Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4waj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A OG1 GLN 1.A O no hydrogen 2.625 N/A HIS 4.A N GLU 27.A O no hydrogen 3.068 N/A HIS 4.A ND1 GLU 27.A OE2 no hydrogen 2.829 N/A TYR 5.A N GLU 27.A O no hydrogen 3.249 N/A LEU 6.A N HIS 60.A O no hydrogen 2.947 N/A TRP 7.A N PHE 29.A O no hydrogen 2.741 N/A ILE 8.A N ILE 62.A O no hydrogen 2.700 N/A GLY 9.A N HIS 31.A O no hydrogen 2.999 N/A CYS 10.A SG ASN 33.A O no hydrogen 3.727 N/A CYS 10.A SG HIS 66.A NE2 no hydrogen 3.690 N/A SER 11.A N ASN 33.A O no hydrogen 2.960 N/A ARG 14.A N ASP 12.A OD1.A no hydrogen 2.712 N/A ARG 14.A NE ASP 12.A OD1.A no hydrogen 3.005 N/A ARG 14.A NH2 ASP 12.A OD2.A no hydrogen 2.245 N/A ARG 14.A NH2 ASN 68.A O no hydrogen 2.921 N/A LEU 20.A N SER 16.A O no hydrogen 3.030 N/A THR 21.A N PRO 17.A O no hydrogen 3.050 N/A THR 21.A OG1 PRO 17.A O no hydrogen 2.394 N/A THR 21.A OG1 GLU 18.A O no hydrogen 3.417 N/A ASN 22.A N GLU 18.A O no hydrogen 3.113 N/A PHE 29.A N TYR 5.A O no hydrogen 2.786 N/A HIS 31.A N TRP 7.A O no hydrogen 2.878 N/A ARG 32.A NE CYS 10.A O no hydrogen 2.862 N/A ARG 32.A NH2 ASP 12.A O no hydrogen 2.949 N/A ASN 33.A N GLY 9.A O no hydrogen 3.128 N/A ASN 33.A ND2 HIS 31.A NE2 no hydrogen 3.221 N/A ASN 33.A ND2 GLN 37.A O no hydrogen 2.965 N/A ASN 36.A N ASN 33.A O no hydrogen 3.409 N/A ASN 36.A ND2 ASN 36.A O no hydrogen 3.050 N/A GLN 37.A N ASN 33.A OD1 no hydrogen 2.945 N/A GLN 37.A NE2 TRP 87.A O no hydrogen 2.907 N/A VAL 38.A N GLN 122.A OE1 no hydrogen 2.720 N/A ASP 42.A N ILE 39.A O no hydrogen 2.990 N/A ASN 44.A N ASP 42.A OD1 no hydrogen 3.116 N/A CYS 45.A N ASP 42.A OD2 no hydrogen 3.070 N/A CYS 45.A SG GLN 37.A O no hydrogen 4.013 N/A LEU 46.A N ASP 42.A O no hydrogen 3.097 N/A SER 47.A N PHE 43.A O no hydrogen 2.833 N/A SER 47.A OG PHE 43.A O no hydrogen 2.778 N/A VAL 48.A N ASN 44.A O no hydrogen 3.347 N/A VAL 49.A N CYS 45.A O no hydrogen 3.055 N/A GLN 50.A N LEU 46.A O no hydrogen 2.805 N/A GLN 50.A NE2 ASP 54.A OD2 no hydrogen 3.042 N/A TYR 51.A N SER 47.A O no hydrogen 2.892 N/A ALA 52.A N VAL 48.A O no hydrogen 2.921 N/A VAL 53.A N VAL 49.A O no hydrogen 2.925 N/A ASP 54.A N GLN 50.A O no hydrogen 2.974 N/A VAL 55.A N TYR 51.A O no hydrogen 3.152 N/A LEU 56.A N TYR 51.A O no hydrogen 3.022 N/A LYS 57.A NZ ASP 54.A O no hydrogen 2.711 N/A ILE 58.A N ALA 52.A O no hydrogen 2.855 N/A HIS 60.A ND1 HIS 145.A NE2 no hydrogen 3.213 N/A ILE 61.A N SER 143.A O no hydrogen 2.976 N/A ILE 62.A N LEU 6.A O no hydrogen 2.848 N/A ILE 63.A N HIS 145.A O no hydrogen 2.783 N/A CYS 64.A N ILE 8.A O no hydrogen 2.978 N/A CYS 64.A SG GLY 65.A O no hydrogen 3.295 N/A CYS 64.A SG TRP 147.A O no hydrogen 3.887 N/A GLY 65.A N TRP 147.A O no hydrogen 2.991 N/A HIS 66.A ND1 THR 67.A O no hydrogen 2.990 N/A THR 67.A N TYR 149.A O no hydrogen 3.176 N/A THR 67.A OG1 TYR 149.A O no hydrogen 3.542 N/A THR 67.A OG1 ASP 150.A OD1 no hydrogen 3.043 N/A CYS 69.A SG ASP 12.A OD2.B no hydrogen 3.477 N/A CYS 69.A SG HIS 66.A NE2 no hydrogen 3.542 N/A GLY 70.A N ASP 12.A OD2.B no hydrogen 3.029 N/A HIS 73.A N CYS 69.A O no hydrogen 3.060 N/A ALA 74.A N GLY 70.A O no hydrogen 2.840 N/A ALA 75.A N GLY 71.A O no hydrogen 2.787 N/A MET 76.A N ILE 72.A O no hydrogen 2.990 N/A MET 76.A N HIS 73.A O no hydrogen 3.086 N/A ALA 77.A N HIS 73.A O no hydrogen 2.841 N/A GLY 82.A N ASP 80.A OD1 no hydrogen 3.046 N/A ASN 85.A N GLY 82.A O no hydrogen 2.693 N/A ASN 85.A ND2 GLY 82.A O no hydrogen 2.943 N/A ASN 86.A N LEU 83.A O no hydrogen 3.113 N/A ASN 86.A ND2 LEU 83.A O no hydrogen 3.086 N/A TRP 87.A NE1 VAL 34.A O no hydrogen 2.777 N/A LEU 88.A N ILE 84.A O no hydrogen 2.970 N/A LEU 89.A N ASN 86.A O no hydrogen 3.304 N/A ILE 91.A N LEU 88.A O no hydrogen 2.991 N/A ARG 92.A N LEU 88.A O no hydrogen 2.963 N/A ARG 92.A NH1 ALA 75.A O no hydrogen 3.045 N/A ARG 92.A NH1 MET 76.A O no hydrogen 3.295 N/A ASP 93.A N LEU 89.A O no hydrogen 2.800 N/A TRP 95.A N ILE 91.A O no hydrogen 2.853 N/A PHE 96.A N ARG 92.A O no hydrogen 3.012 N/A LYS 97.A N ASP 93.A O no hydrogen 2.670 N/A LYS 97.A NZ GLU 121.A OE2 no hydrogen 2.830 N/A LYS 97.A NZ TYR 173.A OH no hydrogen 3.401 N/A HIS 98.A N ILE 94.A O no hydrogen 3.020 N/A HIS 98.A NE2 GLU 121.A OE2 no hydrogen 2.783 N/A GLY 99.A N PHE 96.A O no hydrogen 3.120 N/A LEU 102.A N HIS 98.A O no hydrogen 2.974 N/A GLY 103.A N GLY 99.A O no hydrogen 2.680 N/A LYS 104.A N HIS 100.A O no hydrogen 3.157 N/A LEU 105.A N LEU 102.A O no hydrogen 2.992 N/A LYS 109.A N SER 106.A O no hydrogen 2.681 N/A ARG 110.A NE LEU 105.A O no hydrogen 2.857 N/A ARG 110.A NH2 LEU 105.A O no hydrogen 2.855 N/A MET 113.A N LYS 109.A O no hydrogen 3.165 N/A LEU 114.A N ARG 110.A O no hydrogen 2.897 N/A THR 115.A N ALA 111.A O no hydrogen 3.020 N/A THR 115.A OG1 ALA 111.A O no hydrogen 2.927 N/A LYS 116.A N ASP 112.A O no hydrogen 3.159 N/A LYS 116.A NZ GLN 159.A OE1 no hydrogen 2.817 N/A ILE 117.A N MET 113.A O no hydrogen 2.783 N/A ASN 118.A N LEU 114.A O no hydrogen 2.816 N/A ASN 118.A ND2 ALA 35.A O no hydrogen 3.332 N/A VAL 119.A N THR 115.A O no hydrogen 3.179 N/A ALA 120.A N LYS 116.A O no hydrogen 3.271 N/A GLU 121.A N ILE 117.A O no hydrogen 2.818 N/A GLN 122.A N ASN 118.A O no hydrogen 2.934 N/A GLN 122.A NE2 GLN 37.A OE1 no hydrogen 3.643 N/A GLN 122.A NE2 ASN 118.A OD1 no hydrogen 2.978 N/A VAL 123.A N VAL 119.A O no hydrogen 3.037 N/A TYR 124.A N ALA 120.A O no hydrogen 3.000 N/A TYR 124.A OH GLU 170.A OE2 no hydrogen 2.832 N/A ASN 125.A N GLU 121.A O no hydrogen 2.934 N/A ASN 125.A ND2 VAL 38.A O no hydrogen 2.931 N/A LEU 126.A N GLN 122.A O no hydrogen 2.873 N/A GLY 127.A N VAL 123.A O no hydrogen 2.873 N/A ARG 128.A N TYR 124.A O no hydrogen 3.245 N/A ARG 128.A N ASN 125.A O no hydrogen 3.091 N/A THR 129.A N LEU 126.A O no hydrogen 2.974 N/A THR 129.A OG1 LEU 126.A O no hydrogen 2.572 N/A VAL 132.A N THR 129.A OG1 no hydrogen 3.172 N/A LYS 133.A N THR 129.A O no hydrogen 3.070 N/A SER 134.A N SER 130.A O no hydrogen 2.867 N/A SER 134.A OG SER 130.A O no hydrogen 2.679 N/A ALA 135.A N ILE 131.A O no hydrogen 3.471 N/A TRP 136.A N VAL 132.A O no hydrogen 3.048 N/A TRP 136.A NE1 LEU 142.A O no hydrogen 2.740 N/A GLU 137.A N LYS 133.A O no hydrogen 2.800 N/A ARG 138.A N SER 134.A O no hydrogen 3.048 N/A ARG 138.A NH2 ASP 54.A OD1 no hydrogen 3.109 N/A ARG 138.A NH2 GLN 140.A OE1 no hydrogen 3.257 N/A GLY 139.A N TRP 136.A O no hydrogen 2.777 N/A GLN 140.A N ALA 135.A O no hydrogen 2.880 N/A GLN 140.A NE2 VAL 53.A O no hydrogen 2.974 N/A SER 143.A N GLU 59.A O no hydrogen 2.826 N/A SER 143.A OG GLU 59.A O no hydrogen 3.150 N/A SER 143.A OG HIS 60.A ND1 no hydrogen 2.967 N/A LEU 144.A N ALA 163.A O no hydrogen 2.958 N/A HIS 145.A N ILE 61.A O no hydrogen 2.732 N/A HIS 145.A NE2 HIS 60.A ND1 no hydrogen 3.213 N/A TRP 147.A N ILE 63.A O no hydrogen 2.921 N/A VAL 148.A N VAL 157.A O no hydrogen 2.887 N/A TYR 149.A N GLY 65.A O no hydrogen 2.848 N/A ASP 150.A N PHE 155.A O no hydrogen 3.078 N/A VAL 151.A N THR 67.A OG1 no hydrogen 2.697 N/A ASN 152.A N ASP 150.A OD1 no hydrogen 2.827 N/A ASN 152.A ND2 ASP 150.A OD1 no hydrogen 3.354 N/A ASP 153.A N ASP 150.A O no hydrogen 3.262 N/A GLY 154.A N ASP 150.A O no hydrogen 2.879 N/A PHE 155.A N ASP 153.A OD1 no hydrogen 3.036 N/A VAL 157.A N VAL 148.A O no hydrogen 2.781 N/A GLN 159.A N GLY 146.A O no hydrogen 3.135 N/A GLN 159.A NE2 VAL 157.A O no hydrogen 3.233 N/A GLY 160.A N ASP 158.A OD1 no hydrogen 2.923 N/A ALA 163.A N LEU 144.A O no hydrogen 3.266 N/A THR 164.A N THR 168.A OG1 no hydrogen 2.944 N/A SER 165.A OG THR 168.A OG1 no hydrogen 2.621 N/A ARG 166.A NH1 ARG 166.A O no hydrogen 3.323 N/A ARG 166.A NH2 TYR 124.A OH no hydrogen 3.425 N/A GLU 167.A N GLU 167.A OE1 no hydrogen 2.727 N/A THR 168.A N SER 165.A OG no hydrogen 3.211 N/A THR 168.A OG1 SER 165.A O no hydrogen 2.894 N/A THR 168.A OG1 SER 165.A OG no hydrogen 2.621 N/A LEU 169.A N SER 165.A O no hydrogen 2.987 N/A GLU 170.A N ARG 166.A O no hydrogen 3.194 N/A ILE 171.A N GLU 167.A O no hydrogen 3.121 N/A SER 172.A N THR 168.A O no hydrogen 3.005 N/A SER 172.A OG MET 162.A O no hydrogen 2.777 N/A SER 172.A OG THR 168.A O no hydrogen 2.973 N/A TYR 173.A N LEU 169.A O no hydrogen 2.868 N/A TYR 173.A OH GLU 121.A OE1 no hydrogen 2.755 N/A TYR 173.A OH GLU 121.A OE2 no hydrogen 3.002 N/A ARG 174.A N GLU 170.A O no hydrogen 2.895 N/A ARG 174.A NE GLU 170.A OE1 no hydrogen 2.732 N/A ARG 174.A NH2 GLU 170.A OE1 no hydrogen 3.454 N/A ARG 174.A NH2 GLU 170.A OE2 no hydrogen 3.138 N/A ASN 175.A N ILE 171.A O no hydrogen 3.061 N/A ALA 176.A N SER 172.A O no hydrogen 2.913 N/A ILE 177.A N TYR 173.A O no hydrogen 3.159 N/A ALA 178.A N ARG 174.A O no hydrogen 2.890 N/A ARG 179.A N ASN 175.A O no hydrogen 2.677 N/A LEU 180.A N ALA 176.A O no hydrogen 2.827 N/A SER 181.A N ILE 177.A O no hydrogen 2.841 N/A SER 181.A N ALA 178.A O no hydrogen 3.115 N/A SER 181.A OG ILE 177.A O no hydrogen 2.441 N/A ILE 182.A N ALA 178.A O no hydrogen 2.955 N/A LEU 183.A N ARG 179.A O no hydrogen 3.226 N/A