EXPDTA THEORETICAL MODEL, MODELLER 9.15 2017/03/07 09:13:34 REMARK 6 MODELLER OBJECTIVE FUNCTION: -723.8453 REMARK 6 MODELLER BEST TEMPLATE % SEQ ID: 33.333 REMARK 6 SEQUENCE: model REMARK 6 DOPE score: -723.84528 REMARK 6 GA341 score: 0.19920 REMARK 6 Normalized DOPE score: -0.76764 REMARK 6 TEMPLATE: d1qkra_ ATOM 1 N ASN 772 34.571 7.859 14.204 1.00 28.21 N ATOM 2 CA ASN 772 33.291 8.589 14.031 1.00 28.21 C ATOM 3 CB ASN 772 33.395 9.992 14.668 1.00 28.21 C ATOM 4 CG ASN 772 33.314 9.836 16.188 1.00 28.21 C ATOM 5 OD1 ASN 772 32.275 9.454 16.726 1.00 28.21 O ATOM 6 ND2 ASN 772 34.433 10.144 16.901 1.00 28.21 N ATOM 7 C ASN 772 32.978 8.719 12.579 1.00 28.21 C ATOM 8 O ASN 772 32.060 8.080 12.063 1.00 28.21 O ATOM 9 N ALA 773 33.773 9.547 11.884 1.00 24.18 N ATOM 10 CA ALA 773 33.595 9.749 10.483 1.00 24.18 C ATOM 11 CB ALA 773 34.655 10.696 9.893 1.00 24.18 C ATOM 12 C ALA 773 33.790 8.423 9.829 1.00 24.18 C ATOM 13 O ALA 773 33.075 8.060 8.896 1.00 24.18 O ATOM 14 N LYS 774 34.773 7.658 10.336 1.00100.16 N ATOM 15 CA LYS 774 35.173 6.400 9.769 1.00100.16 C ATOM 16 CB LYS 774 36.337 5.740 10.533 1.00100.16 C ATOM 17 CG LYS 774 37.585 6.606 10.731 1.00100.16 C ATOM 18 CD LYS 774 38.317 6.995 9.446 1.00100.16 C ATOM 19 CE LYS 774 39.405 8.049 9.662 1.00100.16 C ATOM 20 NZ LYS 774 39.820 8.617 8.361 1.00100.16 N ATOM 21 C LYS 774 34.053 5.401 9.827 1.00100.16 C ATOM 22 O LYS 774 33.858 4.631 8.887 1.00100.16 O ATOM 23 N TRP 775 33.280 5.386 10.930 1.00 75.90 N ATOM 24 CA TRP 775 32.331 4.323 11.122 1.00 75.90 C ATOM 25 CB TRP 775 32.262 3.851 12.580 1.00 75.90 C ATOM 26 CG TRP 775 33.585 3.291 13.015 1.00 75.90 C ATOM 27 CD2 TRP 775 34.063 1.995 12.634 1.00 75.90 C ATOM 28 CD1 TRP 775 34.575 3.876 13.747 1.00 75.90 C ATOM 29 NE1 TRP 775 35.647 3.024 13.842 1.00 75.90 N ATOM 30 CE2 TRP 775 35.348 1.861 13.161 1.00 75.90 C ATOM 31 CE3 TRP 775 33.481 1.003 11.897 1.00 75.90 C ATOM 32 CZ2 TRP 775 36.079 0.728 12.960 1.00 75.90 C ATOM 33 CZ3 TRP 775 34.217 -0.142 11.704 1.00 75.90 C ATOM 34 CH2 TRP 775 35.486 -0.271 12.225 1.00 75.90 C ATOM 35 C TRP 775 30.950 4.708 10.716 1.00 75.90 C ATOM 36 O TRP 775 30.603 5.883 10.605 1.00 75.90 O ATOM 37 N ASP 776 30.144 3.658 10.449 1.00 85.04 N ATOM 38 CA ASP 776 28.762 3.740 10.093 1.00 85.04 C ATOM 39 CB ASP 776 28.274 2.407 9.484 1.00 85.04 C ATOM 40 CG ASP 776 26.994 2.596 8.683 1.00 85.04 C ATOM 41 OD1 ASP 776 26.543 3.761 8.524 1.00 85.04 O ATOM 42 OD2 ASP 776 26.452 1.560 8.213 1.00 85.04 O ATOM 43 C ASP 776 28.053 3.967 11.393 1.00 85.04 C ATOM 44 O ASP 776 28.656 3.828 12.455 1.00 85.04 O ATOM 45 N THR 777 26.759 4.339 11.359 1.00105.14 N ATOM 46 CA THR 777 26.114 4.561 12.618 1.00105.14 C ATOM 47 CB THR 777 24.698 5.060 12.508 1.00105.14 C ATOM 48 OG1 THR 777 24.209 5.398 13.798 1.00105.14 O ATOM 49 CG2 THR 777 23.806 3.994 11.857 1.00105.14 C ATOM 50 C THR 777 26.130 3.259 13.358 1.00105.14 C ATOM 51 O THR 777 26.452 3.218 14.542 1.00105.14 O ATOM 52 N GLY 778 25.795 2.152 12.665 1.00 87.89 N ATOM 53 CA GLY 778 25.875 0.856 13.278 1.00 87.89 C ATOM 54 C GLY 778 24.927 0.813 14.427 1.00 87.89 C ATOM 55 O GLY 778 25.210 0.184 15.445 1.00 87.89 O ATOM 56 N GLU 779 23.776 1.493 14.298 1.00228.88 N ATOM 57 CA GLU 779 22.824 1.503 15.366 1.00228.88 C ATOM 58 CB GLU 779 22.331 0.099 15.767 1.00228.88 C ATOM 59 CG GLU 779 21.432 -0.571 14.727 1.00228.88 C ATOM 60 CD GLU 779 20.111 0.175 14.741 1.00228.88 C ATOM 61 OE1 GLU 779 20.163 1.430 14.682 1.00228.88 O ATOM 62 OE2 GLU 779 19.038 -0.482 14.813 1.00228.88 O ATOM 63 C GLU 779 23.491 2.095 16.562 1.00228.88 C ATOM 64 O GLU 779 23.118 1.778 17.692 1.00228.88 O ATOM 65 N ASN 780 24.500 2.968 16.364 1.00 88.28 N ATOM 66 CA ASN 780 25.089 3.581 17.517 1.00 88.28 C ATOM 67 CB ASN 780 26.599 3.291 17.675 1.00 88.28 C ATOM 68 CG ASN 780 26.969 3.495 19.141 1.00 88.28 C ATOM 69 OD1 ASN 780 27.026 4.624 19.625 1.00 88.28 O ATOM 70 ND2 ASN 780 27.195 2.370 19.874 1.00 88.28 N ATOM 71 C ASN 780 24.873 5.054 17.356 1.00 88.28 C ATOM 72 O ASN 780 25.447 5.689 16.471 1.00 88.28 O ATOM 73 N PRO 781 24.016 5.588 18.188 1.00 95.30 N ATOM 74 CA PRO 781 23.685 6.987 18.116 1.00 95.30 C ATOM 75 CD PRO 781 22.899 4.796 18.681 1.00 95.30 C ATOM 76 CB PRO 781 22.411 7.160 18.946 1.00 95.30 C ATOM 77 CG PRO 781 21.733 5.782 18.864 1.00 95.30 C ATOM 78 C PRO 781 24.779 7.936 18.493 1.00 95.30 C ATOM 79 O PRO 781 24.744 9.077 18.033 1.00 95.30 O ATOM 80 N ILE 782 25.742 7.532 19.336 1.00 93.43 N ATOM 81 CA ILE 782 26.752 8.487 19.686 1.00 93.43 C ATOM 82 CB ILE 782 27.713 8.014 20.742 1.00 93.43 C ATOM 83 CG1 ILE 782 28.549 6.822 20.255 1.00 93.43 C ATOM 84 CG2 ILE 782 26.908 7.721 22.018 1.00 93.43 C ATOM 85 CD1 ILE 782 29.728 6.500 21.172 1.00 93.43 C ATOM 86 C ILE 782 27.517 8.787 18.442 1.00 93.43 C ATOM 87 O ILE 782 27.882 9.932 18.178 1.00 93.43 O ATOM 88 N TYR 783 27.764 7.738 17.638 1.00 98.47 N ATOM 89 CA TYR 783 28.518 7.870 16.430 1.00 98.47 C ATOM 90 CB TYR 783 28.690 6.517 15.709 1.00 98.47 C ATOM 91 CG TYR 783 29.613 5.700 16.548 1.00 98.47 C ATOM 92 CD1 TYR 783 29.165 5.094 17.700 1.00 98.47 C ATOM 93 CD2 TYR 783 30.929 5.538 16.174 1.00 98.47 C ATOM 94 CE1 TYR 783 30.023 4.350 18.476 1.00 98.47 C ATOM 95 CE2 TYR 783 31.790 4.796 16.947 1.00 98.47 C ATOM 96 CZ TYR 783 31.337 4.199 18.099 1.00 98.47 C ATOM 97 OH TYR 783 32.221 3.439 18.895 1.00 98.47 O ATOM 98 C TYR 783 27.813 8.813 15.501 1.00 98.47 C ATOM 99 O TYR 783 28.442 9.720 14.959 1.00 98.47 O ATOM 100 N LYS 784 26.488 8.654 15.297 1.00146.90 N ATOM 101 CA LYS 784 25.861 9.542 14.357 1.00146.90 C ATOM 102 CB LYS 784 24.369 9.271 14.088 1.00146.90 C ATOM 103 CG LYS 784 23.851 9.974 12.822 1.00146.90 C ATOM 104 CD LYS 784 23.907 11.508 12.866 1.00146.90 C ATOM 105 CE LYS 784 23.460 12.192 11.568 1.00146.90 C ATOM 106 NZ LYS 784 24.504 12.048 10.525 1.00146.90 N ATOM 107 C LYS 784 25.965 10.927 14.891 1.00146.90 C ATOM 108 O LYS 784 26.327 11.854 14.169 1.00146.90 O ATOM 109 N SER 785 25.659 11.114 16.187 1.00117.29 N ATOM 110 CA SER 785 25.787 12.443 16.697 1.00117.29 C ATOM 111 CB SER 785 24.690 12.824 17.703 1.00117.29 C ATOM 112 OG SER 785 23.423 12.810 17.057 1.00117.29 O ATOM 113 C SER 785 27.077 12.448 17.425 1.00117.29 C ATOM 114 O SER 785 27.114 12.357 18.653 1.00117.29 O ATOM 115 N ALA 786 28.182 12.572 16.672 1.00 18.81 N ATOM 116 CA ALA 786 29.461 12.515 17.304 1.00 18.81 C ATOM 117 CB ALA 786 30.517 11.781 16.462 1.00 18.81 C ATOM 118 C ALA 786 29.940 13.941 17.498 1.00 18.81 C ATOM 119 O ALA 786 31.023 14.277 16.950 1.00 18.81 O ATOM 120 OXT ALA 786 29.227 14.714 18.190 1.00 18.81 O