Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1a44_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PRO 1.A N ASP 34.A O no hydrogen 2.980 N/A SER 5.A N ASP 3.A OD1 no hydrogen 3.015 N/A SER 5.A OG ASP 3.A OD1 no hydrogen 2.800 N/A SER 5.A OG ASP 3.A OD2 no hydrogen 3.294 N/A LYS 6.A N ASP 3.A O no hydrogen 3.049 N/A LYS 6.A NZ ASP 3.A OD2 no hydrogen 2.629 N/A LYS 6.A NZ SER 5.A OG no hydrogen 3.003 N/A TRP 7.A N LEU 4.A O no hydrogen 3.020 N/A TRP 7.A NE1 ASP 17.A O no hydrogen 2.836 N/A GLY 9.A N LYS 6.A O no hydrogen 2.917 N/A SER 12.A N GLY 9.A O no hydrogen 2.909 N/A LEU 13.A N TRP 7.A O no hydrogen 2.917 N/A GLU 15.A N SER 12.A O no hydrogen 3.141 N/A VAL 16.A N LEU 13.A O no hydrogen 2.874 N/A ASP 17.A N LEU 13.A O no hydrogen 3.160 N/A GLU 18.A N ASP 17.A OD1 no hydrogen 2.733 N/A GLN 21.A N PRO 162.A O no hydrogen 3.117 N/A HIS 22.A N VAL 163.A O no hydrogen 2.974 N/A LEU 24.A N GLY 165.A O no hydrogen 2.976 N/A GLN 25.A N THR 53.A O no hydrogen 2.680 N/A LYS 27.A N SER 51.A O no hydrogen 2.978 N/A LYS 27.A NZ GLU 32.A OE1 no hydrogen 3.312 N/A TYR 28.A N ALA 31.A O no hydrogen 2.830 N/A ALA 31.A N TYR 28.A O no hydrogen 3.477 N/A VAL 33.A N VAL 26.A O no hydrogen 2.846 N/A GLY 37.A N CYS 167.A O no hydrogen 2.703 N/A LYS 38.A N GLU 35.A O no hydrogen 3.000 N/A LYS 38.A NZ GLU 32.A O no hydrogen 3.232 N/A LEU 40.A N GLN 169.A O no hydrogen 2.869 N/A THR 41.A N GLN 44.A OE1 no hydrogen 2.874 N/A THR 43.A N ASP 173.A OD2 no hydrogen 2.934 N/A THR 43.A OG1 ASP 173.A OD2 no hydrogen 2.655 N/A GLN 44.A N THR 41.A OG1 no hydrogen 3.009 N/A VAL 45.A N THR 41.A O no hydrogen 3.140 N/A VAL 45.A N PRO 42.A O no hydrogen 3.157 N/A LYS 46.A N THR 43.A O no hydrogen 3.472 N/A ARG 48.A NH2 ASP 104.A OD1 no hydrogen 2.976 N/A THR 50.A N LYS 27.A O no hydrogen 2.771 N/A SER 51.A N LYS 27.A O no hydrogen 3.446 N/A THR 53.A N GLN 25.A O no hydrogen 3.041 N/A LEU 57.A N TRP 54.A O no hydrogen 3.145 N/A ASP 58.A N TYR 63.A OH no hydrogen 2.838 N/A GLY 60.A N ASP 58.A OD1 no hydrogen 2.795 N/A LYS 61.A N ASP 58.A O no hydrogen 2.961 N/A LYS 61.A NZ GLU 125.A OE2 no hydrogen 2.683 N/A TYR 63.A N MET 91.A O no hydrogen 2.847 N/A THR 64.A N TYR 124.A O no hydrogen 2.883 N/A THR 64.A OG1 GLN 126.A OE1 no hydrogen 2.945 N/A LEU 65.A N VAL 88.A O no hydrogen 2.722 N/A VAL 66.A N LEU 122.A O no hydrogen 2.879 N/A LEU 67.A N PHE 86.A O no hydrogen 2.854 N/A THR 68.A N VAL 120.A O no hydrogen 2.895 N/A THR 68.A OG1 GLU 82.A OE1 no hydrogen 2.886 N/A ASP 69.A N TRP 83.A O no hydrogen 2.960 N/A ASP 71.A N ASP 69.A OD1 no hydrogen 2.802 N/A ARG 75.A NH2 PRO 10.A O no hydrogen 2.773 N/A ASP 77.A N SER 74.A OG no hydrogen 2.893 N/A TYR 80.A N ALA 72.A O no hydrogen 2.991 N/A ARG 81.A N PRO 78.A O no hydrogen 3.031 N/A ARG 81.A NE PRO 70.A O no hydrogen 2.680 N/A ARG 81.A NH2 PRO 70.A O no hydrogen 3.151 N/A ARG 81.A NH2 ASP 71.A OD1 no hydrogen 3.199 N/A GLU 82.A N PHE 148.A O no hydrogen 2.839 N/A TRP 83.A N ASP 69.A O no hydrogen 2.876 N/A HIS 84.A N ARG 145.A O no hydrogen 3.042 N/A HIS 84.A ND1 ARG 145.A O no hydrogen 2.928 N/A HIS 84.A NE2 SER 103.A OG no hydrogen 2.791 N/A HIS 85.A N LEU 67.A O no hydrogen 2.833 N/A HIS 85.A ND1 VAL 106.A O no hydrogen 2.824 N/A PHE 86.A N LEU 67.A O no hydrogen 3.189 N/A LEU 87.A N SER 103.A O no hydrogen 3.079 N/A VAL 88.A N LEU 65.A O no hydrogen 2.925 N/A VAL 89.A N THR 100.A O no hydrogen 2.924 N/A ASN 90.A N GLN 126.A OE1 no hydrogen 2.799 N/A ASN 90.A ND2 LEU 130.A O no hydrogen 3.240 N/A MET 91.A N TYR 63.A O no hydrogen 2.909 N/A LYS 92.A N SER 98.A OG no hydrogen 2.810 N/A GLY 93.A N LYS 61.A O no hydrogen 2.937 N/A ASN 94.A ND2 ILE 52.A O no hydrogen 2.768 N/A ASN 95.A N LYS 92.A O no hydrogen 2.973 N/A ASN 95.A ND2 SER 97.A OG no hydrogen 2.788 N/A SER 98.A N ASN 95.A O no hydrogen 2.814 N/A SER 98.A OG ASN 95.A O no hydrogen 2.762 N/A GLY 99.A N ILE 96.A O no hydrogen 3.022 N/A THR 100.A N VAL 89.A O no hydrogen 2.827 N/A LEU 102.A N LEU 87.A O no hydrogen 2.924 N/A SER 103.A N LEU 87.A O no hydrogen 3.169 N/A SER 103.A OG HIS 84.A NE2 no hydrogen 2.791 N/A ASP 104.A N LEU 137.A O no hydrogen 2.949 N/A TYR 105.A N ASP 104.A OD1 no hydrogen 2.738 N/A TYR 105.A OH VAL 45.A O no hydrogen 2.495 N/A VAL 106.A N HIS 85.A O no hydrogen 3.076 N/A SER 108.A OG TYR 168.A OH no hydrogen 2.665 N/A THR 114.A N PRO 111.A O no hydrogen 3.077 N/A THR 114.A OG1 PRO 73.A O no hydrogen 3.361 N/A THR 114.A OG1 PRO 111.A O no hydrogen 2.732 N/A THR 114.A OG1 HIS 117.A NE2 no hydrogen 2.827 N/A HIS 117.A N ALA 170.A O no hydrogen 2.912 N/A HIS 117.A ND1 ASP 69.A OD2 no hydrogen 2.803 N/A HIS 117.A NE2 THR 114.A OG1 no hydrogen 2.827 N/A ARG 118.A N ASP 71.A OD2 no hydrogen 2.804 N/A ARG 118.A NE ASP 71.A OD2 no hydrogen 2.924 N/A ARG 118.A NH1 LEU 11.A O no hydrogen 2.674 N/A ARG 118.A NH1 GLU 15.A OE1 no hydrogen 2.964 N/A ARG 118.A NH2 GLU 15.A OE1 no hydrogen 2.922 N/A ARG 118.A NH2 ASP 71.A OD1 no hydrogen 2.778 N/A TYR 119.A N TYR 168.A O no hydrogen 2.743 N/A VAL 120.A N THR 68.A O no hydrogen 2.833 N/A TRP 121.A N THR 166.A O no hydrogen 2.968 N/A TRP 121.A NE1 TYR 28.A OH no hydrogen 2.909 N/A LEU 122.A N VAL 66.A O no hydrogen 2.918 N/A VAL 123.A N ALA 164.A O no hydrogen 2.836 N/A TYR 124.A N THR 64.A O no hydrogen 2.964 N/A TYR 124.A OH ASP 17.A OD2 no hydrogen 2.533 N/A GLN 126.A N LEU 62.A O no hydrogen 2.901 N/A GLN 126.A NE2 ASN 90.A OD1 no hydrogen 3.083 N/A GLN 126.A NE2 GLY 128.A O no hydrogen 2.710 N/A LEU 130.A N ASN 90.A OD1 no hydrogen 2.801 N/A ASP 133.A N TYR 157.A OH no hydrogen 3.234 N/A LEU 137.A N LEU 102.A O no hydrogen 2.740 N/A ASN 139.A ND2 TYR 105.A O no hydrogen 2.964 N/A ARG 140.A N SER 138.A OG no hydrogen 2.954 N/A ASP 143.A N SER 141.A OG no hydrogen 2.927 N/A ARG 145.A N GLY 142.A O no hydrogen 3.258 N/A ARG 145.A NH1 HIS 84.A O no hydrogen 3.068 N/A ARG 145.A NH1 HIS 85.A O no hydrogen 3.148 N/A ARG 145.A NH1 ASP 104.A O no hydrogen 3.229 N/A ARG 145.A NH2 ASP 104.A O no hydrogen 2.790 N/A ARG 145.A NH2 SER 138.A O no hydrogen 2.914 N/A LYS 147.A N TYR 80.A O no hydrogen 3.032 N/A LYS 147.A NZ LYS 79.A O no hydrogen 3.267 N/A LYS 147.A NZ ARG 81.A O no hydrogen 3.048 N/A PHE 148.A N GLU 82.A O no hydrogen 2.759 N/A VAL 150.A N GLU 82.A OE1 no hydrogen 2.880 N/A PHE 153.A N LYS 149.A O no hydrogen 2.942 N/A ARG 154.A N VAL 150.A O no hydrogen 2.806 N/A ARG 154.A NE ASP 17.A OD2 no hydrogen 2.814 N/A ARG 154.A NH1 LEU 159.A O no hydrogen 3.165 N/A ARG 154.A NH2 ASP 17.A OD1 no hydrogen 2.856 N/A ARG 154.A NH2 ASP 17.A OD2 no hydrogen 3.507 N/A ARG 154.A NH2 GLU 18.A OE2 no hydrogen 3.231 N/A LYS 155.A N ALA 151.A O no hydrogen 3.109 N/A LYS 156.A N SER 152.A O no hydrogen 2.874 N/A LYS 156.A NZ ASP 133.A OD1 no hydrogen 2.826 N/A LYS 156.A NZ GLU 134.A OE2 no hydrogen 2.757 N/A LYS 156.A NZ TYR 157.A OH no hydrogen 3.459 N/A TYR 157.A N PHE 153.A O no hydrogen 3.316 N/A TYR 157.A OH GLU 134.A OE1 no hydrogen 2.498 N/A GLU 158.A N LYS 155.A O no hydrogen 2.962 N/A LEU 159.A N ARG 154.A O no hydrogen 2.821 N/A VAL 163.A N VAL 123.A O no hydrogen 2.883 N/A ALA 164.A N VAL 123.A O no hydrogen 3.406 N/A GLY 165.A N HIS 22.A O no hydrogen 3.060 N/A THR 166.A N TRP 121.A O no hydrogen 2.966 N/A CYS 167.A SG TYR 119.A O no hydrogen 3.735 N/A CYS 167.A SG TYR 168.A O no hydrogen 3.560 N/A TYR 168.A N TYR 119.A O no hydrogen 3.023 N/A TYR 168.A OH SER 108.A OG no hydrogen 2.665 N/A GLN 169.A N LYS 38.A O no hydrogen 2.876 N/A GLN 169.A NE2 GLY 37.A O no hydrogen 2.841 N/A ALA 170.A N HIS 117.A O no hydrogen 3.119 N/A TYR 175.A N ASP 173.A OD1 no hydrogen 2.887 N/A VAL 176.A N ASP 173.A O no hydrogen 3.024 N/A LYS 178.A N TYR 175.A O no hydrogen 2.834 N/A LEU 179.A N TYR 175.A O no hydrogen 3.401 N/A TYR 180.A N VAL 176.A O no hydrogen 3.040 N/A TYR 180.A OH GLY 109.A O no hydrogen 2.598 N/A GLU 181.A N PRO 177.A O no hydrogen 3.006 N/A GLN 182.A N LYS 178.A O no hydrogen 2.989 N/A GLN 182.A NE2 ASN 139.A O no hydrogen 2.900 N/A LEU 183.A N LEU 179.A O no hydrogen 3.002 N/A SER 184.A N GLU 181.A O no hydrogen 3.086 N/A SER 184.A OG GLU 181.A O no hydrogen 2.700 N/A SER 184.A OG GLY 185.A O no hydrogen 3.561 N/A GLY 185.A N GLN 182.A O no hydrogen 3.146 N/A