EXPDTA THEORETICAL MODEL, MODELLER 9.15 2017/03/07 01:04:39 REMARK 6 MODELLER OBJECTIVE FUNCTION: -1298.2303 REMARK 6 MODELLER BEST TEMPLATE % SEQ ID: 29.630 REMARK 6 SEQUENCE: model REMARK 6 DOPE score: -1298.23035 REMARK 6 GA341 score: 0.29141 REMARK 6 Normalized DOPE score: -0.68669 REMARK 6 TEMPLATE: 2w86A01 ATOM 1 N ASN 2 23.592 32.744 35.296 1.00 68.56 N ATOM 2 CA ASN 2 23.300 31.420 34.707 1.00 68.56 C ATOM 3 CB ASN 2 21.781 31.205 34.588 1.00 68.56 C ATOM 4 CG ASN 2 21.212 32.262 33.651 1.00 68.56 C ATOM 5 OD1 ASN 2 20.840 31.970 32.516 1.00 68.56 O ATOM 6 ND2 ASN 2 21.135 33.529 34.140 1.00 68.56 N ATOM 7 C ASN 2 23.917 31.283 33.356 1.00 68.56 C ATOM 8 O ASN 2 24.836 32.019 33.003 1.00 68.56 O ATOM 9 N THR 3 23.429 30.309 32.568 1.00 92.42 N ATOM 10 CA THR 3 23.961 30.104 31.255 1.00 92.42 C ATOM 11 CB THR 3 24.512 28.725 31.038 1.00 92.42 C ATOM 12 OG1 THR 3 25.134 28.639 29.765 1.00 92.42 O ATOM 13 CG2 THR 3 23.363 27.708 31.143 1.00 92.42 C ATOM 14 C THR 3 22.834 30.304 30.300 1.00 92.42 C ATOM 15 O THR 3 21.670 30.137 30.655 1.00 92.42 O ATOM 16 N ASP 4 23.140 30.695 29.051 1.00 78.55 N ATOM 17 CA ASP 4 22.051 30.925 28.154 1.00 78.55 C ATOM 18 CB ASP 4 22.470 31.502 26.789 1.00 78.55 C ATOM 19 CG ASP 4 23.342 30.477 26.077 1.00 78.55 C ATOM 20 OD1 ASP 4 24.176 29.828 26.763 1.00 78.55 O ATOM 21 OD2 ASP 4 23.180 30.326 24.837 1.00 78.55 O ATOM 22 C ASP 4 21.367 29.622 27.910 1.00 78.55 C ATOM 23 O ASP 4 22.008 28.603 27.659 1.00 78.55 O ATOM 24 N GLY 5 20.024 29.633 28.005 1.00 16.24 N ATOM 25 CA GLY 5 19.244 28.467 27.725 1.00 16.24 C ATOM 26 C GLY 5 19.203 27.594 28.936 1.00 16.24 C ATOM 27 O GLY 5 18.595 26.525 28.904 1.00 16.24 O ATOM 28 N SER 6 19.841 28.014 30.045 1.00 85.95 N ATOM 29 CA SER 6 19.814 27.156 31.195 1.00 85.95 C ATOM 30 CB SER 6 20.899 26.067 31.194 1.00 85.95 C ATOM 31 OG SER 6 20.634 25.116 30.176 1.00 85.95 O ATOM 32 C SER 6 20.031 27.969 32.425 1.00 85.95 C ATOM 33 O SER 6 20.078 29.197 32.387 1.00 85.95 O ATOM 34 N PHE 7 20.129 27.269 33.570 1.00118.73 N ATOM 35 CA PHE 7 20.353 27.909 34.827 1.00118.73 C ATOM 36 CB PHE 7 19.079 28.010 35.683 1.00118.73 C ATOM 37 CG PHE 7 18.609 26.615 35.909 1.00118.73 C ATOM 38 CD1 PHE 7 17.886 25.968 34.934 1.00118.73 C ATOM 39 CD2 PHE 7 18.909 25.945 37.072 1.00118.73 C ATOM 40 CE1 PHE 7 17.449 24.679 35.121 1.00118.73 C ATOM 41 CE2 PHE 7 18.473 24.655 37.264 1.00118.73 C ATOM 42 CZ PHE 7 17.744 24.018 36.288 1.00118.73 C ATOM 43 C PHE 7 21.338 27.053 35.545 1.00118.73 C ATOM 44 O PHE 7 21.644 25.946 35.106 1.00118.73 O ATOM 45 N ALA 8 21.894 27.560 36.660 1.00 42.56 N ATOM 46 CA ALA 8 22.853 26.770 37.365 1.00 42.56 C ATOM 47 CB ALA 8 24.303 27.248 37.178 1.00 42.56 C ATOM 48 C ALA 8 22.551 26.871 38.821 1.00 42.56 C ATOM 49 O ALA 8 21.954 27.841 39.286 1.00 42.56 O ATOM 50 N CYS 9 22.939 25.831 39.578 1.00 49.51 N ATOM 51 CA CYS 9 22.763 25.869 40.996 1.00 49.51 C ATOM 52 CB CYS 9 21.985 24.658 41.544 1.00 49.51 C ATOM 53 SG CYS 9 20.261 24.611 40.962 1.00 49.51 S ATOM 54 C CYS 9 24.139 25.825 41.579 1.00 49.51 C ATOM 55 O CYS 9 24.961 25.007 41.174 1.00 49.51 O ATOM 56 N THR 10 24.449 26.733 42.524 1.00106.51 N ATOM 57 CA THR 10 25.742 26.676 43.135 1.00106.51 C ATOM 58 CB THR 10 26.579 27.903 42.929 1.00106.51 C ATOM 59 OG1 THR 10 27.914 27.652 43.343 1.00106.51 O ATOM 60 CG2 THR 10 25.971 29.067 43.730 1.00106.51 C ATOM 61 C THR 10 25.507 26.519 44.598 1.00106.51 C ATOM 62 O THR 10 24.523 27.023 45.136 1.00106.51 O ATOM 63 N CYS 11 26.391 25.786 45.297 1.00 64.57 N ATOM 64 CA CYS 11 26.119 25.627 46.690 1.00 64.57 C ATOM 65 CB CYS 11 25.679 24.218 47.071 1.00 64.57 C ATOM 66 SG CYS 11 24.041 23.951 46.347 1.00 64.57 S ATOM 67 C CYS 11 27.302 26.054 47.484 1.00 64.57 C ATOM 68 O CYS 11 28.375 26.322 46.944 1.00 64.57 O ATOM 69 N ALA 12 27.095 26.176 48.808 1.00 51.06 N ATOM 70 CA ALA 12 28.136 26.602 49.691 1.00 51.06 C ATOM 71 CB ALA 12 27.643 27.023 51.090 1.00 51.06 C ATOM 72 C ALA 12 29.071 25.459 49.866 1.00 51.06 C ATOM 73 O ALA 12 28.728 24.304 49.624 1.00 51.06 O ATOM 74 N PRO 13 30.267 25.770 50.277 1.00236.95 N ATOM 75 CA PRO 13 31.207 24.720 50.503 1.00236.95 C ATOM 76 CD PRO 13 30.915 27.022 49.928 1.00236.95 C ATOM 77 CB PRO 13 32.547 25.408 50.749 1.00236.95 C ATOM 78 CG PRO 13 32.422 26.706 49.921 1.00236.95 C ATOM 79 C PRO 13 30.681 23.892 51.619 1.00236.95 C ATOM 80 O PRO 13 30.060 24.438 52.527 1.00236.95 O ATOM 81 N GLY 14 30.912 22.575 51.582 1.00224.49 N ATOM 82 CA GLY 14 30.375 21.740 52.608 1.00224.49 C ATOM 83 C GLY 14 29.229 21.019 51.983 1.00224.49 C ATOM 84 O GLY 14 28.806 19.966 52.454 1.00224.49 O ATOM 85 N TYR 15 28.706 21.589 50.880 1.00150.52 N ATOM 86 CA TYR 15 27.655 20.968 50.132 1.00150.52 C ATOM 87 CB TYR 15 26.368 21.799 49.915 1.00150.52 C ATOM 88 CG TYR 15 25.907 22.607 51.076 1.00150.52 C ATOM 89 CD1 TYR 15 26.374 22.425 52.353 1.00150.52 C ATOM 90 CD2 TYR 15 25.019 23.628 50.824 1.00150.52 C ATOM 91 CE1 TYR 15 25.908 23.223 53.369 1.00150.52 C ATOM 92 CE2 TYR 15 24.552 24.424 51.842 1.00150.52 C ATOM 93 CZ TYR 15 24.994 24.215 53.120 1.00150.52 C ATOM 94 OH TYR 15 24.532 25.010 54.187 1.00150.52 O ATOM 95 C TYR 15 28.227 20.974 48.750 1.00150.52 C ATOM 96 O TYR 15 29.022 21.862 48.426 1.00150.52 O ATOM 97 N ARG 16 27.910 19.977 47.910 1.00201.26 N ATOM 98 CA ARG 16 28.368 20.095 46.559 1.00201.26 C ATOM 99 CB ARG 16 29.870 19.825 46.406 1.00201.26 C ATOM 100 CG ARG 16 30.217 19.031 45.167 1.00201.26 C ATOM 101 CD ARG 16 30.303 17.571 45.592 1.00201.26 C ATOM 102 NE ARG 16 30.361 16.752 44.366 1.00201.26 N ATOM 103 CZ ARG 16 31.561 16.643 43.733 1.00201.26 C ATOM 104 NH1 ARG 16 32.650 17.328 44.187 1.00201.26 N ATOM 105 NH2 ARG 16 31.677 15.856 42.628 1.00201.26 N ATOM 106 C ARG 16 27.493 19.282 45.660 1.00201.26 C ATOM 107 O ARG 16 27.029 18.196 45.998 1.00201.26 O ATOM 108 N PRO 17 27.253 19.826 44.503 1.00111.71 N ATOM 109 CA PRO 17 26.267 19.336 43.570 1.00111.71 C ATOM 110 CD PRO 17 27.872 21.068 44.080 1.00111.71 C ATOM 111 CB PRO 17 26.134 20.421 42.503 1.00111.71 C ATOM 112 CG PRO 17 27.456 21.211 42.609 1.00111.71 C ATOM 113 C PRO 17 26.451 17.966 43.006 1.00111.71 C ATOM 114 O PRO 17 27.572 17.555 42.722 1.00111.71 O ATOM 115 N GLY 18 25.321 17.255 42.833 1.00 39.49 N ATOM 116 CA GLY 18 25.301 15.935 42.281 1.00 39.49 C ATOM 117 C GLY 18 25.294 16.047 40.788 1.00 39.49 C ATOM 118 O GLY 18 25.193 17.132 40.220 1.00 39.49 O ATOM 119 N PRO 19 25.369 14.891 40.168 1.00166.06 N ATOM 120 CA PRO 19 25.426 14.780 38.736 1.00166.06 C ATOM 121 CD PRO 19 24.893 13.668 40.793 1.00166.06 C ATOM 122 CB PRO 19 25.274 13.289 38.434 1.00166.06 C ATOM 123 CG PRO 19 24.457 12.764 39.629 1.00166.06 C ATOM 124 C PRO 19 24.338 15.598 38.125 1.00166.06 C ATOM 125 O PRO 19 24.593 16.272 37.128 1.00166.06 O ATOM 126 N ARG 20 23.117 15.550 38.687 1.00254.32 N ATOM 127 CA ARG 20 22.130 16.450 38.185 1.00254.32 C ATOM 128 CB ARG 20 20.681 15.949 38.287 1.00254.32 C ATOM 129 CG ARG 20 19.686 16.935 37.678 1.00254.32 C ATOM 130 CD ARG 20 18.240 16.449 37.722 1.00254.32 C ATOM 131 NE ARG 20 17.389 17.581 37.268 1.00254.32 N ATOM 132 CZ ARG 20 16.240 17.867 37.947 1.00254.32 C ATOM 133 NH1 ARG 20 15.854 17.080 38.993 1.00254.32 N ATOM 134 NH2 ARG 20 15.473 18.931 37.571 1.00254.32 N ATOM 135 C ARG 20 22.304 17.628 39.080 1.00254.32 C ATOM 136 O ARG 20 22.317 17.483 40.294 1.00254.32 O ATOM 137 N GLY 21 22.423 18.823 38.492 1.00139.67 N ATOM 138 CA GLY 21 22.789 20.061 39.128 1.00139.67 C ATOM 139 C GLY 21 21.842 20.500 40.212 1.00139.67 C ATOM 140 O GLY 21 22.165 21.406 40.976 1.00139.67 O ATOM 141 N ALA 22 20.612 19.970 40.254 1.00 69.66 N ATOM 142 CA ALA 22 19.610 20.454 41.168 1.00 69.66 C ATOM 143 CB ALA 22 18.245 19.774 40.957 1.00 69.66 C ATOM 144 C ALA 22 19.939 20.320 42.636 1.00 69.66 C ATOM 145 O ALA 22 19.640 21.238 43.399 1.00 69.66 O ATOM 146 N SER 23 20.541 19.207 43.105 1.00 88.03 N ATOM 147 CA SER 23 20.675 19.083 44.534 1.00 88.03 C ATOM 148 CB SER 23 20.101 17.766 45.086 1.00 88.03 C ATOM 149 OG SER 23 20.282 17.700 46.493 1.00 88.03 O ATOM 150 C SER 23 22.106 19.136 44.951 1.00 88.03 C ATOM 151 O SER 23 23.008 18.766 44.200 1.00 88.03 O ATOM 152 N CYS 24 22.341 19.634 46.185 1.00 65.04 N ATOM 153 CA CYS 24 23.681 19.669 46.667 1.00 65.04 C ATOM 154 CB CYS 24 24.122 21.063 47.095 1.00 65.04 C ATOM 155 SG CYS 24 24.183 22.089 45.605 1.00 65.04 S ATOM 156 C CYS 24 23.775 18.695 47.788 1.00 65.04 C ATOM 157 O CYS 24 23.010 18.745 48.750 1.00 65.04 O ATOM 158 N LEU 25 24.743 17.769 47.670 1.00 77.68 N ATOM 159 CA LEU 25 24.846 16.702 48.609 1.00 77.68 C ATOM 160 CB LEU 25 25.174 15.380 47.894 1.00 77.68 C ATOM 161 CG LEU 25 24.137 15.089 46.781 1.00 77.68 C ATOM 162 CD1 LEU 25 24.387 13.746 46.079 1.00 77.68 C ATOM 163 CD2 LEU 25 22.701 15.224 47.307 1.00 77.68 C ATOM 164 C LEU 25 25.904 17.071 49.595 1.00 77.68 C ATOM 165 O LEU 25 27.013 17.453 49.230 1.00 77.68 O ATOM 166 N ASP 26 25.563 16.974 50.893 0.50 56.89 N ATOM 167 CA ASP 26 26.428 17.424 51.943 0.50 56.89 C ATOM 168 CB ASP 26 25.787 17.357 53.335 0.50 56.89 C ATOM 169 CG ASP 26 24.770 18.474 53.452 0.50 56.89 C ATOM 170 OD1 ASP 26 25.060 19.595 52.948 1.00 56.89 O ATOM 171 OD2 ASP 26 23.696 18.230 54.056 1.00 56.89 O ATOM 172 C ASP 26 27.673 16.613 52.026 0.50 56.89 C ATOM 173 O ASP 26 27.641 15.406 52.261 0.50 56.89 O ATOM 174 N VAL 27 28.817 17.273 51.779 1.00 48.37 N ATOM 175 CA VAL 27 30.079 16.652 52.022 1.00 48.37 C ATOM 176 CB VAL 27 31.242 17.365 51.397 1.00 48.37 C ATOM 177 CG1 VAL 27 32.539 16.723 51.918 1.00 48.37 C ATOM 178 CG2 VAL 27 31.094 17.262 49.869 1.00 48.37 C ATOM 179 C VAL 27 30.260 16.663 53.502 1.00 48.37 C ATOM 180 O VAL 27 30.761 15.709 54.094 1.00 48.37 O ATOM 181 N ASP 28 29.820 17.765 54.140 1.00 71.37 N ATOM 182 CA ASP 28 29.983 17.952 55.552 1.00 71.37 C ATOM 183 CB ASP 28 29.451 16.798 56.418 1.00 71.37 C ATOM 184 CG ASP 28 29.565 17.244 57.872 1.00 71.37 C ATOM 185 OD1 ASP 28 29.843 18.453 58.092 1.00 71.37 O ATOM 186 OD2 ASP 28 29.389 16.389 58.781 1.00 71.37 O ATOM 187 C ASP 28 31.474 18.080 55.835 1.00 71.37 C ATOM 188 O ASP 28 32.094 19.029 55.286 1.00 71.37 O ATOM 189 OXT ASP 28 32.012 17.232 56.598 1.00 71.37 O