22.140 1.00 0.00 H ATOM 1484 N ASN A 771 -11.848 1.222 -19.989 1.00 8.62 N ATOM 1485 CA ASN A 771 -11.874 -0.062 -19.297 1.00 8.91 C ATOM 1486 C ASN A 771 -10.873 -0.148 -18.171 1.00 10.40 C ATOM 1487 O ASN A 771 -10.701 -1.231 -17.593 1.00 12.51 O ATOM 1488 CB ASN A 771 -11.704 -1.230 -20.272 1.00 9.02 C ATOM 1489 CG ASN A 771 -13.003 -1.636 -20.911 1.00 8.89 C ATOM 1490 OD1 ASN A 771 -14.063 -1.504 -20.305 1.00 10.94 O ATOM 1491 ND2 ASN A 771 -12.945 -2.117 -22.143 1.00 10.95 N ATOM 1492 HD22 ASN A 771 -12.026 -2.213 -22.621 1.00 0.00 H ATOM 1493 HD21 ASN A 771 -13.818 -2.399 -22.633 1.00 0.00 H ATOM 1494 H ASN A 771 -11.106 1.399 -20.696 1.00 0.00 H ATOM 1495 N CYS A 772 -10.217 0.961 -17.834 1.00 8.49 N ATOM 1496 CA CYS A 772 -9.293 1.024 -16.710 1.00 10.71 C ATOM 1497 C CYS A 772 -9.945 1.781 -15.560 1.00 11.38 C ATOM 1498 O CYS A 772 -10.755 2.684 -15.776 1.00 11.89 O ATOM 1499 CB CYS A 772 -8.020 1.744 -17.123 1.00 11.31 C ATOM 1500 SG CYS A 772 -7.091 0.848 -18.380 1.00 12.36 S ATOM 1501 H CYS A 772 -10.371 1.821 -18.399 1.00 0.00 H ATOM 1502 N LEU A 773 -9.604 1.382 -14.332 1.00 10.65 N ATOM 1503 CA LEU A 773 -10.101 2.006 -13.108 1.00 11.39 C ATOM 1504 C LEU A 773 -8.971 2.712 -12.377 1.00 11.37 C ATOM 1505 O LEU A 773 -7.805 2.316 -12.475 1.00 12.39 O ATOM 1506 CB LEU A 773 -10.702 0.965 -12.164 1.00 13.11 C ATOM 1507 CG LEU A 773 -11.966 0.253 -12.638 1.00 14.21 C ATOM 1508 CD1 LEU A 773 -12.351 -0.786 -11.607 1.00 16.44 C ATOM 1509 CD2 LEU A 773 -13.114 1.213 -12.884 1.00 15.83 C ATOM 1510 H LEU A 773 -8.947 0.581 -14.242 1.00 0.00 H ATOM 1511 N VAL A 774 -9.334 3.748 -11.625 1.00 12.95 N ATOM 1512 CA VAL A 774 -8.374 4.583 -10.901 1.00 13.50 C ATOM 1513 C VAL A 774 -8.711 4.534 -9.420 1.00 14.22 C ATOM 1514 O VAL A 774 -9.857 4.778 -9.029 1.00 14.35 O ATOM 1515 CB VAL A 774 -8.396 6.039 -11.398 1.00 13.65 C ATOM 1516 CG1 VAL A 774 -7.284 6.871 -10.715 1.00 15.35 C ATOM 1517 CG2 VAL A 774 -8.283 6.074 -12.912 1.00 13.73 C ATOM 1518 H VAL A 774 -10.346 3.975 -11.548 1.00 0.00 H ATOM 1519 N GLY A 775 -7.705 4.235 -8.607 1.00 16.03 N ATOM 1520 CA GLY A 775 -7.824 4.272 -7.168 1.00 17.25 C ATOM 1521 C GLY A 775 -7.125 5.481 -6.586 1.00 20.17 C ATOM 1522 O GLY A 775 -7.127 6.557 -7.190 1.00 22.17 O ATOM 1523 H GLY A 775 -6.792 3.962 -9.024 1.00 0.00 H ATOM 1524 N GLU A 776 -6.510 5.318 -5.419 1.00 22.66 N ATOM 1525 CA GLU A 776 -5.804 6.419 -4.787 1.00 25.75 C ATOM 1526 C GLU A 776 -4.418 6.570 -5.402 1.00 26.26 C ATOM 1527 O GLU A 776 -3.817 5.603 -5.865 1.00 26.55 O ATOM 1528 CB GLU A 776 -5.658 6.154 -3.286 1.00 30.28 C ATOM 1529 CG GLU A 776 -6.952 5.745 -2.600 1.00 35.85 C ATOM 1530 CD GLU A 776 -6.768 5.423 -1.116 1.00 41.15 C ATOM 1531 OE1 GLU A 776 -7.792 5.306 -0.408 1.00 43.63 O ATOM 1532 OE2 GLU A 776 -5.606 5.282 -0.657 1.00 42.45 O ATOM 1533 H GLU A 776 -6.535 4.389 -4.952 1.00 0.00 H ATOM 1534 N ASN A 777 -3.905 7.800 -5.399 1.00 26.59 N ATOM 1535 CA ASN A 777 -2.517 8.042 -5.799 1.00 27.63 C ATOM 1536 C ASN A 777 -2.257 7.554 -7.227 1.00 24.96 C ATOM 1537 O ASN A 777 -1.182 7.037 -7.542 1.00 24.85 O ATOM 1538 CB ASN A 777 -1.546 7.373 -4.822 1.00 30.26 C ATOM 1539 CG ASN A 777 -1.782 7.787 -3.386 1.00 34.04 C ATOM 1540 OD1 ASN A 777 -2.022 6.948 -2.513 1.00 36.31 O ATOM 1541 ND2 ASN A 777 -1.724 9.084 -3.133 1.00 35.17 N ATOM 1542 HD22 ASN A 777 -1.518 9.755 -3.901 1.00 0.00 H ATOM 1543 HD21 ASN A 777 -1.884 9.433 -2.166 1.00 0.00 H ATOM 1544 H ASN A 777 -4.500 8.602 -5.108 1.00 0.00 H ATOM 1545 N PHE A 778 -3.255 7.711 -8.100 1.00 23.07 N ATOM 1546 CA PHE A 778 -3.135 7.342 -9.513 1.00 22.01 C ATOM 1547 C PHE A 778 -2.814 5.861 -9.724 1.00 19.57 C ATOM 1548 O PHE A 778 -2.215 5.487 -10.743 1.00 19.23 O ATOM 1549 CB PHE A 778 -2.103 8.211 -10.228 1.00 24.86 C ATOM 1550 CG PHE A 778 -2.351 9.669 -10.066 1.00 26.76 C ATOM 1551 CD1 PHE A 778 -1.850 10.347 -8.969 1.00 28.39 C ATOM 1552 CD2 PHE A 778 -3.118 10.356 -10.988 1.00 27.06 C ATOM 1553 CE1 PHE A 778 -2.089 11.685 -8.806 1.00 29.34 C ATOM 1554 CE2 PHE A 778 -3.371 11.684 -10.830 1.00 28.14 C ATOM 1555 CZ PHE A 778 -2.855 12.358 -9.735 1.00 29.25 C ATOM 1556 H PHE A 778 -4.154 8.111 -7.763 1.00 0.00 H ATOM 1557 N THR A 779 -3.224 4.993 -8.801 1.00 17.74 N ATOM 1558 CA THR A 779 -3.113 3.562 -9.067 1.00 17.22 C ATOM 1559 C THR A 779 -4.157 3.143 -10.094 1.00 15.08 C ATOM 1560 O THR A 779 -5.296 3.623 -10.079 1.00 14.48 O ATOM 1561 CB THR A 779 -3.268 2.746 -7.780 1.00 19.73 C ATOM 1562 OG1 THR A 779 -4.561 2.969 -7.202 1.00 24.63 O ATOM 1563 CG2 THR A 779 -2.189 3.149 -6.797 1.00 19.65 C ATOM 1564 HG1 THR A 779 -4.665 3.930 -6.990 1.00 0.00 H ATOM 1565 H THR A 779 -3.619 5.331 -7.900 1.00 0.00 H ATOM 1566 N ILE A 780 -3.752 2.246 -10.994 1.00 13.61 N ATOM 1567 CA ILE A 780 -4.575 1.820 -12.120 1.00 13.05 C ATOM 1568 C ILE A 780 -4.782 0.315 -12.079 1.00 11.43 C ATOM 1569 O ILE A 780 -3.839 -0.455 -11.839 1.00 13.32 O ATOM 1570 CB ILE A 780 -3.928 2.212 -13.467 1.00 13.38 C ATOM 1571 CG1 ILE A 780 -3.595 3.702 -13.483 1.00 14.01 C ATOM 1572 CG2 ILE A 780 -4.831 1.836 -14.623 1.00 13.99 C ATOM 1573 CD1 ILE A 780 -4.793 4.632 -13.345 1.00 14.31 C ATOM 1574 H ILE A 780 -2.804 1.831 -10.888 1.00 0.00 H ATOM 1575 N LYS A 781 -6.007 -0.106 -12.368 1.00 11.41 N ATOM 1576 CA LYS A 781 -6.280 -1.511 -12.645 1.00 11.99 C ATOM 1577 C LYS A 781 -7.066 -1.653 -13.937 1.00 11.85 C ATOM 1578 O LYS A 781 -8.000 -0.889 -14.202 1.00 12.63 O ATOM 1579 CB LYS A 781 -7.040 -2.160 -11.499 1.00 13.33 C ATOM 1580 CG LYS A 781 -6.270 -2.225 -10.204 1.00 15.76 C ATOM 1581 CD LYS A 781 -7.114 -2.929 -9.140 1.00 18.04 C ATOM 1582 CE LYS A 781 -6.568 -2.789 -7.744 1.00 20.96 C ATOM 1583 NZ LYS A 781 -5.308 -3.523 -7.587 1.00 24.72 N ATOM 1584 HZ1 LYS A 781 -5.470 -4.532 -7.779 1.00 0.00 H ATOM 1585 HZ2 LYS A 781 -4.605 -3.150 -8.256 1.00 0.00 H ATOM 1586 HZ3 LYS A 781 -4.959 -3.406 -6.614 1.00 0.00 H ATOM 1587 H LYS A 781 -6.788 0.580 -12.397 1.00 0.00 H ATOM 1588 N ILE A 782 -6.692 -2.650 -14.725 1.00 10.70 N ATOM 1589 CA ILE A 782 -7.403 -2.951 -15.958 1.00 9.69 C ATOM 1590 C ILE A 782 -8.629 -3.794 -15.631 1.00 10.26 C ATOM 1591 O ILE A 782 -8.546 -4.771 -14.877 1.00 10.68 O ATOM 1592 CB ILE A 782 -6.488 -3.681 -16.950 1.00 11.05 C ATOM 1593 CG1 ILE A 782 -5.243 -2.846 -17.242 1.00 11.29 C ATOM 1594 CG2 ILE A 782 -7.256 -3.960 -18.234 1.00 13.00 C ATOM 1595 CD1 ILE A 782 -4.237 -3.540 -18.123 1.00 10.83 C ATOM 1596 H ILE A 782 -5.872 -3.230 -14.456 1.00 0.00 H ATOM 1597 N ALA A 783 -9.763 -3.408 -16.200 1.00 8.76 N ATOM 1598 CA ALA A 783 -11.038 -4.098 -16.050 1.00 8.39 C ATOM 1599 C ALA A 783 -11.635 -4.363 -17.433 1.00 9.36 C ATOM 1600 O ALA A 783 -10.941 -4.242 -18.452 1.00 10.12 O ATOM 1601 CB ALA A 783 -11.999 -3.264 -15.185 1.00 10.13 C ATOM 1602 H ALA A 783 -9.741 -2.555 -16.794 1.00 0.00 H ATOM 1603 N ASP A 784 -12.907 -4.749 -17.486 1.00 9.40 N ATOM 1604 CA ASP A 784 -13.571 -4.967 -18.777 1.00 10.80 C ATOM 1605 C ASP A 784 -15.074 -4.797 -18.533 1.00 10.96 C ATOM 1606 O ASP A 784 -15.771 -5.746 -18.159 1.00 12.15 O ATOM 1607 CB ASP A 784 -13.255 -6.320 -19.406 1.00 11.42 C ATOM 1608 CG ASP A 784 -13.897 -6.475 -20.764 1.00 14.95 C ATOM 1609 OD1 ASP A 784 -14.603 -5.516 -21.206 1.00 15.77 O ATOM 1610 OD2 ASP A 784 -13.706 -7.541 -21.390 1.00 18.56 O ATOM 1611 H ASP A 784 -13.437 -4.898 -16.603 1.00 0.00 H ATOM 1612 N PHE A 785 -15.543 -3.566 -18.730 1.00 9.47 N ATOM 1613 CA PHE A 785 -16.950 -3.234 -18.523 1.00 9.96 C ATOM 1614 C PHE A 785 -17.875 -3.820 -19.581 1.00 11.94 C ATOM 1615 O PHE A 785 -19.099 -3.705 -19.444 1.00 13.79 O ATOM 1616 CB PHE A 785 -17.153 -1.718 -18.588 1.00 11.89 C ATOM 1617 CG PHE A 785 -16.685 -0.949 -17.394 1.00 11.45 C ATOM 1618 CD1 PHE A 785 -15.365 -0.604 -17.244 1.00 12.26 C ATOM 1619 CD2 PHE A 785 -17.608 -0.492 -16.454 1.00 12.38 C ATOM 1620 CE1 PHE A 785 -14.946 0.155 -16.148 1.00 13.64 C ATOM 1621 CE2 PHE A 785 -17.204 0.276 -15.362 1.00 12.34 C ATOM 1622 CZ PHE A 785 -15.878 0.603 -15.212 1.00 13.20 C ATOM 1623 H PHE A 785 -14.888 -2.820 -19.040 1.00 0.00 H ATOM 1624 N GLY A 786 -17.346 -4.383 -20.643 1.00 11.62 N ATOM 1625 CA GLY A 786 -18.175 -4.733 -21.771 1.00 13.13 C ATOM 1626 C GLY A 786 -18.430 -3.504 -22.621 1.00 12.79 C ATOM 1627 O GLY A 786 -17.836 -2.438 -22.426 1.00 14.72 O ATOM 1628 H GLY A 786 -16.325 -4.578 -20.671 1.00 0.00 H ATOM 1629 N MET A 787 -19.364 -3.648 -23.553 1.00 13.74 N ATOM 1630 CA MET A 787 -19.492 -2.720 -24.664 1.00 13.77 C ATOM 1631 C MET A 787 -20.814 -1.970 -24.689 1.00 15.23 C ATOM 1632 O MET A 787 -21.072 -1.246 -25.659 1.00 15.87 O ATOM 1633 CB MET A 787 -19.297 -3.477 -25.974 1.00 13.99 C ATOM 1634 CG MET A 787 -18.002 -4.238 -25.993 1.00 15.73 C ATOM 1635 SD MET A 787 -17.612 -4.930 -27.583 1.00 17.00 S ATOM 1636 CE MET A 787 -16.010 -5.662 -27.232 1.00 20.31 C ATOM 1637 H MET A 787 -20.024 -4.449 -23.486 1.00 0.00 H ATOM 1638 N SER A 788 -21.627 -2.074 -23.636 1.00 14.93 N ATOM 1639 CA SER A 788 -22.979 -1.537 -23.681 1.00 15.46 C ATOM 1640 C SER A 788 -23.168 -0.167 -23.021 1.00 16.23 C ATOM 1641 O SER A 788 -24.231 0.435 -23.225 1.00 16.00 O ATOM 1642 CB SER A 788 -23.954 -2.533 -23.050 1.00 17.15 C ATOM 1643 OG SER A 788 -24.089 -3.680 -23.871 1.00 17.16 O ATOM 1644 HG SER A 788 -24.433 -3.410 -24.759 1.00 0.00 H ATOM 1645 H SER A 788 -21.290 -2.545 -22.772 1.00 0.00 H ATOM 1646 N ARG A 789 -22.209 0.357 -22.239 1.00 14.68 N ATOM 1647 CA ARG A 789 -22.463 1.633 -21.555 1.00 14.90 C ATOM 1648 C ARG A 789 -22.779 2.736 -22.563 1.00 14.67 C ATOM 1649 O ARG A 789 -22.076 2.896 -23.567 1.00 14.34 O ATOM 1650 CB ARG A 789 -21.250 2.054 -20.723 1.00 14.40 C ATOM 1651 CG ARG A 789 -21.002 1.186 -19.512 1.00 14.49 C ATOM 1652 CD ARG A 789 -19.772 1.649 -18.770 1.00 14.06 C ATOM 1653 NE ARG A 789 -18.565 1.383 -19.517 1.00 11.79 N ATOM 1654 CZ ARG A 789 -17.365 1.810 -19.166 1.00 13.89 C ATOM 1655 NH1 ARG A 789 -17.174 2.578 -18.088 1.00 15.38 N ATOM 1656 NH2 ARG A 789 -16.358 1.485 -19.908 1.00 13.68 N ATOM 1657 HE ARG A 789 -18.646 0.819 -20.387 1.00 0.00 H ATOM 1658 HH12 ARG A 789 -16.216 2.897 -17.840 1.00 0.00 H ATOM 1659 HH11 ARG A 789 -17.984 2.856 -17.498 1.00 0.00 H ATOM 1660 HH22 ARG A 789 -15.402 1.807 -19.657 1.00 0.00 H ATOM 1661 HH21 ARG A 789 -16.504 0.902 -20.757 1.00 0.00 H ATOM 1662 H ARG A 789 -21.300 -0.133 -22.119 1.00 0.00 H ATOM 1663 N ASN A 790 -23.826 3.525 -22.277 1.00 13.98 N ATOM 1664 CA ASN A 790 -24.237 4.574 -23.210 1.00 12.64 C ATOM 1665 C ASN A 790 -23.132 5.592 -23.420 1.00 13.31 C ATOM 1666 O ASN A 790 -22.958 6.116 -24.526 1.00 13.05 O ATOM 1667 CB ASN A 790 -25.467 5.303 -22.680 1.00 14.53 C ATOM 1668 CG ASN A 790 -26.703 4.446 -22.696 1.00 15.83 C ATOM 1669 OD1 ASN A 790 -26.680 3.317 -23.190 1.00 17.81 O ATOM 1670 ND2 ASN A 790 -27.802 4.980 -22.158 1.00 16.74 N ATOM 1671 HD22 ASN A 790 -27.770 5.938 -21.753 1.00 0.00 H ATOM 1672 HD21 ASN A 790 -28.690 4.438 -22.144 1.00 0.00 H ATOM 1673 H ASN A 790 -24.348 3.390 -21.388 1.00 0.00 H ATOM 1674 N LEU A 791 -22.390 5.896 -22.359 1.00 14.16 N ATOM 1675 CA LEU A 791 -21.373 6.939 -22.406 1.00 14.04 C ATOM 1676 C LEU A 791 -20.333 6.668 -23.484 1.00 14.84 C ATOM 1677 O LEU A 791 -19.763 7.612 -24.054 1.00 15.58 O ATOM 1678 CB LEU A 791 -20.708 7.026 -21.040 1.00 17.65 C ATOM 1679 CG LEU A 791 -19.657 8.105 -20.839 1.00 19.96 C ATOM 1680 CD1 LEU A 791 -20.235 9.465 -21.099 1.00 19.95 C ATOM 1681 CD2 LEU A 791 -19.131 8.026 -19.411 1.00 21.31 C ATOM 1682 H LEU A 791 -22.540 5.375 -21.471 1.00 0.00 H ATOM 1683 N TYR A 792 -20.068 5.392 -23.773 1.00 12.05 N ATOM 1684 CA TYR A 792 -19.026 5.001 -24.723 1.00 10.94 C ATOM 1685 C TYR A 792 -19.582 4.351 -25.992 1.00 11.39 C ATOM 1686 O TYR A 792 -18.824 3.719 -26.748 1.00 11.51 O ATOM 1687 CB TYR A 792 -17.989 4.100 -24.047 1.00 10.86 C ATOM 1688 CG TYR A 792 -17.362 4.790 -22.866 1.00 10.07 C ATOM 1689 CD1 TYR A 792 -16.490 5.849 -23.059 1.00 11.21 C ATOM 1690 CD2 TYR A 792 -17.657 4.407 -21.557 1.00 10.98 C ATOM 1691 CE1 TYR A 792 -15.925 6.519 -21.987 1.00 11.59 C ATOM 1692 CE2 TYR A 792 -17.074 5.071 -20.464 1.00 11.89 C ATOM 1693 CZ TYR A 792 -16.209 6.123 -20.699 1.00 11.66 C ATOM 1694 OH TYR A 792 -15.608 6.822 -19.673 1.00 12.75 O ATOM 1695 HH TYR A 792 -15.059 6.202 -19.130 1.00 0.00 H ATOM 1696 H TYR A 792 -20.623 4.647 -23.305 1.00 0.00 H ATOM 1697 N ALA A 793 -20.874 4.522 -26.263 1.00 11.54 N ATOM 1698 CA ALA A 793 -21.462 3.869 -27.426 1.00 12.53 C ATOM 1699 C ALA A 793 -20.743 4.248 -28.717 1.00 12.87 C ATOM 1700 O ALA A 793 -20.636 3.420 -29.631 1.00 14.27 O ATOM 1701 CB ALA A 793 -22.960 4.192 -27.524 1.00 14.54 C ATOM 1702 H ALA A 793 -21.462 5.119 -25.647 1.00 0.00 H ATOM 1703 N GLY A 794 -20.251 5.484 -28.823 1.00 13.08 N ATOM 1704 CA GLY A 794 -19.556 5.908 -30.029 1.00 13.65 C ATOM 1705 C GLY A 794 -18.208 5.245 -30.247 1.00 11.25 C ATOM 1706 O GLY A 794 -17.618 5.390 -31.327 1.00 11.97 O ATOM 1707 H GLY A 794 -20.366 6.152 -28.034 1.00 0.00 H ATOM 1708 N ASP A 795 -17.720 4.514 -29.263 1.00 10.50 N ATOM 1709 CA ASP A 795 -16.459 3.794 -29.375 1.00 9.71 C ATOM 1710 C ASP A 795 -16.631 2.401 -29.944 1.00 9.48 C ATOM 1711 O ASP A 795 -15.635 1.688 -30.101 1.00 9.24 O ATOM 1712 CB ASP A 795 -15.814 3.651 -28.004 1.00 10.75 C ATOM 1713 CG ASP A 795 -15.301 4.958 -27.439 1.00 11.10 C ATOM 1714 OD1 ASP A 795 -15.263 5.969 -28.181 1.00 12.67 O ATOM 1715 OD2 ASP A 795 -14.951 4.943 -26.231 1.00 11.81 O ATOM 1716 H ASP A 795 -18.256 4.450 -28.374 1.00 0.00 H ATOM 1717 N TYR A 796 -17.856 2.000 -30.247 1.00 10.31 N ATOM 1718 CA TYR A 796 -18.146 0.670 -30.734 1.00 10.66 C ATOM 1719 C TYR A 796 -18.897 0.760 -32.056 1.00 12.30 C ATOM 1720 O TYR A 796 -19.727 1.644 -32.267 1.00 14.93 O ATOM 1721 CB TYR A 796 -18.916 -0.137 -29.697 1.00 11.77 C ATOM 1722 CG TYR A 796 -18.096 -0.403 -28.439 1.00 11.10 C ATOM 1723 CD1 TYR A 796 -17.146 -1.410 -28.399 1.00 10.92 C ATOM 1724 CD2 TYR A 796 -18.253 0.379 -27.318 1.00 10.75 C ATOM 1725 CE1 TYR A 796 -16.399 -1.629 -27.268 1.00 10.73 C ATOM 1726 CE2 TYR A 796 -17.523 0.158 -26.181 1.00 9.78 C ATOM 1727 CZ TYR A 796 -16.589 -0.849 -26.149 1.00 10.78 C ATOM 1728 OH TYR A 796 -15.865 -1.067 -24.999 1.00 10.42 O ATOM 1729 HH TYR A 796 -15.241 -1.822 -25.142 1.00 0.00 H ATOM 1730 H TYR A 796 -18.643 2.670 -30.130 1.00 0.00 H ATOM 1731 N TYR A 797 -18.580 -0.173 -32.945 1.00 11.64 N ATOM 1732 CA TYR A 797 -19.166 -0.284 -34.272 1.00 11.85 C ATOM 1733 C TYR A 797 -20.102 -1.486 -34.276 1.00 12.49 C ATOM 1734 O TYR A 797 -19.668 -2.617 -33.995 1.00 12.69 O ATOM 1735 CB TYR A 797 -18.044 -0.462 -35.291 1.00 11.57 C ATOM 1736 CG TYR A 797 -18.515 -0.637 -36.709 1.00 12.80 C ATOM 1737 CD1 TYR A 797 -19.080 0.423 -37.401 1.00 13.51 C ATOM 1738 CD2 TYR A 797 -18.366 -1.856 -37.369 1.00 13.99 C ATOM 1739 CE1 TYR A 797 -19.492 0.285 -38.701 1.00 15.18 C ATOM 1740 CE2 TYR A 797 -18.793 -2.013 -38.689 1.00 14.66 C ATOM 1741 CZ TYR A 797 -19.342 -0.927 -39.342 1.00 15.56 C ATOM 1742 OH TYR A 797 -19.761 -1.014 -40.641 1.00 17.97 O ATOM 1743 HH TYR A 797 -20.122 -0.138 -40.929 1.00 0.00 H ATOM 1744 H TYR A 797 -17.862 -0.875 -32.674 1.00 0.00 H ATOM 1745 N ARG A 798 -21.382 -1.235 -34.559 1.00 14.19 N ATOM 1746 CA ARG A 798 -22.433 -2.244 -34.474 1.00 16.54 C ATOM 1747 C ARG A 798 -22.989 -2.531 -35.853 1.00 17.07 C ATOM 1748 O ARG A 798 -23.427 -1.614 -36.565 1.00 17.01 O ATOM 1749 CB ARG A 798 -23.572 -1.774 -33.560 1.00 19.04 C ATOM 1750 CG ARG A 798 -23.170 -1.687 -32.085 1.00 22.91 C ATOM 1751 CD ARG A 798 -24.111 -0.797 -31.290 1.00 26.66 C ATOM 1752 NE ARG A 798 -23.946 0.604 -31.698 1.00 29.41 N ATOM 1753 CZ ARG A 798 -23.122 1.476 -31.113 1.00 30.99 C ATOM 1754 NH1 ARG A 798 -23.033 2.718 -31.581 1.00 33.10 N ATOM 1755 NH2 ARG A 798 -22.409 1.129 -30.049 1.00 28.73 N ATOM 1756 HE ARG A 798 -24.513 0.942 -32.502 1.00 0.00 H ATOM 1757 HH12 ARG A 798 -22.392 3.400 -31.127 1.00 0.00 H ATOM 1758 HH11 ARG A 798 -23.604 3.007 -32.400 1.00 0.00 H ATOM 1759 HH22 ARG A 798 -21.771 1.819 -29.603 1.00 0.00 H ATOM 1760 HH21 ARG A 798 -22.488 0.167 -29.661 1.00 0.00 H ATOM 1761 H ARG A 798 -21.643 -0.273 -34.855 1.00 0.00 H ATOM 1762 N VAL A 799 -23.029 -3.811 -36.193 1.00 16.59 N ATOM 1763 CA VAL A 799 -23.703 -4.311 -37.382 1.00 18.28 C ATOM 1764 C VAL A 799 -24.583 -5.473 -36.955 1.00 17.14 C ATOM 1765 O VAL A 799 -24.150 -6.320 -36.168 1.00 16.74 O ATOM 1766 CB VAL A 799 -22.681 -4.781 -38.435 1.00 18.78 C ATOM 1767 CG1 VAL A 799 -23.392 -5.450 -39.593 1.00 20.53 C ATOM 1768 CG2 VAL A 799 -21.849 -3.603 -38.932 1.00 19.31 C ATOM 1769 H VAL A 799 -22.551 -4.498 -35.575 1.00 0.00 H ATOM 1770 N GLN A 800 -25.816 -5.515 -37.468 1.00 18.92 N ATOM 1771 CA GLN A 800 -26.741 -6.590 -37.114 1.00 19.58 C ATOM 1772 C GLN A 800 -26.102 -7.948 -37.358 1.00 17.84 C ATOM 1773 O GLN A 800 -25.546 -8.206 -38.430 1.00 17.83 O ATOM 1774 CB GLN A 800 -28.030 -6.480 -37.922 1.00 23.52 C ATOM 1775 CG GLN A 800 -29.008 -7.618 -37.663 1.00 29.16 C ATOM 1776 CD GLN A 800 -29.566 -7.605 -36.240 1.00 34.40 C ATOM 1777 OE1 GLN A 800 -29.784 -6.539 -35.656 1.00 36.28 O ATOM 1778 NE2 GLN A 800 -29.821 -8.790 -35.689 1.00 35.87 N ATOM 1779 HE22 GLN A 800 -29.622 -9.663 -36.218 1.00 0.00 H ATOM 1780 HE21 GLN A 800 -30.220 -8.843 -34.730 1.00 0.00 H ATOM 1781 H GLN A 800 -26.122 -4.772 -38.129 1.00 0.00 H ATOM 1782 N GLY A 801 -26.182 -8.822 -36.354 1.00 15.81 N ATOM 1783 CA GLY A 801 -25.695 -10.171 -36.492 1.00 14.28 C ATOM 1784 C GLY A 801 -24.200 -10.341 -36.330 1.00 15.01 C ATOM 1785 O GLY A 801 -23.708 -11.470 -36.462 1.00 14.63 O ATOM 1786 H GLY A 801 -26.605 -8.523 -35.452 1.00 0.00 H ATOM 1787 N ARG A 802 -23.469 -9.276 -36.020 1.00 15.42 N ATOM 1788 CA ARG A 802 -22.027 -9.324 -35.831 1.00 14.22 C ATOM 1789 C ARG A 802 -21.678 -8.928 -34.401 1.00 13.28 C ATOM 1790 O ARG A 802 -22.452 -8.262 -33.703 1.00 15.05 O ATOM 1791 CB ARG A 802 -21.305 -8.371 -36.778 1.00 14.96 C ATOM 1792 CG ARG A 802 -21.459 -8.704 -38.235 1.00 15.58 C ATOM 1793 CD ARG A 802 -20.471 -7.887 -39.018 1.00 15.67 C ATOM 1794 NE ARG A 802 -20.707 -7.943 -40.448 1.00 18.00 N ATOM 1795 CZ ARG A 802 -20.257 -7.032 -41.302 1.00 19.67 C ATOM 1796 NH1 ARG A 802 -19.554 -5.994 -40.853 1.00 20.39 N ATOM 1797 NH2 ARG A 802 -20.499 -7.154 -42.602 1.00 20.75 N ATOM 1798 HE ARG A 802 -21.259 -8.740 -40.825 1.00 0.00 H ATOM 1799 HH12 ARG A 802 -19.200 -5.278 -41.519 1.00 0.00 H ATOM 1800 HH11 ARG A 802 -19.359 -5.899 -39.836 1.00 0.00 H ATOM 1801 HH22 ARG A 802 -20.144 -6.437 -43.267 1.00 0.00 H ATOM 1802 HH21 ARG A 802 -21.044 -7.966 -42.956 1.00 0.00 H ATOM 1803 H ARG A 802 -23.952 -8.362 -35.907 1.00 0.00 H ATOM 1804 N ALA A 803 -20.490 -9.348 -33.976 1.00 14.39 N ATOM 1805 CA ALA A 803 -19.950 -8.874 -32.713 1.00 15.61 C ATOM 1806 C ALA A 803 -19.804 -7.359 -32.740 1.00 14.64 C ATOM 1807 O ALA A 803 -19.598 -6.747 -33.788 1.00 15.74 O ATOM 1808 CB ALA A 803 -18.582 -9.502 -32.455 1.00 17.64 C ATOM 1809 H ALA A 803 -19.944 -10.020 -34.551 1.00 0.00 H ATOM 1810 N VAL A 804 -19.984 -6.753 -31.583 1.00 15.35 N ATOM 1811 CA VAL A 804 -19.762 -5.324 -31.417 1.00 13.79 C ATOM 1812 C VAL A 804 -18.261 -5.100 -31.339 1.00 12.92 C ATOM 1813 O VAL A 804 -17.562 -5.832 -30.634 1.00 14.62 O ATOM 1814 CB VAL A 804 -20.484 -4.841 -30.149 1.00 16.51 C ATOM 1815 CG1 VAL A 804 -20.250 -3.376 -29.928 1.00 16.59 C ATOM 1816 CG2 VAL A 804 -21.988 -5.145 -30.267 1.00 17.53 C ATOM 1817 H VAL A 804 -20.294 -7.313 -30.764 1.00 0.00 H ATOM 1818 N LEU A 805 -17.753 -4.085 -32.047 1.00 11.52 N ATOM 1819 CA LEU A 805 -16.300 -3.977 -32.215 1.00 10.34 C ATOM 1820 C LEU A 805 -15.741 -2.595 -31.898 1.00 8.89 C ATOM 1821 O LEU A 805 -16.184 -1.601 -32.492 1.00 9.54 O ATOM 1822 CB LEU A 805 -15.923 -4.319 -33.646 1.00 12.86 C ATOM 1823 CG LEU A 805 -16.254 -5.711 -34.128 1.00 18.13 C ATOM 1824 CD1 LEU A 805 -15.917 -5.794 -35.596 1.00 20.43 C ATOM 1825 CD2 LEU A 805 -15.475 -6.717 -33.329 1.00 20.22 C ATOM 1826 H LEU A 805 -18.384 -3.378 -32.475 1.00 0.00 H ATOM 1827 N PRO A 806 -14.704 -2.500 -31.050 1.00 8.42 N ATOM 1828 CA PRO A 806 -14.010 -1.202 -30.774 1.00 8.22 C ATOM 1829 C PRO A 806 -12.994 -0.865 -31.861 1.00 8.18 C ATOM 1830 O PRO A 806 -11.757 -0.908 -31.672 1.00 8.59 O ATOM 1831 CB PRO A 806 -13.346 -1.470 -29.418 1.00 8.82 C ATOM 1832 CG PRO A 806 -13.039 -2.977 -29.460 1.00 10.13 C ATOM 1833 CD PRO A 806 -14.190 -3.607 -30.208 1.00 10.14 C ATOM 1834 N ILE A 807 -13.512 -0.542 -33.051 1.00 9.44 N ATOM 1835 CA ILE A 807 -12.678 -0.485 -34.252 1.00 10.30 C ATOM 1836 C ILE A 807 -11.530 0.510 -34.112 1.00 8.32 C ATOM 1837 O ILE A 807 -10.462 0.295 -34.685 1.00 9.54 O ATOM 1838 CB ILE A 807 -13.502 -0.243 -35.529 1.00 11.16 C ATOM 1839 CG1 ILE A 807 -14.353 1.026 -35.420 1.00 10.62 C ATOM 1840 CG2 ILE A 807 -14.386 -1.455 -35.836 1.00 12.61 C ATOM 1841 CD1 ILE A 807 -15.053 1.439 -36.706 1.00 12.60 C ATOM 1842 H ILE A 807 -14.527 -0.327 -33.124 1.00 0.00 H ATOM 1843 N ARG A 808 -11.728 1.622 -33.398 1.00 7.89 N ATOM 1844 CA ARG A 808 -10.676 2.640 -33.304 1.00 7.60 C ATOM 1845 C ARG A 808 -9.475 2.200 -32.479 1.00 8.46 C ATOM 1846 O ARG A 808 -8.427 2.868 -32.546 1.00 9.78 O ATOM 1847 CB ARG A 808 -11.239 3.982 -32.817 1.00 8.68 C ATOM 1848 CG ARG A 808 -12.212 4.616 -33.800 1.00 10.12 C ATOM 1849 CD ARG A 808 -13.190 5.600 -33.160 1.00 11.13 C ATOM 1850 NE ARG A 808 -14.238 5.908 -34.129 1.00 10.94 N ATOM 1851 CZ ARG A 808 -14.124 6.800 -35.104 1.00 11.55 C ATOM 1852 NH1 ARG A 808 -13.048 7.555 -35.193 1.00 11.17 N ATOM 1853 NH2 ARG A 808 -15.098 6.949 -35.996 1.00 12.13 N ATOM 1854 HE ARG A 808 -15.137 5.392 -34.049 1.00 0.00 H ATOM 1855 HH12 ARG A 808 -12.964 8.253 -35.960 1.00 0.00 H ATOM 1856 HH11 ARG A 808 -12.282 7.453 -34.497 1.00 0.00 H ATOM 1857 HH22 ARG A 808 -15.002 7.650 -36.758 1.00 0.00 H ATOM 1858 HH21 ARG A 808 -15.956 6.364 -35.932 1.00 0.00 H ATOM 1859 H ARG A 808 -12.633 1.767 -32.906 1.00 0.00 H ATOM 1860 N TRP A 809 -9.615 1.124 -31.701 1.00 8.13 N ATOM 1861 CA TRP A 809 -8.536 0.535 -30.919 1.00 7.25 C ATOM 1862 C TRP A 809 -7.962 -0.729 -31.557 1.00 8.69 C ATOM 1863 O TRP A 809 -6.988 -1.289 -31.039 1.00 9.13 O ATOM 1864 CB TRP A 809 -9.034 0.216 -29.484 1.00 7.91 C ATOM 1865 CG TRP A 809 -9.181 1.434 -28.623 1.00 9.16 C ATOM 1866 CD1 TRP A 809 -8.304 1.854 -27.651 1.00 9.46 C ATOM 1867 CD2 TRP A 809 -10.243 2.404 -28.653 1.00 8.01 C ATOM 1868 NE1 TRP A 809 -8.741 3.033 -27.096 1.00 8.46 N ATOM 1869 CE2 TRP A 809 -9.933 3.387 -27.680 1.00 7.97 C ATOM 1870 CE3 TRP A 809 -11.415 2.542 -29.402 1.00 8.53 C ATOM 1871 CZ2 TRP A 809 -10.750 4.493 -27.460 1.00 9.40 C ATOM 1872 CZ3 TRP A 809 -12.226 3.633 -29.174 1.00 7.81 C ATOM 1873 CH2 TRP A 809 -11.887 4.595 -28.214 1.00 9.12 C ATOM 1874 HE1 TRP A 809 -8.249 3.570 -26.354 1.00 0.00 H ATOM 1875 H TRP A 809 -10.553 0.678 -31.650 1.00 0.00 H ATOM 1876 N MET A 810 -8.531 -1.188 -32.672 1.00 9.30 N ATOM 1877 CA MET A 810 -8.234 -2.513 -33.209 1.00 9.81 C ATOM 1878 C MET A 810 -7.142 -2.491 -34.268 1.00 8.97 C ATOM 1879 O MET A 810 -7.190 -1.704 -35.214 1.00 10.12 O ATOM 1880 CB MET A 810 -9.504 -3.105 -33.806 1.00 9.25 C ATOM 1881 CG MET A 810 -10.400 -3.664 -32.722 1.00 10.38 C ATOM 1882 SD MET A 810 -12.080 -4.064 -33.220 1.00 11.13 S ATOM 1883 CE MET A 810 -11.800 -5.353 -34.453 1.00 10.97 C ATOM 1884 H MET A 810 -9.209 -0.582 -33.176 1.00 0.00 H ATOM 1885 N ALA A 811 -6.188 -3.403 -34.132 1.00 8.29 N ATOM 1886 CA ALA A 811 -5.211 -3.654 -35.182 1.00 8.08 C ATOM 1887 C ALA A 811 -5.910 -4.031 -36.476 1.00 7.94 C ATOM 1888 O ALA A 811 -7.029 -4.547 -36.490 1.00 9.78 O ATOM 1889 CB ALA A 811 -4.283 -4.789 -34.767 1.00 8.94 C ATOM 1890 H ALA A 811 -6.137 -3.954 -33.251 1.00 0.00 H ATOM 1891 N TRP A 812 -5.226 -3.752 -37.584 1.00 9.04 N ATOM 1892 CA TRP A 812 -5.819 -4.003 -38.887 1.00 10.65 C ATOM 1893 C TRP A 812 -6.246 -5.460 -39.036 1.00 11.21 C ATOM 1894 O TRP A 812 -7.293 -5.748 -39.628 1.00 12.23 O ATOM 1895 CB TRP A 812 -4.853 -3.570 -39.992 1.00 11.44 C ATOM 1896 CG TRP A 812 -3.623 -4.416 -40.118 1.00 12.64 C ATOM 1897 CD1 TRP A 812 -2.412 -4.231 -39.503 1.00 13.29 C ATOM 1898 CD2 TRP A 812 -3.478 -5.576 -40.947 1.00 12.31 C ATOM 1899 NE1 TRP A 812 -1.522 -5.220 -39.899 1.00 13.46 N ATOM 1900 CE2 TRP A 812 -2.157 -6.056 -40.780 1.00 12.77 C ATOM 1901 CE3 TRP A 812 -4.341 -6.265 -41.808 1.00 13.20 C ATOM 1902 CZ2 TRP A 812 -1.685 -7.185 -41.448 1.00 12.74 C ATOM 1903 CZ3 TRP A 812 -3.865 -7.388 -42.472 1.00 13.90 C ATOM 1904 CH2 TRP A 812 -2.552 -7.841 -42.277 1.00 14.68 C ATOM 1905 HE1 TRP A 812 -0.536 -5.311 -39.580 1.00 0.00 H ATOM 1906 H TRP A 812 -4.267 -3.354 -37.517 1.00 0.00 H ATOM 1907 N GLU A 813 -5.472 -6.396 -38.478 1.00 10.00 N ATOM 1908 CA GLU A 813 -5.820 -7.804 -38.670 1.00 10.29 C ATOM 1909 C GLU A 813 -7.038 -8.206 -37.842 1.00 12.15 C ATOM 1910 O GLU A 813 -7.722 -9.186 -38.182 1.00 12.83 O ATOM 1911 CB GLU A 813 -4.631 -8.732 -38.374 1.00 11.41 C ATOM 1912 CG GLU A 813 -4.248 -8.863 -36.928 1.00 12.25 C ATOM 1913 CD GLU A 813 -3.278 -7.783 -36.404 1.00 11.86 C ATOM 1914 OE1 GLU A 813 -2.895 -6.832 -37.155 1.00 11.21 O ATOM 1915 OE2 GLU A 813 -2.895 -7.902 -35.204 1.00 10.73 O ATOM 1916 H GLU A 813 -4.638 -6.128 -37.918 1.00 0.00 H ATOM 1917 N CYS A 814 -7.299 -7.500 -36.726 1.00 10.50 N ATOM 1918 CA CYS A 814 -8.529 -7.727 -35.982 1.00 11.33 C ATOM 1919 C CYS A 814 -9.724 -7.317 -36.807 1.00 11.63 C ATOM 1920 O CYS A 814 -10.737 -8.019 -36.835 1.00 12.55 O ATOM 1921 CB CYS A 814 -8.544 -6.886 -34.707 1.00 13.25 C ATOM 1922 SG CYS A 814 -7.123 -7.071 -33.672 1.00 14.51 S ATOM 1923 H CYS A 814 -6.618 -6.788 -36.393 1.00 0.00 H ATOM 1924 N ILE A 815 -9.627 -6.166 -37.479 1.00 12.54 N ATOM 1925 CA ILE A 815 -10.734 -5.678 -38.297 1.00 14.36 C ATOM 1926 C ILE A 815 -10.948 -6.586 -39.505 1.00 14.72 C ATOM 1927 O ILE A 815 -12.078 -6.957 -39.832 1.00 16.28 O ATOM 1928 CB ILE A 815 -10.508 -4.209 -38.710 1.00 13.22 C ATOM 1929 CG1 ILE A 815 -10.530 -3.314 -37.465 1.00 13.32 C ATOM 1930 CG2 ILE A 815 -11.547 -3.735 -39.734 1.00 13.86 C ATOM 1931 CD1 ILE A 815 -10.110 -1.875 -37.698 1.00 13.24 C ATOM 1932 H ILE A 815 -8.750 -5.610 -37.419 1.00 0.00 H ATOM 1933 N LEU A 816 -9.872 -6.954 -40.195 1.00 12.31 N ATOM 1934 CA LEU A 816 -10.054 -7.656 -41.463 1.00 14.06 C ATOM 1935 C LEU A 816 -10.284 -9.149 -41.275 1.00 15.31 C ATOM 1936 O LEU A 816 -11.057 -9.755 -42.032 1.00 17.45 O ATOM 1937 CB LEU A 816 -8.844 -7.432 -42.356 1.00 16.15 C ATOM 1938 CG LEU A 816 -8.570 -6.004 -42.846 1.00 19.15 C ATOM 1939 CD1 LEU A 816 -7.501 -6.050 -43.936 1.00 20.39 C ATOM 1940 CD2 LEU A 816 -9.826 -5.327 -43.341 1.00 20.95 C ATOM 1941 H LEU A 816 -8.918 -6.746 -39.838 1.00 0.00 H ATOM 1942 N MET A 817 -9.616 -9.755 -40.288 1.00 15.30 N ATOM 1943 CA MET A 817 -9.612 -11.202 -40.118 1.00 17.66 C ATOM 1944 C MET A 817 -10.159 -11.664 -38.773 1.00 17.03 C ATOM 1945 O MET A 817 -10.269 -12.874 -38.552 1.00 17.90 O ATOM 1946 CB MET A 817 -8.180 -11.747 -40.287 1.00 20.58 C ATOM 1947 CG MET A 817 -7.648 -11.706 -41.716 1.00 23.77 C ATOM 1948 SD MET A 817 -8.722 -12.608 -42.843 1.00 27.10 S ATOM 1949 CE MET A 817 -8.565 -14.283 -42.227 1.00 26.86 C ATOM 1950 H MET A 817 -9.079 -9.171 -39.616 1.00 0.00 H ATOM 1951 N GLY A 818 -10.503 -10.753 -37.861 1.00 16.22 N ATOM 1952 CA GLY A 818 -10.988 -11.191 -36.562 1.00 15.00 C ATOM 1953 C GLY A 818 -9.938 -11.862 -35.713 1.00 14.54 C ATOM 1954 O GLY A 818 -10.272 -12.632 -34.803 1.00 15.40 O ATOM 1955 H GLY A 818 -10.425 -9.739 -38.077 1.00 0.00 H ATOM 1956 N LYS A 819 -8.668 -11.589 -35.980 1.00 14.79 N ATOM 1957 CA LYS A 819 -7.552 -12.258 -35.314 1.00 16.05 C ATOM 1958 C LYS A 819 -7.120 -11.389 -34.139 1.00 13.57 C ATOM 1959 O LYS A 819 -6.481 -10.349 -34.330 1.00 15.18 O ATOM 1960 CB LYS A 819 -6.412 -12.410 -36.316 1.00 23.77 C ATOM 1961 CG LYS A 819 -5.410 -13.506 -36.030 1.00 33.07 C ATOM 1962 CD LYS A 819 -4.963 -14.162 -37.339 1.00 41.01 C ATOM 1963 CE LYS A 819 -3.495 -13.916 -37.658 1.00 47.00 C ATOM 1964 NZ LYS A 819 -2.628 -15.012 -37.120 1.00 51.64 N ATOM 1965 HZ1 LYS A 819 -2.738 -15.064 -36.087 1.00 0.00 H ATOM 1966 HZ2 LYS A 819 -2.912 -15.917 -37.546 1.00 0.00 H ATOM 1967 HZ3 LYS A 819 -1.635 -14.813 -37.355 1.00 0.00 H ATOM 1968 H LYS A 819 -8.456 -10.865 -36.696 1.00 0.00 H ATOM 1969 N PHE A 820 -7.494 -11.794 -32.927 1.00 12.61 N ATOM 1970 CA PHE A 820 -7.118 -11.105 -31.698 1.00 12.05 C ATOM 1971 C PHE A 820 -6.037 -11.906 -30.978 1.00 11.72 C ATOM 1972 O PHE A 820 -6.211 -13.102 -30.709 1.00 13.44 O ATOM 1973 CB PHE A 820 -8.319 -10.944 -30.766 1.00 13.13 C ATOM 1974 CG PHE A 820 -9.319 -9.926 -31.202 1.00 14.00 C ATOM 1975 CD1 PHE A 820 -10.234 -10.208 -32.204 1.00 15.06 C ATOM 1976 CD2 PHE A 820 -9.367 -8.679 -30.590 1.00 13.26 C ATOM 1977 CE1 PHE A 820 -11.174 -9.253 -32.587 1.00 14.21 C ATOM 1978 CE2 PHE A 820 -10.275 -7.731 -30.978 1.00 14.13 C ATOM 1979 CZ PHE A 820 -11.192 -8.015 -31.972 1.00 14.64 C ATOM 1980 H PHE A 820 -8.085 -12.646 -32.853 1.00 0.00 H ATOM 1981 N THR A 821 -4.933 -11.242 -30.650 1.00 11.15 N ATOM 1982 CA THR A 821 -3.771 -11.880 -30.063 1.00 10.77 C ATOM 1983 C THR A 821 -3.163 -10.907 -29.065 1.00 9.26 C ATOM 1984 O THR A 821 -3.564 -9.738 -28.976 1.00 10.01 O ATOM 1985 CB THR A 821 -2.710 -12.163 -31.128 1.00 12.18 C ATOM 1986 OG1 THR A 821 -2.296 -10.924 -31.709 1.00 13.02 O ATOM 1987 CG2 THR A 821 -3.234 -13.111 -32.214 1.00 13.80 C ATOM 1988 HG1 THR A 821 -3.077 -10.478 -32.123 1.00 0.00 H ATOM 1989 H THR A 821 -4.901 -10.217 -30.823 1.00 0.00 H ATOM 1990 N THR A 822 -2.144 -11.363 -28.341 1.00 10.17 N ATOM 1991 CA THR A 822 -1.371 -10.440 -27.518 1.00 9.04 C ATOM 1992 C THR A 822 -0.823 -9.290 -28.352 1.00 9.16 C ATOM 1993 O THR A 822 -0.813 -8.143 -27.898 1.00 10.31 O ATOM 1994 CB THR A 822 -0.258 -11.196 -26.797 1.00 12.60 C ATOM 1995 OG1 THR A 822 -0.850 -12.119 -25.875 1.00 17.70 O ATOM 1996 CG2 THR A 822 0.662 -10.257 -26.048 1.00 12.97 C ATOM 1997 HG1 THR A 822 -0.136 -12.615 -25.402 1.00 0.00 H ATOM 1998 H THR A 822 -1.900 -12.374 -28.362 1.00 0.00 H ATOM 1999 N ALA A 823 -0.410 -9.567 -29.600 1.00 9.71 N ATOM 2000 CA ALA A 823 0.094 -8.511 -30.474 1.00 9.51 C ATOM 2001 C ALA A 823 -0.975 -7.482 -30.826 1.00 10.00 C ATOM 2002 O ALA A 823 -0.648 -6.302 -31.008 1.00 9.95 O ATOM 2003 CB ALA A 823 0.638 -9.127 -31.756 1.00 11.64 C ATOM 2004 H ALA A 823 -0.450 -10.546 -29.948 1.00 0.00 H ATOM 2005 N SER A 824 -2.251 -7.896 -30.965 1.00 9.10 N ATOM 2006 CA SER A 824 -3.288 -6.886 -31.146 1.00 9.08 C ATOM 2007 C SER A 824 -3.570 -6.145 -29.834 1.00 8.54 C ATOM 2008 O SER A 824 -3.923 -4.961 -29.843 1.00 8.39 O ATOM 2009 CB SER A 824 -4.558 -7.456 -31.796 1.00 9.37 C ATOM 2010 OG SER A 824 -5.161 -8.466 -31.028 1.00 10.43 O ATOM 2011 HG SER A 824 -5.413 -8.100 -30.143 1.00 0.00 H ATOM 2012 H SER A 824 -2.489 -8.908 -30.944 1.00 0.00 H ATOM 2013 N ASP A 825 -3.360 -6.797 -28.691 1.00 8.21 N ATOM 2014 CA ASP A 825 -3.443 -6.077 -27.426 1.00 7.74 C ATOM 2015 C ASP A 825 -2.374 -5.003 -27.350 1.00 6.96 C ATOM 2016 O ASP A 825 -2.612 -3.920 -26.803 1.00 7.43 O ATOM 2017 CB ASP A 825 -3.335 -7.045 -26.238 1.00 8.91 C ATOM 2018 CG ASP A 825 -4.674 -7.695 -25.824 1.00 10.87 C ATOM 2019 OD1 ASP A 825 -5.789 -7.351 -26.294 1.00 9.30 O ATOM 2020 OD2 ASP A 825 -4.575 -8.567 -24.957 1.00 11.40 O ATOM 2021 H ASP A 825 -3.138 -7.813 -28.701 1.00 0.00 H ATOM 2022 N VAL A 826 -1.183 -5.286 -27.885 1.00 7.25 N ATOM 2023 CA VAL A 826 -0.115 -4.273 -27.918 1.00 6.72 C ATOM 2024 C VAL A 826 -0.543 -3.068 -28.760 1.00 7.21 C ATOM 2025 O VAL A 826 -0.311 -1.914 -28.382 1.00 7.70 O ATOM 2026 CB VAL A 826 1.206 -4.891 -28.419 1.00 7.99 C ATOM 2027 CG1 VAL A 826 2.216 -3.801 -28.785 1.00 9.03 C ATOM 2028 CG2 VAL A 826 1.784 -5.820 -27.383 1.00 8.10 C ATOM 2029 H VAL A 826 -1.008 -6.231 -28.282 1.00 0.00 H ATOM 2030 N TRP A 827 -1.152 -3.320 -29.922 1.00 7.80 N ATOM 2031 CA TRP A 827 -1.682 -2.233 -30.743 1.00 7.03 C ATOM 2032 C TRP A 827 -2.689 -1.390 -29.960 1.00 7.39 C ATOM 2033 O TRP A 827 -2.604 -0.155 -29.932 1.00 8.67 O ATOM 2034 CB TRP A 827 -2.289 -2.819 -32.021 1.00 8.00 C ATOM 2035 CG TRP A 827 -2.948 -1.838 -32.954 1.00 8.04 C ATOM 2036 CD1 TRP A 827 -4.007 -1.008 -32.690 1.00 8.08 C ATOM 2037 CD2 TRP A 827 -2.615 -1.624 -34.326 1.00 8.13 C ATOM 2038 NE1 TRP A 827 -4.335 -0.289 -33.809 1.00 8.64 N ATOM 2039 CE2 TRP A 827 -3.495 -0.642 -34.827 1.00 8.78 C ATOM 2040 CE3 TRP A 827 -1.649 -2.163 -35.179 1.00 8.55 C ATOM 2041 CZ2 TRP A 827 -3.464 -0.214 -36.154 1.00 9.27 C ATOM 2042 CZ3 TRP A 827 -1.628 -1.745 -36.499 1.00 9.70 C ATOM 2043 CH2 TRP A 827 -2.512 -0.760 -36.963 1.00 10.85 C ATOM 2044 HE1 TRP A 827 -5.100 0.412 -33.873 1.00 0.00 H ATOM 2045 H TRP A 827 -1.250 -4.303 -30.247 1.00 0.00 H ATOM 2046 N ALA A 828 -3.652 -2.043 -29.306 1.00 7.12 N ATOM 2047 CA ALA A 828 -4.628 -1.310 -28.496 1.00 7.15 C ATOM 2048 C ALA A 828 -3.959 -0.573 -27.343 1.00 6.41 C ATOM 2049 O ALA A 828 -4.414 0.507 -26.945 1.00 8.28 O ATOM 2050 CB ALA A 828 -5.674 -2.282 -27.942 1.00 8.64 C ATOM 2051 H ALA A 828 -3.710 -3.079 -29.372 1.00 0.00 H ATOM 2052 N PHE A 829 -2.884 -1.134 -26.795 1.00 6.67 N ATOM 2053 CA PHE A 829 -2.101 -0.414 -25.795 1.00 7.17 C ATOM 2054 C PHE A 829 -1.529 0.872 -26.370 1.00 7.55 C ATOM 2055 O PHE A 829 -1.552 1.916 -25.706 1.00 7.39 O ATOM 2056 CB PHE A 829 -0.998 -1.282 -25.188 1.00 8.59 C ATOM 2057 CG PHE A 829 -0.145 -0.514 -24.248 1.00 8.21 C ATOM 2058 CD1 PHE A 829 -0.556 -0.305 -22.936 1.00 8.94 C ATOM 2059 CD2 PHE A 829 1.024 0.084 -24.671 1.00 9.32 C ATOM 2060 CE1 PHE A 829 0.193 0.487 -22.070 1.00 9.69 C ATOM 2061 CE2 PHE A 829 1.776 0.850 -23.813 1.00 10.89 C ATOM 2062 CZ PHE A 829 1.364 1.048 -22.507 1.00 9.93 C ATOM 2063 H PHE A 829 -2.599 -2.093 -27.081 1.00 0.00 H ATOM 2064 N GLY A 830 -1.002 0.820 -27.597 1.00 7.43 N ATOM 2065 CA GLY A 830 -0.540 2.046 -28.226 1.00 8.97 C ATOM 2066 C GLY A 830 -1.632 3.091 -28.287 1.00 7.71 C ATOM 2067 O GLY A 830 -1.395 4.262 -28.023 1.00 8.53 O ATOM 2068 H GLY A 830 -0.923 -0.089 -28.097 1.00 0.00 H ATOM 2069 N VAL A 831 -2.843 2.680 -28.666 1.00 7.61 N ATOM 2070 CA VAL A 831 -3.957 3.625 -28.739 1.00 8.18 C ATOM 2071 C VAL A 831 -4.310 4.140 -27.345 1.00 6.48 C ATOM 2072 O VAL A 831 -4.623 5.322 -27.168 1.00 8.06 O ATOM 2073 CB VAL A 831 -5.183 2.990 -29.425 1.00 8.16 C ATOM 2074 CG1 VAL A 831 -6.346 3.981 -29.455 1.00 8.04 C ATOM 2075 CG2 VAL A 831 -4.846 2.503 -30.810 1.00 7.38 C ATOM 2076 H VAL A 831 -2.996 1.681 -28.911 1.00 0.00 H ATOM 2077 N THR A 832 -4.290 3.251 -26.346 1.00 6.04 N ATOM 2078 CA THR A 832 -4.587 3.617 -24.956 1.00 7.42 C ATOM 2079 C THR A 832 -3.569 4.622 -24.438 1.00 7.98 C ATOM 2080 O THR A 832 -3.933 5.589 -23.747 1.00 8.86 O ATOM 2081 CB THR A 832 -4.646 2.356 -24.079 1.00 8.42 C ATOM 2082 OG1 THR A 832 -5.674 1.469 -24.563 1.00 8.77 O ATOM 2083 CG2 THR A 832 -4.957 2.685 -22.634 1.00 8.60 C ATOM 2084 HG1 THR A 832 -5.471 1.209 -25.496 1.00 0.00 H ATOM 2085 H THR A 832 -4.055 2.261 -26.563 1.00 0.00 H ATOM 2086 N LEU A 833 -2.290 4.397 -24.750 1.00 7.51 N ATOM 2087 CA LEU A 833 -1.246 5.347 -24.388 1.00 6.77 C ATOM 2088 C LEU A 833 -1.479 6.697 -25.056 1.00 7.25 C ATOM 2089 O LEU A 833 -1.355 7.746 -24.422 1.00 8.80 O ATOM 2090 CB LEU A 833 0.106 4.764 -24.782 1.00 8.18 C ATOM 2091 CG LEU A 833 1.330 5.634 -24.541 1.00 9.29 C ATOM 2092 CD1 LEU A 833 1.479 6.023 -23.095 1.00 10.28 C ATOM 2093 CD2 LEU A 833 2.568 4.922 -25.032 1.00 10.59 C ATOM 2094 H LEU A 833 -2.034 3.528 -25.261 1.00 0.00 H ATOM 2095 N TRP A 834 -1.826 6.687 -26.342 1.00 7.14 N ATOM 2096 CA TRP A 834 -2.211 7.912 -27.022 1.00 7.75 C ATOM 2097 C TRP A 834 -3.347 8.626 -26.274 1.00 8.21 C ATOM 2098 O TRP A 834 -3.305 9.843 -26.062 1.00 9.35 O ATOM 2099 CB TRP A 834 -2.605 7.581 -28.463 1.00 8.02 C ATOM 2100 CG TRP A 834 -3.005 8.770 -29.294 1.00 8.47 C ATOM 2101 CD1 TRP A 834 -2.194 9.509 -30.107 1.00 8.45 C ATOM 2102 CD2 TRP A 834 -4.320 9.318 -29.438 1.00 8.26 C ATOM 2103 NE1 TRP A 834 -2.913 10.497 -30.727 1.00 9.17 N ATOM 2104 CE2 TRP A 834 -4.230 10.392 -30.350 1.00 8.42 C ATOM 2105 CE3 TRP A 834 -5.557 9.000 -28.894 1.00 10.45 C ATOM 2106 CZ2 TRP A 834 -5.338 11.167 -30.698 1.00 9.69 C ATOM 2107 CZ3 TRP A 834 -6.650 9.770 -29.229 1.00 9.61 C ATOM 2108 CH2 TRP A 834 -6.543 10.824 -30.158 1.00 9.71 C ATOM 2109 HE1 TRP A 834 -2.525 11.210 -31.377 1.00 0.00 H ATOM 2110 H TRP A 834 -1.821 5.789 -26.867 1.00 0.00 H ATOM 2111 N GLU A 835 -4.375 7.884 -25.874 1.00 8.22 N ATOM 2112 CA GLU A 835 -5.463 8.495 -25.127 1.00 7.32 C ATOM 2113 C GLU A 835 -4.932 9.175 -23.876 1.00 8.49 C ATOM 2114 O GLU A 835 -5.326 10.300 -23.555 1.00 9.79 O ATOM 2115 CB GLU A 835 -6.490 7.456 -24.680 1.00 8.21 C ATOM 2116 CG GLU A 835 -7.282 6.716 -25.720 1.00 8.59 C ATOM 2117 CD GLU A 835 -8.332 5.850 -25.025 1.00 9.97 C ATOM 2118 OE1 GLU A 835 -9.393 6.400 -24.625 1.00 10.88 O ATOM 2119 OE2 GLU A 835 -8.055 4.646 -24.833 1.00 9.31 O ATOM 2120 H GLU A 835 -4.401 6.868 -26.095 1.00 0.00 H ATOM 2121 N VAL A 836 -4.115 8.460 -23.098 1.00 7.95 N ATOM 2122 CA VAL A 836 -3.551 9.023 -21.873 1.00 8.42 C ATOM 2123 C VAL A 836 -2.808 10.319 -22.166 1.00 9.71 C ATOM 2124 O VAL A 836 -2.935 11.309 -21.437 1.00 9.34 O ATOM 2125 CB VAL A 836 -2.671 7.977 -21.157 1.00 9.41 C ATOM 2126 CG1 VAL A 836 -1.920 8.606 -20.012 1.00 10.75 C ATOM 2127 CG2 VAL A 836 -3.547 6.806 -20.663 1.00 10.66 C ATOM 2128 H VAL A 836 -3.876 7.485 -23.369 1.00 0.00 H ATOM 2129 N LEU A 837 -2.004 10.331 -23.222 1.00 9.12 N ATOM 2130 CA LEU A 837 -1.209 11.510 -23.553 1.00 9.55 C ATOM 2131 C LEU A 837 -2.064 12.632 -24.139 1.00 9.81 C ATOM 2132 O LEU A 837 -1.611 13.785 -24.196 1.00 10.46 O ATOM 2133 CB LEU A 837 -0.077 11.117 -24.503 1.00 10.81 C ATOM 2134 CG LEU A 837 1.215 10.645 -23.811 1.00 14.91 C ATOM 2135 CD1 LEU A 837 1.908 11.787 -23.061 1.00 16.54 C ATOM 2136 CD2 LEU A 837 0.999 9.538 -22.861 1.00 17.94 C ATOM 2137 H LEU A 837 -1.939 9.486 -23.824 1.00 0.00 H ATOM 2138 N MET A 838 -3.281 12.311 -24.568 1.00 9.45 N ATOM 2139 CA MET A 838 -4.303 13.282 -24.952 1.00 10.01 C ATOM 2140 C MET A 838 -5.194 13.680 -23.779 1.00 9.41 C ATOM 2141 O MET A 838 -6.182 14.416 -23.962 1.00 10.54 O ATOM 2142 CB MET A 838 -5.166 12.694 -26.063 1.00 9.73 C ATOM 2143 CG MET A 838 -4.425 12.522 -27.391 1.00 11.09 C ATOM 2144 SD MET A 838 -3.911 14.080 -28.169 1.00 11.41 S ATOM 2145 CE MET A 838 -5.474 14.689 -28.773 1.00 13.61 C ATOM 2146 H MET A 838 -3.521 11.301 -24.635 1.00 0.00 H ATOM 2147 N LEU A 839 -4.858 13.220 -22.575 1.00 9.21 N ATOM 2148 CA LEU A 839 -5.657 13.487 -21.379 1.00 9.67 C ATOM 2149 C LEU A 839 -7.092 13.017 -21.566 1.00 9.22 C ATOM 2150 O LEU A 839 -8.008 13.538 -20.939 1.00 12.01 O ATOM 2151 CB LEU A 839 -5.624 14.974 -20.996 1.00 13.52 C ATOM 2152 CG LEU A 839 -4.337 15.592 -20.429 1.00 15.84 C ATOM 2153 CD1 LEU A 839 -4.114 15.166 -19.012 1.00 16.67 C ATOM 2154 CD2 LEU A 839 -3.090 15.307 -21.222 1.00 16.78 C ATOM 2155 H LEU A 839 -3.994 12.649 -22.482 1.00 0.00 H ATOM 2156 N CYS A 840 -7.289 11.997 -22.405 1.00 8.01 N ATOM 2157 CA CYS A 840 -8.607 11.409 -22.623 1.00 10.20 C ATOM 2158 C CYS A 840 -9.610 12.416 -23.152 1.00 11.58 C ATOM 2159 O CYS A 840 -10.814 12.234 -23.003 1.00 14.57 O ATOM 2160 CB CYS A 840 -9.115 10.703 -21.360 1.00 11.61 C ATOM 2161 SG CYS A 840 -8.156 9.245 -20.977 1.00 12.35 S ATOM 2162 H CYS A 840 -6.474 11.608 -22.921 1.00 0.00 H ATOM 2163 N ARG A 841 -9.137 13.466 -23.830 1.00 12.10 N ATOM 2164 CA ARG A 841 -10.003 14.527 -24.323 1.00 13.75 C ATOM 2165 C ARG A 841 -10.251 14.435 -25.825 1.00 13.11 C ATOM 2166 O ARG A 841 -10.822 15.358 -26.399 1.00 14.12 O ATOM 2167 CB ARG A 841 -9.447 15.896 -23.916 1.00 15.69 C ATOM 2168 CG ARG A 841 -9.695 16.210 -22.422 1.00 17.62 C ATOM 2169 CD ARG A 841 -8.614 17.077 -21.778 1.00 19.63 C ATOM 2170 NE ARG A 841 -8.820 18.504 -21.998 1.00 21.12 N ATOM 2171 CZ ARG A 841 -9.266 19.372 -21.088 1.00 23.35 C ATOM 2172 NH1 ARG A 841 -9.568 18.985 -19.854 1.00 23.56 N ATOM 2173 NH2 ARG A 841 -9.413 20.651 -21.421 1.00 25.38 N ATOM 2174 HE ARG A 841 -8.601 18.876 -22.944 1.00 0.00 H ATOM 2175 HH12 ARG A 841 -9.914 19.679 -19.161 1.00 0.00 H ATOM 2176 HH11 ARG A 841 -9.458 17.988 -19.580 1.00 0.00 H ATOM 2177 HH22 ARG A 841 -9.760 21.335 -20.718 1.00 0.00 H ATOM 2178 HH21 ARG A 841 -9.181 20.968 -22.384 1.00 0.00 H ATOM 2179 H ARG A 841 -8.115 13.527 -24.012 1.00 0.00 H ATOM 2180 N ALA A 842 -9.855 13.335 -26.458 1.00 12.26 N ATOM 2181 CA ALA A 842 -10.117 13.123 -27.871 1.00 12.84 C ATOM 2182 C ALA A 842 -10.344 11.644 -28.144 1.00 12.16 C ATOM 2183 O ALA A 842 -9.746 10.774 -27.506 1.00 14.91 O ATOM 2184 CB ALA A 842 -8.931 13.602 -28.700 1.00 15.86 C ATOM 2185 H ALA A 842 -9.342 12.604 -25.925 1.00 0.00 H ATOM 2186 N GLN A 843 -11.207 11.368 -29.109 1.00 10.69 N ATOM 2187 CA GLN A 843 -11.380 9.982 -29.531 1.00 10.75 C ATOM 2188 C GLN A 843 -10.336 9.638 -30.595 1.00 8.32 C ATOM 2189 O GLN A 843 -10.075 10.450 -31.491 1.00 10.00 O ATOM 2190 CB GLN A 843 -12.762 9.787 -30.139 1.00 12.70 C ATOM 2191 CG GLN A 843 -13.086 8.353 -30.471 1.00 13.25 C ATOM 2192 CD GLN A 843 -14.382 8.215 -31.241 1.00 13.47 C ATOM 2193 OE1 GLN A 843 -14.606 8.899 -32.251 1.00 14.89 O ATOM 2194 NE2 GLN A 843 -15.232 7.325 -30.784 1.00 13.56 N ATOM 2195 HE22 GLN A 843 -15.001 6.774 -29.933 1.00 0.00 H ATOM 2196 HE21 GLN A 843 -16.137 7.171 -31.273 1.00 0.00 H ATOM 2197 H GLN A 843 -11.754 12.129 -29.560 1.00 0.00 H ATOM 2198 N PRO A 844 -9.762 8.437 -30.545 1.00 10.37 N ATOM 2199 CA PRO A 844 -8.819 8.047 -31.595 1.00 8.38 C ATOM 2200 C PRO A 844 -9.461 8.138 -32.977 1.00 8.56 C ATOM 2201 O PRO A 844 -10.597 7.712 -33.179 1.00 9.50 O ATOM 2202 CB PRO A 844 -8.463 6.608 -31.218 1.00 9.73 C ATOM 2203 CG PRO A 844 -8.750 6.508 -29.770 1.00 12.89 C ATOM 2204 CD PRO A 844 -9.843 7.429 -29.468 1.00 10.96 C ATOM 2205 N PHE A 845 -8.722 8.729 -33.924 1.00 9.55 N ATOM 2206 CA PHE A 845 -9.189 8.943 -35.304 1.00 8.67 C ATOM 2207 C PHE A 845 -10.493 9.742 -35.329 1.00 9.94 C ATOM 2208 O PHE A 845 -11.350 9.538 -36.187 1.00 10.51 O ATOM 2209 CB PHE A 845 -9.340 7.629 -36.086 1.00 9.26 C ATOM 2210 CG PHE A 845 -8.041 6.900 -36.316 1.00 10.03 C ATOM 2211 CD1 PHE A 845 -7.035 7.472 -37.093 1.00 10.33 C ATOM 2212 CD2 PHE A 845 -7.823 5.651 -35.776 1.00 11.20 C ATOM 2213 CE1 PHE A 845 -5.837 6.805 -37.314 1.00 11.59 C ATOM 2214 CE2 PHE A 845 -6.611 5.001 -35.993 1.00 10.89 C ATOM 2215 CZ PHE A 845 -5.633 5.576 -36.769 1.00 12.49 C ATOM 2216 H PHE A 845 -7.767 9.054 -33.672 1.00 0.00 H ATOM 2217 N GLY A 846 -10.640 10.659 -34.367 1.00 10.88 N ATOM 2218 CA GLY A 846 -11.920 11.275 -34.080 1.00 11.44 C ATOM 2219 C GLY A 846 -12.525 12.065 -35.218 1.00 12.57 C ATOM 2220 O GLY A 846 -13.745 12.303 -35.217 1.00 13.78 O ATOM 2221 H GLY A 846 -9.810 10.939 -33.807 1.00 0.00 H ATOM 2222 N GLN A 847 -11.717 12.516 -36.171 1.00 11.25 N ATOM 2223 CA GLN A 847 -12.250 13.263 -37.303 1.00 11.66 C ATOM 2224 C GLN A 847 -12.613 12.361 -38.473 1.00 12.05 C ATOM 2225 O GLN A 847 -13.166 12.852 -39.473 1.00 14.73 O ATOM 2226 CB GLN A 847 -11.279 14.365 -37.747 1.00 13.38 C ATOM 2227 CG GLN A 847 -10.904 15.373 -36.658 1.00 14.73 C ATOM 2228 CD GLN A 847 -12.100 16.143 -36.098 1.00 16.32 C ATOM 2229 OE1 GLN A 847 -12.807 15.654 -35.214 1.00 18.23 O ATOM 2230 NE2 GLN A 847 -12.312 17.359 -36.595 1.00 16.35 N ATOM 2231 HE22 GLN A 847 -11.690 17.732 -37.341 1.00 0.00 H ATOM 2232 HE21 GLN A 847 -13.100 17.937 -36.238 1.00 0.00 H ATOM 2233 H GLN A 847 -10.695 12.334 -36.109 1.00 0.00 H ATOM 2234 N LEU A 848 -12.333 11.067 -38.360 1.00 11.34 N ATOM 2235 CA LEU A 848 -12.663 10.098 -39.396 1.00 11.28 C ATOM 2236 C LEU A 848 -13.918 9.312 -39.024 1.00 9.98 C ATOM 2237 O LEU A 848 -14.161 9.005 -37.852 1.00 11.71 O ATOM 2238 CB LEU A 848 -11.512 9.101 -39.581 1.00 12.12 C ATOM 2239 CG LEU A 848 -10.155 9.692 -39.928 1.00 13.88 C ATOM 2240 CD1 LEU A 848 -9.145 8.590 -40.153 1.00 15.14 C ATOM 2241 CD2 LEU A 848 -10.245 10.582 -41.141 1.00 14.46 C ATOM 2242 H LEU A 848 -11.859 10.733 -37.497 1.00 0.00 H ATOM 2243 N THR A 849 -14.667 8.908 -40.043 1.00 10.98 N ATOM 2244 CA THR A 849 -15.868 8.115 -39.819 1.00 11.93 C ATOM 2245 C THR A 849 -15.490 6.667 -39.506 1.00 11.31 C ATOM 2246 O THR A 849 -14.369 6.225 -39.758 1.00 11.18 O ATOM 2247 CB THR A 849 -16.752 8.101 -41.065 1.00 12.83 C ATOM 2248 OG1 THR A 849 -16.074 7.391 -42.089 1.00 14.30 O ATOM 2249 CG2 THR A 849 -17.103 9.487 -41.545 1.00 13.75 C ATOM 2250 HG1 THR A 849 -16.636 7.373 -42.904 1.00 0.00 H ATOM 2251 H THR A 849 -14.393 9.161 -41.014 1.00 0.00 H ATOM 2252 N ASP A 850 -16.458 5.917 -38.965 1.00 11.86 N ATOM 2253 CA ASP A 850 -16.232 4.491 -38.744 1.00 11.48 C ATOM 2254 C ASP A 850 -15.818 3.799 -40.044 1.00 12.28 C ATOM 2255 O ASP A 850 -14.913 2.953 -40.051 1.00 11.69 O ATOM 2256 CB ASP A 850 -17.501 3.826 -38.201 1.00 13.05 C ATOM 2257 CG ASP A 850 -17.814 4.177 -36.753 1.00 15.60 C ATOM 2258 OD1 ASP A 850 -16.979 4.749 -36.018 1.00 17.70 O ATOM 2259 OD2 ASP A 850 -18.951 3.858 -36.348 1.00 16.05 O ATOM 2260 H ASP A 850 -17.367 6.348 -38.703 1.00 0.00 H ATOM 2261 N GLU A 851 -16.486 4.143 -41.150 1.00 13.18 N ATOM 2262 CA GLU A 851 -16.153 3.568 -42.448 1.00 15.78 C ATOM 2263 C GLU A 851 -14.706 3.878 -42.813 1.00 13.41 C ATOM 2264 O GLU A 851 -13.977 3.009 -43.304 1.00 13.70 O ATOM 2265 CB GLU A 851 -17.121 4.107 -43.508 1.00 20.88 C ATOM 2266 CG GLU A 851 -16.891 3.559 -44.929 1.00 29.17 C ATOM 2267 CD GLU A 851 -17.909 4.077 -45.954 1.00 36.81 C ATOM 2268 OE1 GLU A 851 -18.736 4.951 -45.609 1.00 39.65 O ATOM 2269 OE2 GLU A 851 -17.880 3.597 -47.110 1.00 40.01 O ATOM 2270 H GLU A 851 -17.259 4.835 -41.083 1.00 0.00 H ATOM 2271 N GLN A 852 -14.264 5.109 -42.556 1.00 12.38 N ATOM 2272 CA GLN A 852 -12.884 5.464 -42.852 1.00 10.77 C ATOM 2273 C GLN A 852 -11.904 4.680 -41.983 1.00 10.38 C ATOM 2274 O GLN A 852 -10.807 4.328 -42.442 1.00 11.24 O ATOM 2275 CB GLN A 852 -12.701 6.970 -42.712 1.00 11.03 C ATOM 2276 CG GLN A 852 -13.347 7.730 -43.862 1.00 12.44 C ATOM 2277 CD GLN A 852 -13.263 9.225 -43.695 1.00 12.60 C ATOM 2278 OE1 GLN A 852 -13.534 9.766 -42.612 1.00 12.57 O ATOM 2279 NE2 GLN A 852 -12.873 9.915 -44.770 1.00 12.26 N ATOM 2280 HE22 GLN A 852 -12.656 9.417 -45.657 1.00 0.00 H ATOM 2281 HE21 GLN A 852 -12.786 10.950 -44.720 1.00 0.00 H ATOM 2282 H GLN A 852 -14.906 5.816 -42.144 1.00 0.00 H ATOM 2283 N VAL A 853 -12.262 4.418 -40.721 1.00 10.39 N ATOM 2284 CA VAL A 853 -11.379 3.633 -39.863 1.00 10.68 C ATOM 2285 C VAL A 853 -11.228 2.208 -40.394 1.00 10.19 C ATOM 2286 O VAL A 853 -10.122 1.643 -40.422 1.00 9.91 O ATOM 2287 CB VAL A 853 -11.882 3.690 -38.409 1.00 11.04 C ATOM 2288 CG1 VAL A 853 -11.169 2.666 -37.540 1.00 10.28 C ATOM 2289 CG2 VAL A 853 -11.705 5.115 -37.850 1.00 11.53 C ATOM 2290 H VAL A 853 -13.167 4.773 -40.352 1.00 0.00 H ATOM 2291 N ILE A 854 -12.325 1.616 -40.847 1.00 10.83 N ATOM 2292 CA ILE A 854 -12.265 0.271 -41.406 1.00 11.01 C ATOM 2293 C ILE A 854 -11.476 0.269 -42.711 1.00 11.07 C ATOM 2294 O ILE A 854 -10.687 -0.640 -42.981 1.00 13.13 O ATOM 2295 CB ILE A 854 -13.698 -0.261 -41.570 1.00 12.40 C ATOM 2296 CG1 ILE A 854 -14.345 -0.429 -40.184 1.00 14.17 C ATOM 2297 CG2 ILE A 854 -13.709 -1.540 -42.395 1.00 15.10 C ATOM 2298 CD1 ILE A 854 -15.836 -0.606 -40.247 1.00 15.50 C ATOM 2299 H ILE A 854 -13.236 2.116 -40.803 1.00 0.00 H ATOM 2300 N GLU A 855 -11.687 1.286 -43.539 1.00 12.44 N ATOM 2301 CA GLU A 855 -10.929 1.448 -44.779 1.00 14.24 C ATOM 2302 C GLU A 855 -9.432 1.548 -44.476 1.00 12.91 C ATOM 2303 O GLU A 855 -8.597 0.983 -45.194 1.00 12.79 O ATOM 2304 CB GLU A 855 -11.505 2.723 -45.417 1.00 20.00 C ATOM 2305 CG GLU A 855 -11.043 3.369 -46.671 1.00 28.40 C ATOM 2306 CD GLU A 855 -11.821 4.719 -46.795 1.00 33.40 C ATOM 2307 OE1 GLU A 855 -11.202 5.810 -46.844 1.00 33.90 O ATOM 2308 OE2 GLU A 855 -13.083 4.683 -46.739 1.00 35.82 O ATOM 2309 H GLU A 855 -12.414 1.989 -43.298 1.00 0.00 H ATOM 2310 N ASN A 856 -9.079 2.228 -43.384 1.00 12.22 N ATOM 2311 CA ASN A 856 -7.674 2.368 -43.016 1.00 10.41 C ATOM 2312 C ASN A 856 -7.061 1.003 -42.695 1.00 10.54 C ATOM 2313 O ASN A 856 -5.887 0.742 -43.002 1.00 10.77 O ATOM 2314 CB ASN A 856 -7.569 3.314 -41.817 1.00 11.29 C ATOM 2315 CG ASN A 856 -6.149 3.719 -41.504 1.00 12.27 C ATOM 2316 OD1 ASN A 856 -5.371 4.029 -42.391 1.00 11.90 O ATOM 2317 ND2 ASN A 856 -5.809 3.728 -40.228 1.00 13.52 N ATOM 2318 HD22 ASN A 856 -6.503 3.456 -39.503 1.00 0.00 H ATOM 2319 HD21 ASN A 856 -4.847 4.007 -39.948 1.00 0.00 H ATOM 2320 H ASN A 856 -9.813 2.663 -42.789 1.00 0.00 H ATOM 2321 N ALA A 857 -7.839 0.114 -42.074 1.00 11.23 N ATOM 2322 CA ALA A 857 -7.336 -1.229 -41.828 1.00 12.15 C ATOM 2323 C ALA A 857 -6.960 -1.895 -43.149 1.00 11.98 C ATOM 2324 O ALA A 857 -5.918 -2.567 -43.258 1.00 11.29 O ATOM 2325 CB ALA A 857 -8.402 -2.048 -41.113 1.00 12.66 C ATOM 2326 H ALA A 857 -8.797 0.379 -41.768 1.00 0.00 H ATOM 2327 N GLY A 858 -7.792 -1.703 -44.177 1.00 12.46 N ATOM 2328 CA GLY A 858 -7.469 -2.237 -45.490 1.00 13.14 C ATOM 2329 C GLY A 858 -6.180 -1.656 -46.039 1.00 12.50 C ATOM 2330 O GLY A 858 -5.391 -2.353 -46.677 1.00 13.26 O ATOM 2331 H GLY A 858 -8.674 -1.170 -44.037 1.00 0.00 H ATOM 2332 N GLU A 859 -5.941 -0.368 -45.787 1.00 11.83 N ATOM 2333 CA GLU A 859 -4.704 0.231 -46.261 1.00 12.96 C ATOM 2334 C GLU A 859 -3.491 -0.348 -45.557 1.00 11.89 C ATOM 2335 O GLU A 859 -2.428 -0.444 -46.172 1.00 12.71 O ATOM 2336 CB GLU A 859 -4.762 1.752 -46.147 1.00 14.41 C ATOM 2337 CG GLU A 859 -5.774 2.383 -47.112 1.00 16.63 C ATOM 2338 CD GLU A 859 -5.343 2.330 -48.587 1.00 20.41 C ATOM 2339 OE1 GLU A 859 -4.350 1.652 -48.927 1.00 20.53 O ATOM 2340 OE2 GLU A 859 -5.997 2.984 -49.418 1.00 23.27 O ATOM 2341 H GLU A 859 -6.632 0.201 -45.257 1.00 0.00 H ATOM 2342 N PHE A 860 -3.611 -0.730 -44.278 1.00 10.46 N ATOM 2343 CA PHE A 860 -2.498 -1.409 -43.631 1.00 11.23 C ATOM 2344 C PHE A 860 -2.206 -2.726 -44.330 1.00 12.58 C ATOM 2345 O PHE A 860 -1.042 -3.053 -44.608 1.00 13.22 O ATOM 2346 CB PHE A 860 -2.808 -1.656 -42.150 1.00 11.39 C ATOM 2347 CG PHE A 860 -2.457 -0.510 -41.261 1.00 11.73 C ATOM 2348 CD1 PHE A 860 -1.143 -0.362 -40.805 1.00 12.36 C ATOM 2349 CD2 PHE A 860 -3.418 0.404 -40.846 1.00 12.16 C ATOM 2350 CE1 PHE A 860 -0.793 0.675 -39.964 1.00 13.31 C ATOM 2351 CE2 PHE A 860 -3.070 1.469 -39.990 1.00 12.61 C ATOM 2352 CZ PHE A 860 -1.742 1.612 -39.567 1.00 12.53 C ATOM 2353 H PHE A 860 -4.490 -0.543 -43.754 1.00 0.00 H ATOM 2354 N PHE A 861 -3.252 -3.485 -44.643 1.00 12.39 N ATOM 2355 CA PHE A 861 -3.064 -4.738 -45.362 1.00 13.51 C ATOM 2356 C PHE A 861 -2.411 -4.505 -46.718 1.00 14.13 C ATOM 2357 O PHE A 861 -1.438 -5.178 -47.080 1.00 14.98 O ATOM 2358 CB PHE A 861 -4.388 -5.466 -45.552 1.00 15.98 C ATOM 2359 CG PHE A 861 -4.304 -6.554 -46.574 1.00 18.64 C ATOM 2360 CD1 PHE A 861 -3.644 -7.734 -46.293 1.00 19.46 C ATOM 2361 CD2 PHE A 861 -4.851 -6.382 -47.830 1.00 20.54 C ATOM 2362 CE1 PHE A 861 -3.558 -8.734 -47.241 1.00 20.71 C ATOM 2363 CE2 PHE A 861 -4.757 -7.377 -48.779 1.00 21.00 C ATOM 2364 CZ PHE A 861 -4.106 -8.541 -48.484 1.00 21.06 C ATOM 2365 H PHE A 861 -4.210 -3.182 -44.373 1.00 0.00 H ATOM 2366 N ARG A 862 -2.937 -3.553 -47.483 1.00 13.50 N ATOM 2367 CA ARG A 862 -2.442 -3.349 -48.837 1.00 14.50 C ATOM 2368 C ARG A 862 -0.991 -2.902 -48.829 1.00 15.44 C ATOM 2369 O ARG A 862 -0.232 -3.231 -49.742 1.00 15.58 O ATOM 2370 CB ARG A 862 -3.313 -2.322 -49.548 1.00 15.37 C ATOM 2371 CG ARG A 862 -4.725 -2.799 -49.743 1.00 16.04 C ATOM 2372 CD ARG A 862 -5.629 -1.692 -50.200 1.00 20.23 C ATOM 2373 NE ARG A 862 -7.028 -1.995 -49.955 1.00 26.62 N ATOM 2374 CZ ARG A 862 -8.033 -1.232 -50.363 1.00 32.01 C ATOM 2375 NH1 ARG A 862 -7.793 -0.111 -51.053 1.00 33.75 N ATOM 2376 NH2 ARG A 862 -9.279 -1.592 -50.083 1.00 34.45 N ATOM 2377 HE ARG A 862 -7.255 -2.862 -49.428 1.00 0.00 H ATOM 2378 HH12 ARG A 862 -8.585 0.484 -51.371 1.00 0.00 H ATOM 2379 HH11 ARG A 862 -6.815 0.166 -51.272 1.00 0.00 H ATOM 2380 HH22 ARG A 862 -10.074 -1.001 -50.398 1.00 0.00 H ATOM 2381 HH21 ARG A 862 -9.460 -2.465 -49.548 1.00 0.00 H ATOM 2382 H ARG A 862 -3.703 -2.954 -47.114 1.00 0.00 H ATOM 2383 N ASP A 863 -0.596 -2.127 -47.828 1.00 16.53 N ATOM 2384 CA ASP A 863 0.811 -1.791 -47.602 1.00 19.15 C ATOM 2385 C ASP A 863 1.409 -0.997 -48.763 1.00 18.94 C ATOM 2386 O ASP A 863 2.528 -1.261 -49.208 1.00 19.80 O ATOM 2387 CB ASP A 863 1.634 -3.046 -47.310 1.00 23.00 C ATOM 2388 CG ASP A 863 2.946 -2.736 -46.619 1.00 27.13 C ATOM 2389 OD1 ASP A 863 3.080 -1.633 -46.048 1.00 28.02 O ATOM 2390 OD2 ASP A 863 3.843 -3.603 -46.656 1.00 30.79 O ATOM 2391 H ASP A 863 -1.313 -1.743 -47.179 1.00 0.00 H ATOM 2392 N GLN A 864 0.659 -0.004 -49.242 1.00 18.27 N ATOM 2393 CA GLN A 864 1.071 0.877 -50.332 1.00 20.81 C ATOM 2394 C GLN A 864 1.383 2.303 -49.850 1.00 20.24 C ATOM 2395 O GLN A 864 1.450 3.228 -50.661 1.00 22.18 O ATOM 2396 CB GLN A 864 -0.007 0.877 -51.425 1.00 25.45 C ATOM 2397 CG GLN A 864 -0.150 -0.484 -52.154 1.00 30.58 C ATOM 2398 CD GLN A 864 -1.599 -0.894 -52.478 1.00 35.27 C ATOM 2399 OE1 GLN A 864 -2.544 -0.170 -52.179 1.00 37.49 O ATOM 2400 NE2 GLN A 864 -1.768 -2.081 -53.088 1.00 36.17 N ATOM 2401 HE22 GLN A 864 -0.942 -2.666 -53.325 1.00 0.00 H ATOM 2402 HE21 GLN A 864 -2.725 -2.414 -53.322 1.00 0.00 H ATOM 2403 H GLN A 864 -0.276 0.153 -48.814 1.00 0.00 H ATOM 2404 N GLY A 865 1.583 2.499 -48.551 1.00 18.66 N ATOM 2405 CA GLY A 865 1.925 3.807 -48.012 1.00 18.89 C ATOM 2406 C GLY A 865 0.765 4.750 -47.775 1.00 18.47 C ATOM 2407 O GLY A 865 0.998 5.938 -47.491 1.00 20.54 O ATOM 2408 H GLY A 865 1.492 1.693 -47.900 1.00 0.00 H ATOM 2409 N ARG A 866 -0.478 4.272 -47.847 1.00 16.16 N ATOM 2410 CA ARG A 866 -1.634 5.137 -47.634 1.00 15.70 C ATOM 2411 C ARG A 866 -2.272 4.967 -46.260 1.00 13.79 C ATOM 2412 O ARG A 866 -3.236 5.670 -45.952 1.00 13.22 O ATOM 2413 CB ARG A 866 -2.679 4.912 -48.719 1.00 18.75 C ATOM 2414 CG ARG A 866 -2.193 5.318 -50.105 1.00 22.82 C ATOM 2415 CD ARG A 866 -3.308 5.225 -51.125 1.00 26.59 C ATOM 2416 NE ARG A 866 -3.770 3.850 -51.276 1.00 29.20 N ATOM 2417 CZ ARG A 866 -3.335 2.997 -52.201 1.00 31.13 C ATOM 2418 NH1 ARG A 866 -2.424 3.370 -53.097 1.00 30.68 N ATOM 2419 NH2 ARG A 866 -3.819 1.762 -52.225 1.00 32.98 N ATOM 2420 HE ARG A 866 -4.494 3.510 -50.611 1.00 0.00 H ATOM 2421 HH12 ARG A 866 -2.093 2.694 -53.814 1.00 0.00 H ATOM 2422 HH11 ARG A 866 -2.043 4.338 -53.080 1.00 0.00 H ATOM 2423 HH22 ARG A 866 -3.487 1.087 -52.943 1.00 0.00 H ATOM 2424 HH21 ARG A 866 -4.531 1.469 -51.526 1.00 0.00 H ATOM 2425 H ARG A 866 -0.626 3.265 -48.059 1.00 0.00 H ATOM 2426 N GLN A 867 -1.793 4.032 -45.446 1.00 12.51 N ATOM 2427 CA GLN A 867 -2.316 3.888 -44.094 1.00 11.82 C ATOM 2428 C GLN A 867 -1.963 5.121 -43.258 1.00 10.96 C ATOM 2429 O GLN A 867 -0.924 5.768 -43.452 1.00 11.98 O ATOM 2430 CB GLN A 867 -1.788 2.605 -43.446 1.00 14.50 C ATOM 2431 CG GLN A 867 -0.348 2.624 -42.989 1.00 19.68 C ATOM 2432 CD GLN A 867 0.680 2.441 -44.065 1.00 24.09 C ATOM 2433 OE1 GLN A 867 0.373 2.288 -45.264 1.00 24.72 O ATOM 2434 NE2 GLN A 867 1.951 2.452 -43.638 1.00 27.57 N ATOM 2435 HE22 GLN A 867 2.159 2.583 -42.627 1.00 0.00 H ATOM 2436 HE21 GLN A 867 2.729 2.330 -44.317 1.00 0.00 H ATOM 2437 H GLN A 867 -1.038 3.398 -45.777 1.00 0.00 H ATOM 2438 N VAL A 868 -2.851 5.459 -42.325 1.00 9.86 N ATOM 2439 CA VAL A 868 -2.682 6.612 -41.456 1.00 9.83 C ATOM 2440 C VAL A 868 -2.701 6.177 -39.993 1.00 9.03 C ATOM 2441 O VAL A 868 -3.279 5.151 -39.614 1.00 9.79 O ATOM 2442 CB VAL A 868 -3.721 7.717 -41.731 1.00 10.80 C ATOM 2443 CG1 VAL A 868 -3.578 8.236 -43.171 1.00 12.21 C ATOM 2444 CG2 VAL A 868 -5.137 7.234 -41.479 1.00 11.52 C ATOM 2445 H VAL A 868 -3.703 4.873 -42.213 1.00 0.00 H ATOM 2446 N TYR A 869 -2.076 7.008 -39.174 1.00 9.09 N ATOM 2447 CA TYR A 869 -1.834 6.781 -37.766 1.00 9.06 C ATOM 2448 C TYR A 869 -2.407 7.927 -36.946 1.00 10.03 C ATOM 2449 O TYR A 869 -2.596 9.047 -37.431 1.00 9.93 O ATOM 2450 CB TYR A 869 -0.320 6.746 -37.479 1.00 9.65 C ATOM 2451 CG TYR A 869 0.389 5.690 -38.243 1.00 10.20 C ATOM 2452 CD1 TYR A 869 0.497 4.407 -37.725 1.00 10.60 C ATOM 2453 CD2 TYR A 869 0.927 5.938 -39.498 1.00 12.72 C ATOM 2454 CE1 TYR A 869 1.143 3.406 -38.422 1.00 11.48 C ATOM 2455 CE2 TYR A 869 1.559 4.937 -40.201 1.00 13.22 C ATOM 2456 CZ TYR A 869 1.668 3.676 -39.659 1.00 12.81 C ATOM 2457 OH TYR A 869 2.301 2.698 -40.386 1.00 15.62 O ATOM 2458 HH TYR A 869 2.301 1.853 -39.870 1.00 0.00 H ATOM 2459 H TYR A 869 -1.729 7.901 -39.578 1.00 0.00 H ATOM 2460 N LEU A 870 -2.660 7.645 -35.673 1.00 8.82 N ATOM 2461 CA LEU A 870 -2.933 8.708 -34.728 1.00 8.72 C ATOM 2462 C LEU A 870 -1.768 9.681 -34.703 1.00 8.05 C ATOM 2463 O LEU A 870 -0.595 9.286 -34.797 1.00 9.78 O ATOM 2464 CB LEU A 870 -3.122 8.083 -33.357 1.00 8.83 C ATOM 2465 CG LEU A 870 -4.296 7.094 -33.272 1.00 7.76 C ATOM 2466 CD1 LEU A 870 -4.314 6.427 -31.900 1.00 8.98 C ATOM 2467 CD2 LEU A 870 -5.621 7.773 -33.529 1.00 9.20 C ATOM 2468 H LEU A 870 -2.662 6.655 -35.353 1.00 0.00 H ATOM 2469 N SER A 871 -2.095 10.958 -34.585 1.00 8.70 N ATOM 2470 CA SER A 871 -1.076 12.002 -34.583 1.00 9.62 C ATOM 2471 C SER A 871 -0.379 12.097 -33.228 1.00 10.02 C ATOM 2472 O SER A 871 -0.888 11.652 -32.205 1.00 12.34 O ATOM 2473 CB SER A 871 -1.722 13.356 -34.857 1.00 11.49 C ATOM 2474 OG SER A 871 -2.386 13.401 -36.110 1.00 14.70 O ATOM 2475 HG SER A 871 -2.786 14.297 -36.238 1.00 0.00 H ATOM 2476 H SER A 871 -3.097 11.222 -34.492 1.00 0.00 H ATOM 2477 N ARG A 872 0.767 12.759 -33.208 1.00 10.41 N ATOM 2478 CA ARG A 872 1.532 12.879 -31.973 1.00 10.34 C ATOM 2479 C ARG A 872 0.844 13.860 -31.027 1.00 11.46 C ATOM 2480 O ARG A 872 0.667 15.037 -31.386 1.00 12.98 O ATOM 2481 CB ARG A 872 2.951 13.353 -32.272 1.00 10.94 C ATOM 2482 CG ARG A 872 3.798 13.512 -31.017 1.00 11.45 C ATOM 2483 CD ARG A 872 5.264 13.768 -31.329 1.00 14.06 C ATOM 2484 NE ARG A 872 5.465 15.103 -31.880 1.00 16.92 N ATOM 2485 CZ ARG A 872 5.585 16.217 -31.157 1.00 18.67 C ATOM 2486 NH1 ARG A 872 5.754 17.375 -31.770 1.00 20.03 N ATOM 2487 NH2 ARG A 872 5.537 16.186 -29.828 1.00 19.25 N ATOM 2488 HE ARG A 872 5.519 15.193 -32.915 1.00 0.00 H ATOM 2489 HH12 ARG A 872 5.848 18.249 -31.214 1.00 0.00 H ATOM 2490 HH11 ARG A 872 5.793 17.413 -32.809 1.00 0.00 H ATOM 2491 HH22 ARG A 872 5.633 17.067 -29.284 1.00 0.00 H ATOM 2492 HH21 ARG A 872 5.404 15.281 -29.333 1.00 0.00 H ATOM 2493 H ARG A 872 1.125 13.197 -34.081 1.00 0.00 H ATOM 2494 N PRO A 873 0.462 13.444 -29.819 1.00 10.77 N ATOM 2495 CA PRO A 873 -0.172 14.384 -28.893 1.00 10.82 C ATOM 2496 C PRO A 873 0.776 15.504 -28.520 1.00 12.74 C ATOM 2497 O PRO A 873 2.001 15.301 -28.430 1.00 13.46 O ATOM 2498 CB PRO A 873 -0.500 13.509 -27.670 1.00 11.08 C ATOM 2499 CG PRO A 873 -0.632 12.133 -28.226 1.00 11.07 C ATOM 2500 CD PRO A 873 0.407 12.058 -29.314 1.00 10.64 C ATOM 2501 N PRO A 874 0.246 16.690 -28.224 1.00 14.26 N ATOM 2502 CA PRO A 874 1.096 17.779 -27.704 1.00 15.07 C ATOM 2503 C PRO A 874 1.938 17.416 -26.485 1.00 13.34 C ATOM 2504 O PRO A 874 3.076 17.884 -26.356 1.00 14.05 O ATOM 2505 CB PRO A 874 0.064 18.866 -27.375 1.00 18.81 C ATOM 2506 CG PRO A 874 -1.012 18.640 -28.308 1.00 18.85 C ATOM 2507 CD PRO A 874 -1.118 17.163 -28.495 1.00 16.58 C ATOM 2508 N ALA A 875 1.406 16.605 -25.587 1.00 12.94 N ATOM 2509 CA ALA A 875 2.108 16.192 -24.379 1.00 13.37 C ATOM 2510 C ALA A 875 3.139 15.099 -24.631 1.00 13.61 C ATOM 2511 O ALA A 875 3.863 14.741 -23.704 1.00 14.49 O ATOM 2512 CB ALA A 875 1.100 15.728 -23.324 1.00 14.97 C ATOM 2513 H ALA A 875 0.444 16.246 -25.750 1.00 0.00 H ATOM 2514 N CYS A 876 3.247 14.585 -25.860 1.00 13.83 N ATOM 2515 CA CYS A 876 4.044 13.403 -26.143 1.00 12.19 C ATOM 2516 C CYS A 876 5.346 13.772 -26.850 1.00 12.34 C ATOM 2517 O CYS A 876 5.302 14.257 -27.994 1.00 13.94 O ATOM 2518 CB CYS A 876 3.216 12.476 -27.026 1.00 12.40 C ATOM 2519 SG CYS A 876 4.051 10.953 -27.473 1.00 13.28 S ATOM 2520 H CYS A 876 2.742 15.048 -26.643 1.00 0.00 H ATOM 2521 N PRO A 877 6.518 13.520 -26.259 1.00 13.20 N ATOM 2522 CA PRO A 877 7.778 13.737 -26.988 1.00 13.88 C ATOM 2523 C PRO A 877 7.939 12.742 -28.128 1.00 12.63 C ATOM 2524 O PRO A 877 7.322 11.678 -28.136 1.00 12.38 O ATOM 2525 CB PRO A 877 8.855 13.517 -25.928 1.00 16.42 C ATOM 2526 CG PRO A 877 8.149 13.467 -24.624 1.00 15.97 C ATOM 2527 CD PRO A 877 6.742 13.093 -24.870 1.00 13.11 C ATOM 2528 N GLN A 878 8.800 13.093 -29.089 1.00 13.96 N ATOM 2529 CA GLN A 878 8.951 12.267 -30.285 1.00 15.16 C ATOM 2530 C GLN A 878 9.410 10.850 -29.947 1.00 14.81 C ATOM 2531 O GLN A 878 8.959 9.885 -30.578 1.00 14.78 O ATOM 2532 CB GLN A 878 9.901 12.943 -31.267 1.00 17.36 C ATOM 2533 CG GLN A 878 10.178 12.150 -32.543 1.00 17.90 C ATOM 2534 CD GLN A 878 8.959 11.911 -33.395 1.00 19.53 C ATOM 2535 OE1 GLN A 878 7.972 12.648 -33.326 1.00 19.37 O ATOM 2536 NE2 GLN A 878 9.027 10.882 -34.232 1.00 20.98 N ATOM 2537 HE22 GLN A 878 9.880 10.287 -34.256 1.00 0.00 H ATOM 2538 HE21 GLN A 878 8.228 10.671 -34.863 1.00 0.00 H ATOM 2539 H GLN A 878 9.366 13.959 -28.985 1.00 0.00 H ATOM 2540 N GLY A 879 10.286 10.698 -28.946 1.00 14.28 N ATOM 2541 CA GLY A 879 10.749 9.365 -28.576 1.00 13.31 C ATOM 2542 C GLY A 879 9.622 8.455 -28.106 1.00 13.74 C ATOM 2543 O GLY A 879 9.586 7.261 -28.432 1.00 14.61 O ATOM 2544 H GLY A 879 10.637 11.531 -28.432 1.00 0.00 H ATOM 2545 N LEU A 880 8.690 9.006 -27.324 1.00 12.14 N ATOM 2546 CA LEU A 880 7.534 8.245 -26.883 1.00 12.05 C ATOM 2547 C LEU A 880 6.587 7.972 -28.045 1.00 11.08 C ATOM 2548 O LEU A 880 5.989 6.898 -28.125 1.00 10.92 O ATOM 2549 CB LEU A 880 6.825 9.001 -25.755 1.00 12.40 C ATOM 2550 CG LEU A 880 5.650 8.288 -25.084 1.00 13.06 C ATOM 2551 CD1 LEU A 880 6.121 6.989 -24.424 1.00 13.51 C ATOM 2552 CD2 LEU A 880 5.004 9.206 -24.053 1.00 14.23 C ATOM 2553 H LEU A 880 8.794 9.997 -27.026 1.00 0.00 H ATOM 2554 N TYR A 881 6.427 8.940 -28.947 1.00 11.20 N ATOM 2555 CA TYR A 881 5.625 8.708 -30.142 1.00 11.80 C ATOM 2556 C TYR A 881 6.180 7.554 -30.970 1.00 10.35 C ATOM 2557 O TYR A 881 5.414 6.761 -31.541 1.00 10.33 O ATOM 2558 CB TYR A 881 5.518 9.991 -30.970 1.00 12.49 C ATOM 2559 CG TYR A 881 4.556 9.877 -32.122 1.00 11.89 C ATOM 2560 CD1 TYR A 881 3.199 9.683 -31.901 1.00 10.73 C ATOM 2561 CD2 TYR A 881 4.999 9.959 -33.424 1.00 13.50 C ATOM 2562 CE1 TYR A 881 2.291 9.561 -32.977 1.00 11.47 C ATOM 2563 CE2 TYR A 881 4.119 9.834 -34.492 1.00 12.83 C ATOM 2564 CZ TYR A 881 2.770 9.646 -34.268 1.00 12.54 C ATOM 2565 OH TYR A 881 1.942 9.543 -35.352 1.00 13.27 O ATOM 2566 HH TYR A 881 1.011 9.412 -35.043 1.00 0.00 H ATOM 2567 H TYR A 881 6.877 9.866 -28.798 1.00 0.00 H ATOM 2568 N GLU A 882 7.509 7.434 -31.043 1.00 11.01 N ATOM 2569 CA GLU A 882 8.104 6.324 -31.779 1.00 10.51 C ATOM 2570 C GLU A 882 7.770 4.971 -31.154 1.00 10.90 C ATOM 2571 O GLU A 882 7.570 3.991 -31.883 1.00 12.13 O ATOM 2572 CB GLU A 882 9.618 6.541 -31.916 1.00 13.32 C ATOM 2573 CG GLU A 882 9.871 7.687 -32.864 1.00 15.55 C ATOM 2574 CD GLU A 882 11.294 8.129 -32.998 1.00 24.46 C ATOM 2575 OE1 GLU A 882 12.197 7.580 -32.326 1.00 28.84 O ATOM 2576 OE2 GLU A 882 11.486 9.053 -33.804 1.00 26.27 O ATOM 2577 H GLU A 882 8.120 8.133 -30.574 1.00 0.00 H ATOM 2578 N LEU A 883 7.661 4.912 -29.824 1.00 11.53 N ATOM 2579 CA LEU A 883 7.160 3.710 -29.163 1.00 11.21 C ATOM 2580 C LEU A 883 5.735 3.394 -29.617 1.00 10.46 C ATOM 2581 O LEU A 883 5.410 2.242 -29.938 1.00 10.58 O ATOM 2582 CB LEU A 883 7.237 3.880 -27.642 1.00 12.53 C ATOM 2583 CG LEU A 883 6.576 2.800 -26.769 1.00 11.56 C ATOM 2584 CD1 LEU A 883 7.229 2.774 -25.387 1.00 14.39 C ATOM 2585 CD2 LEU A 883 5.045 2.969 -26.616 1.00 10.74 C ATOM 2586 H LEU A 883 7.937 5.735 -29.251 1.00 0.00 H ATOM 2587 N MET A 884 4.870 4.416 -29.682 1.00 10.04 N ATOM 2588 CA MET A 884 3.509 4.185 -30.163 1.00 9.67 C ATOM 2589 C MET A 884 3.527 3.611 -31.576 1.00 10.11 C ATOM 2590 O MET A 884 2.801 2.658 -31.894 1.00 10.06 O ATOM 2591 CB MET A 884 2.682 5.477 -30.117 1.00 11.58 C ATOM 2592 CG MET A 884 2.429 6.078 -28.740 1.00 13.84 C ATOM 2593 SD MET A 884 1.525 7.693 -28.963 1.00 18.02 S ATOM 2594 CE MET A 884 1.582 8.347 -27.289 1.00 17.72 C ATOM 2595 H MET A 884 5.166 5.370 -29.391 1.00 0.00 H ATOM 2596 N LEU A 885 4.322 4.213 -32.453 1.00 10.07 N ATOM 2597 CA LEU A 885 4.389 3.736 -33.821 1.00 11.30 C ATOM 2598 C LEU A 885 4.838 2.281 -33.868 1.00 10.76 C ATOM 2599 O LEU A 885 4.347 1.502 -34.695 1.00 11.73 O ATOM 2600 CB LEU A 885 5.314 4.625 -34.644 1.00 11.64 C ATOM 2601 CG LEU A 885 4.856 6.067 -34.878 1.00 13.42 C ATOM 2602 CD1 LEU A 885 5.933 6.850 -35.617 1.00 14.18 C ATOM 2603 CD2 LEU A 885 3.575 6.137 -35.655 1.00 14.90 C ATOM 2604 H LEU A 885 4.897 5.028 -32.158 1.00 0.00 H ATOM 2605 N ARG A 886 5.740 1.874 -32.961 1.00 10.35 N ATOM 2606 CA ARG A 886 6.134 0.465 -32.921 1.00 10.53 C ATOM 2607 C ARG A 886 4.951 -0.432 -32.549 1.00 9.91 C ATOM 2608 O ARG A 886 4.819 -1.540 -33.077 1.00 9.70 O ATOM 2609 CB ARG A 886 7.291 0.254 -31.947 1.00 10.99 C ATOM 2610 CG ARG A 886 8.596 0.839 -32.404 1.00 13.26 C ATOM 2611 CD ARG A 886 9.779 0.362 -31.539 1.00 14.73 C ATOM 2612 NE ARG A 886 9.836 0.992 -30.211 1.00 15.56 N ATOM 2613 CZ ARG A 886 10.396 2.182 -29.960 1.00 16.23 C ATOM 2614 NH1 ARG A 886 10.877 2.928 -30.936 1.00 17.97 N ATOM 2615 NH2 ARG A 886 10.430 2.657 -28.729 1.00 16.12 N ATOM 2616 HE ARG A 886 9.412 0.478 -29.412 1.00 0.00 H ATOM 2617 HH12 ARG A 886 11.308 3.850 -30.722 1.00 0.00 H ATOM 2618 HH11 ARG A 886 10.825 2.594 -31.920 1.00 0.00 H ATOM 2619 HH22 ARG A 886 10.866 3.582 -28.540 1.00 0.00 H ATOM 2620 HH21 ARG A 886 10.020 2.106 -27.948 1.00 0.00 H ATOM 2621 H ARG A 886 6.155 2.554 -32.293 1.00 0.00 H ATOM 2622 N CYS A 887 4.080 0.034 -31.651 1.00 8.90 N ATOM 2623 CA CYS A 887 2.873 -0.717 -31.309 1.00 9.00 C ATOM 2624 C CYS A 887 1.952 -0.904 -32.503 1.00 8.45 C ATOM 2625 O CYS A 887 1.149 -1.831 -32.515 1.00 9.53 O ATOM 2626 CB CYS A 887 2.127 -0.011 -30.191 1.00 10.84 C ATOM 2627 SG CYS A 887 3.018 -0.011 -28.599 1.00 10.46 S ATOM 2628 H CYS A 887 4.263 0.947 -31.187 1.00 0.00 H ATOM 2629 N TRP A 888 2.028 -0.012 -33.486 1.00 8.10 N ATOM 2630 CA TRP A 888 1.188 -0.033 -34.662 1.00 9.48 C ATOM 2631 C TRP A 888 1.918 -0.582 -35.874 1.00 9.38 C ATOM 2632 O TRP A 888 1.508 -0.318 -37.000 1.00 11.10 O ATOM 2633 CB TRP A 888 0.618 1.365 -34.938 1.00 7.63 C ATOM 2634 CG TRP A 888 -0.107 1.934 -33.736 1.00 8.85 C ATOM 2635 CD1 TRP A 888 -0.885 1.262 -32.847 1.00 8.61 C ATOM 2636 CD2 TRP A 888 -0.090 3.306 -33.297 1.00 8.74 C ATOM 2637 NE1 TRP A 888 -1.331 2.106 -31.870 1.00 8.20 N ATOM 2638 CE2 TRP A 888 -0.858 3.373 -32.119 1.00 8.95 C ATOM 2639 CE3 TRP A 888 0.524 4.467 -33.770 1.00 8.67 C ATOM 2640 CZ2 TRP A 888 -1.058 4.574 -31.436 1.00 8.01 C ATOM 2641 CZ3 TRP A 888 0.327 5.641 -33.096 1.00 9.09 C ATOM 2642 CH2 TRP A 888 -0.460 5.690 -31.939 1.00 8.00 C ATOM 2643 HE1 TRP A 888 -1.932 1.834 -31.066 1.00 0.00 H ATOM 2644 H TRP A 888 2.735 0.747 -33.404 1.00 0.00 H ATOM 2645 N SER A 889 2.971 -1.366 -35.653 1.00 9.05 N ATOM 2646 CA SER A 889 3.658 -2.023 -36.756 1.00 10.29 C ATOM 2647 C SER A 889 2.666 -2.879 -37.534 1.00 10.83 C ATOM 2648 O SER A 889 1.773 -3.506 -36.956 1.00 11.09 O ATOM 2649 CB SER A 889 4.783 -2.921 -36.224 1.00 13.07 C ATOM 2650 OG SER A 889 5.814 -2.177 -35.573 1.00 14.16 O ATOM 2651 HG SER A 889 6.212 -1.536 -36.214 1.00 0.00 H ATOM 2652 H SER A 889 3.307 -1.511 -34.680 1.00 0.00 H ATOM 2653 N ARG A 890 2.837 -2.920 -38.851 1.00 11.59 N ATOM 2654 CA ARG A 890 1.959 -3.755 -39.667 1.00 12.49 C ATOM 2655 C ARG A 890 2.074 -5.221 -39.270 1.00 12.58 C ATOM 2656 O ARG A 890 1.065 -5.921 -39.118 1.00 13.47 O ATOM 2657 CB ARG A 890 2.296 -3.585 -41.152 1.00 13.15 C ATOM 2658 CG ARG A 890 1.427 -4.462 -42.041 1.00 14.80 C ATOM 2659 CD ARG A 890 1.799 -4.344 -43.473 1.00 15.94 C ATOM 2660 NE ARG A 890 0.865 -5.040 -44.344 1.00 17.51 N ATOM 2661 CZ ARG A 890 0.896 -6.333 -44.622 1.00 20.90 C ATOM 2662 NH1 ARG A 890 1.834 -7.117 -44.096 1.00 23.61 N ATOM 2663 NH2 ARG A 890 -0.015 -6.839 -45.442 1.00 21.57 N ATOM 2664 HE ARG A 890 0.111 -4.475 -44.784 1.00 0.00 H ATOM 2665 HH12 ARG A 890 1.849 -8.132 -44.321 1.00 0.00 H ATOM 2666 HH11 ARG A 890 2.552 -6.714 -43.460 1.00 0.00 H ATOM 2667 HH22 ARG A 890 -0.003 -7.854 -45.670 1.00 0.00 H ATOM 2668 HH21 ARG A 890 -0.741 -6.221 -45.857 1.00 0.00 H ATOM 2669 H ARG A 890 3.591 -2.361 -39.298 1.00 0.00 H ATOM 2670 N GLU A 891 3.297 -5.713 -39.143 1.00 12.60 N ATOM 2671 CA GLU A 891 3.512 -7.121 -38.825 1.00 15.58 C ATOM 2672 C GLU A 891 3.351 -7.317 -37.330 1.00 14.46 C ATOM 2673 O GLU A 891 4.050 -6.686 -36.530 1.00 14.87 O ATOM 2674 CB GLU A 891 4.894 -7.598 -39.268 1.00 20.66 C ATOM 2675 CG GLU A 891 5.307 -7.091 -40.648 1.00 26.91 C ATOM 2676 CD GLU A 891 4.277 -7.365 -41.727 1.00 31.87 C ATOM 2677 OE1 GLU A 891 3.602 -8.414 -41.670 1.00 35.08 O ATOM 2678 OE2 GLU A 891 4.150 -6.524 -42.642 1.00 32.76 O ATOM 2679 H GLU A 891 4.117 -5.086 -39.272 1.00 0.00 H ATOM 2680 N SER A 892 2.448 -8.209 -36.948 1.00 15.75 N ATOM 2681 CA SER A 892 2.167 -8.410 -35.532 1.00 16.99 C ATOM 2682 C SER A 892 3.416 -8.788 -34.762 1.00 17.24 C ATOM 2683 O SER A 892 3.632 -8.320 -33.636 1.00 15.84 O ATOM 2684 CB SER A 892 1.155 -9.542 -35.400 1.00 17.92 C ATOM 2685 OG SER A 892 -0.102 -9.110 -35.837 1.00 17.63 O ATOM 2686 HG SER A 892 -0.043 -8.833 -36.786 1.00 0.00 H ATOM 2687 H SER A 892 1.938 -8.768 -37.662 1.00 0.00 H ATOM 2688 N GLU A 893 4.277 -9.605 -35.369 1.00 20.43 N ATOM 2689 CA GLU A 893 5.473 -10.069 -34.681 1.00 25.01 C ATOM 2690 C GLU A 893 6.505 -8.967 -34.444 1.00 24.16 C ATOM 2691 O GLU A 893 7.398 -9.161 -33.608 1.00 25.02 O ATOM 2692 CB GLU A 893 6.120 -11.232 -35.443 1.00 30.74 C ATOM 2693 CG GLU A 893 6.571 -10.889 -36.854 1.00 36.17 C ATOM 2694 CD GLU A 893 5.503 -11.173 -37.923 1.00 40.02 C ATOM 2695 OE1 GLU A 893 4.285 -11.037 -37.637 1.00 39.75 O ATOM 2696 OE2 GLU A 893 5.893 -11.538 -39.052 1.00 43.01 O ATOM 2697 H GLU A 893 4.092 -9.914 -36.345 1.00 0.00 H ATOM 2698 N GLN A 894 6.421 -7.830 -35.152 1.00 22.34 N ATOM 2699 CA GLN A 894 7.369 -6.742 -34.936 1.00 21.25 C ATOM 2700 C GLN A 894 6.959 -5.826 -33.796 1.00 17.78 C ATOM 2701 O GLN A 894 7.769 -4.994 -33.369 1.00 18.94 O ATOM 2702 CB GLN A 894 7.515 -5.860 -36.179 1.00 25.09 C ATOM 2703 CG GLN A 894 8.253 -6.460 -37.333 1.00 31.06 C ATOM 2704 CD GLN A 894 8.336 -5.468 -38.476 1.00 35.68 C ATOM 2705 OE1 GLN A 894 8.284 -4.257 -38.249 1.00 38.12 O ATOM 2706 NE2 GLN A 894 8.435 -5.965 -39.705 1.00 37.99 N ATOM 2707 HE22 GLN A 894 8.476 -6.994 -39.848 1.00 0.00 H ATOM 2708 HE21 GLN A 894 8.472 -5.324 -40.524 1.00 0.00 H ATOM 2709 H GLN A 894 5.670 -7.723 -35.864 1.00 0.00 H ATOM 2710 N ARG A 895 5.722 -5.930 -33.316 1.00 13.33 N ATOM 2711 CA ARG A 895 5.293 -5.073 -32.236 1.00 12.72 C ATOM 2712 C ARG A 895 6.040 -5.456 -30.958 1.00 13.46 C ATOM 2713 O ARG A 895 6.316 -6.638 -30.734 1.00 14.20 O ATOM 2714 CB ARG A 895 3.773 -5.207 -32.063 1.00 10.66 C ATOM 2715 CG ARG A 895 3.012 -4.753 -33.317 1.00 9.94 C ATOM 2716 CD ARG A 895 1.491 -4.998 -33.246 1.00 9.66 C ATOM 2717 NE ARG A 895 0.913 -4.876 -34.568 1.00 10.00 N ATOM 2718 CZ ARG A 895 -0.197 -5.478 -34.985 1.00 9.49 C ATOM 2719 NH1 ARG A 895 -0.926 -6.199 -34.147 1.00 9.82 N ATOM 2720 NH2 ARG A 895 -0.532 -5.402 -36.270 1.00 10.57 N ATOM 2721 HE ARG A 895 1.408 -4.266 -35.249 1.00 0.00 H ATOM 2722 HH12 ARG A 895 -1.793 -6.666 -34.481 1.00 0.00 H ATOM 2723 HH11 ARG A 895 -0.632 -6.298 -33.154 1.00 0.00 H ATOM 2724 HH22 ARG A 895 -1.397 -5.868 -36.610 1.00 0.00 H ATOM 2725 HH21 ARG A 895 0.071 -4.877 -36.934 1.00 0.00 H ATOM 2726 H ARG A 895 5.065 -6.628 -33.719 1.00 0.00 H ATOM 2727 N PRO A 896 6.409 -4.480 -30.121 1.00 13.32 N ATOM 2728 CA PRO A 896 7.187 -4.807 -28.922 1.00 13.91 C ATOM 2729 C PRO A 896 6.373 -5.643 -27.953 1.00 13.31 C ATOM 2730 O PRO A 896 5.136 -5.543 -27.911 1.00 14.08 O ATOM 2731 CB PRO A 896 7.505 -3.429 -28.313 1.00 14.59 C ATOM 2732 CG PRO A 896 6.917 -2.396 -29.255 1.00 14.41 C ATOM 2733 CD PRO A 896 6.003 -3.065 -30.181 1.00 12.73 C ATOM 2734 N PRO A 897 7.023 -6.452 -27.131 1.00 12.06 N ATOM 2735 CA PRO A 897 6.309 -7.138 -26.058 1.00 12.05 C ATOM 2736 C PRO A 897 6.039 -6.175 -24.914 1.00 10.61 C ATOM 2737 O PRO A 897 6.740 -5.172 -24.720 1.00 10.75 O ATOM 2738 CB PRO A 897 7.300 -8.221 -25.618 1.00 13.39 C ATOM 2739 CG PRO A 897 8.631 -7.623 -25.916 1.00 13.14 C ATOM 2740 CD PRO A 897 8.452 -6.779 -27.148 1.00 13.13 C ATOM 2741 N PHE A 898 4.993 -6.494 -24.155 1.00 10.92 N ATOM 2742 CA PHE A 898 4.652 -5.684 -22.992 1.00 10.27 C ATOM 2743 C PHE A 898 5.796 -5.548 -21.988 1.00 10.69 C ATOM 2744 O PHE A 898 5.891 -4.528 -21.297 1.00 10.81 O ATOM 2745 CB PHE A 898 3.403 -6.224 -22.316 1.00 10.37 C ATOM 2746 CG PHE A 898 2.139 -5.855 -23.037 1.00 8.62 C ATOM 2747 CD1 PHE A 898 1.760 -4.535 -23.120 1.00 9.75 C ATOM 2748 CD2 PHE A 898 1.348 -6.804 -23.649 1.00 8.77 C ATOM 2749 CE1 PHE A 898 0.614 -4.180 -23.790 1.00 11.06 C ATOM 2750 CE2 PHE A 898 0.185 -6.441 -24.310 1.00 9.70 C ATOM 2751 CZ PHE A 898 -0.175 -5.133 -24.381 1.00 10.62 C ATOM 2752 H PHE A 898 4.416 -7.326 -24.393 1.00 0.00 H ATOM 2753 N SER A 899 6.657 -6.562 -21.859 1.00 10.14 N ATOM 2754 CA SER A 899 7.795 -6.434 -20.948 1.00 10.44 C ATOM 2755 C SER A 899 8.688 -5.266 -21.337 1.00 9.90 C ATOM 2756 O SER A 899 9.222 -4.568 -20.462 1.00 11.08 O ATOM 2757 CB SER A 899 8.611 -7.723 -20.906 1.00 10.72 C ATOM 2758 OG SER A 899 8.969 -8.098 -22.209 1.00 11.45 O ATOM 2759 HG SER A 899 9.498 -8.934 -22.177 1.00 0.00 H ATOM 2760 H SER A 899 6.519 -7.437 -22.403 1.00 0.00 H ATOM 2761 N GLN A 900 8.870 -5.037 -22.649 1.00 10.43 N ATOM 2762 CA GLN A 900 9.689 -3.922 -23.106 1.00 10.75 C ATOM 2763 C GLN A 900 8.948 -2.596 -22.980 1.00 10.49 C ATOM 2764 O GLN A 900 9.544 -1.581 -22.595 1.00 11.11 O ATOM 2765 CB GLN A 900 10.104 -4.150 -24.555 1.00 13.45 C ATOM 2766 CG GLN A 900 11.367 -3.423 -25.016 1.00 18.84 C ATOM 2767 CD GLN A 900 12.670 -3.799 -24.252 1.00 21.50 C ATOM 2768 OE1 GLN A 900 12.780 -3.589 -23.049 1.00 22.67 O ATOM 2769 NE2 GLN A 900 13.674 -4.295 -24.978 1.00 22.59 N ATOM 2770 HE22 GLN A 900 13.547 -4.461 -25.997 1.00 0.00 H ATOM 2771 HE21 GLN A 900 14.584 -4.516 -24.525 1.00 0.00 H ATOM 2772 H GLN A 900 8.421 -5.664 -23.347 1.00 0.00 H ATOM 2773 N LEU A 901 7.662 -2.593 -23.317 1.00 10.18 N ATOM 2774 CA LEU A 901 6.862 -1.384 -23.194 1.00 9.16 C ATOM 2775 C LEU A 901 6.872 -0.908 -21.751 1.00 9.54 C ATOM 2776 O LEU A 901 7.058 0.284 -21.480 1.00 9.05 O ATOM 2777 CB LEU A 901 5.433 -1.651 -23.672 1.00 9.83 C ATOM 2778 CG LEU A 901 5.286 -1.924 -25.167 1.00 10.89 C ATOM 2779 CD1 LEU A 901 3.946 -2.548 -25.505 1.00 10.75 C ATOM 2780 CD2 LEU A 901 5.501 -0.625 -25.934 1.00 12.94 C ATOM 2781 H LEU A 901 7.222 -3.466 -23.673 1.00 0.00 H ATOM 2782 N HIS A 902 6.702 -1.836 -20.804 1.00 9.89 N ATOM 2783 CA HIS A 902 6.717 -1.440 -19.407 1.00 10.45 C ATOM 2784 C HIS A 902 8.072 -0.864 -19.024 1.00 9.85 C ATOM 2785 O HIS A 902 8.147 0.165 -18.340 1.00 10.68 O ATOM 2786 CB HIS A 902 6.380 -2.605 -18.497 1.00 11.99 C ATOM 2787 CG HIS A 902 6.517 -2.247 -17.059 1.00 13.25 C ATOM 2788 ND1 HIS A 902 7.674 -2.481 -16.348 1.00 14.58 N ATOM 2789 CD2 HIS A 902 5.697 -1.558 -16.233 1.00 14.55 C ATOM 2790 CE1 HIS A 902 7.541 -1.988 -15.131 1.00 15.98 C ATOM 2791 NE2 HIS A 902 6.346 -1.432 -15.033 1.00 15.83 N ATOM 2792 H HIS A 902 6.560 -2.833 -21.065 1.00 0.00 H ATOM 2793 N ARG A 903 9.154 -1.525 -19.437 1.00 9.71 N ATOM 2794 CA ARG A 903 10.485 -1.046 -19.088 1.00 9.41 C ATOM 2795 C ARG A 903 10.691 0.367 -19.614 1.00 9.79 C ATOM 2796 O ARG A 903 11.186 1.250 -18.894 1.00 10.98 O ATOM 2797 CB ARG A 903 11.544 -1.976 -19.666 1.00 10.58 C ATOM 2798 CG ARG A 903 13.003 -1.549 -19.345 1.00 11.99 C ATOM 2799 CD ARG A 903 14.006 -1.970 -20.407 1.00 12.91 C ATOM 2800 NE ARG A 903 13.662 -1.298 -21.657 1.00 13.35 N ATOM 2801 CZ ARG A 903 13.807 0.015 -21.864 1.00 14.06 C ATOM 2802 NH1 ARG A 903 14.351 0.795 -20.934 1.00 15.36 N ATOM 2803 NH2 ARG A 903 13.417 0.551 -22.995 1.00 14.18 N ATOM 2804 HE ARG A 903 13.281 -1.876 -22.433 1.00 0.00 H ATOM 2805 HH12 ARG A 903 14.458 1.815 -21.108 1.00 0.00 H ATOM 2806 HH11 ARG A 903 14.670 0.385 -20.033 1.00 0.00 H ATOM 2807 HH22 ARG A 903 13.531 1.573 -23.153 1.00 0.00 H ATOM 2808 HH21 ARG A 903 12.993 -0.045 -23.734 1.00 0.00 H ATOM 2809 H ARG A 903 9.047 -2.386 -20.011 1.00 0.00 H ATOM 2810 N PHE A 904 10.346 0.588 -20.885 1.00 10.12 N ATOM 2811 CA PHE A 904 10.520 1.910 -21.481 1.00 9.66 C ATOM 2812 C PHE A 904 9.808 2.969 -20.657 1.00 9.22 C ATOM 2813 O PHE A 904 10.388 4.013 -20.332 1.00 11.08 O ATOM 2814 CB PHE A 904 9.976 1.890 -22.913 1.00 10.50 C ATOM 2815 CG PHE A 904 10.240 3.140 -23.699 1.00 11.21 C ATOM 2816 CD1 PHE A 904 9.582 4.323 -23.413 1.00 11.91 C ATOM 2817 CD2 PHE A 904 11.124 3.122 -24.757 1.00 11.99 C ATOM 2818 CE1 PHE A 904 9.822 5.473 -24.152 1.00 12.49 C ATOM 2819 CE2 PHE A 904 11.360 4.265 -25.503 1.00 13.26 C ATOM 2820 CZ PHE A 904 10.719 5.442 -25.184 1.00 12.80 C ATOM 2821 H PHE A 904 9.950 -0.187 -21.455 1.00 0.00 H ATOM 2822 N LEU A 905 8.533 2.719 -20.327 1.00 8.76 N ATOM 2823 CA LEU A 905 7.722 3.712 -19.633 1.00 10.05 C ATOM 2824 C LEU A 905 8.139 3.885 -18.179 1.00 11.89 C ATOM 2825 O LEU A 905 8.068 4.999 -17.646 1.00 13.03 O ATOM 2826 CB LEU A 905 6.250 3.307 -19.722 1.00 10.16 C ATOM 2827 CG LEU A 905 5.661 3.287 -21.150 1.00 10.69 C ATOM 2828 CD1 LEU A 905 4.335 2.507 -21.246 1.00 11.38 C ATOM 2829 CD2 LEU A 905 5.405 4.694 -21.626 1.00 12.43 C ATOM 2830 H LEU A 905 8.114 1.799 -20.571 1.00 0.00 H ATOM 2831 N ALA A 906 8.592 2.817 -17.526 1.00 12.37 N ATOM 2832 CA ALA A 906 8.974 2.892 -16.119 1.00 13.58 C ATOM 2833 C ALA A 906 10.320 3.572 -15.918 1.00 16.91 C ATOM 2834 O ALA A 906 10.568 4.148 -14.856 1.00 18.78 O ATOM 2835 CB ALA A 906 9.034 1.484 -15.531 1.00 15.20 C ATOM 2836 H ALA A 906 8.675 1.910 -18.029 1.00 0.00 H ATOM 2837 N GLU A 907 11.216 3.461 -16.894 1.00 18.28 N ATOM 2838 CA GLU A 907 12.473 4.194 -16.845 1.00 23.10 C ATOM 2839 C GLU A 907 12.212 5.674 -17.066 1.00 29.66 C ATOM 2840 O GLU A 907 12.663 6.518 -16.285 1.00 31.95 O ATOM 2841 CB GLU A 907 13.397 3.654 -17.933 1.00 23.81 C ATOM 2842 CG GLU A 907 14.779 4.265 -17.973 1.00 25.33 C ATOM 2843 CD GLU A 907 15.694 3.477 -18.889 1.00 25.12 C ATOM 2844 OE1 GLU A 907 15.361 3.389 -20.084 1.00 20.74 O ATOM 2845 OE2 GLU A 907 16.710 2.903 -18.410 1.00 28.39 O ATOM 2846 H GLU A 907 11.016 2.841 -17.705 1.00 0.00 H ATOM 2847 N ASP A 908 11.453 5.992 -18.120 1.00 33.00 N ATOM 2848 CA ASP A 908 11.082 7.356 -18.476 1.00 35.50 C ATOM 2849 C ASP A 908 10.221 7.991 -17.369 1.00 34.39 C ATOM 2850 O ASP A 908 10.302 9.201 -17.109 1.00 33.92 O ATOM 2851 CB ASP A 908 10.323 7.343 -19.815 1.00 38.22 C ATOM 2852 CG ASP A 908 11.208 7.698 -21.006 1.00 41.91 C ATOM 2853 OD1 ASP A 908 12.458 7.571 -20.908 1.00 42.34 O ATOM 2854 OD2 ASP A 908 10.642 8.113 -22.047 1.00 43.45 O ATOM 2855 H ASP A 908 11.106 5.219 -18.723 1.00 0.00 H TER 2856 ASP A 908 HETATM 2857 O HOH 1 -11.454 -2.039 -1.419 1.00 31.77 O HETATM 2858 O HOH 2 2.805 0.755 -46.411 1.00 32.67 O HETATM 2859 O HOH 3 -8.136 10.688 -25.639 1.00 30.97 O HETATM 2860 O HOH 4 -13.484 6.565 -24.986 1.00 14.45 O HETATM 2861 O HOH 5 0.924 -18.823 -17.919 1.00 39.80 O HETATM 2862 O HOH 6 8.954 -2.896 -32.606 1.00 22.56 O HETATM 2863 O HOH 7 -23.421 -18.172 -0.836 1.00 29.07 O HETATM 2864 O HOH 8 -14.774 13.697 -15.814 1.00 36.83 O HETATM 2865 O HOH 9 2.890 0.503 -39.231 1.00 18.57 O HETATM 2866 O HOH 10 2.544 -1.401 -11.151 1.00 36.39 O HETATM 2867 O HOH 11 -23.984 -8.391 8.431 1.00 34.31 O HETATM 2868 O HOH 12 -24.683 -7.948 -22.435 1.00 33.57 O HETATM 2869 O HOH 13 -9.094 12.795 -32.346 1.00 29.20 O HETATM 2870 O HOH 14 -21.693 -14.041 -24.900 1.00 31.24 O HETATM 2871 O HOH 15 -8.614 -5.513 -7.591 1.00 27.68 O HETATM 2872 O HOH 16 -8.675 -12.915 -9.092 1.00 15.08 O HETATM 2873 O HOH 17 -22.374 0.118 -27.458 1.00 37.53 O HETATM 2874 O HOH 18 -22.170 -0.034 -40.824 1.00 39.56 O HETATM 2875 O HOH 19 -1.016 -15.843 -11.703 1.00 25.05 O HETATM 2876 O HOH 20 8.564 -7.933 -31.050 1.00 42.22 O HETATM 2877 O HOH 21 12.957 5.235 -31.457 1.00 39.30 O HETATM 2878 O HOH 22 -24.486 -13.002 -21.955 1.00 31.91 O HETATM 2879 O HOH 23 1.404 -5.157 -12.366 1.00 14.29 O HETATM 2880 O HOH 24 9.796 10.588 -22.125 1.00 36.41 O HETATM 2881 O HOH 25 -16.799 8.945 -33.690 1.00 28.11 O HETATM 2882 O HOH 26 -25.891 -8.961 2.325 1.00 43.76 O HETATM 2883 O HOH 27 -17.072 -25.873 -15.595 1.00 19.83 O HETATM 2884 O HOH 28 -38.037 -12.626 -11.802 1.00 30.16 O HETATM 2885 O HOH 29 -5.483 -6.127 -8.003 1.00 20.60 O HETATM 2886 O HOH 30 -13.373 11.600 -22.810 1.00 29.65 O HETATM 2887 O HOH 31 -17.550 -21.020 -3.841 1.00 29.48 O HETATM 2888 O HOH 32 -24.768 0.859 -25.793 1.00 28.07 O HETATM 2889 O HOH 33 -20.010 4.379 -11.370 1.00 33.09 O HETATM 2890 O HOH 34 -3.277 -17.624 -12.070 1.00 24.71 O HETATM 2891 O HOH 35 1.895 5.789 -51.268 1.00 26.94 O HETATM 2892 O HOH 36 -26.816 -8.167 -33.845 1.00 30.60 O HETATM 2893 O HOH 37 7.730 -0.615 -36.581 1.00 32.31 O HETATM 2894 O HOH 38 -15.541 -5.407 -23.704 1.00 18.43 O HETATM 2895 O HOH 39 -20.077 1.329 -24.405 1.00 14.11 O HETATM 2896 O HOH 40 -24.655 -8.270 -32.185 1.00 42.47 O HETATM 2897 O HOH 41 0.257 4.808 -7.930 1.00 35.06 O HETATM 2898 O HOH 42 -3.673 -10.148 -33.962 1.00 14.74 O HETATM 2899 O HOH 43 -34.748 -15.937 -17.143 1.00 37.21 O HETATM 2900 O HOH 44 1.275 -10.558 -10.706 1.00 26.57 O HETATM 2901 O HOH 45 -16.724 8.018 -27.245 1.00 33.78 O HETATM 2902 O HOH 46 -19.250 -11.146 -35.539 1.00 18.60 O HETATM 2903 O HOH 47 -20.048 3.846 -33.895 1.00 40.85 O HETATM 2904 O HOH 48 -1.644 16.244 -25.283 1.00 13.43 O HETATM 2905 O HOH 49 3.572 22.399 -19.460 1.00 32.12 O HETATM 2906 O HOH 50 -8.624 20.812 -15.901 1.00 42.46 O HETATM 2907 O HOH 51 -16.723 -8.233 -18.589 1.00 36.80 O HETATM 2908 O HOH 52 3.659 -17.958 -19.990 1.00 39.38 O HETATM 2909 O HOH 53 5.308 17.830 -24.838 1.00 38.69 O HETATM 2910 O HOH 54 0.699 -14.086 -24.863 1.00 34.99 O HETATM 2911 O HOH 55 -17.993 -6.283 -16.372 1.00 16.84 O HETATM 2912 O HOH 56 4.759 -9.128 -31.315 1.00 23.15 O HETATM 2913 O HOH 57 -6.654 -7.566 -28.960 1.00 11.87 O HETATM 2914 O HOH 58 -6.126 22.929 -21.792 1.00 25.32 O HETATM 2915 O HOH 59 -8.069 9.605 -4.392 1.00 34.48 O HETATM 2916 O HOH 60 -30.821 -3.562 -7.238 1.00 38.95 O HETATM 2917 O HOH 61 -0.738 -8.412 -38.376 1.00 22.11 O HETATM 2918 O HOH 62 -14.086 2.541 -32.155 1.00 10.48 O HETATM 2919 O HOH 63 -5.955 -3.962 -31.339 1.00 11.08 O HETATM 2920 O HOH 64 -21.248 3.516 -37.753 1.00 31.27 O HETATM 2921 O HOH 65 -35.812 -8.993 -11.529 1.00 40.08 O HETATM 2922 O HOH 66 -13.002 -25.054 -15.886 1.00 24.06 O HETATM 2923 O HOH 67 0.289 0.193 -9.119 1.00 22.68 O HETATM 2924 O HOH 68 -30.826 -4.010 -13.140 1.00 33.09 O HETATM 2925 O HOH 69 4.820 1.764 -37.363 1.00 26.46 O HETATM 2926 O HOH 70 -8.110 0.827 -35.953 1.00 11.41 O HETATM 2927 O HOH 71 -11.348 -2.590 -44.767 1.00 32.67 O HETATM 2928 O HOH 72 5.868 -4.174 -39.512 1.00 29.51 O HETATM 2929 O HOH 73 7.055 8.411 -14.366 1.00 25.90 O HETATM 2930 O HOH 74 -16.137 -8.710 -21.804 1.00 31.83 O HETATM 2931 O HOH 75 -19.402 -3.297 -42.095 1.00 31.95 O HETATM 2932 O HOH 76 1.553 5.775 -44.604 1.00 30.23 O HETATM 2933 O HOH 77 -15.293 -7.263 -30.112 1.00 42.85 O HETATM 2934 O HOH 78 -2.440 -10.361 -23.984 1.00 20.06 O HETATM 2935 O HOH 79 -5.191 -18.200 -21.129 1.00 22.64 O HETATM 2936 O HOH 80 -11.436 20.220 -37.994 1.00 34.96 O HETATM 2937 O HOH 81 -6.229 14.336 -9.378 1.00 32.43 O HETATM 2938 O HOH 82 -18.862 0.095 -22.160 1.00 15.61 O HETATM 2939 O HOH 83 -7.443 -14.855 -28.989 1.00 26.73 O HETATM 2940 O HOH 84 -17.098 7.776 -44.610 1.00 24.58 O HETATM 2941 O HOH 85 8.259 -10.745 -22.455 1.00 21.38 O HETATM 2942 O HOH 86 -20.329 -12.184 -17.521 1.00 25.87 O HETATM 2943 O HOH 87 -23.654 -22.894 -17.742 1.00 18.54 O HETATM 2944 O HOH 88 -4.256 -6.708 -5.824 1.00 41.42 O HETATM 2945 O HOH 89 -17.727 6.416 -16.197 1.00 36.82 O HETATM 2946 O HOH 90 -9.915 9.097 -24.858 1.00 20.28 O HETATM 2947 O HOH 91 -0.515 23.987 -14.286 1.00 33.48 O HETATM 2948 O HOH 92 -19.717 -4.896 -35.835 1.00 14.83 O HETATM 2949 O HOH 93 -27.291 -21.296 -17.424 1.00 22.84 O HETATM 2950 O HOH 94 3.987 19.886 -28.035 1.00 43.76 O HETATM 2951 O HOH 95 -28.835 -16.956 -11.800 1.00 22.61 O HETATM 2952 O HOH 96 -6.367 1.877 -34.106 1.00 9.72 O HETATM 2953 O HOH 97 -2.289 4.948 -35.162 1.00 10.43 O HETATM 2954 O HOH 98 -18.284 -14.755 -20.288 1.00 23.63 O HETATM 2955 O HOH 99 5.202 -3.188 -12.380 1.00 28.69 O HETATM 2956 O HOH 100 -21.260 -12.587 -37.134 1.00 16.16 O HETATM 2957 O HOH 101 -10.374 -3.762 -7.785 1.00 29.68 O HETATM 2958 O HOH 102 -13.072 -7.931 -24.063 1.00 17.01 O HETATM 2959 O HOH 103 -14.319 -6.752 -38.208 1.00 20.52 O HETATM 2960 O HOH 104 -13.313 -6.530 -28.667 1.00 23.23 O HETATM 2961 O HOH 105 11.593 5.381 -28.820 1.00 15.83 O HETATM 2962 O HOH 106 -6.290 16.677 -25.577 1.00 18.86 O HETATM 2963 O HOH 107 -11.946 20.168 -15.649 1.00 42.73 O HETATM 2964 O HOH 108 -15.066 11.861 -32.809 1.00 25.04 O HETATM 2965 O HOH 109 -9.160 -15.345 -37.904 1.00 34.66 O HETATM 2966 O HOH 110 -1.679 1.441 -48.164 1.00 15.18 O HETATM 2967 O HOH 111 -21.314 -2.980 -21.020 1.00 22.78 O HETATM 2968 O HOH 112 -4.774 -18.589 -24.892 1.00 45.36 O HETATM 2969 O HOH 113 -20.684 -6.096 -23.795 1.00 34.49 O HETATM 2970 O HOH 114 -20.922 -1.604 -14.761 1.00 31.60 O HETATM 2971 O HOH 115 -7.212 -4.961 -26.572 1.00 10.95 O HETATM 2972 O HOH 116 -27.731 -1.111 2.928 1.00 25.16 O HETATM 2973 O HOH 117 -14.937 0.937 -44.921 1.00 26.84 O HETATM 2974 O HOH 118 -15.845 -0.262 -22.072 1.00 14.61 O HETATM 2975 O HOH 119 -24.602 -6.543 5.432 1.00 29.59 O HETATM 2976 O HOH 120 -24.059 -18.491 -22.976 1.00 30.03 O HETATM 2977 O HOH 121 -9.039 0.223 -47.854 1.00 33.44 O HETATM 2978 O HOH 122 2.329 -14.913 -14.291 1.00 26.55 O HETATM 2979 O HOH 123 -15.737 9.596 -20.074 1.00 23.56 O HETATM 2980 O HOH 124 -21.240 -9.209 -17.807 1.00 27.09 O HETATM 2981 O HOH 125 -10.453 -1.454 -27.273 1.00 10.18 O HETATM 2982 O HOH 126 -23.153 -4.394 -26.424 1.00 35.92 O HETATM 2983 O HOH 127 -11.612 4.861 -23.831 1.00 10.46 O HETATM 2984 O HOH 128 -16.227 3.984 -33.335 1.00 12.32 O HETATM 2985 O HOH 129 -2.844 -2.352 -6.721 1.00 33.85 O HETATM 2986 O HOH 130 2.729 -7.606 -13.919 1.00 15.59 O HETATM 2987 O HOH 131 5.033 17.788 -16.115 1.00 25.47 O HETATM 2988 O HOH 132 -12.744 -12.400 -33.453 1.00 14.34 O HETATM 2989 O HOH 133 4.597 -10.935 -20.506 1.00 16.62 O HETATM 2990 O HOH 134 -14.142 -8.927 -28.511 1.00 39.04 O HETATM 2991 O HOH 135 -25.925 -6.165 -0.375 1.00 50.04 O HETATM 2992 O HOH 136 -5.779 8.988 -8.047 1.00 27.68 O HETATM 2993 O HOH 137 -11.846 8.546 -47.179 1.00 29.44 O HETATM 2994 O HOH 138 -12.931 -10.117 -20.504 1.00 44.49 O HETATM 2995 O HOH 139 -30.057 -5.763 -15.257 1.00 19.60 O HETATM 2996 O HOH 140 -9.807 -3.613 -29.054 1.00 12.81 O HETATM 2997 O HOH 141 10.498 -2.660 -16.117 1.00 29.29 O HETATM 2998 O HOH 142 -23.601 -12.480 -17.791 1.00 18.64 O HETATM 2999 O HOH 143 -5.584 -9.366 -10.526 1.00 16.00 O HETATM 3000 O HOH 144 8.867 -5.122 -17.696 1.00 14.20 O HETATM 3001 O HOH 145 -27.772 -14.951 -10.070 1.00 14.19 O HETATM 3002 O HOH 146 4.845 -1.429 -40.209 1.00 28.44 O HETATM 3003 O HOH 147 -17.669 -20.827 -12.621 1.00 13.48 O HETATM 3004 O HOH 148 5.682 16.464 -22.340 1.00 26.20 O HETATM 3005 O HOH 149 16.159 0.115 -18.672 1.00 21.47 O HETATM 3006 O HOH 150 -15.994 10.917 -36.320 1.00 26.35 O HETATM 3007 O HOH 151 4.408 16.668 -34.891 1.00 36.15 O HETATM 3008 O HOH 152 -20.747 -8.358 -29.333 1.00 25.81 O HETATM 3009 O HOH 153 -21.530 5.848 -0.313 1.00 43.40 O HETATM 3010 O HOH 154 -19.586 7.638 -27.045 1.00 20.86 O HETATM 3011 O HOH 155 -6.940 14.708 -38.251 1.00 11.34 O HETATM 3012 O HOH 156 -25.798 -23.157 -13.689 1.00 23.98 O HETATM 3013 O HOH 157 8.859 3.909 -34.450 1.00 16.22 O HETATM 3014 O HOH 158 -19.444 -22.131 -0.214 1.00 39.57 O HETATM 3015 O HOH 159 3.230 9.594 -37.925 1.00 22.11 O HETATM 3016 O HOH 160 -15.092 -10.048 -31.647 1.00 23.48 O HETATM 3017 O HOH 161 11.127 2.649 -33.792 1.00 25.69 O HETATM 3018 O HOH 162 3.976 -9.626 -15.403 1.00 17.86 O HETATM 3019 O HOH 163 7.151 5.969 -15.090 1.00 30.12 O HETATM 3020 O HOH 164 10.078 15.676 -28.947 1.00 33.02 O HETATM 3021 O HOH 165 -24.792 -7.778 -17.704 1.00 19.64 O HETATM 3022 O HOH 166 11.994 12.622 -27.628 1.00 31.67 O HETATM 3023 O HOH 167 -24.243 -4.822 -19.764 1.00 20.66 O HETATM 3024 O HOH 168 -7.834 1.710 -38.649 1.00 14.44 O HETATM 3025 O HOH 169 -11.957 0.342 1.650 1.00 30.28 O HETATM 3026 O HOH 170 -22.273 1.500 -34.908 1.00 23.65 O HETATM 3027 O HOH 171 -9.493 -13.965 -27.575 1.00 28.89 O HETATM 3028 O HOH 172 -27.359 4.052 -5.869 1.00 29.83 O HETATM 3029 O HOH 173 7.539 10.256 -36.641 1.00 21.38 O HETATM 3030 O HOH 174 -13.809 -10.043 -17.832 1.00 25.91 O HETATM 3031 O HOH 175 -8.334 -14.562 -32.700 1.00 20.31 O HETATM 3032 O HOH 176 -13.457 -18.772 -7.552 1.00 38.50 O HETATM 3033 O HOH 177 -22.795 -5.371 -33.751 1.00 23.35 O HETATM 3034 O HOH 178 -23.609 -9.032 -13.841 1.00 21.24 O HETATM 3035 O HOH 179 -13.678 -2.247 9.432 1.00 40.10 O HETATM 3036 O HOH 180 -18.869 7.317 -38.140 1.00 21.39 O HETATM 3037 O HOH 181 -23.996 -23.097 -10.637 1.00 23.45 O HETATM 3038 O HOH 182 -16.425 6.052 -13.605 1.00 26.11 O HETATM 3039 O HOH 183 -7.382 -15.286 -24.312 1.00 16.44 O HETATM 3040 O HOH 184 12.381 -0.615 -25.475 1.00 33.73 O HETATM 3041 O HOH 185 4.057 19.285 -17.838 1.00 36.06 O HETATM 3042 O HOH 186 -26.802 -3.657 -39.516 1.00 29.70 O HETATM 3043 O HOH 187 1.583 14.030 -35.729 1.00 31.36 O HETATM 3044 O HOH 188 -10.823 -14.760 -31.635 1.00 17.61 O HETATM 3045 O HOH 189 -21.780 -22.094 -9.149 1.00 31.27 O HETATM 3046 O HOH 190 -20.396 -5.254 -44.854 1.00 34.72 O HETATM 3047 O HOH 191 13.427 -4.376 -27.915 1.00 40.49 O HETATM 3048 O HOH 192 -19.154 5.385 -41.396 1.00 21.69 O HETATM 3049 O HOH 193 -14.910 -16.730 -2.192 1.00 19.98 O HETATM 3050 O HOH 194 -26.089 3.356 -26.084 1.00 27.22 O HETATM 3051 O HOH 195 -2.048 -14.317 -28.409 1.00 20.69 O HETATM 3052 O HOH 196 7.551 -4.586 -12.936 1.00 25.92 O HETATM 3053 O HOH 197 -25.904 -20.507 -7.588 1.00 29.35 O HETATM 3054 O HOH 198 -7.057 19.087 -24.304 1.00 22.58 O HETATM 3055 O HOH 199 -9.625 3.273 -4.177 1.00 29.08 O HETATM 3056 O HOH 200 -9.040 -18.409 -18.369 1.00 16.67 O HETATM 3057 O HOH 201 -5.729 9.792 -4.181 1.00 32.76 O HETATM 3058 O HOH 202 -1.554 27.901 -16.645 1.00 34.47 O HETATM 3059 O HOH 203 -33.242 -18.448 -20.499 1.00 27.73 O HETATM 3060 O HOH 204 -12.121 13.804 -30.540 1.00 23.57 O HETATM 3061 O HOH 205 -27.427 -4.177 2.576 1.00 31.57 O HETATM 3062 O HOH 206 -18.349 -5.518 -38.171 1.00 17.39 O HETATM 3063 O HOH 207 -11.144 14.589 -32.981 1.00 25.44 O HETATM 3064 O HOH 208 -20.166 -4.527 -16.782 1.00 33.36 O HETATM 3065 O HOH 209 -7.366 26.121 -19.078 1.00 37.76 O HETATM 3066 O HOH 210 1.119 -0.987 -43.892 1.00 38.12 O HETATM 3067 O HOH 211 -23.145 1.019 -37.946 1.00 36.69 O HETATM 3068 O HOH 212 -22.597 -16.795 1.369 1.00 33.36 O HETATM 3069 O HOH 213 3.808 -9.208 -24.706 1.00 14.79 O HETATM 3070 O HOH 214 -12.344 10.456 -24.894 1.00 38.55 O HETATM 3071 O HOH 215 -30.966 -18.147 -22.457 1.00 20.47 O HETATM 3072 O HOH 216 -19.776 7.039 -43.701 1.00 35.30 O HETATM 3073 O HOH 217 0.145 18.446 -11.447 1.00 37.23 O HETATM 3074 O HOH 218 -13.306 10.967 -9.041 1.00 42.31 O HETATM 3075 O HOH 219 -25.603 -5.829 -2.677 1.00 36.76 O HETATM 3076 O HOH 220 11.012 9.622 -24.675 1.00 15.43 O HETATM 3077 O HOH 221 3.685 -7.882 -29.235 1.00 29.99 O HETATM 3078 O HOH 222 -6.180 2.423 -4.502 1.00 43.08 O HETATM 3079 O HOH 223 -15.876 4.315 -8.798 1.00 21.89 O HETATM 3080 O HOH 224 -27.770 -0.587 5.512 1.00 37.58 O HETATM 3081 O HOH 225 -19.184 3.348 -15.908 1.00 32.71 O HETATM 3082 O HOH 226 0.734 -12.308 -30.356 1.00 17.67 O HETATM 3083 O HOH 227 -30.356 -19.706 -4.685 1.00 35.36 O HETATM 3084 O HOH 228 -24.011 -15.464 4.222 1.00 42.18 O HETATM 3085 O HOH 229 -29.306 -13.976 -23.558 1.00 31.54 O HETATM 3086 O HOH 230 -18.283 6.746 -34.043 1.00 28.71 O HETATM 3087 O HOH 231 -15.800 13.491 -37.973 1.00 27.71 O HETATM 3088 O HOH 232 -29.799 -14.183 -1.603 1.00 42.81 O HETATM 3089 O HOH 233 -9.635 25.592 -17.446 1.00 35.45 O HETATM 3090 O HOH 234 -1.814 -11.671 -35.310 1.00 26.22 O HETATM 3091 O HOH 235 -23.259 5.811 -31.116 1.00 36.65 O HETATM 3092 O HOH 236 -3.286 -19.637 -14.541 1.00 34.72 O HETATM 3093 O HOH 237 -1.508 -15.192 -25.892 1.00 38.53 O HETATM 3094 O HOH 238 2.538 -0.203 -42.056 1.00 39.05 O HETATM 3095 O HOH 239 -12.741 -21.069 -11.214 1.00 26.26 O HETATM 3096 O HOH 240 -3.063 13.807 -31.405 1.00 20.22 O HETATM 3097 O HOH 241 -29.356 -10.234 -25.716 1.00 34.84 O HETATM 3098 O HOH 242 4.438 0.152 -13.006 1.00 21.46 O HETATM 3099 O HOH 243 -6.457 -0.911 -38.407 1.00 19.83 O HETATM 3100 O HOH 244 5.534 -9.513 -22.432 1.00 15.74 O HETATM 3101 O HOH 245 -5.897 -15.900 -32.259 1.00 32.32 O HETATM 3102 O HOH 246 -9.309 -15.681 -35.154 1.00 22.71 O HETATM 3103 O HOH 247 -8.986 20.001 -36.109 1.00 36.60 O HETATM 3104 O HOH 248 -18.078 -23.394 -13.300 1.00 28.51 O HETATM 3105 O HOH 249 -8.221 -4.589 -48.436 1.00 30.99 O HETATM 3106 O HOH 250 -25.655 4.412 -30.623 1.00 37.99 O HETATM 3107 O HOH 251 0.386 -12.635 -33.244 1.00 28.74 O HETATM 3108 O HOH 252 -3.793 2.921 -34.311 1.00 13.64 O HETATM 3109 O HOH 253 -23.628 1.590 -16.263 1.00 27.13 O HETATM 3110 O HOH 254 -14.282 -6.164 12.435 1.00 44.57 O HETATM 3111 O HOH 255 6.343 3.806 -13.175 1.00 23.67 O HETATM 3112 O HOH 256 -1.878 -20.486 -19.984 1.00 37.92 O HETATM 3113 O HOH 257 -4.852 -1.141 -5.243 1.00 46.07 O HETATM 3114 O HOH 258 -16.529 -24.762 -11.680 1.00 33.35 O HETATM 3115 O HOH 259 -8.055 16.902 -27.690 1.00 16.40 O HETATM 3116 O HOH 260 -9.518 22.468 -24.341 1.00 19.77 O HETATM 3117 O HOH 261 -22.644 -2.962 -15.399 1.00 38.98 O HETATM 3118 O HOH 262 -22.042 5.630 -33.217 1.00 40.45 O HETATM 3119 O HOH 263 -6.610 18.505 -29.504 1.00 23.62 O HETATM 3120 O HOH 264 -25.311 -21.834 -15.881 1.00 22.90 O HETATM 3121 O HOH 265 -12.110 8.172 -26.711 1.00 30.45 O HETATM 3122 O HOH 266 -2.422 -20.516 -24.515 1.00 39.27 O HETATM 3123 O HOH 267 -23.060 -2.211 -19.048 1.00 22.22 O HETATM 3124 O HOH 268 -27.027 -5.548 4.856 1.00 35.51 O HETATM 3125 O HOH 269 -7.603 -5.102 -29.417 1.00 12.92 O HETATM 3126 O HOH 270 5.178 4.404 -38.834 1.00 34.04 O HETATM 3127 O HOH 271 4.798 -13.346 -21.846 1.00 30.68 O HETATM 3128 O HOH 272 6.807 8.831 -11.761 1.00 30.56 O HETATM 3129 O HOH 273 4.717 10.186 -10.870 1.00 36.99 O HETATM 3130 O HOH 274 -17.252 4.200 -13.381 1.00 21.66 O HETATM 3131 O HOH 275 -16.641 10.259 -22.703 1.00 31.68 O HETATM 3132 O HOH 276 14.670 -1.112 -26.759 1.00 39.68 O HETATM 3133 O HOH 277 3.389 -5.883 -10.552 1.00 27.71 O HETATM 3134 O HOH 278 -5.694 20.531 -22.866 1.00 33.56 O HETATM 3135 O HOH 279 -15.100 8.896 -24.689 1.00 20.65 O HETATM 3136 O HOH 280 -16.871 10.120 -28.668 1.00 36.93 O HETATM 3137 O HOH 281 -23.838 -2.493 -28.085 1.00 44.66 O HETATM 3138 O HOH 282 10.614 -3.681 -31.041 1.00 40.64 O HETATM 3139 O HOH 283 -13.308 -1.136 -46.170 1.00 31.36 O HETATM 3140 O HOH 284 -12.084 -15.957 -4.864 1.00 37.17 O HETATM 3141 O HOH 285 -22.129 -6.017 -18.204 1.00 37.66 O HETATM 3142 O HOH 286 -21.753 0.017 -16.097 1.00 38.41 O HETATM 3143 O HOH 287 4.431 -16.539 -15.209 1.00 33.63 O HETATM 3144 O HOH 288 -23.344 -11.530 -20.232 1.00 28.02 O HETATM 3145 O HOH 289 -16.174 -21.358 -6.107 1.00 38.19 O HETATM 3146 O HOH 290 -14.399 13.380 -30.759 1.00 31.36 O HETATM 3147 O HOH 291 -19.230 -12.031 -19.917 1.00 39.36 O HETATM 3148 O HOH 292 -26.693 -13.418 -23.518 1.00 33.43 O HETATM 3149 O HOH 293 -15.358 -21.274 -11.190 1.00 26.03 O HETATM 3150 O HOH 294 9.950 -1.753 -34.829 1.00 37.01 O HETATM 3151 O HOH 295 -17.243 -3.194 -43.159 1.00 40.14 O HETATM 3152 O HOH 296 -20.551 3.176 -41.239 1.00 38.50 O HETATM 3153 O HOH 297 -6.486 -16.288 -26.900 1.00 34.63 O HETATM 3154 O HOH 298 -16.802 -7.665 -24.272 1.00 26.02 O HETATM 3155 O HOH 299 -15.276 12.268 -28.329 1.00 32.99 O HETATM 3156 O HOH 300 11.145 -2.723 -28.630 1.00 41.11 O HETATM 3157 O HOH 301 6.623 -10.530 -28.239 1.00 45.94 O HETATM 3158 O HOH 302 -22.093 -6.512 -26.327 1.00 37.18 O HETATM 3159 O HOH 303 -26.540 -11.060 -25.454 1.00 34.47 O HETATM 3160 O HOH 304 -17.185 -0.375 -44.011 1.00 36.17 O HETATM 3161 O HOH 305 -27.587 -1.659 -31.052 1.00 38.92 O HETATM 3162 O HOH 306 -10.225 -4.214 -46.750 1.00 32.96 O HETATM 3163 O HOH 307 -14.334 -10.322 -34.497 1.00 18.60 O HETATM 3164 O HOH 308 -1.971 -10.843 -39.429 1.00 42.94 O HETATM 3165 O HOH 309 -23.741 -10.030 -16.169 1.00 19.17 O HETATM 3166 O HOH 310 -25.224 -4.892 -32.130 1.00 45.34 O HETATM 3167 O HOH 311 -14.394 -7.826 -25.985 1.00 41.91 O HETATM 3168 O HOH 312 -29.696 -21.821 -15.795 1.00 36.80 O HETATM 3169 O HOH 313 -18.472 10.179 -38.084 1.00 35.20 O HETATM 3170 O HOH 314 -31.252 -11.869 -24.368 1.00 34.54 O HETATM 3171 O HOH 315 4.032 -9.846 -27.319 1.00 30.21 O HETATM 3172 O HOH 316 1.078 -16.649 -12.935 1.00 42.30 O HETATM 3173 O HOH 317 -3.874 17.505 -26.582 1.00 16.53 O HETATM 3174 O HOH 318 -5.997 11.970 -7.737 1.00 38.73 O HETATM 3175 O HOH 319 -0.208 -15.010 -30.253 1.00 48.92 O HETATM 3176 O HOH 320 -15.646 -4.316 -38.804 1.00 22.73 O HETATM 3177 O HOH 321 -31.690 -22.806 -22.978 1.00 35.21 O HETATM 3178 O HOH 322 -35.031 -16.858 -19.626 1.00 54.07 O HETATM 3179 O HOH 323 -25.711 -3.344 -30.049 1.00 37.60 O HETATM 3180 O HOH 324 -23.659 -8.493 -20.194 1.00 31.90 O HETATM 3181 O HOH 325 -17.782 5.013 -10.565 1.00 39.79 O HETATM 3182 O HOH 326 -17.102 11.532 -18.887 1.00 39.09 O HETATM 3183 O HOH 327 -29.169 -11.124 -1.710 1.00 36.84 O HETATM 3184 O HOH 328 -18.728 -12.835 -31.195 1.00 21.94 O HETATM 3185 O HOH 329 5.606 18.093 -19.920 1.00 39.41 O HETATM 3186 O HOH 330 8.115 16.070 -21.752 1.00 33.96 O HETATM 3187 O HOH 331 14.331 5.365 -27.503 1.00 38.90 O HETATM 3188 O HOH 332 -35.386 -15.062 -20.885 1.00 54.32 O HETATM 3189 O HOH 333 11.612 0.194 -34.996 1.00 37.52 O HETATM 3190 O HOH 334 3.504 7.429 -41.766 1.00 27.84 O HETATM 3191 O HOH 335 -19.110 -21.296 -10.093 1.00 37.29 O HETATM 3192 O HOH 336 4.329 7.467 -39.438 1.00 38.14 O HETATM 3193 C4 D A 6 -15.446 -8.941 -11.376 1.00 -0.04 C HETATM 3194 C5 D A 6 -15.050 -8.643 -12.667 1.00 -0.01 C HETATM 3195 C6 D A 6 -15.237 -7.355 -13.141 1.00 0.10 C HETATM 3196 C36 D A 6 -15.795 -6.357 -12.350 1.00 -0.02 C HETATM 3197 C19 D A 6 -15.895 -5.100 -13.179 1.00 0.04 C HETATM 3198 C17 D A 6 -15.241 -5.531 -14.498 1.00 0.21 C HETATM 3199 N7 D A 6 -14.938 -6.855 -14.403 1.00 -0.19 N HETATM 3200 C8 D A 6 -14.315 -7.610 -15.478 1.00 0.15 C HETATM 3201 C9 D A 6 -12.801 -7.540 -15.374 1.00 0.21 C HETATM 3202 N11 D A 6 -12.124 -8.370 -16.165 1.00 -0.28 N HETATM 3203 C12 D A 6 -10.685 -8.543 -16.067 1.00 0.13 C HETATM 3204 C13 D A 6 -9.967 -8.191 -17.323 1.00 0.41 C HETATM 3205 F14 D A 6 -10.064 -6.917 -17.605 1.00 -0.17 F HETATM 3206 F15 D A 6 -8.660 -8.447 -17.243 1.00 -0.17 F HETATM 3207 F16 D A 6 -10.461 -8.839 -18.385 1.00 -0.17 F HETATM 3208 H12 D A 6 -10.310 -7.900 -15.257 1.00 0.06 H HETATM 3209 H13 D A 6 -10.475 -9.596 -15.827 1.00 0.06 H HETATM 3210 H19 D A 6 -12.626 -8.895 -16.853 1.00 0.19 H HETATM 3211 O10 D A 6 -12.256 -6.771 -14.583 1.00 -0.39 O HETATM 3212 H3 D A 6 -14.633 -8.661 -15.413 1.00 0.09 H HETATM 3213 H4 D A 6 -14.631 -7.190 -16.445 1.00 0.09 H HETATM 3214 O18 D A 6 -15.044 -4.823 -15.472 1.00 -0.32 O HETATM 3215 C20 D A 6 -15.178 -3.884 -12.546 1.00 -0.05 C HETATM 3216 C21 D A 6 -15.528 -2.580 -13.239 1.00 0.02 C HETATM 3217 N22 D A 6 -16.985 -2.402 -13.336 1.00 -0.27 N HETATM 3218 C23 D A 6 -17.567 -3.440 -14.184 1.00 0.02 C HETATM 3219 C24 D A 6 -17.384 -4.775 -13.478 1.00 -0.05 C HETATM 3220 H9 D A 6 -17.935 -4.748 -12.527 1.00 0.01 H HETATM 3221 H10 D A 6 -17.795 -5.570 -14.118 1.00 0.01 H HETATM 3222 H14 D A 6 -18.638 -3.241 -14.337 1.00 0.05 H HETATM 3223 H15 D A 6 -17.055 -3.458 -15.157 1.00 0.05 H HETATM 3224 C25 D A 6 -17.715 -1.475 -12.692 1.00 0.22 C HETATM 3225 C26 D A 6 -17.027 -0.560 -11.716 1.00 0.11 C HETATM 3226 C27 D A 6 -17.277 0.805 -11.708 1.00 -0.02 C HETATM 3227 C28 D A 6 -16.647 1.577 -10.753 1.00 -0.01 C HETATM 3228 C29 D A 6 -15.818 0.931 -9.839 1.00 0.12 C HETATM 3229 C30 D A 6 -15.615 -0.452 -9.862 1.00 0.08 C HETATM 3230 C32 D A 6 -14.744 -0.759 -8.792 1.00 0.04 C HETATM 3231 N33 D A 6 -14.403 0.356 -8.162 1.00 -0.19 N HETATM 3232 N34 D A 6 -15.059 1.368 -8.793 1.00 -0.20 N HETATM 3233 H20 D A 6 -14.990 2.356 -8.511 1.00 0.25 H HETATM 3234 H18 D A 6 -14.405 -1.759 -8.526 1.00 0.07 H HETATM 3235 N31 D A 6 -16.251 -1.172 -10.807 1.00 -0.28 N HETATM 3236 H11 D A 6 -16.793 2.651 -10.716 1.00 0.07 H HETATM 3237 H16 D A 6 -17.948 1.252 -12.432 1.00 0.07 H HETATM 3238 O35 D A 6 -18.920 -1.381 -12.826 1.00 -0.38 O HETATM 3239 H7 D A 6 -15.099 -2.586 -14.252 1.00 0.05 H HETATM 3240 H8 D A 6 -15.102 -1.744 -12.665 1.00 0.05 H HETATM 3241 H5 D A 6 -15.472 -3.812 -11.489 1.00 0.01 H HETATM 3242 H6 D A 6 -14.091 -4.040 -12.615 1.00 0.01 H HETATM 3243 C2 D A 6 -16.164 -6.680 -11.060 1.00 0.02 C HETATM 3244 C3 D A 6 -16.002 -7.967 -10.567 1.00 -0.04 C HETATM 3245 H17 D A 6 -16.309 -8.207 -9.555 1.00 0.06 H HETATM 3246 BR1 D A 6 -16.954 -5.399 -9.891 1.00 -0.03 BR HETATM 3247 H2 D A 6 -14.602 -9.403 -13.296 1.00 0.06 H HETATM 3248 H1 D A 6 -15.319 -9.948 -10.995 1.00 0.08 H CONECT 1 2 17 18 19 CONECT 17 1 CONECT 18 1 CONECT 19 1 CONECT 356 357 367 368 369 CONECT 367 356 CONECT 368 356 CONECT 369 356 CONECT 1148 1149 1154 1155 1156 CONECT 1155 1148 CONECT 1156 1148 CONECT 3193 3194 3244 3248 CONECT 3194 3193 3195 3247 CONECT 3195 3194 3196 3199 CONECT 3196 3195 3197 3243 CONECT 3197 3196 3198 3215 3219 CONECT 3198 3197 3199 3214 CONECT 3199 3195 3198 3200 CONECT 3200 3199 3201 3212 3213 CONECT 3201 3200 3202 3211 CONECT 3202 3201 3203 3210 CONECT 3203 3202 3204 3208 3209 CONECT 3204 3203 3205 3206 3207 CONECT 3205 3204 CONECT 3206 3204 CONECT 3207 3204 CONECT 3208 3203 CONECT 3209 3203 CONECT 3210 3202 CONECT 3211 3201 CONECT 3212 3200 CONECT 3213 3200 CONECT 3214 3198 CONECT 3215 3197 3216 3241 3242 CONECT 3216 3215 3217 3239 3240 CONECT 3217 3216 3218 3224 CONECT 3218 3217 3219 3222 3223 CONECT 3219 3197 3218 3220 3221 CONECT 3220 3219 CONECT 3221 3219 CONECT 3222 3218 CONECT 3223 3218 CONECT 3224 3217 3225 3238 CONECT 3225 3224 3226 3235 CONECT 3226 3225 3227 3237 CONECT 3227 3226 3228 3236 CONECT 3228 3227 3229 3232 CONECT 3229 3228 3230 3235 CONECT 3230 3229 3231 3234 CONECT 3231 3230 3232 CONECT 3232 3228 3231 3233 CONECT 3233 3232 CONECT 3234 3230 CONECT 3235 3225 3229 CONECT 3236 3227 CONECT 3237 3226 CONECT 3238 3224 CONECT 3239 3216 CONECT 3240 3216 CONECT 3241 3215 CONECT 3242 3215 CONECT 3243 3196 3244 3246 CONECT 3244 3193 3243 3245 CONECT 3245 3244 CONECT 3246 3243 CONECT 3247 3194 CONECT 3248 3193 MASTER 0 0 0 0 0 0 0 0 3245 3 67 24 END
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Related entries of code: 6fex
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
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Protein Sequence Similarity
3zos
RCSB PDB
PDBbind
315aa, >3ZOS_1|Chains... at 100%
4bkj
RCSB PDB
PDBbind
315aa, >4BKJ_1|Chains... at 100%
4ckr
RCSB PDB
PDBbind
315aa, >4CKR_1|Chain... at 100%
5bvk
RCSB PDB
PDBbind
324aa, >5BVK_1|Chain... at 96%
5bvn
RCSB PDB
PDBbind
324aa, >5BVN_1|Chain... at 96%
5bvo
RCSB PDB
PDBbind
324aa, >5BVO_1|Chain... at 96%
5bvw
RCSB PDB
PDBbind
324aa, >5BVW_1|Chain... at 96%
5fdp
RCSB PDB
PDBbind
337aa, >5FDP_1|Chain... *
6few
RCSB PDB
PDBbind
321aa, >6FEW_1|Chain... at 95%
6fil
RCSB PDB
PDBbind
321aa, >6FIL_1|Chain... at 95%
6gwr
RCSB PDB
PDBbind
315aa, >6GWR_1|Chains... at 100%
6hp9
RCSB PDB
PDBbind
315aa, >6HP9_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
6fex
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
DDR1 kinase
Ligand Name
D6Z
EC.Number
E.C.-.-.-.-
Resolution
1.29(Å)
Affinity (Kd/Ki/IC50)
IC50=0.029uM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) ACS Chem. Biol. Vol. 14: pp. 37-49
Ligand Properties
Formula
C
2
3
H
2
0
BrF
3
N
6
O
3
Molecular Weight
565.343
Exact Mass
564.073
No. of atoms
56
No. of bonds
60
Polar Surface Area
111.29
LOGP Value
2.59 (
Computed with XLOGP3
)
3.31 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 9
No. of Rings: 5
Canonical SMILES
O=C(CN1c2cccc(c2C2(C1=O)CCN(CC2)C(=O)c1ccc2c(n1)cn[nH]2)Br)NCC(F)(F)F
InChI String
InChI=1S/C23H20BrF3N6O3/c24-13-2-1-3-17-19(13)22(21(36)33(17)11-18(34)28-12-23(25,26)27)6-8-32(9-7-22)20(35)15-5-4-14-16(30-15)10-29-31-14/h1-5,10H,6-9,11-12H2,(H,28,34)(H,29,31)
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q08345
Entrez Gene ID
NCBI Entrez Gene ID:
780
ASD
Information of known allosteric effects of PDB entries
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