NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
653635 | 6vla | 30717 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 LEU 1 H1 LEU 1 17.402 -1.987 4.221 2 H2 LEU 1 H2 LEU 1 16.465 -3.391 4.205 3 H3 LEU 1 H3 LEU 1 15.763 -1.911 4.621 4 HA LEU 1 HA LEU 1 16.175 -1.070 2.399 5 HB2 LEU 1 HB2 LEU 1 17.098 -3.906 1.895 6 HB3 LEU 1 HB3 LEU 1 16.718 -2.756 0.633 7 HG LEU 1 HG LEU 1 18.545 -1.288 1.724 8 HD11 LEU 1 HD11 LEU 1 19.330 -3.996 2.785 9 HD12 LEU 1 HD12 LEU 1 18.837 -2.609 3.753 10 HD13 LEU 1 HD13 LEU 1 20.328 -2.545 2.816 11 HD21 LEU 1 HD21 LEU 1 18.708 -2.297 -0.483 12 HD22 LEU 1 HD22 LEU 1 19.248 -3.811 0.240 13 HD23 LEU 1 HD23 LEU 1 20.254 -2.367 0.361 14 H MET 2 H MET 2 14.772 -1.809 0.473 15 HA MET 2 HA MET 2 12.767 -2.434 -0.371 16 HB2 MET 2 HB2 MET 2 12.812 -4.446 1.880 17 HB3 MET 2 HB3 MET 2 11.544 -4.371 0.668 18 HG2 MET 2 HG2 MET 2 14.459 -4.818 0.085 19 HG3 MET 2 HG3 MET 2 13.242 -6.087 0.200 20 HE1 MET 2 HE1 MET 2 10.946 -5.352 -2.859 21 HE2 MET 2 HE2 MET 2 10.714 -4.806 -1.198 22 HE3 MET 2 HE3 MET 2 11.294 -6.441 -1.516 23 H GLY 3 H GLY 3 13.211 -0.735 2.291 24 HA2 GLY 3 HA2 GLY 3 10.725 -0.689 3.624 25 HA3 GLY 3 HA3 GLY 3 11.897 0.623 3.600 26 H LEU 4 H LEU 4 11.917 0.947 0.781 27 HA LEU 4 HA LEU 4 9.914 2.799 0.263 28 HB2 LEU 4 HB2 LEU 4 10.936 1.044 -1.931 29 HB3 LEU 4 HB3 LEU 4 10.564 2.753 -1.975 30 HG LEU 4 HG LEU 4 12.792 2.081 -0.207 31 HD11 LEU 4 HD11 LEU 4 12.949 0.394 -2.079 32 HD12 LEU 4 HD12 LEU 4 14.338 1.477 -1.900 33 HD13 LEU 4 HD13 LEU 4 13.153 1.765 -3.176 34 HD21 LEU 4 HD21 LEU 4 13.759 4.007 -1.291 35 HD22 LEU 4 HD22 LEU 4 12.085 4.354 -0.843 36 HD23 LEU 4 HD23 LEU 4 12.491 3.983 -2.518 37 H PHE 5 H PHE 5 10.203 -0.546 -0.714 38 HA PHE 5 HA PHE 5 7.764 -0.663 -2.124 39 HB2 PHE 5 HB2 PHE 5 9.897 -2.061 -2.431 40 HB3 PHE 5 HB3 PHE 5 9.302 -3.023 -1.075 41 HD1 PHE 5 HD1 PHE 5 8.167 -4.929 -1.588 42 HD2 PHE 5 HD2 PHE 5 7.941 -1.627 -4.258 43 HE1 PHE 5 HE1 PHE 5 6.733 -6.249 -3.088 44 HE2 PHE 5 HE2 PHE 5 6.511 -2.942 -5.767 45 HZ PHE 5 HZ PHE 5 5.903 -5.255 -5.182 46 H ASN 6 H ASN 6 8.781 -1.759 1.101 47 HA ASN 6 HA ASN 6 6.409 -3.080 1.834 48 HB2 ASN 6 HB2 ASN 6 8.424 -1.591 3.508 49 HB3 ASN 6 HB3 ASN 6 7.052 -2.431 4.207 50 HD21 ASN 6 HD21 ASN 6 8.639 -3.718 1.393 51 HD22 ASN 6 HD22 ASN 6 9.386 -5.057 2.189 52 H ARG 7 H ARG 7 7.322 0.304 1.904 53 HA ARG 7 HA ARG 7 5.067 1.173 3.341 54 HB2 ARG 7 HB2 ARG 7 6.838 2.674 3.409 55 HB3 ARG 7 HB3 ARG 7 7.204 2.477 1.706 56 HG2 ARG 7 HG2 ARG 7 4.654 3.794 2.498 57 HG3 ARG 7 HG3 ARG 7 6.169 4.695 2.593 58 HD2 ARG 7 HD2 ARG 7 6.614 4.201 0.245 59 HD3 ARG 7 HD3 ARG 7 5.118 3.271 0.155 60 HE ARG 7 HE ARG 7 4.286 5.715 0.991 61 HH11 ARG 7 HH11 ARG 7 6.248 4.652 -1.708 62 HH12 ARG 7 HH12 ARG 7 5.731 5.934 -2.750 63 HH21 ARG 7 HH21 ARG 7 3.612 7.412 -0.376 64 HH22 ARG 7 HH22 ARG 7 4.236 7.509 -1.996 65 H ILE 8 H ILE 8 5.844 0.760 -0.056 66 HA ILE 8 HA ILE 8 3.503 1.882 -1.156 67 HB ILE 8 HB ILE 8 5.290 -0.296 -2.258 68 HG12 ILE 8 HG12 ILE 8 5.196 2.677 -2.822 69 HG13 ILE 8 HG13 ILE 8 6.413 1.864 -1.845 70 HG21 ILE 8 HG21 ILE 8 4.312 0.194 -4.432 71 HG22 ILE 8 HG22 ILE 8 3.235 1.380 -3.697 72 HG23 ILE 8 HG23 ILE 8 3.064 -0.330 -3.298 73 HD11 ILE 8 HD11 ILE 8 7.145 0.609 -3.803 74 HD12 ILE 8 HD12 ILE 8 7.242 2.350 -4.071 75 HD13 ILE 8 HD13 ILE 8 5.921 1.420 -4.780 76 H ILE 9 H ILE 9 4.255 -1.327 0.086 77 HA ILE 9 HA ILE 9 2.036 -2.732 -0.838 78 HB ILE 9 HB ILE 9 3.281 -3.112 1.884 79 HG12 ILE 9 HG12 ILE 9 5.081 -3.081 0.284 80 HG13 ILE 9 HG13 ILE 9 4.791 -4.745 0.777 81 HG21 ILE 9 HG21 ILE 9 2.607 -5.429 1.642 82 HG22 ILE 9 HG22 ILE 9 1.934 -5.081 0.051 83 HG23 ILE 9 HG23 ILE 9 1.213 -4.360 1.489 84 HD11 ILE 9 HD11 ILE 9 3.837 -3.477 -1.771 85 HD12 ILE 9 HD12 ILE 9 3.589 -5.153 -1.286 86 HD13 ILE 9 HD13 ILE 9 5.221 -4.559 -1.604 87 H ARG 10 H ARG 10 2.379 -0.588 1.924 88 HA ARG 10 HA ARG 10 -0.316 -1.090 2.834 89 HB2 ARG 10 HB2 ARG 10 1.925 0.653 3.766 90 HB3 ARG 10 HB3 ARG 10 0.296 0.969 4.348 91 HG2 ARG 10 HG2 ARG 10 1.463 -0.401 5.931 92 HG3 ARG 10 HG3 ARG 10 0.205 -1.373 5.159 93 HD2 ARG 10 HD2 ARG 10 1.961 -2.140 3.547 94 HD3 ARG 10 HD3 ARG 10 3.154 -1.377 4.595 95 HE ARG 10 HE ARG 10 1.480 -3.173 6.045 96 HH11 ARG 10 HH11 ARG 10 4.245 -2.991 3.919 97 HH12 ARG 10 HH12 ARG 10 4.907 -4.514 4.425 98 HH21 ARG 10 HH21 ARG 10 2.356 -5.176 6.744 99 HH22 ARG 10 HH22 ARG 10 3.842 -5.745 6.051 100 H LYS 11 H LYS 11 1.341 1.183 0.822 101 HA LYS 11 HA LYS 11 -0.728 3.157 0.806 102 HB2 LYS 11 HB2 LYS 11 1.558 3.754 0.182 103 HB3 LYS 11 HB3 LYS 11 1.514 2.616 -1.156 104 HG2 LYS 11 HG2 LYS 11 1.240 4.945 -1.878 105 HG3 LYS 11 HG3 LYS 11 -0.144 3.939 -2.294 106 HD2 LYS 11 HD2 LYS 11 -0.880 6.100 -1.470 107 HD3 LYS 11 HD3 LYS 11 -1.356 4.826 -0.350 108 HE2 LYS 11 HE2 LYS 11 0.472 5.388 1.127 109 HE3 LYS 11 HE3 LYS 11 1.078 6.575 -0.028 110 HZ1 LYS 11 HZ1 LYS 11 -0.949 7.846 0.266 111 HZ2 LYS 11 HZ2 LYS 11 -0.173 7.624 1.752 112 HZ3 LYS 11 HZ3 LYS 11 -1.540 6.708 1.371 113 H VAL 12 H VAL 12 0.078 0.325 -1.090 114 HA VAL 12 HA VAL 12 -2.117 0.665 -2.908 115 HB VAL 12 HB VAL 12 -0.364 -1.737 -2.364 116 HG11 VAL 12 HG11 VAL 12 -1.306 -2.715 -4.366 117 HG12 VAL 12 HG12 VAL 12 -2.294 -1.278 -4.640 118 HG13 VAL 12 HG13 VAL 12 -2.617 -2.311 -3.250 119 HG21 VAL 12 HG21 VAL 12 0.831 0.170 -3.321 120 HG22 VAL 12 HG22 VAL 12 -0.353 0.269 -4.625 121 HG23 VAL 12 HG23 VAL 12 0.695 -1.143 -4.489 122 H VAL 13 H VAL 13 -1.642 -0.790 0.212 123 HA VAL 13 HA VAL 13 -3.847 -2.568 0.110 124 HB VAL 13 HB VAL 13 -1.760 -2.109 1.867 125 HG11 VAL 13 HG11 VAL 13 -4.326 -1.422 3.289 126 HG12 VAL 13 HG12 VAL 13 -2.959 -0.341 3.016 127 HG13 VAL 13 HG13 VAL 13 -2.775 -1.749 4.061 128 HG21 VAL 13 HG21 VAL 13 -4.215 -3.803 2.203 129 HG22 VAL 13 HG22 VAL 13 -2.712 -4.002 3.104 130 HG23 VAL 13 HG23 VAL 13 -2.730 -4.230 1.354 131 H LYS 14 H LYS 14 -3.352 0.744 0.667 132 HA LYS 14 HA LYS 14 -5.795 1.477 1.832 133 HB2 LYS 14 HB2 LYS 14 -3.772 2.900 0.124 134 HB3 LYS 14 HB3 LYS 14 -5.190 3.727 0.770 135 HG2 LYS 14 HG2 LYS 14 -3.037 2.367 2.384 136 HG3 LYS 14 HG3 LYS 14 -3.194 4.104 2.136 137 HD2 LYS 14 HD2 LYS 14 -5.283 2.376 3.455 138 HD3 LYS 14 HD3 LYS 14 -4.063 3.303 4.327 139 HE2 LYS 14 HE2 LYS 14 -6.074 4.484 2.425 140 HE3 LYS 14 HE3 LYS 14 -6.268 4.437 4.175 141 HZ1 LYS 14 HZ1 LYS 14 -4.062 5.806 2.728 142 HZ2 LYS 14 HZ2 LYS 14 -4.283 5.784 4.403 143 HZ3 LYS 14 HZ3 LYS 14 -5.406 6.569 3.415 144 H LEU 15 H LEU 15 -4.791 0.985 -1.553 145 HA LEU 15 HA LEU 15 -7.443 1.789 -2.450 146 HB2 LEU 15 HB2 LEU 15 -6.566 1.596 -4.687 147 HB3 LEU 15 HB3 LEU 15 -5.462 2.519 -3.689 148 HG LEU 15 HG LEU 15 -4.252 0.181 -3.442 149 HD11 LEU 15 HD11 LEU 15 -5.653 -0.066 -6.097 150 HD12 LEU 15 HD12 LEU 15 -5.897 -1.100 -4.689 151 HD13 LEU 15 HD13 LEU 15 -4.343 -1.096 -5.524 152 HD21 LEU 15 HD21 LEU 15 -4.053 1.938 -5.883 153 HD22 LEU 15 HD22 LEU 15 -2.817 0.814 -5.316 154 HD23 LEU 15 HD23 LEU 15 -3.255 2.212 -4.333 155 H PHE 16 H PHE 16 -5.723 -0.990 -1.555 156 HA PHE 16 HA PHE 16 -7.235 -2.923 -3.024 157 HB2 PHE 16 HB2 PHE 16 -4.936 -3.251 -2.007 158 HB3 PHE 16 HB3 PHE 16 -5.722 -3.320 -0.439 159 HD1 PHE 16 HD1 PHE 16 -5.412 -5.014 -3.698 160 HD2 PHE 16 HD2 PHE 16 -6.809 -5.275 0.311 161 HE1 PHE 16 HE1 PHE 16 -5.792 -7.427 -3.988 162 HE2 PHE 16 HE2 PHE 16 -7.194 -7.686 0.027 163 HZ PHE 16 HZ PHE 16 -6.683 -8.763 -2.127 164 H ASN 17 H ASN 17 -7.324 -1.583 0.234 165 HA ASN 17 HA ASN 17 -9.776 -3.036 0.852 166 HB2 ASN 17 HB2 ASN 17 -7.943 -1.276 2.476 167 HB3 ASN 17 HB3 ASN 17 -9.515 -1.779 3.083 168 HD21 ASN 17 HD21 ASN 17 -7.654 -3.872 1.045 169 HD22 ASN 17 HD22 ASN 17 -7.213 -5.013 2.267 Start of MODEL 2 1 H1 LEU 1 H1 LEU 1 17.247 -1.615 -1.627 2 H2 LEU 1 H2 LEU 1 15.788 -0.828 -1.945 3 H3 LEU 1 H3 LEU 1 15.901 -2.504 -2.133 4 HA LEU 1 HA LEU 1 16.233 -2.804 0.212 5 HB2 LEU 1 HB2 LEU 1 15.883 0.197 0.326 6 HB3 LEU 1 HB3 LEU 1 15.947 -0.863 1.719 7 HG LEU 1 HG LEU 1 18.201 -0.389 -0.233 8 HD11 LEU 1 HD11 LEU 1 17.828 0.500 2.621 9 HD12 LEU 1 HD12 LEU 1 17.780 1.533 1.194 10 HD13 LEU 1 HD13 LEU 1 19.283 0.731 1.651 11 HD21 LEU 1 HD21 LEU 1 18.091 -2.039 2.288 12 HD22 LEU 1 HD22 LEU 1 19.549 -1.683 1.362 13 HD23 LEU 1 HD23 LEU 1 18.262 -2.651 0.644 14 H MET 2 H MET 2 14.421 -3.233 1.497 15 HA MET 2 HA MET 2 11.981 -3.135 -0.035 16 HB2 MET 2 HB2 MET 2 11.069 -4.631 1.641 17 HB3 MET 2 HB3 MET 2 12.658 -5.185 1.144 18 HG2 MET 2 HG2 MET 2 13.624 -4.239 3.177 19 HG3 MET 2 HG3 MET 2 12.028 -3.682 3.674 20 HE1 MET 2 HE1 MET 2 14.379 -6.733 3.092 21 HE2 MET 2 HE2 MET 2 13.089 -7.087 1.945 22 HE3 MET 2 HE3 MET 2 13.308 -8.105 3.368 23 H GLY 3 H GLY 3 13.383 -1.098 2.201 24 HA2 GLY 3 HA2 GLY 3 11.267 -0.235 3.794 25 HA3 GLY 3 HA3 GLY 3 12.617 0.766 3.293 26 H LEU 4 H LEU 4 12.001 0.518 0.458 27 HA LEU 4 HA LEU 4 10.050 2.614 0.204 28 HB2 LEU 4 HB2 LEU 4 10.914 0.977 -2.126 29 HB3 LEU 4 HB3 LEU 4 10.640 2.703 -2.020 30 HG LEU 4 HG LEU 4 12.898 1.752 -0.431 31 HD11 LEU 4 HD11 LEU 4 13.052 1.682 -3.440 32 HD12 LEU 4 HD12 LEU 4 12.919 0.242 -2.423 33 HD13 LEU 4 HD13 LEU 4 14.338 1.295 -2.295 34 HD21 LEU 4 HD21 LEU 4 13.929 3.730 -1.387 35 HD22 LEU 4 HD22 LEU 4 12.316 4.111 -0.781 36 HD23 LEU 4 HD23 LEU 4 12.582 3.910 -2.512 37 H PHE 5 H PHE 5 10.367 -0.736 -0.714 38 HA PHE 5 HA PHE 5 8.004 -1.040 -2.152 39 HB2 PHE 5 HB2 PHE 5 10.127 -2.483 -2.074 40 HB3 PHE 5 HB3 PHE 5 9.404 -3.237 -0.649 41 HD1 PHE 5 HD1 PHE 5 8.927 -2.670 -4.265 42 HD2 PHE 5 HD2 PHE 5 7.734 -4.873 -0.831 43 HE1 PHE 5 HE1 PHE 5 7.674 -4.223 -5.704 44 HE2 PHE 5 HE2 PHE 5 6.478 -6.430 -2.261 45 HZ PHE 5 HZ PHE 5 6.447 -6.106 -4.700 46 H ASN 6 H ASN 6 8.761 -1.878 1.229 47 HA ASN 6 HA ASN 6 6.286 -2.965 1.933 48 HB2 ASN 6 HB2 ASN 6 8.273 -1.446 3.622 49 HB3 ASN 6 HB3 ASN 6 6.875 -2.284 4.280 50 HD21 ASN 6 HD21 ASN 6 9.687 -2.748 4.795 51 HD22 ASN 6 HD22 ASN 6 10.002 -4.391 4.351 52 H ARG 7 H ARG 7 7.356 0.372 1.763 53 HA ARG 7 HA ARG 7 5.134 1.430 3.151 54 HB2 ARG 7 HB2 ARG 7 7.024 2.797 3.191 55 HB3 ARG 7 HB3 ARG 7 7.360 2.555 1.487 56 HG2 ARG 7 HG2 ARG 7 4.893 4.016 2.271 57 HG3 ARG 7 HG3 ARG 7 6.453 4.835 2.375 58 HD2 ARG 7 HD2 ARG 7 6.892 4.351 0.042 59 HD3 ARG 7 HD3 ARG 7 5.382 3.444 -0.070 60 HE ARG 7 HE ARG 7 4.482 5.824 0.702 61 HH11 ARG 7 HH11 ARG 7 6.855 5.037 -1.746 62 HH12 ARG 7 HH12 ARG 7 6.436 6.378 -2.762 63 HH21 ARG 7 HH21 ARG 7 3.925 7.588 -0.636 64 HH22 ARG 7 HH22 ARG 7 4.769 7.828 -2.132 65 H ILE 8 H ILE 8 5.918 0.729 -0.179 66 HA ILE 8 HA ILE 8 3.627 1.926 -1.350 67 HB ILE 8 HB ILE 8 5.388 -0.322 -2.343 68 HG12 ILE 8 HG12 ILE 8 6.507 1.869 -2.069 69 HG13 ILE 8 HG13 ILE 8 6.411 1.375 -3.755 70 HG21 ILE 8 HG21 ILE 8 3.291 1.242 -3.845 71 HG22 ILE 8 HG22 ILE 8 3.192 -0.460 -3.391 72 HG23 ILE 8 HG23 ILE 8 4.408 0.074 -4.551 73 HD11 ILE 8 HD11 ILE 8 5.941 3.728 -3.541 74 HD12 ILE 8 HD12 ILE 8 4.653 3.396 -2.383 75 HD13 ILE 8 HD13 ILE 8 4.489 2.871 -4.060 76 H ILE 9 H ILE 9 4.290 -1.238 0.058 77 HA ILE 9 HA ILE 9 2.067 -2.631 -0.899 78 HB ILE 9 HB ILE 9 3.231 -2.974 1.862 79 HG12 ILE 9 HG12 ILE 9 5.078 -3.007 0.301 80 HG13 ILE 9 HG13 ILE 9 4.758 -4.643 0.863 81 HG21 ILE 9 HG21 ILE 9 1.857 -4.922 0.023 82 HG22 ILE 9 HG22 ILE 9 1.168 -4.192 1.473 83 HG23 ILE 9 HG23 ILE 9 2.531 -5.302 1.607 84 HD11 ILE 9 HD11 ILE 9 3.854 -3.499 -1.758 85 HD12 ILE 9 HD12 ILE 9 3.635 -5.158 -1.205 86 HD13 ILE 9 HD13 ILE 9 5.259 -4.538 -1.520 87 H ARG 10 H ARG 10 2.471 -0.801 2.110 88 HA ARG 10 HA ARG 10 -0.232 -1.105 2.878 89 HB2 ARG 10 HB2 ARG 10 1.581 1.068 3.889 90 HB3 ARG 10 HB3 ARG 10 0.287 0.238 4.742 91 HG2 ARG 10 HG2 ARG 10 3.007 -0.793 4.040 92 HG3 ARG 10 HG3 ARG 10 2.292 -0.603 5.642 93 HD2 ARG 10 HD2 ARG 10 0.606 -2.332 4.959 94 HD3 ARG 10 HD3 ARG 10 1.560 -2.594 3.505 95 HE ARG 10 HE ARG 10 3.290 -2.859 5.657 96 HH11 ARG 10 HH11 ARG 10 0.419 -4.460 4.455 97 HH12 ARG 10 HH12 ARG 10 0.881 -6.020 5.053 98 HH21 ARG 10 HH21 ARG 10 3.894 -4.920 6.459 99 HH22 ARG 10 HH22 ARG 10 2.854 -6.282 6.188 100 H LYS 11 H LYS 11 1.494 1.200 0.958 101 HA LYS 11 HA LYS 11 -0.432 3.281 0.983 102 HB2 LYS 11 HB2 LYS 11 1.877 3.626 0.197 103 HB3 LYS 11 HB3 LYS 11 1.595 2.520 -1.138 104 HG2 LYS 11 HG2 LYS 11 1.505 4.818 -1.891 105 HG3 LYS 11 HG3 LYS 11 -0.074 4.050 -2.058 106 HD2 LYS 11 HD2 LYS 11 -0.819 5.122 0.007 107 HD3 LYS 11 HD3 LYS 11 0.765 5.870 0.199 108 HE2 LYS 11 HE2 LYS 11 0.447 7.093 -1.890 109 HE3 LYS 11 HE3 LYS 11 -1.124 6.326 -2.107 110 HZ1 LYS 11 HZ1 LYS 11 -0.386 8.115 0.142 111 HZ2 LYS 11 HZ2 LYS 11 -1.896 7.404 -0.101 112 HZ3 LYS 11 HZ3 LYS 11 -1.322 8.557 -1.193 113 H VAL 12 H VAL 12 0.165 0.529 -1.127 114 HA VAL 12 HA VAL 12 -2.060 1.000 -2.843 115 HB VAL 12 HB VAL 12 -0.373 -1.465 -2.379 116 HG11 VAL 12 HG11 VAL 12 -1.332 -2.334 -4.456 117 HG12 VAL 12 HG12 VAL 12 -2.375 -0.915 -4.579 118 HG13 VAL 12 HG13 VAL 12 -2.597 -2.057 -3.255 119 HG21 VAL 12 HG21 VAL 12 -0.357 0.580 -4.603 120 HG22 VAL 12 HG22 VAL 12 0.674 -0.849 -4.502 121 HG23 VAL 12 HG23 VAL 12 0.838 0.444 -3.314 122 H VAL 13 H VAL 13 -1.680 -0.540 0.233 123 HA VAL 13 HA VAL 13 -3.746 -2.453 -0.003 124 HB VAL 13 HB VAL 13 -1.763 -1.892 1.831 125 HG11 VAL 13 HG11 VAL 13 -4.408 -1.449 3.199 126 HG12 VAL 13 HG12 VAL 13 -3.124 -0.258 2.992 127 HG13 VAL 13 HG13 VAL 13 -2.855 -1.677 4.004 128 HG21 VAL 13 HG21 VAL 13 -2.572 -4.066 1.222 129 HG22 VAL 13 HG22 VAL 13 -4.082 -3.779 2.087 130 HG23 VAL 13 HG23 VAL 13 -2.560 -3.891 2.977 131 H LYS 14 H LYS 14 -3.538 0.865 0.644 132 HA LYS 14 HA LYS 14 -6.026 1.324 1.837 133 HB2 LYS 14 HB2 LYS 14 -4.111 3.005 0.258 134 HB3 LYS 14 HB3 LYS 14 -5.569 3.675 0.975 135 HG2 LYS 14 HG2 LYS 14 -3.346 2.330 2.390 136 HG3 LYS 14 HG3 LYS 14 -3.583 4.074 2.255 137 HD2 LYS 14 HD2 LYS 14 -5.353 4.070 3.689 138 HD3 LYS 14 HD3 LYS 14 -5.785 2.393 3.296 139 HE2 LYS 14 HE2 LYS 14 -4.274 1.524 4.644 140 HE3 LYS 14 HE3 LYS 14 -3.143 2.831 4.326 141 HZ1 LYS 14 HZ1 LYS 14 -4.300 4.218 5.890 142 HZ2 LYS 14 HZ2 LYS 14 -3.977 2.752 6.666 143 HZ3 LYS 14 HZ3 LYS 14 -5.529 3.076 6.084 144 H LEU 15 H LEU 15 -5.005 1.063 -1.557 145 HA LEU 15 HA LEU 15 -7.727 1.654 -2.404 146 HB2 LEU 15 HB2 LEU 15 -6.889 1.570 -4.656 147 HB3 LEU 15 HB3 LEU 15 -5.824 2.553 -3.675 148 HG LEU 15 HG LEU 15 -4.415 0.344 -3.499 149 HD11 LEU 15 HD11 LEU 15 -5.943 -0.086 -6.066 150 HD12 LEU 15 HD12 LEU 15 -6.005 -1.107 -4.628 151 HD13 LEU 15 HD13 LEU 15 -4.510 -0.982 -5.557 152 HD21 LEU 15 HD21 LEU 15 -4.501 2.035 -5.993 153 HD22 LEU 15 HD22 LEU 15 -3.139 1.055 -5.449 154 HD23 LEU 15 HD23 LEU 15 -3.667 2.440 -4.493 155 H PHE 16 H PHE 16 -5.722 -0.967 -1.615 156 HA PHE 16 HA PHE 16 -6.984 -3.032 -3.095 157 HB2 PHE 16 HB2 PHE 16 -4.734 -3.224 -2.079 158 HB3 PHE 16 HB3 PHE 16 -5.465 -3.178 -0.485 159 HD1 PHE 16 HD1 PHE 16 -5.463 -5.140 -3.639 160 HD2 PHE 16 HD2 PHE 16 -6.110 -5.128 0.565 161 HE1 PHE 16 HE1 PHE 16 -5.720 -7.585 -3.672 162 HE2 PHE 16 HE2 PHE 16 -6.367 -7.571 0.536 163 HZ PHE 16 HZ PHE 16 -6.171 -8.804 -1.583 164 H ASN 17 H ASN 17 -7.285 -1.925 0.261 165 HA ASN 17 HA ASN 17 -9.359 -3.764 0.924 166 HB2 ASN 17 HB2 ASN 17 -8.628 -1.150 2.267 167 HB3 ASN 17 HB3 ASN 17 -9.658 -2.398 2.952 168 HD21 ASN 17 HD21 ASN 17 -7.973 -4.591 1.961 169 HD22 ASN 17 HD22 ASN 17 -6.564 -4.585 2.962 Start of MODEL 3 1 H1 LEU 1 H1 LEU 1 14.490 -2.863 6.296 2 H2 LEU 1 H2 LEU 1 14.517 -1.225 5.891 3 H3 LEU 1 H3 LEU 1 15.939 -1.998 6.373 4 HA LEU 1 HA LEU 1 15.920 -1.675 3.999 5 HB2 LEU 1 HB2 LEU 1 15.724 -4.460 5.092 6 HB3 LEU 1 HB3 LEU 1 15.941 -4.214 3.371 7 HG LEU 1 HG LEU 1 18.046 -3.008 3.813 8 HD11 LEU 1 HD11 LEU 1 17.616 -2.106 6.000 9 HD12 LEU 1 HD12 LEU 1 19.047 -3.131 6.060 10 HD13 LEU 1 HD13 LEU 1 17.512 -3.726 6.687 11 HD21 LEU 1 HD21 LEU 1 17.848 -5.745 5.053 12 HD22 LEU 1 HD22 LEU 1 19.346 -4.957 4.558 13 HD23 LEU 1 HD23 LEU 1 18.130 -5.373 3.351 14 H MET 2 H MET 2 14.948 -2.011 1.979 15 HA MET 2 HA MET 2 13.230 -2.057 0.498 16 HB2 MET 2 HB2 MET 2 12.117 -4.073 2.457 17 HB3 MET 2 HB3 MET 2 11.398 -3.725 0.892 18 HG2 MET 2 HG2 MET 2 14.194 -4.757 1.300 19 HG3 MET 2 HG3 MET 2 12.795 -5.757 0.914 20 HE1 MET 2 HE1 MET 2 13.956 -6.790 -1.189 21 HE2 MET 2 HE2 MET 2 15.414 -5.872 -0.819 22 HE3 MET 2 HE3 MET 2 14.743 -5.841 -2.449 23 H GLY 3 H GLY 3 13.280 -0.013 2.422 24 HA2 GLY 3 HA2 GLY 3 10.831 0.397 3.764 25 HA3 GLY 3 HA3 GLY 3 12.001 1.643 3.361 26 H LEU 4 H LEU 4 11.800 0.980 0.495 27 HA LEU 4 HA LEU 4 9.709 2.741 -0.289 28 HB2 LEU 4 HB2 LEU 4 10.855 0.701 -2.130 29 HB3 LEU 4 HB3 LEU 4 10.432 2.373 -2.447 30 HG LEU 4 HG LEU 4 12.549 2.220 -0.510 31 HD11 LEU 4 HD11 LEU 4 14.244 1.196 -1.837 32 HD12 LEU 4 HD12 LEU 4 13.131 0.987 -3.189 33 HD13 LEU 4 HD13 LEU 4 12.898 0.048 -1.705 34 HD21 LEU 4 HD21 LEU 4 13.545 3.792 -2.015 35 HD22 LEU 4 HD22 LEU 4 11.814 4.134 -1.871 36 HD23 LEU 4 HD23 LEU 4 12.440 3.315 -3.306 37 H PHE 5 H PHE 5 10.309 -0.588 -1.085 38 HA PHE 5 HA PHE 5 8.003 -1.522 -2.089 39 HB2 PHE 5 HB2 PHE 5 9.796 -2.944 -2.108 40 HB3 PHE 5 HB3 PHE 5 10.190 -2.706 -0.430 41 HD1 PHE 5 HD1 PHE 5 7.971 -4.431 -2.817 42 HD2 PHE 5 HD2 PHE 5 9.290 -4.198 1.221 43 HE1 PHE 5 HE1 PHE 5 6.896 -6.590 -2.341 44 HE2 PHE 5 HE2 PHE 5 8.212 -6.354 1.703 45 HZ PHE 5 HZ PHE 5 7.015 -7.555 -0.082 46 H ASN 6 H ASN 6 8.833 -2.025 1.314 47 HA ASN 6 HA ASN 6 6.397 -2.991 2.184 48 HB2 ASN 6 HB2 ASN 6 8.410 -1.328 3.693 49 HB3 ASN 6 HB3 ASN 6 6.980 -1.998 4.458 50 HD21 ASN 6 HD21 ASN 6 10.108 -2.692 3.163 51 HD22 ASN 6 HD22 ASN 6 10.177 -4.344 3.682 52 H ARG 7 H ARG 7 7.364 0.397 1.870 53 HA ARG 7 HA ARG 7 5.084 1.374 3.222 54 HB2 ARG 7 HB2 ARG 7 6.892 2.825 3.302 55 HB3 ARG 7 HB3 ARG 7 7.293 2.584 1.611 56 HG2 ARG 7 HG2 ARG 7 4.743 3.953 2.303 57 HG3 ARG 7 HG3 ARG 7 6.267 4.834 2.445 58 HD2 ARG 7 HD2 ARG 7 6.800 4.304 0.131 59 HD3 ARG 7 HD3 ARG 7 5.302 3.386 -0.011 60 HE ARG 7 HE ARG 7 4.435 5.829 0.745 61 HH11 ARG 7 HH11 ARG 7 6.568 4.752 -1.813 62 HH12 ARG 7 HH12 ARG 7 6.161 6.057 -2.877 63 HH21 ARG 7 HH21 ARG 7 3.911 7.565 -0.647 64 HH22 ARG 7 HH22 ARG 7 4.677 7.675 -2.200 65 H ILE 8 H ILE 8 5.915 0.755 -0.131 66 HA ILE 8 HA ILE 8 3.598 1.921 -1.278 67 HB ILE 8 HB ILE 8 5.354 -0.300 -2.348 68 HG12 ILE 8 HG12 ILE 8 5.349 2.665 -2.966 69 HG13 ILE 8 HG13 ILE 8 6.510 1.863 -1.913 70 HG21 ILE 8 HG21 ILE 8 3.335 1.429 -3.781 71 HG22 ILE 8 HG22 ILE 8 3.155 -0.289 -3.423 72 HG23 ILE 8 HG23 ILE 8 4.411 0.255 -4.538 73 HD11 ILE 8 HD11 ILE 8 6.129 1.334 -4.850 74 HD12 ILE 8 HD12 ILE 8 7.290 0.524 -3.799 75 HD13 ILE 8 HD13 ILE 8 7.442 2.253 -4.116 76 H ILE 9 H ILE 9 4.329 -1.283 0.009 77 HA ILE 9 HA ILE 9 2.151 -2.709 -0.975 78 HB ILE 9 HB ILE 9 3.202 -3.082 1.823 79 HG12 ILE 9 HG12 ILE 9 5.169 -2.973 0.464 80 HG13 ILE 9 HG13 ILE 9 4.857 -4.666 0.826 81 HG21 ILE 9 HG21 ILE 9 1.264 -4.408 1.282 82 HG22 ILE 9 HG22 ILE 9 2.684 -5.448 1.385 83 HG23 ILE 9 HG23 ILE 9 2.040 -4.991 -0.191 84 HD11 ILE 9 HD11 ILE 9 4.094 -3.311 -1.738 85 HD12 ILE 9 HD12 ILE 9 4.005 -5.033 -1.373 86 HD13 ILE 9 HD13 ILE 9 5.577 -4.234 -1.490 87 H ARG 10 H ARG 10 2.425 -0.779 1.982 88 HA ARG 10 HA ARG 10 -0.351 -1.209 2.624 89 HB2 ARG 10 HB2 ARG 10 1.956 0.048 3.965 90 HB3 ARG 10 HB3 ARG 10 0.375 0.687 4.390 91 HG2 ARG 10 HG2 ARG 10 0.855 -0.971 5.951 92 HG3 ARG 10 HG3 ARG 10 -0.272 -1.720 4.814 93 HD2 ARG 10 HD2 ARG 10 1.420 -3.275 5.138 94 HD3 ARG 10 HD3 ARG 10 1.761 -2.567 3.577 95 HE ARG 10 HE ARG 10 3.293 -1.088 5.180 96 HH11 ARG 10 HH11 ARG 10 2.841 -4.544 4.966 97 HH12 ARG 10 HH12 ARG 10 4.422 -4.917 5.566 98 HH21 ARG 10 HH21 ARG 10 5.387 -1.569 5.971 99 HH22 ARG 10 HH22 ARG 10 5.877 -3.226 6.131 100 H LYS 11 H LYS 11 1.438 1.101 0.821 101 HA LYS 11 HA LYS 11 -0.510 3.195 0.975 102 HB2 LYS 11 HB2 LYS 11 1.808 3.644 0.255 103 HB3 LYS 11 HB3 LYS 11 1.560 2.638 -1.165 104 HG2 LYS 11 HG2 LYS 11 -0.251 4.198 -1.867 105 HG3 LYS 11 HG3 LYS 11 0.201 5.244 -0.522 106 HD2 LYS 11 HD2 LYS 11 2.430 5.515 -1.450 107 HD3 LYS 11 HD3 LYS 11 2.042 4.397 -2.760 108 HE2 LYS 11 HE2 LYS 11 0.256 5.940 -3.496 109 HE3 LYS 11 HE3 LYS 11 0.742 7.067 -2.234 110 HZ1 LYS 11 HZ1 LYS 11 2.894 7.276 -3.274 111 HZ2 LYS 11 HZ2 LYS 11 1.688 7.633 -4.399 112 HZ3 LYS 11 HZ3 LYS 11 2.481 6.141 -4.456 113 H VAL 12 H VAL 12 0.098 0.449 -1.121 114 HA VAL 12 HA VAL 12 -2.113 1.029 -2.868 115 HB VAL 12 HB VAL 12 -0.398 -1.449 -2.598 116 HG11 VAL 12 HG11 VAL 12 -2.319 -0.708 -4.805 117 HG12 VAL 12 HG12 VAL 12 -2.658 -1.883 -3.539 118 HG13 VAL 12 HG13 VAL 12 -1.353 -2.182 -4.693 119 HG21 VAL 12 HG21 VAL 12 0.653 -0.636 -4.665 120 HG22 VAL 12 HG22 VAL 12 0.849 0.505 -3.335 121 HG23 VAL 12 HG23 VAL 12 -0.347 0.815 -4.594 122 H VAL 13 H VAL 13 -1.628 -0.739 0.076 123 HA VAL 13 HA VAL 13 -3.812 -2.516 -0.152 124 HB VAL 13 HB VAL 13 -1.728 -2.201 1.595 125 HG11 VAL 13 HG11 VAL 13 -2.833 -0.486 2.894 126 HG12 VAL 13 HG12 VAL 13 -2.683 -1.965 3.843 127 HG13 VAL 13 HG13 VAL 13 -4.234 -1.532 3.124 128 HG21 VAL 13 HG21 VAL 13 -2.661 -4.148 2.736 129 HG22 VAL 13 HG22 VAL 13 -2.758 -4.265 0.980 130 HG23 VAL 13 HG23 VAL 13 -4.197 -3.868 1.917 131 H LYS 14 H LYS 14 -3.417 0.757 0.565 132 HA LYS 14 HA LYS 14 -5.822 1.351 1.877 133 HB2 LYS 14 HB2 LYS 14 -3.903 2.883 0.154 134 HB3 LYS 14 HB3 LYS 14 -5.352 3.656 0.805 135 HG2 LYS 14 HG2 LYS 14 -3.103 2.409 2.379 136 HG3 LYS 14 HG3 LYS 14 -3.419 4.131 2.189 137 HD2 LYS 14 HD2 LYS 14 -5.254 2.149 3.534 138 HD3 LYS 14 HD3 LYS 14 -4.181 3.277 4.361 139 HE2 LYS 14 HE2 LYS 14 -6.419 4.061 2.506 140 HE3 LYS 14 HE3 LYS 14 -6.519 4.063 4.265 141 HZ1 LYS 14 HZ1 LYS 14 -4.729 5.738 2.589 142 HZ2 LYS 14 HZ2 LYS 14 -4.680 5.681 4.277 143 HZ3 LYS 14 HZ3 LYS 14 -6.057 6.264 3.492 144 H LEU 15 H LEU 15 -4.960 1.106 -1.577 145 HA LEU 15 HA LEU 15 -7.676 1.820 -2.304 146 HB2 LEU 15 HB2 LEU 15 -6.937 1.697 -4.595 147 HB3 LEU 15 HB3 LEU 15 -5.794 2.627 -3.652 148 HG LEU 15 HG LEU 15 -4.473 0.363 -3.541 149 HD11 LEU 15 HD11 LEU 15 -6.094 0.003 -6.058 150 HD12 LEU 15 HD12 LEU 15 -6.190 -1.003 -4.614 151 HD13 LEU 15 HD13 LEU 15 -4.707 -0.970 -5.568 152 HD21 LEU 15 HD21 LEU 15 -4.607 2.098 -6.001 153 HD22 LEU 15 HD22 LEU 15 -3.277 1.024 -5.578 154 HD23 LEU 15 HD23 LEU 15 -3.651 2.407 -4.552 155 H PHE 16 H PHE 16 -5.823 -0.953 -1.611 156 HA PHE 16 HA PHE 16 -7.386 -2.854 -3.056 157 HB2 PHE 16 HB2 PHE 16 -5.028 -3.195 -2.189 158 HB3 PHE 16 HB3 PHE 16 -5.725 -3.356 -0.585 159 HD1 PHE 16 HD1 PHE 16 -6.849 -5.347 0.093 160 HD2 PHE 16 HD2 PHE 16 -5.513 -4.887 -3.919 161 HE1 PHE 16 HE1 PHE 16 -7.261 -7.736 -0.314 162 HE2 PHE 16 HE2 PHE 16 -5.923 -7.278 -4.332 163 HZ PHE 16 HZ PHE 16 -6.800 -8.704 -2.530 164 H ASN 17 H ASN 17 -7.304 -1.757 0.315 165 HA ASN 17 HA ASN 17 -9.554 -3.437 1.031 166 HB2 ASN 17 HB2 ASN 17 -7.894 -1.436 2.560 167 HB3 ASN 17 HB3 ASN 17 -9.328 -2.180 3.254 168 HD21 ASN 17 HD21 ASN 17 -7.206 -3.881 1.074 169 HD22 ASN 17 HD22 ASN 17 -6.559 -4.975 2.246 Start of MODEL 4 1 H1 LEU 1 H1 LEU 1 17.333 -1.129 2.703 2 H2 LEU 1 H2 LEU 1 15.870 -0.708 3.434 3 H3 LEU 1 H3 LEU 1 15.965 -0.848 1.754 4 HA LEU 1 HA LEU 1 16.374 -3.189 1.915 5 HB2 LEU 1 HB2 LEU 1 16.097 -2.698 4.881 6 HB3 LEU 1 HB3 LEU 1 16.116 -4.285 4.137 7 HG LEU 1 HG LEU 1 18.396 -2.307 4.043 8 HD11 LEU 1 HD11 LEU 1 18.055 -4.818 5.671 9 HD12 LEU 1 HD12 LEU 1 18.023 -3.168 6.294 10 HD13 LEU 1 HD13 LEU 1 19.506 -3.820 5.595 11 HD21 LEU 1 HD21 LEU 1 18.186 -5.172 3.129 12 HD22 LEU 1 HD22 LEU 1 19.675 -4.231 3.191 13 HD23 LEU 1 HD23 LEU 1 18.374 -3.751 2.102 14 H MET 2 H MET 2 14.501 -2.738 0.711 15 HA MET 2 HA MET 2 12.339 -2.884 0.127 16 HB2 MET 2 HB2 MET 2 11.115 -4.728 0.917 17 HB3 MET 2 HB3 MET 2 12.801 -5.194 1.029 18 HG2 MET 2 HG2 MET 2 12.755 -4.725 3.437 19 HG3 MET 2 HG3 MET 2 11.050 -4.301 3.307 20 HE1 MET 2 HE1 MET 2 9.163 -6.029 2.569 21 HE2 MET 2 HE2 MET 2 9.464 -7.738 2.252 22 HE3 MET 2 HE3 MET 2 10.083 -6.513 1.144 23 H GLY 3 H GLY 3 13.073 -0.948 2.466 24 HA2 GLY 3 HA2 GLY 3 10.635 -0.608 3.913 25 HA3 GLY 3 HA3 GLY 3 11.945 0.560 3.796 26 H LEU 4 H LEU 4 11.954 0.649 0.947 27 HA LEU 4 HA LEU 4 10.067 2.654 0.356 28 HB2 LEU 4 HB2 LEU 4 11.121 0.835 -1.767 29 HB3 LEU 4 HB3 LEU 4 10.848 2.562 -1.832 30 HG LEU 4 HG LEU 4 12.923 1.799 0.068 31 HD11 LEU 4 HD11 LEU 4 13.125 0.043 -1.716 32 HD12 LEU 4 HD12 LEU 4 14.545 1.083 -1.521 33 HD13 LEU 4 HD13 LEU 4 13.432 1.351 -2.864 34 HD21 LEU 4 HD21 LEU 4 12.908 3.647 -2.307 35 HD22 LEU 4 HD22 LEU 4 14.062 3.641 -0.971 36 HD23 LEU 4 HD23 LEU 4 12.377 4.086 -0.682 37 H PHE 5 H PHE 5 10.275 -0.749 -0.355 38 HA PHE 5 HA PHE 5 8.019 -0.941 -2.017 39 HB2 PHE 5 HB2 PHE 5 10.097 -2.436 -1.852 40 HB3 PHE 5 HB3 PHE 5 9.280 -3.204 -0.490 41 HD1 PHE 5 HD1 PHE 5 7.903 -5.003 -0.858 42 HD2 PHE 5 HD2 PHE 5 8.694 -2.309 -4.052 43 HE1 PHE 5 HE1 PHE 5 6.674 -6.476 -2.399 44 HE2 PHE 5 HE2 PHE 5 7.465 -3.775 -5.594 45 HZ PHE 5 HZ PHE 5 6.455 -5.858 -4.772 46 H ASN 6 H ASN 6 8.554 -1.870 1.387 47 HA ASN 6 HA ASN 6 6.019 -2.898 1.926 48 HB2 ASN 6 HB2 ASN 6 7.906 -1.393 3.743 49 HB3 ASN 6 HB3 ASN 6 6.444 -2.189 4.304 50 HD21 ASN 6 HD21 ASN 6 9.195 -2.711 5.034 51 HD22 ASN 6 HD22 ASN 6 9.496 -4.366 4.644 52 H ARG 7 H ARG 7 7.176 0.417 1.926 53 HA ARG 7 HA ARG 7 4.868 1.551 3.057 54 HB2 ARG 7 HB2 ARG 7 6.733 2.908 3.220 55 HB3 ARG 7 HB3 ARG 7 7.262 2.559 1.585 56 HG2 ARG 7 HG2 ARG 7 4.777 4.149 2.003 57 HG3 ARG 7 HG3 ARG 7 6.356 4.914 2.220 58 HD2 ARG 7 HD2 ARG 7 6.986 4.051 -0.037 59 HD3 ARG 7 HD3 ARG 7 5.319 3.518 -0.235 60 HE ARG 7 HE ARG 7 4.975 6.108 0.331 61 HH11 ARG 7 HH11 ARG 7 7.173 4.535 -1.893 62 HH12 ARG 7 HH12 ARG 7 7.188 5.856 -3.014 63 HH21 ARG 7 HH21 ARG 7 4.978 7.844 -1.160 64 HH22 ARG 7 HH22 ARG 7 5.939 7.736 -2.599 65 H ILE 8 H ILE 8 5.841 0.755 -0.215 66 HA ILE 8 HA ILE 8 3.603 1.918 -1.520 67 HB ILE 8 HB ILE 8 5.457 -0.318 -2.347 68 HG12 ILE 8 HG12 ILE 8 6.465 1.916 -2.205 69 HG13 ILE 8 HG13 ILE 8 6.381 1.360 -3.873 70 HG21 ILE 8 HG21 ILE 8 4.514 -0.168 -4.586 71 HG22 ILE 8 HG22 ILE 8 3.343 1.026 -4.030 72 HG23 ILE 8 HG23 ILE 8 3.270 -0.627 -3.422 73 HD11 ILE 8 HD11 ILE 8 4.369 2.750 -4.193 74 HD12 ILE 8 HD12 ILE 8 5.797 3.687 -3.758 75 HD13 ILE 8 HD13 ILE 8 4.558 3.356 -2.549 76 H ILE 9 H ILE 9 4.239 -1.246 -0.078 77 HA ILE 9 HA ILE 9 2.020 -2.623 -1.076 78 HB ILE 9 HB ILE 9 3.138 -3.029 1.697 79 HG12 ILE 9 HG12 ILE 9 5.026 -3.008 0.197 80 HG13 ILE 9 HG13 ILE 9 4.693 -4.668 0.675 81 HG21 ILE 9 HG21 ILE 9 1.093 -4.253 1.211 82 HG22 ILE 9 HG22 ILE 9 2.463 -5.354 1.358 83 HG23 ILE 9 HG23 ILE 9 1.836 -4.934 -0.236 84 HD11 ILE 9 HD11 ILE 9 3.599 -5.065 -1.451 85 HD12 ILE 9 HD12 ILE 9 5.256 -4.495 -1.673 86 HD13 ILE 9 HD13 ILE 9 3.900 -3.393 -1.922 87 H ARG 10 H ARG 10 2.401 -0.607 1.786 88 HA ARG 10 HA ARG 10 -0.346 -0.979 2.567 89 HB2 ARG 10 HB2 ARG 10 2.036 0.327 3.704 90 HB3 ARG 10 HB3 ARG 10 0.500 1.081 4.108 91 HG2 ARG 10 HG2 ARG 10 1.442 -0.727 5.675 92 HG3 ARG 10 HG3 ARG 10 -0.267 -0.786 5.245 93 HD2 ARG 10 HD2 ARG 10 0.122 -2.512 3.643 94 HD3 ARG 10 HD3 ARG 10 1.865 -2.353 3.810 95 HE ARG 10 HE ARG 10 0.986 -2.972 6.322 96 HH11 ARG 10 HH11 ARG 10 0.672 -4.448 3.170 97 HH12 ARG 10 HH12 ARG 10 0.554 -6.062 3.785 98 HH21 ARG 10 HH21 ARG 10 0.805 -5.097 7.152 99 HH22 ARG 10 HH22 ARG 10 0.618 -6.429 6.058 100 H LYS 11 H LYS 11 1.432 1.276 0.637 101 HA LYS 11 HA LYS 11 -0.518 3.360 0.714 102 HB2 LYS 11 HB2 LYS 11 1.875 3.606 -0.096 103 HB3 LYS 11 HB3 LYS 11 1.389 2.753 -1.555 104 HG2 LYS 11 HG2 LYS 11 -0.291 4.514 -1.982 105 HG3 LYS 11 HG3 LYS 11 0.316 5.388 -0.574 106 HD2 LYS 11 HD2 LYS 11 2.566 5.415 -1.655 107 HD3 LYS 11 HD3 LYS 11 1.823 4.721 -3.098 108 HE2 LYS 11 HE2 LYS 11 1.181 7.377 -1.824 109 HE3 LYS 11 HE3 LYS 11 2.003 7.112 -3.360 110 HZ1 LYS 11 HZ1 LYS 11 -0.024 6.135 -4.234 111 HZ2 LYS 11 HZ2 LYS 11 -0.317 7.702 -3.673 112 HZ3 LYS 11 HZ3 LYS 11 -0.808 6.374 -2.757 113 H VAL 12 H VAL 12 0.050 0.522 -1.252 114 HA VAL 12 HA VAL 12 -2.227 0.995 -2.956 115 HB VAL 12 HB VAL 12 -0.435 -1.422 -2.650 116 HG11 VAL 12 HG11 VAL 12 -2.706 -1.986 -3.463 117 HG12 VAL 12 HG12 VAL 12 -1.455 -2.268 -4.677 118 HG13 VAL 12 HG13 VAL 12 -2.488 -0.841 -4.786 119 HG21 VAL 12 HG21 VAL 12 0.502 -0.686 -4.798 120 HG22 VAL 12 HG22 VAL 12 0.713 0.534 -3.541 121 HG23 VAL 12 HG23 VAL 12 -0.543 0.733 -4.763 122 H VAL 13 H VAL 13 -1.575 -0.662 0.025 123 HA VAL 13 HA VAL 13 -3.710 -2.509 -0.072 124 HB VAL 13 HB VAL 13 -1.550 -2.086 1.584 125 HG11 VAL 13 HG11 VAL 13 -2.415 -1.859 3.853 126 HG12 VAL 13 HG12 VAL 13 -4.025 -1.538 3.208 127 HG13 VAL 13 HG13 VAL 13 -2.708 -0.406 2.896 128 HG21 VAL 13 HG21 VAL 13 -2.351 -4.060 2.773 129 HG22 VAL 13 HG22 VAL 13 -2.522 -4.198 1.023 130 HG23 VAL 13 HG23 VAL 13 -3.933 -3.854 2.022 131 H LYS 14 H LYS 14 -3.374 0.787 0.596 132 HA LYS 14 HA LYS 14 -5.765 1.321 1.967 133 HB2 LYS 14 HB2 LYS 14 -3.919 2.908 0.216 134 HB3 LYS 14 HB3 LYS 14 -5.348 3.644 0.945 135 HG2 LYS 14 HG2 LYS 14 -3.045 2.367 2.411 136 HG3 LYS 14 HG3 LYS 14 -3.331 4.096 2.239 137 HD2 LYS 14 HD2 LYS 14 -5.246 2.192 3.567 138 HD3 LYS 14 HD3 LYS 14 -4.030 3.129 4.434 139 HE2 LYS 14 HE2 LYS 14 -6.191 4.309 2.699 140 HE3 LYS 14 HE3 LYS 14 -6.288 4.167 4.451 141 HZ1 LYS 14 HZ1 LYS 14 -5.571 6.368 3.823 142 HZ2 LYS 14 HZ2 LYS 14 -4.281 5.742 2.930 143 HZ3 LYS 14 HZ3 LYS 14 -4.306 5.570 4.612 144 H LEU 15 H LEU 15 -4.971 1.025 -1.486 145 HA LEU 15 HA LEU 15 -7.715 1.705 -2.183 146 HB2 LEU 15 HB2 LEU 15 -6.981 1.655 -4.477 147 HB3 LEU 15 HB3 LEU 15 -5.867 2.602 -3.516 148 HG LEU 15 HG LEU 15 -4.497 0.352 -3.452 149 HD11 LEU 15 HD11 LEU 15 -6.089 0.083 -5.999 150 HD12 LEU 15 HD12 LEU 15 -6.138 -1.010 -4.615 151 HD13 LEU 15 HD13 LEU 15 -4.664 -0.863 -5.573 152 HD21 LEU 15 HD21 LEU 15 -3.270 1.133 -5.423 153 HD22 LEU 15 HD22 LEU 15 -3.700 2.459 -4.344 154 HD23 LEU 15 HD23 LEU 15 -4.616 2.200 -5.828 155 H PHE 16 H PHE 16 -5.838 -0.985 -1.420 156 HA PHE 16 HA PHE 16 -7.386 -2.906 -2.929 157 HB2 PHE 16 HB2 PHE 16 -4.910 -3.101 -2.302 158 HB3 PHE 16 HB3 PHE 16 -5.466 -3.485 -0.680 159 HD1 PHE 16 HD1 PHE 16 -5.641 -5.696 -0.129 160 HD2 PHE 16 HD2 PHE 16 -6.142 -4.546 -4.193 161 HE1 PHE 16 HE1 PHE 16 -5.882 -8.060 -0.765 162 HE2 PHE 16 HE2 PHE 16 -6.385 -6.907 -4.836 163 HZ PHE 16 HZ PHE 16 -6.254 -8.669 -3.119 164 H ASN 17 H ASN 17 -7.003 -1.928 0.462 165 HA ASN 17 HA ASN 17 -9.404 -3.467 1.162 166 HB2 ASN 17 HB2 ASN 17 -7.276 -2.140 2.847 167 HB3 ASN 17 HB3 ASN 17 -8.783 -2.721 3.533 168 HD21 ASN 17 HD21 ASN 17 -7.066 -4.325 0.939 169 HD22 ASN 17 HD22 ASN 17 -6.590 -5.710 1.858 Start of MODEL 5 1 H1 LEU 1 H1 LEU 1 16.286 -0.444 1.798 2 H2 LEU 1 H2 LEU 1 17.806 -1.009 1.323 3 H3 LEU 1 H3 LEU 1 16.520 -2.090 1.501 4 HA LEU 1 HA LEU 1 16.703 0.075 -0.503 5 HB2 LEU 1 HB2 LEU 1 18.202 -1.847 -0.925 6 HB3 LEU 1 HB3 LEU 1 16.820 -2.922 -0.843 7 HG LEU 1 HG LEU 1 15.843 -1.628 -2.789 8 HD11 LEU 1 HD11 LEU 1 18.658 -0.563 -2.926 9 HD12 LEU 1 HD12 LEU 1 17.200 0.374 -2.601 10 HD13 LEU 1 HD13 LEU 1 17.428 -0.383 -4.177 11 HD21 LEU 1 HD21 LEU 1 16.806 -3.826 -3.077 12 HD22 LEU 1 HD22 LEU 1 18.421 -3.130 -3.185 13 HD23 LEU 1 HD23 LEU 1 17.233 -2.797 -4.443 14 H MET 2 H MET 2 14.866 -2.700 0.755 15 HA MET 2 HA MET 2 12.657 -2.168 -1.020 16 HB2 MET 2 HB2 MET 2 13.191 -4.206 1.110 17 HB3 MET 2 HB3 MET 2 11.565 -3.993 0.484 18 HG2 MET 2 HG2 MET 2 12.679 -5.805 -0.655 19 HG3 MET 2 HG3 MET 2 12.366 -4.480 -1.772 20 HE1 MET 2 HE1 MET 2 15.693 -5.959 -3.172 21 HE2 MET 2 HE2 MET 2 14.041 -5.468 -3.547 22 HE3 MET 2 HE3 MET 2 14.332 -6.839 -2.478 23 H GLY 3 H GLY 3 13.643 -0.548 1.590 24 HA2 GLY 3 HA2 GLY 3 11.459 -0.276 3.293 25 HA3 GLY 3 HA3 GLY 3 12.622 0.997 2.948 26 H LEU 4 H LEU 4 11.971 1.009 0.094 27 HA LEU 4 HA LEU 4 9.848 2.868 0.007 28 HB2 LEU 4 HB2 LEU 4 10.554 1.170 -2.349 29 HB3 LEU 4 HB3 LEU 4 10.090 2.856 -2.312 30 HG LEU 4 HG LEU 4 12.640 2.239 -0.995 31 HD11 LEU 4 HD11 LEU 4 12.419 2.132 -3.998 32 HD12 LEU 4 HD12 LEU 4 12.534 0.694 -2.981 33 HD13 LEU 4 HD13 LEU 4 13.860 1.867 -3.013 34 HD21 LEU 4 HD21 LEU 4 11.774 4.514 -1.291 35 HD22 LEU 4 HD22 LEU 4 11.787 4.284 -3.040 36 HD23 LEU 4 HD23 LEU 4 13.302 4.280 -2.137 37 H PHE 5 H PHE 5 10.152 -0.479 -0.991 38 HA PHE 5 HA PHE 5 7.542 -0.688 -2.041 39 HB2 PHE 5 HB2 PHE 5 9.731 -1.983 -2.602 40 HB3 PHE 5 HB3 PHE 5 9.226 -3.047 -1.282 41 HD1 PHE 5 HD1 PHE 5 8.399 -1.836 -4.639 42 HD2 PHE 5 HD2 PHE 5 7.343 -4.510 -1.505 43 HE1 PHE 5 HE1 PHE 5 6.902 -3.041 -6.175 44 HE2 PHE 5 HE2 PHE 5 5.844 -5.718 -3.036 45 HZ PHE 5 HZ PHE 5 5.623 -4.983 -5.374 46 H ASN 6 H ASN 6 9.031 -1.703 1.012 47 HA ASN 6 HA ASN 6 6.903 -3.098 2.145 48 HB2 ASN 6 HB2 ASN 6 8.883 -1.220 3.448 49 HB3 ASN 6 HB3 ASN 6 7.759 -2.217 4.355 50 HD21 ASN 6 HD21 ASN 6 9.539 -3.206 5.374 51 HD22 ASN 6 HD22 ASN 6 10.468 -4.425 4.573 52 H ARG 7 H ARG 7 7.496 0.358 1.901 53 HA ARG 7 HA ARG 7 5.227 1.069 3.456 54 HB2 ARG 7 HB2 ARG 7 6.913 2.656 3.556 55 HB3 ARG 7 HB3 ARG 7 7.273 2.532 1.844 56 HG2 ARG 7 HG2 ARG 7 4.654 3.674 2.674 57 HG3 ARG 7 HG3 ARG 7 6.113 4.656 2.836 58 HD2 ARG 7 HD2 ARG 7 6.626 4.257 0.476 59 HD3 ARG 7 HD3 ARG 7 5.159 3.296 0.326 60 HE ARG 7 HE ARG 7 4.252 5.690 1.235 61 HH11 ARG 7 HH11 ARG 7 6.311 4.764 -1.428 62 HH12 ARG 7 HH12 ARG 7 5.803 6.068 -2.453 63 HH21 ARG 7 HH21 ARG 7 3.577 7.424 -0.107 64 HH22 ARG 7 HH22 ARG 7 4.247 7.581 -1.699 65 H ILE 8 H ILE 8 5.946 0.594 0.079 66 HA ILE 8 HA ILE 8 3.609 1.705 -1.033 67 HB ILE 8 HB ILE 8 5.361 -0.531 -2.065 68 HG12 ILE 8 HG12 ILE 8 5.230 2.411 -2.762 69 HG13 ILE 8 HG13 ILE 8 6.494 1.636 -1.813 70 HG21 ILE 8 HG21 ILE 8 3.135 -0.662 -3.067 71 HG22 ILE 8 HG22 ILE 8 4.335 -0.140 -4.250 72 HG23 ILE 8 HG23 ILE 8 3.237 1.037 -3.529 73 HD11 ILE 8 HD11 ILE 8 7.241 2.018 -4.073 74 HD12 ILE 8 HD12 ILE 8 5.868 1.114 -4.708 75 HD13 ILE 8 HD13 ILE 8 7.107 0.287 -3.766 76 H ILE 9 H ILE 9 4.292 -1.458 0.372 77 HA ILE 9 HA ILE 9 2.112 -2.913 -0.523 78 HB ILE 9 HB ILE 9 3.188 -3.039 2.297 79 HG12 ILE 9 HG12 ILE 9 5.064 -3.187 0.765 80 HG13 ILE 9 HG13 ILE 9 4.747 -4.766 1.476 81 HG21 ILE 9 HG21 ILE 9 2.500 -5.386 2.207 82 HG22 ILE 9 HG22 ILE 9 1.855 -5.128 0.586 83 HG23 ILE 9 HG23 ILE 9 1.138 -4.293 1.964 84 HD11 ILE 9 HD11 ILE 9 3.871 -3.886 -1.256 85 HD12 ILE 9 HD12 ILE 9 3.655 -5.487 -0.547 86 HD13 ILE 9 HD13 ILE 9 5.277 -4.885 -0.899 87 H ARG 10 H ARG 10 2.368 -0.869 2.343 88 HA ARG 10 HA ARG 10 -0.345 -1.204 3.073 89 HB2 ARG 10 HB2 ARG 10 1.407 1.053 3.998 90 HB3 ARG 10 HB3 ARG 10 0.113 0.246 4.872 91 HG2 ARG 10 HG2 ARG 10 2.862 -0.770 4.272 92 HG3 ARG 10 HG3 ARG 10 2.117 -0.506 5.847 93 HD2 ARG 10 HD2 ARG 10 0.465 -2.295 5.215 94 HD3 ARG 10 HD3 ARG 10 1.470 -2.623 3.813 95 HE ARG 10 HE ARG 10 3.178 -2.758 5.952 96 HH11 ARG 10 HH11 ARG 10 0.203 -4.370 5.063 97 HH12 ARG 10 HH12 ARG 10 0.653 -5.877 5.791 98 HH21 ARG 10 HH21 ARG 10 3.760 -4.735 6.935 99 HH22 ARG 10 HH22 ARG 10 2.668 -6.079 6.870 100 H LYS 11 H LYS 11 1.394 1.028 1.067 101 HA LYS 11 HA LYS 11 -0.595 3.067 0.993 102 HB2 LYS 11 HB2 LYS 11 1.730 3.502 0.310 103 HB3 LYS 11 HB3 LYS 11 1.547 2.384 -1.035 104 HG2 LYS 11 HG2 LYS 11 -0.235 3.840 -1.944 105 HG3 LYS 11 HG3 LYS 11 0.095 4.990 -0.649 106 HD2 LYS 11 HD2 LYS 11 2.378 5.260 -1.454 107 HD3 LYS 11 HD3 LYS 11 2.083 4.072 -2.725 108 HE2 LYS 11 HE2 LYS 11 0.728 6.749 -2.402 109 HE3 LYS 11 HE3 LYS 11 1.911 6.310 -3.633 110 HZ1 LYS 11 HZ1 LYS 11 0.345 4.701 -4.518 111 HZ2 LYS 11 HZ2 LYS 11 -0.343 6.245 -4.501 112 HZ3 LYS 11 HZ3 LYS 11 -0.792 5.110 -3.332 113 H VAL 12 H VAL 12 0.127 0.220 -0.929 114 HA VAL 12 HA VAL 12 -1.990 0.634 -2.801 115 HB VAL 12 HB VAL 12 -0.390 -1.844 -2.145 116 HG11 VAL 12 HG11 VAL 12 -1.304 -2.831 -4.135 117 HG12 VAL 12 HG12 VAL 12 -2.148 -1.337 -4.545 118 HG13 VAL 12 HG13 VAL 12 -2.653 -2.273 -3.139 119 HG21 VAL 12 HG21 VAL 12 -0.182 0.122 -4.430 120 HG22 VAL 12 HG22 VAL 12 0.788 -1.337 -4.235 121 HG23 VAL 12 HG23 VAL 12 0.939 -0.015 -3.076 122 H VAL 13 H VAL 13 -1.741 -0.817 0.344 123 HA VAL 13 HA VAL 13 -3.967 -2.553 0.131 124 HB VAL 13 HB VAL 13 -1.976 -2.091 1.997 125 HG11 VAL 13 HG11 VAL 13 -3.126 -1.738 4.132 126 HG12 VAL 13 HG12 VAL 13 -4.614 -1.375 3.257 127 HG13 VAL 13 HG13 VAL 13 -3.208 -0.323 3.081 128 HG21 VAL 13 HG21 VAL 13 -2.988 -3.978 3.180 129 HG22 VAL 13 HG22 VAL 13 -2.917 -4.211 1.434 130 HG23 VAL 13 HG23 VAL 13 -4.444 -3.782 2.205 131 H LYS 14 H LYS 14 -3.454 0.759 0.705 132 HA LYS 14 HA LYS 14 -5.939 1.509 1.767 133 HB2 LYS 14 HB2 LYS 14 -3.822 2.915 0.169 134 HB3 LYS 14 HB3 LYS 14 -5.267 3.758 0.735 135 HG2 LYS 14 HG2 LYS 14 -3.104 2.469 2.389 136 HG3 LYS 14 HG3 LYS 14 -3.488 4.185 2.270 137 HD2 LYS 14 HD2 LYS 14 -5.260 2.049 3.462 138 HD3 LYS 14 HD3 LYS 14 -4.313 3.232 4.362 139 HE2 LYS 14 HE2 LYS 14 -5.610 5.040 3.436 140 HE3 LYS 14 HE3 LYS 14 -6.492 3.923 2.400 141 HZ1 LYS 14 HZ1 LYS 14 -7.467 2.904 4.323 142 HZ2 LYS 14 HZ2 LYS 14 -7.731 4.572 4.400 143 HZ3 LYS 14 HZ3 LYS 14 -6.541 3.863 5.365 144 H LEU 15 H LEU 15 -4.800 1.023 -1.570 145 HA LEU 15 HA LEU 15 -7.403 1.843 -2.579 146 HB2 LEU 15 HB2 LEU 15 -6.427 1.632 -4.778 147 HB3 LEU 15 HB3 LEU 15 -5.380 2.570 -3.735 148 HG LEU 15 HG LEU 15 -4.178 0.234 -3.413 149 HD11 LEU 15 HD11 LEU 15 -5.424 -0.003 -6.146 150 HD12 LEU 15 HD12 LEU 15 -5.733 -1.050 -4.761 151 HD13 LEU 15 HD13 LEU 15 -4.136 -1.027 -5.510 152 HD21 LEU 15 HD21 LEU 15 -2.635 0.887 -5.195 153 HD22 LEU 15 HD22 LEU 15 -3.135 2.273 -4.227 154 HD23 LEU 15 HD23 LEU 15 -3.838 2.013 -5.822 155 H PHE 16 H PHE 16 -5.706 -0.972 -1.674 156 HA PHE 16 HA PHE 16 -7.191 -2.868 -3.215 157 HB2 PHE 16 HB2 PHE 16 -4.910 -3.179 -2.097 158 HB3 PHE 16 HB3 PHE 16 -5.792 -3.373 -0.591 159 HD1 PHE 16 HD1 PHE 16 -5.446 -4.775 -4.004 160 HD2 PHE 16 HD2 PHE 16 -6.666 -5.442 0.018 161 HE1 PHE 16 HE1 PHE 16 -5.740 -7.168 -4.494 162 HE2 PHE 16 HE2 PHE 16 -6.963 -7.836 -0.466 163 HZ PHE 16 HZ PHE 16 -6.500 -8.700 -2.724 164 H ASN 17 H ASN 17 -7.419 -1.474 -0.006 165 HA ASN 17 HA ASN 17 -9.789 -2.965 0.690 166 HB2 ASN 17 HB2 ASN 17 -8.307 -0.691 2.004 167 HB3 ASN 17 HB3 ASN 17 -9.853 -1.259 2.616 168 HD21 ASN 17 HD21 ASN 17 -7.503 -3.408 1.186 169 HD22 ASN 17 HD22 ASN 17 -7.068 -4.217 2.649 Start of MODEL 6 1 H1 LEU 1 H1 LEU 1 16.047 -3.983 -0.606 2 H2 LEU 1 H2 LEU 1 17.082 -3.220 -1.693 3 H3 LEU 1 H3 LEU 1 15.685 -3.981 -2.255 4 HA LEU 1 HA LEU 1 15.793 -1.597 -0.517 5 HB2 LEU 1 HB2 LEU 1 15.178 -1.998 -3.436 6 HB3 LEU 1 HB3 LEU 1 14.569 -0.610 -2.561 7 HG LEU 1 HG LEU 1 16.973 -0.045 -2.001 8 HD11 LEU 1 HD11 LEU 1 17.494 -2.170 -4.070 9 HD12 LEU 1 HD12 LEU 1 18.061 -2.139 -2.401 10 HD13 LEU 1 HD13 LEU 1 18.674 -0.963 -3.560 11 HD21 LEU 1 HD21 LEU 1 17.406 0.930 -4.216 12 HD22 LEU 1 HD22 LEU 1 15.743 1.172 -3.682 13 HD23 LEU 1 HD23 LEU 1 16.111 -0.062 -4.885 14 H MET 2 H MET 2 14.500 -3.283 0.805 15 HA MET 2 HA MET 2 11.797 -3.721 -0.171 16 HB2 MET 2 HB2 MET 2 11.481 -5.067 1.832 17 HB3 MET 2 HB3 MET 2 12.964 -5.535 1.014 18 HG2 MET 2 HG2 MET 2 14.296 -4.389 2.628 19 HG3 MET 2 HG3 MET 2 12.872 -3.667 3.366 20 HE1 MET 2 HE1 MET 2 14.876 -6.988 2.749 21 HE2 MET 2 HE2 MET 2 13.282 -7.382 2.104 22 HE3 MET 2 HE3 MET 2 13.860 -8.174 3.569 23 H GLY 3 H GLY 3 13.489 -1.543 1.900 24 HA2 GLY 3 HA2 GLY 3 11.511 -0.870 3.760 25 HA3 GLY 3 HA3 GLY 3 12.809 0.194 3.239 26 H LEU 4 H LEU 4 12.146 0.484 0.557 27 HA LEU 4 HA LEU 4 10.146 2.497 0.636 28 HB2 LEU 4 HB2 LEU 4 10.859 1.097 -1.897 29 HB3 LEU 4 HB3 LEU 4 10.533 2.795 -1.629 30 HG LEU 4 HG LEU 4 12.933 1.821 -0.281 31 HD11 LEU 4 HD11 LEU 4 12.917 1.998 -3.284 32 HD12 LEU 4 HD12 LEU 4 12.822 0.470 -2.404 33 HD13 LEU 4 HD13 LEU 4 14.249 1.507 -2.234 34 HD21 LEU 4 HD21 LEU 4 13.827 3.894 -1.145 35 HD22 LEU 4 HD22 LEU 4 12.237 4.178 -0.431 36 HD23 LEU 4 HD23 LEU 4 12.418 4.098 -2.186 37 H PHE 5 H PHE 5 10.314 -0.733 -0.687 38 HA PHE 5 HA PHE 5 7.885 -0.700 -2.058 39 HB2 PHE 5 HB2 PHE 5 9.959 -2.195 -2.336 40 HB3 PHE 5 HB3 PHE 5 9.242 -3.190 -1.066 41 HD1 PHE 5 HD1 PHE 5 8.429 -1.695 -4.371 42 HD2 PHE 5 HD2 PHE 5 7.757 -4.871 -1.623 43 HE1 PHE 5 HE1 PHE 5 7.064 -2.853 -6.055 44 HE2 PHE 5 HE2 PHE 5 6.387 -6.036 -3.304 45 HZ PHE 5 HZ PHE 5 6.039 -5.027 -5.522 46 H ASN 6 H ASN 6 8.726 -1.947 1.167 47 HA ASN 6 HA ASN 6 6.273 -3.148 1.786 48 HB2 ASN 6 HB2 ASN 6 8.237 -1.741 3.600 49 HB3 ASN 6 HB3 ASN 6 6.860 -2.663 4.183 50 HD21 ASN 6 HD21 ASN 6 9.685 -3.118 4.651 51 HD22 ASN 6 HD22 ASN 6 10.024 -4.708 4.063 52 H ARG 7 H ARG 7 7.336 0.195 2.038 53 HA ARG 7 HA ARG 7 5.039 1.109 3.393 54 HB2 ARG 7 HB2 ARG 7 6.850 2.523 3.655 55 HB3 ARG 7 HB3 ARG 7 7.344 2.373 1.979 56 HG2 ARG 7 HG2 ARG 7 4.802 3.791 2.615 57 HG3 ARG 7 HG3 ARG 7 6.346 4.606 2.883 58 HD2 ARG 7 HD2 ARG 7 6.976 4.176 0.567 59 HD3 ARG 7 HD3 ARG 7 5.448 3.342 0.302 60 HE ARG 7 HE ARG 7 4.565 5.724 1.071 61 HH11 ARG 7 HH11 ARG 7 7.170 4.946 -1.125 62 HH12 ARG 7 HH12 ARG 7 6.928 6.343 -2.124 63 HH21 ARG 7 HH21 ARG 7 4.245 7.571 -0.229 64 HH22 ARG 7 HH22 ARG 7 5.254 7.838 -1.614 65 H ILE 8 H ILE 8 5.947 0.743 0.037 66 HA ILE 8 HA ILE 8 3.713 2.050 -1.110 67 HB ILE 8 HB ILE 8 5.394 -0.189 -2.257 68 HG12 ILE 8 HG12 ILE 8 5.591 2.812 -2.626 69 HG13 ILE 8 HG13 ILE 8 6.680 1.833 -1.647 70 HG21 ILE 8 HG21 ILE 8 3.560 1.755 -3.659 71 HG22 ILE 8 HG22 ILE 8 3.229 0.043 -3.390 72 HG23 ILE 8 HG23 ILE 8 4.569 0.532 -4.433 73 HD11 ILE 8 HD11 ILE 8 7.390 0.631 -3.653 74 HD12 ILE 8 HD12 ILE 8 7.678 2.365 -3.783 75 HD13 ILE 8 HD13 ILE 8 6.313 1.634 -4.626 76 H ILE 9 H ILE 9 4.283 -1.238 0.021 77 HA ILE 9 HA ILE 9 2.042 -2.508 -1.040 78 HB ILE 9 HB ILE 9 3.166 -3.042 1.708 79 HG12 ILE 9 HG12 ILE 9 5.013 -3.068 0.165 80 HG13 ILE 9 HG13 ILE 9 4.612 -4.728 0.592 81 HG21 ILE 9 HG21 ILE 9 1.726 -4.842 -0.228 82 HG22 ILE 9 HG22 ILE 9 1.058 -4.159 1.255 83 HG23 ILE 9 HG23 ILE 9 2.381 -5.321 1.339 84 HD11 ILE 9 HD11 ILE 9 3.445 -4.993 -1.516 85 HD12 ILE 9 HD12 ILE 9 5.121 -4.495 -1.764 86 HD13 ILE 9 HD13 ILE 9 3.813 -3.320 -1.936 87 H ARG 10 H ARG 10 2.386 -0.636 1.941 88 HA ARG 10 HA ARG 10 -0.389 -1.045 2.619 89 HB2 ARG 10 HB2 ARG 10 1.962 0.159 3.942 90 HB3 ARG 10 HB3 ARG 10 0.397 0.825 4.387 91 HG2 ARG 10 HG2 ARG 10 1.376 -1.127 5.767 92 HG3 ARG 10 HG3 ARG 10 -0.330 -1.159 5.328 93 HD2 ARG 10 HD2 ARG 10 0.082 -2.707 3.556 94 HD3 ARG 10 HD3 ARG 10 1.821 -2.541 3.742 95 HE ARG 10 HE ARG 10 1.231 -3.487 6.119 96 HH11 ARG 10 HH11 ARG 10 -0.095 -4.461 3.027 97 HH12 ARG 10 HH12 ARG 10 -0.373 -6.100 3.518 98 HH21 ARG 10 HH21 ARG 10 0.870 -5.655 6.761 99 HH22 ARG 10 HH22 ARG 10 0.164 -6.773 5.636 100 H LYS 11 H LYS 11 1.472 1.263 0.916 101 HA LYS 11 HA LYS 11 -0.394 3.413 1.014 102 HB2 LYS 11 HB2 LYS 11 1.969 3.715 0.364 103 HB3 LYS 11 HB3 LYS 11 1.700 2.723 -1.060 104 HG2 LYS 11 HG2 LYS 11 0.141 4.386 -1.931 105 HG3 LYS 11 HG3 LYS 11 0.403 5.383 -0.499 106 HD2 LYS 11 HD2 LYS 11 2.785 5.553 -1.071 107 HD3 LYS 11 HD3 LYS 11 2.502 4.579 -2.514 108 HE2 LYS 11 HE2 LYS 11 1.230 7.247 -1.926 109 HE3 LYS 11 HE3 LYS 11 2.595 6.986 -3.005 110 HZ1 LYS 11 HZ1 LYS 11 -0.121 5.843 -3.355 111 HZ2 LYS 11 HZ2 LYS 11 1.186 5.598 -4.392 112 HZ3 LYS 11 HZ3 LYS 11 0.521 7.142 -4.226 113 H VAL 12 H VAL 12 0.125 0.641 -1.063 114 HA VAL 12 HA VAL 12 -2.096 1.292 -2.800 115 HB VAL 12 HB VAL 12 -0.323 -1.154 -2.637 116 HG11 VAL 12 HG11 VAL 12 -2.511 -1.711 -3.586 117 HG12 VAL 12 HG12 VAL 12 -1.254 -1.762 -4.824 118 HG13 VAL 12 HG13 VAL 12 -2.356 -0.386 -4.739 119 HG21 VAL 12 HG21 VAL 12 0.705 -0.252 -4.669 120 HG22 VAL 12 HG22 VAL 12 0.853 0.872 -3.318 121 HG23 VAL 12 HG23 VAL 12 -0.347 1.160 -4.577 122 H VAL 13 H VAL 13 -1.602 -0.422 0.132 123 HA VAL 13 HA VAL 13 -3.648 -2.357 -0.137 124 HB VAL 13 HB VAL 13 -1.618 -1.927 1.655 125 HG11 VAL 13 HG11 VAL 13 -2.867 -0.271 2.915 126 HG12 VAL 13 HG12 VAL 13 -2.615 -1.728 3.874 127 HG13 VAL 13 HG13 VAL 13 -4.188 -1.417 3.141 128 HG21 VAL 13 HG21 VAL 13 -2.526 -4.042 1.018 129 HG22 VAL 13 HG22 VAL 13 -4.000 -3.725 1.934 130 HG23 VAL 13 HG23 VAL 13 -2.462 -3.920 2.775 131 H LYS 14 H LYS 14 -3.484 0.938 0.591 132 HA LYS 14 HA LYS 14 -5.870 1.539 1.785 133 HB2 LYS 14 HB2 LYS 14 -4.272 2.907 -0.362 134 HB3 LYS 14 HB3 LYS 14 -5.620 3.677 0.485 135 HG2 LYS 14 HG2 LYS 14 -3.109 2.668 1.747 136 HG3 LYS 14 HG3 LYS 14 -3.471 4.359 1.408 137 HD2 LYS 14 HD2 LYS 14 -4.435 4.420 3.406 138 HD3 LYS 14 HD3 LYS 14 -5.635 3.339 2.716 139 HE2 LYS 14 HE2 LYS 14 -4.914 2.276 4.645 140 HE3 LYS 14 HE3 LYS 14 -4.155 1.437 3.300 141 HZ1 LYS 14 HZ1 LYS 14 -2.621 1.858 5.154 142 HZ2 LYS 14 HZ2 LYS 14 -2.822 3.521 4.938 143 HZ3 LYS 14 HZ3 LYS 14 -2.113 2.591 3.717 144 H LEU 15 H LEU 15 -5.198 1.072 -1.703 145 HA LEU 15 HA LEU 15 -8.017 1.343 -2.306 146 HB2 LEU 15 HB2 LEU 15 -7.326 1.065 -4.633 147 HB3 LEU 15 HB3 LEU 15 -6.387 2.297 -3.816 148 HG LEU 15 HG LEU 15 -4.639 0.382 -3.495 149 HD11 LEU 15 HD11 LEU 15 -4.612 -1.205 -5.360 150 HD12 LEU 15 HD12 LEU 15 -6.192 -0.617 -5.880 151 HD13 LEU 15 HD13 LEU 15 -6.024 -1.435 -4.327 152 HD21 LEU 15 HD21 LEU 15 -3.617 1.001 -5.642 153 HD22 LEU 15 HD22 LEU 15 -4.246 2.397 -4.772 154 HD23 LEU 15 HD23 LEU 15 -5.138 1.736 -6.139 155 H PHE 16 H PHE 16 -5.848 -1.093 -1.449 156 HA PHE 16 HA PHE 16 -7.143 -3.305 -2.719 157 HB2 PHE 16 HB2 PHE 16 -4.726 -3.126 -1.800 158 HB3 PHE 16 HB3 PHE 16 -5.446 -3.481 -0.238 159 HD1 PHE 16 HD1 PHE 16 -6.266 -5.673 0.285 160 HD2 PHE 16 HD2 PHE 16 -4.692 -4.798 -3.572 161 HE1 PHE 16 HE1 PHE 16 -6.140 -8.079 -0.207 162 HE2 PHE 16 HE2 PHE 16 -4.566 -7.203 -4.070 163 HZ PHE 16 HZ PHE 16 -5.290 -8.847 -2.387 164 H ASN 17 H ASN 17 -7.302 -1.721 0.421 165 HA ASN 17 HA ASN 17 -9.342 -3.603 1.324 166 HB2 ASN 17 HB2 ASN 17 -7.759 -1.459 2.690 167 HB3 ASN 17 HB3 ASN 17 -9.225 -2.099 3.432 168 HD21 ASN 17 HD21 ASN 17 -6.008 -2.834 2.358 169 HD22 ASN 17 HD22 ASN 17 -5.849 -4.319 3.224 Start of MODEL 7 1 H1 LEU 1 H1 LEU 1 18.377 -2.105 -0.405 2 H2 LEU 1 H2 LEU 1 17.319 -2.560 -1.640 3 H3 LEU 1 H3 LEU 1 17.160 -3.239 -0.101 4 HA LEU 1 HA LEU 1 16.547 -1.136 0.829 5 HB2 LEU 1 HB2 LEU 1 16.864 -0.173 -2.014 6 HB3 LEU 1 HB3 LEU 1 16.090 0.752 -0.745 7 HG LEU 1 HG LEU 1 18.977 -0.125 -0.714 8 HD11 LEU 1 HD11 LEU 1 17.752 2.565 -1.285 9 HD12 LEU 1 HD12 LEU 1 18.554 1.519 -2.457 10 HD13 LEU 1 HD13 LEU 1 19.473 2.228 -1.130 11 HD21 LEU 1 HD21 LEU 1 18.073 0.119 1.519 12 HD22 LEU 1 HD22 LEU 1 17.414 1.701 1.105 13 HD23 LEU 1 HD23 LEU 1 19.159 1.459 1.158 14 H MET 2 H MET 2 14.832 -2.657 1.140 15 HA MET 2 HA MET 2 12.764 -2.577 -0.954 16 HB2 MET 2 HB2 MET 2 11.756 -4.518 0.129 17 HB3 MET 2 HB3 MET 2 13.435 -4.834 -0.282 18 HG2 MET 2 HG2 MET 2 14.123 -4.701 1.955 19 HG3 MET 2 HG3 MET 2 12.618 -3.934 2.458 20 HE1 MET 2 HE1 MET 2 14.177 -7.234 0.988 21 HE2 MET 2 HE2 MET 2 12.776 -6.948 -0.041 22 HE3 MET 2 HE3 MET 2 12.794 -8.326 1.057 23 H GLY 3 H GLY 3 13.597 -1.046 1.834 24 HA2 GLY 3 HA2 GLY 3 11.300 -0.989 3.414 25 HA3 GLY 3 HA3 GLY 3 12.485 0.305 3.316 26 H LEU 4 H LEU 4 12.105 0.852 0.547 27 HA LEU 4 HA LEU 4 10.043 2.739 0.504 28 HB2 LEU 4 HB2 LEU 4 10.823 1.261 -1.978 29 HB3 LEU 4 HB3 LEU 4 10.430 2.956 -1.787 30 HG LEU 4 HG LEU 4 12.856 2.139 -0.369 31 HD11 LEU 4 HD11 LEU 4 12.808 0.691 -2.446 32 HD12 LEU 4 HD12 LEU 4 14.203 1.771 -2.283 33 HD13 LEU 4 HD13 LEU 4 12.883 2.193 -3.378 34 HD21 LEU 4 HD21 LEU 4 13.669 4.204 -1.339 35 HD22 LEU 4 HD22 LEU 4 12.069 4.453 -0.636 36 HD23 LEU 4 HD23 LEU 4 12.250 4.297 -2.383 37 H PHE 5 H PHE 5 10.229 -0.526 -0.768 38 HA PHE 5 HA PHE 5 7.702 -0.446 -2.032 39 HB2 PHE 5 HB2 PHE 5 9.807 -1.817 -2.630 40 HB3 PHE 5 HB3 PHE 5 9.223 -2.958 -1.411 41 HD1 PHE 5 HD1 PHE 5 7.603 -4.543 -1.935 42 HD2 PHE 5 HD2 PHE 5 8.204 -1.225 -4.528 43 HE1 PHE 5 HE1 PHE 5 6.080 -5.556 -3.579 44 HE2 PHE 5 HE2 PHE 5 6.683 -2.233 -6.176 45 HZ PHE 5 HZ PHE 5 5.618 -4.400 -5.703 46 H ASN 6 H ASN 6 8.872 -1.771 1.043 47 HA ASN 6 HA ASN 6 6.529 -3.126 1.797 48 HB2 ASN 6 HB2 ASN 6 8.542 -1.658 3.496 49 HB3 ASN 6 HB3 ASN 6 7.218 -2.600 4.165 50 HD21 ASN 6 HD21 ASN 6 7.170 -4.862 3.797 51 HD22 ASN 6 HD22 ASN 6 8.629 -5.730 3.465 52 H ARG 7 H ARG 7 7.425 0.254 1.931 53 HA ARG 7 HA ARG 7 5.175 1.056 3.434 54 HB2 ARG 7 HB2 ARG 7 6.942 2.552 3.585 55 HB3 ARG 7 HB3 ARG 7 7.321 2.436 1.876 56 HG2 ARG 7 HG2 ARG 7 4.762 3.719 2.702 57 HG3 ARG 7 HG3 ARG 7 6.280 4.609 2.871 58 HD2 ARG 7 HD2 ARG 7 6.764 4.274 0.519 59 HD3 ARG 7 HD3 ARG 7 5.306 3.297 0.341 60 HE ARG 7 HE ARG 7 4.484 5.754 1.321 61 HH11 ARG 7 HH11 ARG 7 6.145 4.600 -1.534 62 HH12 ARG 7 HH12 ARG 7 5.480 5.827 -2.565 63 HH21 ARG 7 HH21 ARG 7 3.622 7.372 -0.038 64 HH22 ARG 7 HH22 ARG 7 4.057 7.407 -1.718 65 H ILE 8 H ILE 8 5.917 0.683 0.042 66 HA ILE 8 HA ILE 8 3.579 1.864 -1.019 67 HB ILE 8 HB ILE 8 5.323 -0.314 -2.184 68 HG12 ILE 8 HG12 ILE 8 5.304 2.678 -2.646 69 HG13 ILE 8 HG13 ILE 8 6.509 1.798 -1.712 70 HG21 ILE 8 HG21 ILE 8 4.354 0.269 -4.341 71 HG22 ILE 8 HG22 ILE 8 3.302 1.453 -3.564 72 HG23 ILE 8 HG23 ILE 8 3.097 -0.266 -3.221 73 HD11 ILE 8 HD11 ILE 8 7.334 2.343 -3.925 74 HD12 ILE 8 HD12 ILE 8 5.978 1.484 -4.657 75 HD13 ILE 8 HD13 ILE 8 7.186 0.597 -3.728 76 H ILE 9 H ILE 9 4.248 -1.279 0.362 77 HA ILE 9 HA ILE 9 2.088 -2.723 -0.685 78 HB ILE 9 HB ILE 9 3.260 -3.052 2.077 79 HG12 ILE 9 HG12 ILE 9 5.053 -3.096 0.444 80 HG13 ILE 9 HG13 ILE 9 4.764 -4.719 1.058 81 HG21 ILE 9 HG21 ILE 9 1.851 -5.021 0.290 82 HG22 ILE 9 HG22 ILE 9 1.178 -4.263 1.733 83 HG23 ILE 9 HG23 ILE 9 2.544 -5.371 1.874 84 HD11 ILE 9 HD11 ILE 9 5.181 -4.669 -1.349 85 HD12 ILE 9 HD12 ILE 9 3.754 -3.651 -1.560 86 HD13 ILE 9 HD13 ILE 9 3.580 -5.299 -0.957 87 H ARG 10 H ARG 10 2.336 -0.601 2.117 88 HA ARG 10 HA ARG 10 -0.431 -0.998 2.841 89 HB2 ARG 10 HB2 ARG 10 1.891 0.406 3.967 90 HB3 ARG 10 HB3 ARG 10 0.350 1.197 4.249 91 HG2 ARG 10 HG2 ARG 10 1.175 -0.400 6.026 92 HG3 ARG 10 HG3 ARG 10 -0.482 -0.620 5.465 93 HD2 ARG 10 HD2 ARG 10 -0.000 -2.559 4.369 94 HD3 ARG 10 HD3 ARG 10 1.686 -2.139 4.110 95 HE ARG 10 HE ARG 10 1.675 -2.438 6.739 96 HH11 ARG 10 HH11 ARG 10 0.150 -4.457 4.312 97 HH12 ARG 10 HH12 ARG 10 0.313 -5.905 5.248 98 HH21 ARG 10 HH21 ARG 10 1.890 -4.356 7.956 99 HH22 ARG 10 HH22 ARG 10 1.298 -5.852 7.303 100 H LYS 11 H LYS 11 1.430 1.200 0.926 101 HA LYS 11 HA LYS 11 -0.493 3.273 0.729 102 HB2 LYS 11 HB2 LYS 11 1.854 3.564 0.036 103 HB3 LYS 11 HB3 LYS 11 1.616 2.393 -1.255 104 HG2 LYS 11 HG2 LYS 11 -0.090 3.901 -2.236 105 HG3 LYS 11 HG3 LYS 11 0.317 5.095 -1.003 106 HD2 LYS 11 HD2 LYS 11 2.589 5.214 -1.817 107 HD3 LYS 11 HD3 LYS 11 2.269 3.928 -2.982 108 HE2 LYS 11 HE2 LYS 11 1.028 6.675 -2.934 109 HE3 LYS 11 HE3 LYS 11 2.207 6.071 -4.094 110 HZ1 LYS 11 HZ1 LYS 11 -0.568 5.076 -3.739 111 HZ2 LYS 11 HZ2 LYS 11 0.569 4.418 -4.803 112 HZ3 LYS 11 HZ3 LYS 11 0.012 5.995 -5.035 113 H VAL 12 H VAL 12 0.120 0.314 -1.067 114 HA VAL 12 HA VAL 12 -2.075 0.725 -2.881 115 HB VAL 12 HB VAL 12 -0.348 -1.698 -2.358 116 HG11 VAL 12 HG11 VAL 12 -2.599 -2.259 -3.259 117 HG12 VAL 12 HG12 VAL 12 -1.282 -2.658 -4.368 118 HG13 VAL 12 HG13 VAL 12 -2.264 -1.218 -4.644 119 HG21 VAL 12 HG21 VAL 12 -0.314 0.350 -4.576 120 HG22 VAL 12 HG22 VAL 12 0.697 -1.094 -4.500 121 HG23 VAL 12 HG23 VAL 12 0.882 0.177 -3.290 122 H VAL 13 H VAL 13 -1.654 -0.709 0.244 123 HA VAL 13 HA VAL 13 -3.810 -2.540 0.135 124 HB VAL 13 HB VAL 13 -1.768 -2.027 1.901 125 HG11 VAL 13 HG11 VAL 13 -2.938 -0.209 2.989 126 HG12 VAL 13 HG12 VAL 13 -2.797 -1.587 4.081 127 HG13 VAL 13 HG13 VAL 13 -4.332 -1.250 3.279 128 HG21 VAL 13 HG21 VAL 13 -2.761 -4.152 1.467 129 HG22 VAL 13 HG22 VAL 13 -4.238 -3.679 2.304 130 HG23 VAL 13 HG23 VAL 13 -2.731 -3.857 3.203 131 H LYS 14 H LYS 14 -3.430 0.790 0.595 132 HA LYS 14 HA LYS 14 -5.917 1.432 1.758 133 HB2 LYS 14 HB2 LYS 14 -3.855 2.946 0.186 134 HB3 LYS 14 HB3 LYS 14 -5.321 3.730 0.782 135 HG2 LYS 14 HG2 LYS 14 -3.195 2.390 2.444 136 HG3 LYS 14 HG3 LYS 14 -3.444 4.124 2.272 137 HD2 LYS 14 HD2 LYS 14 -5.503 2.233 3.393 138 HD3 LYS 14 HD3 LYS 14 -4.352 3.125 4.384 139 HE2 LYS 14 HE2 LYS 14 -6.322 4.385 2.489 140 HE3 LYS 14 HE3 LYS 14 -6.575 4.211 4.224 141 HZ1 LYS 14 HZ1 LYS 14 -4.406 5.767 2.920 142 HZ2 LYS 14 HZ2 LYS 14 -4.589 5.568 4.589 143 HZ3 LYS 14 HZ3 LYS 14 -5.761 6.405 3.704 144 H LEU 15 H LEU 15 -4.828 0.958 -1.586 145 HA LEU 15 HA LEU 15 -7.460 1.749 -2.535 146 HB2 LEU 15 HB2 LEU 15 -6.569 1.504 -4.757 147 HB3 LEU 15 HB3 LEU 15 -5.464 2.439 -3.776 148 HG LEU 15 HG LEU 15 -4.225 0.154 -3.475 149 HD11 LEU 15 HD11 LEU 15 -4.366 -1.263 -5.465 150 HD12 LEU 15 HD12 LEU 15 -5.712 -0.292 -6.060 151 HD13 LEU 15 HD13 LEU 15 -5.890 -1.232 -4.579 152 HD21 LEU 15 HD21 LEU 15 -3.282 2.123 -4.532 153 HD22 LEU 15 HD22 LEU 15 -4.146 1.756 -6.025 154 HD23 LEU 15 HD23 LEU 15 -2.876 0.675 -5.454 155 H PHE 16 H PHE 16 -5.804 -1.017 -1.493 156 HA PHE 16 HA PHE 16 -7.339 -2.937 -2.982 157 HB2 PHE 16 HB2 PHE 16 -5.014 -3.291 -1.989 158 HB3 PHE 16 HB3 PHE 16 -5.807 -3.423 -0.426 159 HD1 PHE 16 HD1 PHE 16 -6.591 -5.475 0.309 160 HD2 PHE 16 HD2 PHE 16 -5.833 -4.899 -3.839 161 HE1 PHE 16 HE1 PHE 16 -7.010 -7.865 -0.096 162 HE2 PHE 16 HE2 PHE 16 -6.254 -7.287 -4.249 163 HZ PHE 16 HZ PHE 16 -6.844 -8.773 -2.377 164 H ASN 17 H ASN 17 -7.336 -1.700 0.344 165 HA ASN 17 HA ASN 17 -9.923 -2.981 0.839 166 HB2 ASN 17 HB2 ASN 17 -7.918 -1.632 2.640 167 HB3 ASN 17 HB3 ASN 17 -9.550 -1.984 3.189 168 HD21 ASN 17 HD21 ASN 17 -7.877 -4.074 0.970 169 HD22 ASN 17 HD22 ASN 17 -7.622 -5.374 2.078 Start of MODEL 8 1 H1 LEU 1 H1 LEU 1 16.267 -1.317 -2.082 2 H2 LEU 1 H2 LEU 1 15.597 -2.361 -0.940 3 H3 LEU 1 H3 LEU 1 15.445 -0.692 -0.745 4 HA LEU 1 HA LEU 1 14.095 -0.536 -2.713 5 HB2 LEU 1 HB2 LEU 1 14.408 -3.535 -2.738 6 HB3 LEU 1 HB3 LEU 1 13.236 -2.660 -3.703 7 HG LEU 1 HG LEU 1 16.239 -2.436 -3.932 8 HD11 LEU 1 HD11 LEU 1 15.897 -3.502 -6.112 9 HD12 LEU 1 HD12 LEU 1 14.182 -3.688 -5.746 10 HD13 LEU 1 HD13 LEU 1 15.386 -4.544 -4.784 11 HD21 LEU 1 HD21 LEU 1 15.183 -0.315 -4.444 12 HD22 LEU 1 HD22 LEU 1 14.035 -1.118 -5.512 13 HD23 LEU 1 HD23 LEU 1 15.747 -1.080 -5.929 14 H MET 2 H MET 2 14.029 -2.928 -0.112 15 HA MET 2 HA MET 2 11.225 -3.103 0.108 16 HB2 MET 2 HB2 MET 2 13.434 -3.651 2.083 17 HB3 MET 2 HB3 MET 2 11.736 -3.922 2.453 18 HG2 MET 2 HG2 MET 2 11.575 -5.504 0.611 19 HG3 MET 2 HG3 MET 2 13.267 -5.220 0.213 20 HE1 MET 2 HE1 MET 2 13.534 -7.907 0.288 21 HE2 MET 2 HE2 MET 2 11.857 -8.086 0.795 22 HE3 MET 2 HE3 MET 2 13.142 -8.877 1.707 23 H GLY 3 H GLY 3 13.547 -0.816 1.367 24 HA2 GLY 3 HA2 GLY 3 12.024 0.452 3.325 25 HA3 GLY 3 HA3 GLY 3 13.243 1.243 2.336 26 H LEU 4 H LEU 4 11.854 0.690 -0.158 27 HA LEU 4 HA LEU 4 9.820 2.768 -0.075 28 HB2 LEU 4 HB2 LEU 4 10.355 1.125 -2.497 29 HB3 LEU 4 HB3 LEU 4 9.957 2.827 -2.378 30 HG LEU 4 HG LEU 4 12.546 2.120 -1.230 31 HD11 LEU 4 HD11 LEU 4 13.655 1.697 -3.304 32 HD12 LEU 4 HD12 LEU 4 12.173 1.977 -4.216 33 HD13 LEU 4 HD13 LEU 4 12.311 0.550 -3.181 34 HD21 LEU 4 HD21 LEU 4 11.707 4.408 -1.512 35 HD22 LEU 4 HD22 LEU 4 11.660 4.164 -3.260 36 HD23 LEU 4 HD23 LEU 4 13.203 4.138 -2.407 37 H PHE 5 H PHE 5 10.201 -0.574 -1.067 38 HA PHE 5 HA PHE 5 7.676 -0.960 -2.134 39 HB2 PHE 5 HB2 PHE 5 9.777 -2.323 -2.464 40 HB3 PHE 5 HB3 PHE 5 9.406 -3.104 -0.923 41 HD1 PHE 5 HD1 PHE 5 7.580 -2.251 -4.063 42 HD2 PHE 5 HD2 PHE 5 8.395 -5.142 -1.052 43 HE1 PHE 5 HE1 PHE 5 6.116 -3.855 -5.215 44 HE2 PHE 5 HE2 PHE 5 6.932 -6.754 -2.198 45 HZ PHE 5 HZ PHE 5 5.789 -6.111 -4.283 46 H ASN 6 H ASN 6 8.830 -1.690 1.170 47 HA ASN 6 HA ASN 6 6.561 -3.116 1.995 48 HB2 ASN 6 HB2 ASN 6 8.430 -1.403 3.639 49 HB3 ASN 6 HB3 ASN 6 7.212 -2.471 4.320 50 HD21 ASN 6 HD21 ASN 6 10.098 -2.534 4.637 51 HD22 ASN 6 HD22 ASN 6 10.608 -4.094 4.096 52 H ARG 7 H ARG 7 7.274 0.366 2.235 53 HA ARG 7 HA ARG 7 4.788 0.883 3.501 54 HB2 ARG 7 HB2 ARG 7 5.310 3.251 3.281 55 HB3 ARG 7 HB3 ARG 7 6.676 2.353 3.924 56 HG2 ARG 7 HG2 ARG 7 7.710 3.711 2.410 57 HG3 ARG 7 HG3 ARG 7 7.410 2.267 1.439 58 HD2 ARG 7 HD2 ARG 7 6.765 4.121 0.108 59 HD3 ARG 7 HD3 ARG 7 5.282 3.339 0.671 60 HE ARG 7 HE ARG 7 5.294 5.146 2.448 61 HH11 ARG 7 HH11 ARG 7 6.757 5.639 -0.696 62 HH12 ARG 7 HH12 ARG 7 6.423 7.337 -0.722 63 HH21 ARG 7 HH21 ARG 7 4.871 7.395 2.415 64 HH22 ARG 7 HH22 ARG 7 5.359 8.338 1.043 65 H ILE 8 H ILE 8 5.873 0.627 0.248 66 HA ILE 8 HA ILE 8 3.668 1.860 -1.031 67 HB ILE 8 HB ILE 8 5.492 -0.358 -1.973 68 HG12 ILE 8 HG12 ILE 8 6.600 1.804 -1.665 69 HG13 ILE 8 HG13 ILE 8 6.493 1.399 -3.374 70 HG21 ILE 8 HG21 ILE 8 3.308 -0.493 -3.100 71 HG22 ILE 8 HG22 ILE 8 4.606 -0.037 -4.205 72 HG23 ILE 8 HG23 ILE 8 3.484 1.188 -3.611 73 HD11 ILE 8 HD11 ILE 8 4.558 2.903 -3.580 74 HD12 ILE 8 HD12 ILE 8 6.021 3.731 -3.047 75 HD13 ILE 8 HD13 ILE 8 4.754 3.348 -1.883 76 H ILE 9 H ILE 9 4.272 -1.425 0.152 77 HA ILE 9 HA ILE 9 1.989 -2.684 -0.830 78 HB ILE 9 HB ILE 9 3.053 -3.212 1.936 79 HG12 ILE 9 HG12 ILE 9 4.993 -3.149 0.491 80 HG13 ILE 9 HG13 ILE 9 4.634 -4.815 0.927 81 HG21 ILE 9 HG21 ILE 9 1.023 -4.392 1.348 82 HG22 ILE 9 HG22 ILE 9 2.375 -5.518 1.458 83 HG23 ILE 9 HG23 ILE 9 1.783 -5.004 -0.122 84 HD11 ILE 9 HD11 ILE 9 5.283 -4.557 -1.411 85 HD12 ILE 9 HD12 ILE 9 3.886 -3.508 -1.668 86 HD13 ILE 9 HD13 ILE 9 3.648 -5.199 -1.233 87 H ARG 10 H ARG 10 2.477 -0.833 2.125 88 HA ARG 10 HA ARG 10 -0.174 -1.120 3.063 89 HB2 ARG 10 HB2 ARG 10 1.675 1.135 3.799 90 HB3 ARG 10 HB3 ARG 10 0.426 0.389 4.784 91 HG2 ARG 10 HG2 ARG 10 3.102 -0.722 4.028 92 HG3 ARG 10 HG3 ARG 10 2.491 -0.358 5.641 93 HD2 ARG 10 HD2 ARG 10 0.699 -2.126 5.115 94 HD3 ARG 10 HD3 ARG 10 1.763 -2.607 3.800 95 HE ARG 10 HE ARG 10 2.854 -2.485 6.515 96 HH11 ARG 10 HH11 ARG 10 1.837 -4.408 3.775 97 HH12 ARG 10 HH12 ARG 10 2.683 -5.827 4.295 98 HH21 ARG 10 HH21 ARG 10 3.938 -4.363 7.221 99 HH22 ARG 10 HH22 ARG 10 3.851 -5.811 6.269 100 H LYS 11 H LYS 11 1.458 1.168 1.008 101 HA LYS 11 HA LYS 11 -0.577 3.165 1.043 102 HB2 LYS 11 HB2 LYS 11 1.821 3.547 0.375 103 HB3 LYS 11 HB3 LYS 11 1.499 2.641 -1.097 104 HG2 LYS 11 HG2 LYS 11 1.420 5.008 -1.540 105 HG3 LYS 11 HG3 LYS 11 -0.185 4.302 -1.744 106 HD2 LYS 11 HD2 LYS 11 -0.813 5.095 0.486 107 HD3 LYS 11 HD3 LYS 11 0.792 5.797 0.689 108 HE2 LYS 11 HE2 LYS 11 -1.198 6.566 -1.442 109 HE3 LYS 11 HE3 LYS 11 -0.895 7.468 0.041 110 HZ1 LYS 11 HZ1 LYS 11 1.045 6.974 -2.147 111 HZ2 LYS 11 HZ2 LYS 11 1.413 7.754 -0.697 112 HZ3 LYS 11 HZ3 LYS 11 0.306 8.446 -1.770 113 H VAL 12 H VAL 12 0.161 0.369 -0.919 114 HA VAL 12 HA VAL 12 -1.962 0.778 -2.797 115 HB VAL 12 HB VAL 12 -0.242 -1.628 -2.177 116 HG11 VAL 12 HG11 VAL 12 -1.132 -2.597 -4.262 117 HG12 VAL 12 HG12 VAL 12 -2.253 -1.240 -4.401 118 HG13 VAL 12 HG13 VAL 12 -2.399 -2.364 -3.054 119 HG21 VAL 12 HG21 VAL 12 0.825 -1.086 -4.315 120 HG22 VAL 12 HG22 VAL 12 0.942 0.259 -3.180 121 HG23 VAL 12 HG23 VAL 12 -0.235 0.314 -4.493 122 H VAL 13 H VAL 13 -1.665 -0.718 0.326 123 HA VAL 13 HA VAL 13 -3.847 -2.503 0.108 124 HB VAL 13 HB VAL 13 -1.862 -1.996 1.974 125 HG11 VAL 13 HG11 VAL 13 -3.004 -1.687 4.110 126 HG12 VAL 13 HG12 VAL 13 -4.519 -1.401 3.256 127 HG13 VAL 13 HG13 VAL 13 -3.170 -0.279 3.062 128 HG21 VAL 13 HG21 VAL 13 -2.805 -3.930 3.146 129 HG22 VAL 13 HG22 VAL 13 -2.730 -4.148 1.398 130 HG23 VAL 13 HG23 VAL 13 -4.269 -3.779 2.176 131 H LYS 14 H LYS 14 -3.453 0.818 0.599 132 HA LYS 14 HA LYS 14 -5.948 1.488 1.720 133 HB2 LYS 14 HB2 LYS 14 -3.852 2.937 0.147 134 HB3 LYS 14 HB3 LYS 14 -5.345 3.752 0.619 135 HG2 LYS 14 HG2 LYS 14 -3.262 2.552 2.434 136 HG3 LYS 14 HG3 LYS 14 -3.601 4.264 2.196 137 HD2 LYS 14 HD2 LYS 14 -5.434 2.217 3.444 138 HD3 LYS 14 HD3 LYS 14 -4.572 3.505 4.281 139 HE2 LYS 14 HE2 LYS 14 -5.844 5.170 3.015 140 HE3 LYS 14 HE3 LYS 14 -6.707 3.876 2.188 141 HZ1 LYS 14 HZ1 LYS 14 -8.016 4.759 4.004 142 HZ2 LYS 14 HZ2 LYS 14 -6.780 4.422 5.105 143 HZ3 LYS 14 HZ3 LYS 14 -7.588 3.156 4.330 144 H LEU 15 H LEU 15 -4.826 0.995 -1.621 145 HA LEU 15 HA LEU 15 -7.462 1.729 -2.607 146 HB2 LEU 15 HB2 LEU 15 -6.516 1.474 -4.821 147 HB3 LEU 15 HB3 LEU 15 -5.481 2.470 -3.822 148 HG LEU 15 HG LEU 15 -4.174 0.224 -3.447 149 HD11 LEU 15 HD11 LEU 15 -4.172 -1.204 -5.415 150 HD12 LEU 15 HD12 LEU 15 -5.486 -0.261 -6.116 151 HD13 LEU 15 HD13 LEU 15 -5.760 -1.196 -4.647 152 HD21 LEU 15 HD21 LEU 15 -2.748 0.805 -5.352 153 HD22 LEU 15 HD22 LEU 15 -3.252 2.232 -4.449 154 HD23 LEU 15 HD23 LEU 15 -4.025 1.844 -5.985 155 H PHE 16 H PHE 16 -5.708 -1.010 -1.616 156 HA PHE 16 HA PHE 16 -7.180 -2.967 -3.109 157 HB2 PHE 16 HB2 PHE 16 -4.852 -3.230 -2.082 158 HB3 PHE 16 HB3 PHE 16 -5.668 -3.426 -0.537 159 HD1 PHE 16 HD1 PHE 16 -5.008 -4.923 -3.798 160 HD2 PHE 16 HD2 PHE 16 -6.923 -5.432 -0.035 161 HE1 PHE 16 HE1 PHE 16 -5.290 -7.318 -4.272 162 HE2 PHE 16 HE2 PHE 16 -7.203 -7.831 -0.501 163 HZ PHE 16 HZ PHE 16 -6.386 -8.776 -2.619 164 H ASN 17 H ASN 17 -7.271 -1.698 0.194 165 HA ASN 17 HA ASN 17 -9.648 -3.273 0.820 166 HB2 ASN 17 HB2 ASN 17 -7.894 -1.437 2.455 167 HB3 ASN 17 HB3 ASN 17 -9.410 -2.076 3.073 168 HD21 ASN 17 HD21 ASN 17 -7.388 -3.945 0.956 169 HD22 ASN 17 HD22 ASN 17 -6.848 -5.078 2.143 Start of MODEL 9 1 H1 LEU 1 H1 LEU 1 16.150 -2.971 -2.116 2 H2 LEU 1 H2 LEU 1 14.563 -2.567 -2.530 3 H3 LEU 1 H3 LEU 1 14.865 -3.921 -1.567 4 HA LEU 1 HA LEU 1 15.690 -2.545 0.200 5 HB2 LEU 1 HB2 LEU 1 14.965 -0.302 -1.684 6 HB3 LEU 1 HB3 LEU 1 15.334 -0.079 0.012 7 HG LEU 1 HG LEU 1 17.250 -1.158 -2.058 8 HD11 LEU 1 HD11 LEU 1 18.417 0.973 -1.755 9 HD12 LEU 1 HD12 LEU 1 17.120 1.526 -0.696 10 HD13 LEU 1 HD13 LEU 1 16.789 1.200 -2.395 11 HD21 LEU 1 HD21 LEU 1 17.648 -0.468 0.853 12 HD22 LEU 1 HD22 LEU 1 18.928 -0.895 -0.281 13 HD23 LEU 1 HD23 LEU 1 17.696 -2.082 0.142 14 H MET 2 H MET 2 14.144 -3.179 1.539 15 HA MET 2 HA MET 2 11.411 -3.249 0.797 16 HB2 MET 2 HB2 MET 2 10.979 -4.138 2.996 17 HB3 MET 2 HB3 MET 2 12.439 -4.873 2.354 18 HG2 MET 2 HG2 MET 2 13.806 -3.442 3.737 19 HG3 MET 2 HG3 MET 2 12.374 -2.603 4.327 20 HE1 MET 2 HE1 MET 2 13.599 -4.621 7.464 21 HE2 MET 2 HE2 MET 2 13.168 -3.030 6.838 22 HE3 MET 2 HE3 MET 2 14.601 -3.860 6.229 23 H GLY 3 H GLY 3 13.345 -0.822 2.259 24 HA2 GLY 3 HA2 GLY 3 11.564 0.565 3.864 25 HA3 GLY 3 HA3 GLY 3 12.842 1.320 2.926 26 H LEU 4 H LEU 4 11.926 0.730 0.353 27 HA LEU 4 HA LEU 4 9.869 2.725 0.053 28 HB2 LEU 4 HB2 LEU 4 10.709 0.950 -2.181 29 HB3 LEU 4 HB3 LEU 4 10.318 2.658 -2.205 30 HG LEU 4 HG LEU 4 12.718 1.982 -0.673 31 HD11 LEU 4 HD11 LEU 4 12.739 1.725 -3.678 32 HD12 LEU 4 HD12 LEU 4 12.741 0.347 -2.571 33 HD13 LEU 4 HD13 LEU 4 14.094 1.490 -2.569 34 HD21 LEU 4 HD21 LEU 4 11.977 4.270 -1.137 35 HD22 LEU 4 HD22 LEU 4 12.131 3.968 -2.868 36 HD23 LEU 4 HD23 LEU 4 13.562 3.947 -1.838 37 H PHE 5 H PHE 5 10.286 -0.676 -0.718 38 HA PHE 5 HA PHE 5 7.882 -1.021 -2.081 39 HB2 PHE 5 HB2 PHE 5 10.022 -2.416 -2.136 40 HB3 PHE 5 HB3 PHE 5 9.393 -3.216 -0.692 41 HD1 PHE 5 HD1 PHE 5 8.363 -2.354 -4.167 42 HD2 PHE 5 HD2 PHE 5 8.086 -5.092 -0.922 43 HE1 PHE 5 HE1 PHE 5 7.051 -3.885 -5.576 44 HE2 PHE 5 HE2 PHE 5 6.770 -6.625 -2.323 45 HZ PHE 5 HZ PHE 5 6.252 -6.024 -4.655 46 H ASN 6 H ASN 6 8.741 -1.880 1.276 47 HA ASN 6 HA ASN 6 6.302 -3.064 1.993 48 HB2 ASN 6 HB2 ASN 6 8.273 -1.505 3.669 49 HB3 ASN 6 HB3 ASN 6 6.905 -2.382 4.337 50 HD21 ASN 6 HD21 ASN 6 8.390 -3.629 5.547 51 HD22 ASN 6 HD22 ASN 6 9.266 -4.928 4.810 52 H ARG 7 H ARG 7 7.356 0.284 2.019 53 HA ARG 7 HA ARG 7 5.069 1.317 3.290 54 HB2 ARG 7 HB2 ARG 7 6.906 2.721 3.425 55 HB3 ARG 7 HB3 ARG 7 7.390 2.422 1.768 56 HG2 ARG 7 HG2 ARG 7 4.907 3.978 2.341 57 HG3 ARG 7 HG3 ARG 7 6.493 4.747 2.451 58 HD2 ARG 7 HD2 ARG 7 6.935 3.835 0.130 59 HD3 ARG 7 HD3 ARG 7 5.220 3.434 0.066 60 HE ARG 7 HE ARG 7 5.476 6.132 0.782 61 HH11 ARG 7 HH11 ARG 7 6.039 4.057 -1.982 62 HH12 ARG 7 HH12 ARG 7 5.784 5.319 -3.144 63 HH21 ARG 7 HH21 ARG 7 5.150 7.792 -0.741 64 HH22 ARG 7 HH22 ARG 7 5.289 7.446 -2.437 65 H ILE 8 H ILE 8 5.968 0.665 -0.021 66 HA ILE 8 HA ILE 8 3.771 1.891 -1.304 67 HB ILE 8 HB ILE 8 5.424 -0.482 -2.185 68 HG12 ILE 8 HG12 ILE 8 5.606 2.445 -2.932 69 HG13 ILE 8 HG13 ILE 8 6.709 1.601 -1.851 70 HG21 ILE 8 HG21 ILE 8 4.585 -0.022 -4.434 71 HG22 ILE 8 HG22 ILE 8 3.551 1.253 -3.790 72 HG23 ILE 8 HG23 ILE 8 3.268 -0.425 -3.329 73 HD11 ILE 8 HD11 ILE 8 7.389 0.151 -3.700 74 HD12 ILE 8 HD12 ILE 8 7.684 1.854 -4.046 75 HD13 ILE 8 HD13 ILE 8 6.305 1.030 -4.776 76 H ILE 9 H ILE 9 4.270 -1.353 0.033 77 HA ILE 9 HA ILE 9 1.984 -2.595 -0.963 78 HB ILE 9 HB ILE 9 3.032 -3.108 1.814 79 HG12 ILE 9 HG12 ILE 9 4.975 -3.076 0.363 80 HG13 ILE 9 HG13 ILE 9 4.607 -4.729 0.834 81 HG21 ILE 9 HG21 ILE 9 1.762 -4.919 -0.227 82 HG22 ILE 9 HG22 ILE 9 0.985 -4.266 1.213 83 HG23 ILE 9 HG23 ILE 9 2.321 -5.403 1.373 84 HD11 ILE 9 HD11 ILE 9 5.261 -4.530 -1.504 85 HD12 ILE 9 HD12 ILE 9 3.877 -3.473 -1.789 86 HD13 ILE 9 HD13 ILE 9 3.620 -5.154 -1.319 87 H ARG 10 H ARG 10 2.461 -0.733 1.997 88 HA ARG 10 HA ARG 10 -0.203 -1.008 2.881 89 HB2 ARG 10 HB2 ARG 10 1.660 1.231 3.647 90 HB3 ARG 10 HB3 ARG 10 0.349 0.544 4.594 91 HG2 ARG 10 HG2 ARG 10 3.027 -0.645 3.983 92 HG3 ARG 10 HG3 ARG 10 2.322 -0.277 5.557 93 HD2 ARG 10 HD2 ARG 10 0.531 -1.992 4.919 94 HD3 ARG 10 HD3 ARG 10 1.643 -2.490 3.651 95 HE ARG 10 HE ARG 10 3.279 -2.777 5.596 96 HH11 ARG 10 HH11 ARG 10 -0.168 -3.316 5.846 97 HH12 ARG 10 HH12 ARG 10 -0.022 -4.508 7.097 98 HH21 ARG 10 HH21 ARG 10 3.480 -4.337 7.255 99 HH22 ARG 10 HH22 ARG 10 2.053 -5.091 7.895 100 H LYS 11 H LYS 11 1.414 1.291 0.808 101 HA LYS 11 HA LYS 11 -0.661 3.264 0.921 102 HB2 LYS 11 HB2 LYS 11 1.715 3.757 0.269 103 HB3 LYS 11 HB3 LYS 11 1.432 2.888 -1.233 104 HG2 LYS 11 HG2 LYS 11 -0.183 4.493 -1.947 105 HG3 LYS 11 HG3 LYS 11 -0.167 5.287 -0.372 106 HD2 LYS 11 HD2 LYS 11 1.124 6.612 -1.891 107 HD3 LYS 11 HD3 LYS 11 2.232 5.848 -0.753 108 HE2 LYS 11 HE2 LYS 11 3.173 5.718 -2.954 109 HE3 LYS 11 HE3 LYS 11 2.688 4.100 -2.454 110 HZ1 LYS 11 HZ1 LYS 11 1.107 5.882 -4.227 111 HZ2 LYS 11 HZ2 LYS 11 0.711 4.294 -3.803 112 HZ3 LYS 11 HZ3 LYS 11 2.076 4.599 -4.755 113 H VAL 12 H VAL 12 0.079 0.481 -1.026 114 HA VAL 12 HA VAL 12 -2.062 0.920 -2.897 115 HB VAL 12 HB VAL 12 -0.291 -1.470 -2.372 116 HG11 VAL 12 HG11 VAL 12 -2.230 -1.051 -4.654 117 HG12 VAL 12 HG12 VAL 12 -2.537 -2.091 -3.266 118 HG13 VAL 12 HG13 VAL 12 -1.213 -2.467 -4.376 119 HG21 VAL 12 HG21 VAL 12 0.861 0.457 -3.326 120 HG22 VAL 12 HG22 VAL 12 -0.338 0.555 -4.615 121 HG23 VAL 12 HG23 VAL 12 0.735 -0.840 -4.512 122 H VAL 13 H VAL 13 -1.620 -0.754 0.136 123 HA VAL 13 HA VAL 13 -3.806 -2.526 -0.085 124 HB VAL 13 HB VAL 13 -1.738 -2.168 1.696 125 HG11 VAL 13 HG11 VAL 13 -2.724 -1.902 3.909 126 HG12 VAL 13 HG12 VAL 13 -4.286 -1.538 3.176 127 HG13 VAL 13 HG13 VAL 13 -2.921 -0.447 2.932 128 HG21 VAL 13 HG21 VAL 13 -2.689 -4.107 2.850 129 HG22 VAL 13 HG22 VAL 13 -2.725 -4.253 1.094 130 HG23 VAL 13 HG23 VAL 13 -4.200 -3.860 1.975 131 H LYS 14 H LYS 14 -3.403 0.756 0.612 132 HA LYS 14 HA LYS 14 -5.847 1.351 1.852 133 HB2 LYS 14 HB2 LYS 14 -3.845 2.891 0.240 134 HB3 LYS 14 HB3 LYS 14 -5.307 3.670 0.851 135 HG2 LYS 14 HG2 LYS 14 -3.141 2.353 2.483 136 HG3 LYS 14 HG3 LYS 14 -3.420 4.083 2.319 137 HD2 LYS 14 HD2 LYS 14 -5.362 2.115 3.523 138 HD3 LYS 14 HD3 LYS 14 -4.285 3.165 4.440 139 HE2 LYS 14 HE2 LYS 14 -6.390 4.126 2.512 140 HE3 LYS 14 HE3 LYS 14 -6.601 4.034 4.258 141 HZ1 LYS 14 HZ1 LYS 14 -5.996 6.263 3.559 142 HZ2 LYS 14 HZ2 LYS 14 -4.576 5.687 2.847 143 HZ3 LYS 14 HZ3 LYS 14 -4.774 5.597 4.521 144 H LEU 15 H LEU 15 -4.915 0.991 -1.567 145 HA LEU 15 HA LEU 15 -7.620 1.735 -2.365 146 HB2 LEU 15 HB2 LEU 15 -6.824 1.589 -4.633 147 HB3 LEU 15 HB3 LEU 15 -5.702 2.528 -3.673 148 HG LEU 15 HG LEU 15 -4.388 0.268 -3.499 149 HD11 LEU 15 HD11 LEU 15 -5.921 -0.130 -6.065 150 HD12 LEU 15 HD12 LEU 15 -6.089 -1.104 -4.604 151 HD13 LEU 15 HD13 LEU 15 -4.567 -1.105 -5.496 152 HD21 LEU 15 HD21 LEU 15 -4.454 1.965 -5.987 153 HD22 LEU 15 HD22 LEU 15 -3.136 0.897 -5.509 154 HD23 LEU 15 HD23 LEU 15 -3.539 2.297 -4.516 155 H PHE 16 H PHE 16 -5.813 -0.982 -1.516 156 HA PHE 16 HA PHE 16 -7.246 -2.940 -3.040 157 HB2 PHE 16 HB2 PHE 16 -4.878 -3.138 -2.101 158 HB3 PHE 16 HB3 PHE 16 -5.628 -3.411 -0.537 159 HD1 PHE 16 HD1 PHE 16 -6.555 -5.513 0.035 160 HD2 PHE 16 HD2 PHE 16 -5.224 -4.761 -3.934 161 HE1 PHE 16 HE1 PHE 16 -6.730 -7.913 -0.475 162 HE2 PHE 16 HE2 PHE 16 -5.400 -7.157 -4.452 163 HZ PHE 16 HZ PHE 16 -6.153 -8.738 -2.723 164 H ASN 17 H ASN 17 -7.285 -1.794 0.308 165 HA ASN 17 HA ASN 17 -9.497 -3.514 1.029 166 HB2 ASN 17 HB2 ASN 17 -7.938 -1.383 2.484 167 HB3 ASN 17 HB3 ASN 17 -9.384 -2.099 3.181 168 HD21 ASN 17 HD21 ASN 17 -7.289 -4.009 1.188 169 HD22 ASN 17 HD22 ASN 17 -6.608 -4.962 2.462 Start of MODEL 10 1 H1 LEU 1 H1 LEU 1 16.064 -1.085 2.782 2 H2 LEU 1 H2 LEU 1 15.940 0.366 1.932 3 H3 LEU 1 H3 LEU 1 17.458 -0.319 2.210 4 HA LEU 1 HA LEU 1 16.825 -0.695 -0.051 5 HB2 LEU 1 HB2 LEU 1 18.086 -2.446 1.178 6 HB3 LEU 1 HB3 LEU 1 16.568 -3.222 1.583 7 HG LEU 1 HG LEU 1 16.147 -3.535 -0.865 8 HD11 LEU 1 HD11 LEU 1 17.546 -1.791 -1.756 9 HD12 LEU 1 HD12 LEU 1 18.098 -3.351 -2.367 10 HD13 LEU 1 HD13 LEU 1 18.984 -2.547 -1.073 11 HD21 LEU 1 HD21 LEU 1 17.023 -5.348 0.499 12 HD22 LEU 1 HD22 LEU 1 18.667 -4.766 0.241 13 HD23 LEU 1 HD23 LEU 1 17.729 -5.387 -1.116 14 H MET 2 H MET 2 14.615 -2.637 1.977 15 HA MET 2 HA MET 2 12.662 -2.541 -0.188 16 HB2 MET 2 HB2 MET 2 12.760 -4.169 2.354 17 HB3 MET 2 HB3 MET 2 11.447 -4.245 1.186 18 HG2 MET 2 HG2 MET 2 12.991 -5.022 -0.522 19 HG3 MET 2 HG3 MET 2 14.326 -4.907 0.622 20 HE1 MET 2 HE1 MET 2 13.601 -7.526 -1.089 21 HE2 MET 2 HE2 MET 2 13.854 -8.771 0.134 22 HE3 MET 2 HE3 MET 2 14.972 -7.413 0.014 23 H GLY 3 H GLY 3 13.382 -0.527 2.194 24 HA2 GLY 3 HA2 GLY 3 11.039 -0.163 3.691 25 HA3 GLY 3 HA3 GLY 3 12.242 1.077 3.369 26 H LEU 4 H LEU 4 11.950 0.994 0.512 27 HA LEU 4 HA LEU 4 9.841 2.811 0.083 28 HB2 LEU 4 HB2 LEU 4 10.842 1.049 -2.111 29 HB3 LEU 4 HB3 LEU 4 10.382 2.736 -2.178 30 HG LEU 4 HG LEU 4 12.730 2.195 -0.518 31 HD11 LEU 4 HD11 LEU 4 12.945 1.902 -3.505 32 HD12 LEU 4 HD12 LEU 4 12.875 0.522 -2.406 33 HD13 LEU 4 HD13 LEU 4 14.214 1.677 -2.300 34 HD21 LEU 4 HD21 LEU 4 11.909 4.437 -1.080 35 HD22 LEU 4 HD22 LEU 4 12.179 4.095 -2.790 36 HD23 LEU 4 HD23 LEU 4 13.546 4.164 -1.679 37 H PHE 5 H PHE 5 10.278 -0.527 -0.890 38 HA PHE 5 HA PHE 5 7.821 -0.829 -2.193 39 HB2 PHE 5 HB2 PHE 5 10.023 -2.155 -2.411 40 HB3 PHE 5 HB3 PHE 5 9.427 -3.087 -1.032 41 HD1 PHE 5 HD1 PHE 5 7.919 -4.836 -1.319 42 HD2 PHE 5 HD2 PHE 5 8.560 -2.072 -4.489 43 HE1 PHE 5 HE1 PHE 5 6.599 -6.263 -2.825 44 HE2 PHE 5 HE2 PHE 5 7.239 -3.496 -5.999 45 HZ PHE 5 HZ PHE 5 6.258 -5.593 -5.167 46 H ASN 6 H ASN 6 8.899 -1.802 1.057 47 HA ASN 6 HA ASN 6 6.571 -3.153 1.841 48 HB2 ASN 6 HB2 ASN 6 8.528 -1.563 3.500 49 HB3 ASN 6 HB3 ASN 6 7.257 -2.570 4.177 50 HD21 ASN 6 HD21 ASN 6 7.545 -4.594 2.069 51 HD22 ASN 6 HD22 ASN 6 8.988 -5.463 2.448 52 H ARG 7 H ARG 7 7.437 0.260 2.018 53 HA ARG 7 HA ARG 7 5.103 1.030 3.394 54 HB2 ARG 7 HB2 ARG 7 6.785 2.580 3.626 55 HB3 ARG 7 HB3 ARG 7 7.307 2.424 1.959 56 HG2 ARG 7 HG2 ARG 7 4.670 3.686 2.533 57 HG3 ARG 7 HG3 ARG 7 6.153 4.604 2.808 58 HD2 ARG 7 HD2 ARG 7 6.853 4.087 0.497 59 HD3 ARG 7 HD3 ARG 7 5.315 3.269 0.245 60 HE ARG 7 HE ARG 7 4.343 5.580 0.834 61 HH11 ARG 7 HH11 ARG 7 7.396 5.091 -0.814 62 HH12 ARG 7 HH12 ARG 7 7.265 6.539 -1.760 63 HH21 ARG 7 HH21 ARG 7 4.171 7.497 -0.412 64 HH22 ARG 7 HH22 ARG 7 5.436 7.906 -1.527 65 H ILE 8 H ILE 8 5.938 0.617 0.031 66 HA ILE 8 HA ILE 8 3.650 1.800 -1.117 67 HB ILE 8 HB ILE 8 5.407 -0.433 -2.145 68 HG12 ILE 8 HG12 ILE 8 6.575 1.698 -1.850 69 HG13 ILE 8 HG13 ILE 8 6.394 1.320 -3.559 70 HG21 ILE 8 HG21 ILE 8 3.204 -0.529 -3.206 71 HG22 ILE 8 HG22 ILE 8 4.453 -0.026 -4.348 72 HG23 ILE 8 HG23 ILE 8 3.351 1.169 -3.663 73 HD11 ILE 8 HD11 ILE 8 5.987 3.660 -3.178 74 HD12 ILE 8 HD12 ILE 8 4.754 3.284 -1.976 75 HD13 ILE 8 HD13 ILE 8 4.488 2.872 -3.670 76 H ILE 9 H ILE 9 4.223 -1.351 0.337 77 HA ILE 9 HA ILE 9 2.017 -2.708 -0.778 78 HB ILE 9 HB ILE 9 3.130 -3.231 1.975 79 HG12 ILE 9 HG12 ILE 9 5.022 -3.103 0.453 80 HG13 ILE 9 HG13 ILE 9 4.738 -4.772 0.929 81 HG21 ILE 9 HG21 ILE 9 1.841 -5.036 -0.059 82 HG22 ILE 9 HG22 ILE 9 1.117 -4.458 1.442 83 HG23 ILE 9 HG23 ILE 9 2.498 -5.553 1.493 84 HD11 ILE 9 HD11 ILE 9 5.296 -4.551 -1.433 85 HD12 ILE 9 HD12 ILE 9 3.872 -3.533 -1.664 86 HD13 ILE 9 HD13 ILE 9 3.681 -5.220 -1.193 87 H ARG 10 H ARG 10 2.397 -0.547 1.926 88 HA ARG 10 HA ARG 10 -0.283 -1.045 2.903 89 HB2 ARG 10 HB2 ARG 10 1.307 1.270 3.901 90 HB3 ARG 10 HB3 ARG 10 0.295 0.128 4.773 91 HG2 ARG 10 HG2 ARG 10 3.008 -0.510 3.682 92 HG3 ARG 10 HG3 ARG 10 2.660 -0.074 5.357 93 HD2 ARG 10 HD2 ARG 10 1.271 -2.000 5.627 94 HD3 ARG 10 HD3 ARG 10 1.385 -2.360 3.907 95 HE ARG 10 HE ARG 10 3.908 -2.324 5.319 96 HH11 ARG 10 HH11 ARG 10 1.200 -4.286 4.288 97 HH12 ARG 10 HH12 ARG 10 2.087 -5.772 4.357 98 HH21 ARG 10 HH21 ARG 10 5.074 -4.274 5.424 99 HH22 ARG 10 HH22 ARG 10 4.292 -5.768 5.009 100 H LYS 11 H LYS 11 1.433 1.196 0.921 101 HA LYS 11 HA LYS 11 -0.531 3.259 0.878 102 HB2 LYS 11 HB2 LYS 11 1.827 3.625 0.240 103 HB3 LYS 11 HB3 LYS 11 1.617 2.558 -1.139 104 HG2 LYS 11 HG2 LYS 11 0.037 4.105 -2.132 105 HG3 LYS 11 HG3 LYS 11 0.158 5.160 -0.722 106 HD2 LYS 11 HD2 LYS 11 2.529 5.518 -1.181 107 HD3 LYS 11 HD3 LYS 11 2.432 4.436 -2.571 108 HE2 LYS 11 HE2 LYS 11 0.852 6.985 -2.265 109 HE3 LYS 11 HE3 LYS 11 2.354 6.841 -3.177 110 HZ1 LYS 11 HZ1 LYS 11 1.275 5.222 -4.616 111 HZ2 LYS 11 HZ2 LYS 11 0.433 6.689 -4.620 112 HZ3 LYS 11 HZ3 LYS 11 -0.167 5.376 -3.743 113 H VAL 12 H VAL 12 0.101 0.361 -0.979 114 HA VAL 12 HA VAL 12 -2.047 0.824 -2.838 115 HB VAL 12 HB VAL 12 -0.360 -1.627 -2.309 116 HG11 VAL 12 HG11 VAL 12 -1.293 -2.557 -4.342 117 HG12 VAL 12 HG12 VAL 12 -2.267 -1.105 -4.593 118 HG13 VAL 12 HG13 VAL 12 -2.606 -2.165 -3.226 119 HG21 VAL 12 HG21 VAL 12 0.882 0.261 -3.234 120 HG22 VAL 12 HG22 VAL 12 -0.295 0.405 -4.540 121 HG23 VAL 12 HG23 VAL 12 0.723 -1.031 -4.424 122 H VAL 13 H VAL 13 -1.678 -0.713 0.261 123 HA VAL 13 HA VAL 13 -3.840 -2.518 0.065 124 HB VAL 13 HB VAL 13 -1.842 -2.038 1.889 125 HG11 VAL 13 HG11 VAL 13 -3.053 -0.275 3.008 126 HG12 VAL 13 HG12 VAL 13 -2.931 -1.687 4.059 127 HG13 VAL 13 HG13 VAL 13 -4.446 -1.336 3.227 128 HG21 VAL 13 HG21 VAL 13 -2.797 -3.931 3.107 129 HG22 VAL 13 HG22 VAL 13 -2.789 -4.167 1.360 130 HG23 VAL 13 HG23 VAL 13 -4.289 -3.746 2.186 131 H LYS 14 H LYS 14 -3.473 0.796 0.631 132 HA LYS 14 HA LYS 14 -5.947 1.432 1.787 133 HB2 LYS 14 HB2 LYS 14 -3.910 2.927 0.174 134 HB3 LYS 14 HB3 LYS 14 -5.389 3.719 0.726 135 HG2 LYS 14 HG2 LYS 14 -3.253 2.464 2.442 136 HG3 LYS 14 HG3 LYS 14 -3.545 4.188 2.226 137 HD2 LYS 14 HD2 LYS 14 -5.478 2.225 3.461 138 HD3 LYS 14 HD3 LYS 14 -4.446 3.340 4.353 139 HE2 LYS 14 HE2 LYS 14 -6.550 4.154 2.356 140 HE3 LYS 14 HE3 LYS 14 -6.770 4.149 4.103 141 HZ1 LYS 14 HZ1 LYS 14 -4.954 5.755 4.276 142 HZ2 LYS 14 HZ2 LYS 14 -6.226 6.348 3.332 143 HZ3 LYS 14 HZ3 LYS 14 -4.813 5.791 2.588 144 H LEU 15 H LEU 15 -4.911 1.034 -1.600 145 HA LEU 15 HA LEU 15 -7.589 1.736 -2.485 146 HB2 LEU 15 HB2 LEU 15 -6.734 1.519 -4.732 147 HB3 LEU 15 HB3 LEU 15 -5.646 2.497 -3.770 148 HG LEU 15 HG LEU 15 -4.348 0.219 -3.488 149 HD11 LEU 15 HD11 LEU 15 -4.440 -1.139 -5.518 150 HD12 LEU 15 HD12 LEU 15 -5.796 -0.175 -6.103 151 HD13 LEU 15 HD13 LEU 15 -5.977 -1.162 -4.653 152 HD21 LEU 15 HD21 LEU 15 -3.430 2.235 -4.470 153 HD22 LEU 15 HD22 LEU 15 -4.281 1.912 -5.981 154 HD23 LEU 15 HD23 LEU 15 -2.997 0.830 -5.443 155 H PHE 16 H PHE 16 -5.768 -0.986 -1.585 156 HA PHE 16 HA PHE 16 -7.188 -2.978 -3.046 157 HB2 PHE 16 HB2 PHE 16 -4.914 -3.265 -2.040 158 HB3 PHE 16 HB3 PHE 16 -5.661 -3.259 -0.454 159 HD1 PHE 16 HD1 PHE 16 -6.926 -4.922 -3.518 160 HD2 PHE 16 HD2 PHE 16 -5.171 -5.394 0.330 161 HE1 PHE 16 HE1 PHE 16 -7.272 -7.351 -3.666 162 HE2 PHE 16 HE2 PHE 16 -5.515 -7.825 0.190 163 HZ PHE 16 HZ PHE 16 -6.567 -8.807 -1.809 164 H ASN 17 H ASN 17 -7.379 -1.722 0.255 165 HA ASN 17 HA ASN 17 -9.679 -3.369 0.876 166 HB2 ASN 17 HB2 ASN 17 -8.233 -1.212 2.415 167 HB3 ASN 17 HB3 ASN 17 -9.707 -1.966 3.008 168 HD21 ASN 17 HD21 ASN 17 -7.195 -3.631 1.216 169 HD22 ASN 17 HD22 ASN 17 -6.678 -4.639 2.522
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