Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4kk9_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 1.A N ASP 1.A OD2 no hydrogen 2.196 N/A VAL 3.A N SER 26.A OG no hydrogen 3.055 N/A THR 5.A N SER 24.A O no hydrogen 3.084 N/A THR 5.A OG1 SER 24.A O no hydrogen 3.493 N/A GLN 6.A NE2 TYR 85.A O no hydrogen 2.463 N/A SER 7.A N THR 22.A O no hydrogen 3.285 N/A ALA 9.A N SER 7.A O no hydrogen 2.679 N/A SER 12.A OG GLU 104.A O no hydrogen 2.581 N/A SER 12.A OG TYR 139.A OH no hydrogen 3.008 N/A ALA 13.A N GLU 104.A O no hydrogen 3.425 N/A LYS 18.A N ASP 17.A OD1 no hydrogen 2.740 N/A LYS 18.A NZ ASN 75.A OD1 no hydrogen 2.514 N/A VAL 19.A N ILE 74.A O no hydrogen 3.295 N/A MET 21.A N LEU 72.A O no hydrogen 3.178 N/A CYS 23.A N TYR 70.A O no hydrogen 3.259 N/A SER 24.A N THR 5.A O no hydrogen 2.886 N/A SER 26.A N VAL 3.A O no hydrogen 3.243 N/A SER 28.A OG GLY 67.A O no hydrogen 3.422 N/A VAL 29.A N GLY 67.A O no hydrogen 2.719 N/A HIS 33.A N GLN 88.A O no hydrogen 2.699 N/A TYR 35.A N TYR 86.A O no hydrogen 2.572 N/A TYR 35.A OH GLN 88.A OE1 no hydrogen 2.310 N/A GLN 36.A N LYS 44.A O no hydrogen 2.740 N/A GLN 37.A N THR 84.A O no hydrogen 2.812 N/A LYS 38.A NZ GLU 80.A O no hydrogen 2.935 N/A LYS 38.A NZ ALA 82.A O no hydrogen 3.325 N/A THR 41.A OG1 SER 42.A O no hydrogen 3.392 N/A LYS 44.A N GLN 36.A O no hydrogen 2.817 N/A LYS 44.A NZ THR 41.A OG1 no hydrogen 3.381 N/A LYS 44.A NZ SER 42.A O no hydrogen 3.393 N/A TRP 46.A N TRP 34.A O no hydrogen 2.712 N/A ILE 47.A N TRP 34.A O no hydrogen 3.093 N/A TYR 48.A N LYS 52.A O no hydrogen 2.856 N/A ASP 49.A N HIS 33.A ND1 no hydrogen 3.136 N/A THR 50.A N ILE 32.A O no hydrogen 2.943 N/A SER 51.A N TYR 48.A O no hydrogen 3.106 N/A SER 51.A N ASP 49.A O no hydrogen 2.507 N/A LYS 52.A N TYR 48.A O no hydrogen 2.755 N/A LYS 52.A NZ ASP 49.A OD2 no hydrogen 3.209 N/A THR 54.A OG1 ARG 45.A O no hydrogen 3.469 N/A VAL 57.A N THR 54.A O no hydrogen 2.825 N/A ARG 60.A NE ASP 81.A OD1 no hydrogen 2.970 N/A ARG 60.A NH2 GLU 80.A OE1 no hydrogen 3.235 N/A ARG 60.A NH2 ASP 81.A OD1 no hydrogen 2.362 N/A PHE 61.A N PRO 58.A O no hydrogen 2.979 N/A SER 62.A OG THR 73.A O no hydrogen 3.518 N/A SER 64.A N SER 71.A O no hydrogen 3.187 N/A SER 66.A N SER 69.A O no hydrogen 2.984 N/A THR 68.A N SER 66.A O no hydrogen 2.612 N/A THR 68.A OG1 ALA 25.A O no hydrogen 2.431 N/A THR 68.A OG1 SER 27.A O no hydrogen 3.308 N/A THR 68.A OG1 THR 68.A O no hydrogen 2.648 N/A SER 69.A N SER 66.A O no hydrogen 3.219 N/A TYR 70.A N CYS 23.A O no hydrogen 2.903 N/A TYR 70.A OH VAL 29.A O no hydrogen 2.152 N/A SER 71.A N SER 64.A O no hydrogen 3.060 N/A SER 71.A OG THR 73.A OG1 no hydrogen 3.418 N/A LEU 72.A N MET 21.A O no hydrogen 3.117 N/A THR 73.A N SER 62.A O no hydrogen 2.750 N/A THR 73.A OG1 SER 71.A OG no hydrogen 3.418 N/A ILE 74.A N VAL 19.A O no hydrogen 3.014 N/A ASN 75.A N ARG 60.A O no hydrogen 2.936 N/A MET 77.A N ASP 17.A O no hydrogen 2.988 N/A THR 84.A N GLN 37.A O no hydrogen 2.754 N/A TYR 85.A N THR 101.A O no hydrogen 2.888 N/A TYR 85.A OH GLN 36.A OE1 no hydrogen 2.719 N/A TYR 85.A OH ASP 81.A O no hydrogen 2.782 N/A TYR 86.A N TYR 35.A O no hydrogen 2.801 N/A TYR 86.A OH GLN 37.A OE1 no hydrogen 3.087 N/A CYS 87.A N GLN 6.A OE1 no hydrogen 2.917 N/A GLN 88.A N HIS 33.A O no hydrogen 2.721 N/A GLN 89.A N THR 96.A O no hydrogen 3.042 N/A GLN 89.A NE2 SER 92.A O no hydrogen 3.420 N/A GLN 89.A NE2 PRO 94.A O no hydrogen 3.184 N/A TRP 90.A NE1 HIS 93.A ND1 no hydrogen 3.104 N/A SER 91.A OG GLN 89.A OE1 no hydrogen 3.387 N/A SER 91.A OG SER 92.A OG no hydrogen 3.128 N/A SER 92.A N GLN 89.A OE1 no hydrogen 2.769 N/A SER 92.A OG SER 91.A OG no hydrogen 3.128 N/A GLN 95.A N GLN 95.A OE1 no hydrogen 2.033 N/A THR 96.A N GLN 89.A O no hydrogen 3.365 N/A THR 96.A OG1 ILE 2.A O no hydrogen 2.857 N/A GLY 98.A N CYS 87.A O no hydrogen 2.694 N/A THR 101.A OG1 PRO 8.A O no hydrogen 3.044 N/A THR 101.A OG1 GLY 100.A O no hydrogen 2.989 N/A LYS 102.A N ALA 9.A O no hydrogen 2.863 N/A LEU 103.A N ALA 83.A O no hydrogen 2.810 N/A GLU 104.A N MET 11.A O no hydrogen 2.911 N/A LEU 106.A N ALA 13.A O no hydrogen 3.312 N/A ARG 107.A NE ALA 108.A O no hydrogen 2.425 N/A ARG 107.A NH1 ASP 169.A O no hydrogen 3.160 N/A ARG 107.A NH2 ALA 108.A O no hydrogen 3.078 N/A ALA 110.A N TYR 139.A O no hydrogen 3.306 N/A THR 113.A N ASN 136.A O no hydrogen 3.009 N/A SER 115.A N PHE 134.A O no hydrogen 3.043 N/A PHE 117.A N VAL 132.A O no hydrogen 2.933 N/A SER 121.A OG GLU 122.A OE1 no hydrogen 3.248 N/A GLU 122.A N GLU 122.A OE1 no hydrogen 2.881 N/A GLN 123.A NE2 SER 130.A OG no hydrogen 2.777 N/A LEU 124.A N SER 120.A O no hydrogen 3.207 N/A THR 125.A N SER 121.A O no hydrogen 3.362 N/A THR 125.A OG1 SER 121.A O no hydrogen 2.926 N/A SER 126.A N LEU 124.A O no hydrogen 2.497 N/A GLY 127.A N LEU 124.A O no hydrogen 2.710 N/A GLY 128.A N GLN 123.A O no hydrogen 3.283 N/A ALA 129.A N LEU 180.A O no hydrogen 2.920 N/A SER 130.A N GLN 123.A OE1 no hydrogen 2.830 N/A SER 130.A OG THR 179.A OG1 no hydrogen 3.378 N/A VAL 131.A N LEU 178.A O no hydrogen 2.701 N/A VAL 132.A N PHE 117.A O no hydrogen 3.183 N/A CYS 133.A N SER 176.A O no hydrogen 2.689 N/A CYS 133.A SG SER 115.A O no hydrogen 3.369 N/A PHE 134.A N SER 115.A O no hydrogen 2.802 N/A LEU 135.A N MET 174.A O no hydrogen 2.927 N/A ASN 136.A N THR 113.A O no hydrogen 3.380 N/A ASN 137.A N SER 173.A OG no hydrogen 3.326 N/A PHE 138.A N TYR 172.A O no hydrogen 2.951 N/A TYR 139.A N ALA 110.A O no hydrogen 3.179 N/A TYR 139.A OH SER 12.A OG no hydrogen 3.008 N/A ASN 144.A N THR 196.A O no hydrogen 2.868 N/A LYS 146.A N GLU 194.A O no hydrogen 2.923 N/A LYS 146.A NZ GLU 153.A OE1 no hydrogen 2.768 N/A TRP 147.A NE1 SER 176.A OG no hydrogen 3.315 N/A LYS 148.A N THR 192.A O no hydrogen 2.640 N/A LYS 148.A NZ GLU 194.A OE2 no hydrogen 2.821 N/A ILE 149.A N SER 152.A O no hydrogen 2.875 N/A ASP 150.A N SER 190.A O no hydrogen 2.553 N/A SER 152.A N ILE 149.A O no hydrogen 3.140 N/A SER 152.A OG GLU 153.A O no hydrogen 3.348 N/A ARG 154.A N TRP 147.A O no hydrogen 2.867 N/A ARG 154.A NE ASN 156.A O no hydrogen 3.150 N/A ARG 154.A NH1 GLU 184.A OE1 no hydrogen 3.048 N/A ARG 154.A NH2 ASN 156.A O no hydrogen 3.497 N/A GLN 155.A NE2 GLU 153.A OE1 no hydrogen 3.021 N/A LEU 159.A N THR 177.A O no hydrogen 3.004 N/A SER 161.A N SER 175.A O no hydrogen 3.007 N/A THR 163.A N SER 173.A O no hydrogen 3.089 N/A THR 163.A OG1 SER 173.A O no hydrogen 3.548 N/A GLN 165.A NE2 ILE 105.A O no hydrogen 2.978 N/A ASP 166.A N THR 171.A O no hydrogen 3.078 N/A LYS 168.A N ASP 166.A OD2 no hydrogen 3.097 N/A ASP 169.A N ASP 166.A OD2 no hydrogen 3.126 N/A SER 170.A N ASP 166.A O no hydrogen 3.073 N/A THR 171.A N ASP 169.A OD1 no hydrogen 2.921 N/A THR 171.A OG1 ASP 169.A OD1 no hydrogen 2.395 N/A THR 171.A OG1 ASP 169.A OD2 no hydrogen 3.193 N/A TYR 172.A OH GLU 104.A OE2 no hydrogen 2.580 N/A SER 173.A N THR 163.A OG1 no hydrogen 3.022 N/A SER 175.A N SER 161.A O no hydrogen 3.168 N/A SER 176.A N CYS 133.A O no hydrogen 2.885 N/A SER 176.A OG ASN 160.A OD1 no hydrogen 2.101 N/A THR 177.A N LEU 159.A O no hydrogen 3.077 N/A LEU 178.A N VAL 131.A O no hydrogen 2.963 N/A THR 179.A N GLY 157.A O no hydrogen 2.878 N/A THR 179.A OG1 SER 130.A OG no hydrogen 3.378 N/A LEU 180.A N ALA 129.A O no hydrogen 2.605 N/A LYS 182.A N GLY 127.A O no hydrogen 2.835 N/A GLU 184.A N THR 181.A OG1 no hydrogen 3.137 N/A TYR 185.A N THR 181.A O no hydrogen 2.829 N/A GLU 186.A N LYS 182.A O no hydrogen 2.923 N/A ARG 187.A N GLU 184.A O no hydrogen 3.362 N/A ARG 187.A NH1 GLU 184.A OE2 no hydrogen 3.146 N/A HIS 188.A N TYR 185.A O no hydrogen 3.295 N/A HIS 188.A ND1 ASP 150.A OD1 no hydrogen 3.022 N/A ASN 189.A N ASP 150.A OD2 no hydrogen 3.148 N/A SER 190.A N ASP 150.A OD2 no hydrogen 3.040 N/A TYR 191.A N PHE 208.A O no hydrogen 3.158 N/A TYR 191.A OH TYR 185.A O no hydrogen 2.919 N/A THR 192.A N LYS 148.A O no hydrogen 2.651 N/A CYS 193.A N LYS 206.A O no hydrogen 2.928 N/A GLU 194.A N LYS 146.A O no hydrogen 2.693 N/A ALA 195.A N ILE 204.A O no hydrogen 3.363 N/A THR 196.A N ASN 144.A O no hydrogen 2.677 N/A LYS 198.A NZ ASP 109.A OD2 no hydrogen 2.885 N/A THR 199.A OG1 HIS 197.A ND1 no hydrogen 2.551 N/A SER 200.A OG SER 202.A O no hydrogen 3.165 N/A SER 202.A N SER 200.A OG no hydrogen 3.081 N/A ILE 204.A N ALA 195.A O no hydrogen 3.156 N/A LYS 206.A N CYS 193.A O no hydrogen 3.213 N/A PHE 208.A N TYR 191.A O no hydrogen 3.123 N/A ARG 210.A N ASN 189.A O no hydrogen 2.541 N/A ARG 210.A NE HIS 188.A O no hydrogen 2.733 N/A ARG 210.A NH2 HIS 188.A O no hydrogen 3.068 N/A ALA 211.A N ASN 189.A OD1 no hydrogen 2.644 N/A