Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2jij_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 3.A N GLU 81.A OE2 no hydrogen 2.913 N/A TRP 11.A NE1 ASN 29.A O no hydrogen 2.808 N/A VAL 16.A N LEU 26.A O no hydrogen 2.738 N/A LEU 18.A N ALA 24.A O no hydrogen 2.825 N/A SER 19.A OG PRO 22.A O no hydrogen 2.727 N/A ALA 24.A N SER 19.A O no hydrogen 3.221 N/A PHE 25.A N MET 166.A O no hydrogen 2.636 N/A LEU 26.A N VAL 16.A O no hydrogen 2.728 N/A LEU 27.A N ALA 164.A O no hydrogen 2.783 N/A LYS 28.A N GLU 14.A O no hydrogen 2.924 N/A LYS 28.A NZ ASP 163.A OD1 no hydrogen 3.534 N/A LYS 28.A NZ ASP 163.A OD2 no hydrogen 2.784 N/A ASN 29.A N ASP 163.A OD1 no hydrogen 3.138 N/A LEU 31.A N GLY 162.A O no hydrogen 2.923 N/A SER 32.A N GLU 35.A OE1 no hydrogen 2.963 N/A GLU 34.A N GLU 34.A OE1 no hydrogen 2.692 N/A GLU 35.A N SER 32.A OG no hydrogen 3.093 N/A CYS 36.A N SER 32.A O no hydrogen 3.012 N/A CYS 36.A SG SER 32.A O no hydrogen 3.366 N/A CYS 36.A SG TYR 125.A O no hydrogen 3.982 N/A ASP 37.A N ASP 33.A O no hydrogen 2.957 N/A TYR 38.A N GLU 34.A O no hydrogen 2.762 N/A TYR 38.A OH ASP 62.A OD2 no hydrogen 2.560 N/A ILE 39.A N GLU 35.A O no hydrogen 2.970 N/A VAL 40.A N CYS 36.A O no hydrogen 3.010 N/A GLU 41.A N ASP 37.A O no hydrogen 2.859 N/A LYS 42.A N TYR 38.A O no hydrogen 2.975 N/A ALA 43.A N ILE 39.A O no hydrogen 2.798 N/A ARG 44.A N VAL 40.A O no hydrogen 2.804 N/A ARG 44.A NH2 GLU 41.A OE1 no hydrogen 3.287 N/A LYS 46.A N ALA 43.A O no hydrogen 2.889 N/A LYS 46.A NZ TRP 56.A O no hydrogen 3.029 N/A MET 47.A N ARG 44.A O no hydrogen 3.223 N/A VAL 48.A N GLY 54.A O no hydrogen 3.336 N/A ARG 50.A NH1 SER 52.A O no hydrogen 2.911 N/A ARG 50.A NH1 SER 52.A OG no hydrogen 2.881 N/A THR 51.A OG1 ARG 50.A O no hydrogen 3.079 N/A THR 53.A N HIS 90.A O no hydrogen 3.276 N/A GLY 54.A N VAL 48.A O no hydrogen 2.849 N/A THR 55.A N VAL 88.A O no hydrogen 2.954 N/A PHE 57.A N LEU 86.A O no hydrogen 2.673 N/A ALA 58.A N GLU 61.A OE1 no hydrogen 2.609 N/A LYS 59.A NZ LEU 80.A O no hydrogen 2.757 N/A LYS 59.A NZ HIS 83.A O no hydrogen 3.156 N/A GLY 60.A N GLU 69.A OE1 no hydrogen 2.959 N/A GLU 61.A N ALA 58.A O no hydrogen 2.961 N/A ILE 65.A N ASP 62.A OD1 no hydrogen 2.688 N/A SER 66.A N ASP 62.A O no hydrogen 2.771 N/A SER 66.A OG ASP 62.A O no hydrogen 2.833 N/A LYS 67.A N SER 63.A O no hydrogen 3.285 N/A LYS 67.A N VAL 64.A O no hydrogen 3.279 N/A LYS 67.A NZ GLU 9.A OE1 no hydrogen 2.846 N/A GLU 69.A N ILE 65.A O no hydrogen 2.755 N/A LYS 70.A N SER 66.A O no hydrogen 2.934 N/A ARG 71.A N LYS 67.A O no hydrogen 2.977 N/A ARG 71.A NH1 PHE 30.A O no hydrogen 2.951 N/A ARG 71.A NH1 GLU 35.A OE1 no hydrogen 2.796 N/A ARG 71.A NH1 GLU 35.A OE2 no hydrogen 3.407 N/A ARG 71.A NH2 GLU 35.A OE2 no hydrogen 2.777 N/A VAL 72.A N ILE 68.A O no hydrogen 2.898 N/A ALA 73.A N GLU 69.A O no hydrogen 3.011 N/A GLN 74.A N LYS 70.A O no hydrogen 3.014 N/A GLN 74.A NE2 PHE 4.A O no hydrogen 2.970 N/A GLN 74.A NE2 GLU 6.A O no hydrogen 3.002 N/A VAL 75.A N ARG 71.A O no hydrogen 2.928 N/A THR 76.A N VAL 72.A O no hydrogen 3.046 N/A THR 76.A OG1 VAL 72.A O no hydrogen 2.926 N/A THR 76.A OG1 ALA 73.A O no hydrogen 3.185 N/A MET 77.A N GLN 74.A O no hydrogen 3.356 N/A ILE 78.A N ALA 73.A O no hydrogen 3.009 N/A ILE 78.A N THR 76.A OG1 no hydrogen 3.210 N/A LEU 80.A N GLY 3.A O no hydrogen 2.857 N/A GLU 81.A N GLU 81.A OE2 no hydrogen 2.674 N/A ASN 82.A N PRO 79.A O no hydrogen 3.078 N/A ASN 82.A ND2 HIS 200.A O no hydrogen 2.760 N/A HIS 83.A N LEU 80.A O no hydrogen 2.969 N/A HIS 83.A NE2 ILE 78.A O no hydrogen 2.951 N/A GLU 84.A N TRP 198.A O no hydrogen 3.072 N/A LEU 86.A N PHE 57.A O no hydrogen 2.945 N/A GLN 87.A N THR 196.A O no hydrogen 3.213 N/A VAL 88.A N THR 55.A O no hydrogen 2.839 N/A LEU 89.A N SER 194.A O no hydrogen 2.861 N/A HIS 90.A N THR 53.A O no hydrogen 2.986 N/A HIS 90.A NE2 ASP 191.A OD1 no hydrogen 2.703 N/A TYR 91.A N LYS 192.A O no hydrogen 2.669 N/A HIS 92.A N GLN 95.A OE1 no hydrogen 2.590 N/A HIS 92.A ND1 ASP 93.A OD1 no hydrogen 2.572 N/A GLY 94.A N THR 187.A O no hydrogen 2.916 N/A GLN 95.A N HIS 92.A O no hydrogen 3.439 N/A LYS 96.A NZ GLU 98.A OE2 no hydrogen 3.353 N/A TYR 97.A N SER 184.A O no hydrogen 3.104 N/A HIS 100.A N HIS 182.A O no hydrogen 2.848 N/A HIS 100.A ND1 GLU 98.A O no hydrogen 3.093 N/A PHE 104.A N GLN 117.A OE1 no hydrogen 3.302 N/A VAL 108.A N ASP 106.A OD1 no hydrogen 3.200 N/A ASN 109.A N ASP 106.A O no hydrogen 3.174 N/A ALA 110.A N PRO 107.A O no hydrogen 3.394 N/A HIS 114.A N GLY 111.A O no hydrogen 3.240 N/A GLY 115.A N PRO 112.A O no hydrogen 2.992 N/A GLY 116.A N GLY 111.A O no hydrogen 3.009 N/A GLN 117.A NE2 PHE 104.A O no hydrogen 3.383 N/A ARG 118.A NE GLU 84.A OE2 no hydrogen 3.063 N/A ARG 118.A NH1 ASP 102.A O no hydrogen 3.281 N/A ARG 118.A NH2 GLU 84.A OE2 no hydrogen 3.312 N/A VAL 119.A N ILE 199.A O no hydrogen 2.680 N/A VAL 120.A N ILE 199.A O no hydrogen 3.141 N/A THR 121.A N PHE 167.A O no hydrogen 3.035 N/A THR 121.A OG1 ASP 102.A OD2 no hydrogen 2.294 N/A MET 122.A N LYS 197.A O no hydrogen 2.834 N/A LEU 123.A N LEU 165.A O no hydrogen 2.646 N/A MET 124.A N ALA 195.A O no hydrogen 2.665 N/A TYR 125.A N ASP 163.A O no hydrogen 3.080 N/A TYR 125.A OH THR 135.A OG1 no hydrogen 2.718 N/A LEU 126.A N TRP 193.A O no hydrogen 2.764 N/A THR 127.A OG1 ASP 191.A O no hydrogen 2.556 N/A VAL 129.A N PRO 159.A O no hydrogen 3.056 N/A GLU 131.A N LYS 189.A O no hydrogen 2.583 N/A GLY 133.A N PRO 186.A O no hydrogen 2.843 N/A GLU 134.A N GLU 134.A OE1 no hydrogen 2.645 N/A THR 135.A N VAL 157.A O no hydrogen 3.072 N/A THR 135.A OG1 TYR 125.A OH no hydrogen 2.718 N/A VAL 136.A N GLY 183.A O no hydrogen 2.859 N/A LEU 137.A N LEU 155.A O no hydrogen 2.808 N/A ASN 139.A ND2 PRO 178.A O no hydrogen 2.743 N/A ALA 140.A N LEU 137.A O no hydrogen 3.051 N/A GLU 141.A N SER 21.A O no hydrogen 3.051 N/A VAL 144.A N GLY 154.A O no hydrogen 2.987 N/A SER 148.A N GLU 134.A OE2 no hydrogen 2.898 N/A SER 148.A OG GLU 134.A OE1 no hydrogen 2.798 N/A SER 148.A OG GLU 134.A OE2 no hydrogen 3.126 N/A LYS 152.A N SER 148.A O no hydrogen 3.113 N/A ARG 153.A N CYS 150.A O no hydrogen 3.174 N/A GLY 154.A N ALA 151.A O no hydrogen 3.212 N/A VAL 157.A N THR 135.A O no hydrogen 2.950 N/A LYS 161.A N THR 128.A OG1 no hydrogen 2.774 N/A LYS 161.A NZ ASP 37.A OD1 no hydrogen 2.861 N/A GLY 162.A N TYR 125.A O no hydrogen 2.940 N/A ASP 163.A N ILE 160.A O no hydrogen 3.085 N/A ALA 164.A N LEU 27.A O no hydrogen 2.847 N/A LEU 165.A N LEU 123.A O no hydrogen 2.647 N/A MET 166.A N PHE 25.A O no hydrogen 2.769 N/A PHE 167.A N THR 121.A O no hydrogen 2.998 N/A TYR 168.A N ARG 23.A O no hydrogen 2.901 N/A SER 169.A N VAL 119.A O no hydrogen 2.819 N/A SER 169.A OG ARG 118.A O no hydrogen 3.083 N/A SER 169.A OG VAL 119.A O no hydrogen 3.358 N/A LYS 171.A N SER 175.A O no hydrogen 2.729 N/A GLY 174.A N LYS 171.A O no hydrogen 2.829 N/A SER 175.A N ASP 173.A OD1 no hydrogen 2.924 N/A SER 175.A OG ASP 173.A OD1 no hydrogen 2.841 N/A ASN 176.A ND2 PHE 104.A O no hydrogen 3.404 N/A ASP 177.A N SER 169.A O no hydrogen 2.918 N/A ALA 179.A N ASP 177.A OD1 no hydrogen 3.243 N/A SER 180.A N ASP 177.A O no hydrogen 2.893 N/A SER 180.A OG ASP 177.A O no hydrogen 2.838 N/A LEU 181.A N PRO 178.A O no hydrogen 3.501 N/A HIS 182.A N HIS 100.A O no hydrogen 2.566 N/A GLY 183.A N VAL 136.A O no hydrogen 2.839 N/A SER 184.A N TYR 97.A O no hydrogen 2.887 N/A CYS 185.A N GLU 134.A O no hydrogen 2.769 N/A THR 187.A N GLN 95.A O no hydrogen 3.291 N/A LYS 189.A N GLU 131.A O no hydrogen 3.389 N/A LYS 192.A N TYR 91.A O no hydrogen 2.966 N/A LYS 192.A NZ GLY 133.A O no hydrogen 2.865 N/A LYS 192.A NZ SER 184.A OG no hydrogen 2.582 N/A TRP 193.A N THR 127.A OG1 no hydrogen 3.213 N/A SER 194.A N LEU 89.A O no hydrogen 2.940 N/A ALA 195.A N MET 124.A O no hydrogen 2.792 N/A THR 196.A N GLN 87.A O no hydrogen 2.720 N/A LYS 197.A N MET 122.A O no hydrogen 2.761 N/A LYS 197.A NZ GLU 69.A OE2 no hydrogen 2.723 N/A LYS 197.A NZ GLU 84.A O no hydrogen 2.678 N/A LYS 197.A NZ GLY 85.A O no hydrogen 3.197 N/A TRP 198.A NE1 ASP 102.A OD2 no hydrogen 2.676 N/A ILE 199.A N VAL 120.A O no hydrogen 2.857 N/A HIS 200.A N ASN 82.A O no hydrogen 2.729 N/A HIS 200.A ND1 GLY 116.A O no hydrogen 2.738 N/A HIS 200.A NE2 GLU 84.A OE2 no hydrogen 2.523 N/A VAL 201.A N GLN 117.A O no hydrogen 3.008 N/A ALA 202.A N GLY 115.A O no hydrogen 2.827 N/A ILE 204.A N GLU 81.A O no hydrogen 3.014 N/A GLY 205.A N GLU 113.A O no hydrogen 2.753 N/A