Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4jk3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A N ASP 4.A OD2 no hydrogen 3.026 N/A ASN 7.A N ASP 3.A O no hydrogen 2.861 N/A ILE 8.A N ASP 4.A O no hydrogen 2.810 N/A ASN 9.A N LEU 5.A O no hydrogen 3.155 N/A LEU 11.A N ILE 8.A O no hydrogen 3.020 N/A GLN 12.A N ASN 9.A O no hydrogen 3.165 N/A GLN 12.A NE2 ASN 9.A OD1 no hydrogen 3.698 N/A ALA 14.A N GLN 10.A O no hydrogen 3.197 N/A ASP 15.A N LEU 11.A O no hydrogen 2.879 N/A SER 16.A N GLN 12.A O no hydrogen 3.023 N/A SER 16.A OG GLN 12.A O no hydrogen 3.262 N/A ALA 17.A N LYS 13.A O no hydrogen 2.827 N/A VAL 18.A N ALA 14.A O no hydrogen 2.911 N/A GLN 19.A N ASP 15.A O no hydrogen 2.865 N/A GLU 20.A N SER 16.A O no hydrogen 2.739 N/A VAL 21.A N ALA 17.A O no hydrogen 3.141 N/A THR 22.A N VAL 18.A O no hydrogen 2.880 N/A THR 22.A OG1 VAL 18.A O no hydrogen 2.670 N/A GLY 23.A N GLN 19.A O no hydrogen 2.814 N/A LEU 24.A N THR 22.A OG1 no hydrogen 3.228 N/A ILE 26.A N ASP 15.A OD1 no hydrogen 2.766 N/A GLY 28.A N ASP 25.A OD1 no hydrogen 2.659 N/A ILE 29.A N ASP 25.A O no hydrogen 2.870 N/A CYS 30.A N ILE 26.A O no hydrogen 3.015 N/A CYS 30.A SG ILE 26.A O no hydrogen 3.372 N/A LYS 31.A N LYS 27.A O no hydrogen 3.015 N/A ALA 32.A N GLY 28.A O no hydrogen 2.803 N/A LEU 33.A N ILE 29.A O no hydrogen 2.758 N/A LEU 33.A N CYS 30.A O no hydrogen 3.204 N/A TYR 34.A N CYS 30.A O no hydrogen 2.825 N/A TYR 34.A OH SER 241.A OG no hydrogen 2.726 N/A GLY 35.A N LYS 31.A O no hydrogen 2.829 N/A THR 36.A OG1 LEU 246.A O no hydrogen 3.411 N/A SER 38.A OG PHE 65.A O no hydrogen 3.349 N/A SER 39.A N GLU 41.A OE1 no hydrogen 2.736 N/A SER 39.A OG GLU 41.A OE2 no hydrogen 3.336 N/A GLU 41.A N GLU 41.A OE1 no hydrogen 2.720 N/A LYS 42.A N GLU 88.A OE1 no hydrogen 2.738 N/A VAL 43.A N ASP 68.A O no hydrogen 3.016 N/A GLY 44.A N ILE 89.A O no hydrogen 2.736 N/A ILE 45.A N PHE 70.A O no hydrogen 2.798 N/A VAL 46.A N LEU 91.A O no hydrogen 3.130 N/A THR 49.A N ASP 75.A OD1 no hydrogen 3.001 N/A THR 49.A OG1 ASP 75.A OD2 no hydrogen 3.040 N/A SER 55.A OG GLY 52.A O no hydrogen 3.062 N/A SER 57.A N ASN 53.A O no hydrogen 3.018 N/A SER 57.A OG ASN 53.A O no hydrogen 2.943 N/A LEU 58.A N PHE 54.A O no hydrogen 3.035 N/A HIS 59.A N SER 55.A O no hydrogen 2.848 N/A HIS 59.A NE2 SER 69.A O no hydrogen 3.152 N/A ALA 60.A N ALA 56.A O no hydrogen 2.989 N/A ILE 61.A N SER 57.A O no hydrogen 2.807 N/A THR 62.A N LEU 58.A O no hydrogen 2.846 N/A THR 62.A OG1 LEU 58.A O no hydrogen 2.683 N/A THR 62.A OG1 HIS 59.A O no hydrogen 3.145 N/A THR 62.A OG1 SER 69.A OG no hydrogen 2.756 N/A GLN 63.A N HIS 59.A O no hydrogen 3.037 N/A GLN 63.A NE2 SER 69.A OG no hydrogen 3.396 N/A TYR 64.A N ALA 60.A O no hydrogen 3.159 N/A TYR 64.A OH ASP 15.A OD2 no hydrogen 2.574 N/A PHE 65.A N THR 62.A O no hydrogen 3.283 N/A GLY 66.A N GLN 63.A O no hydrogen 2.938 N/A PHE 67.A N THR 62.A O no hydrogen 3.172 N/A ASP 68.A N GLU 41.A O no hydrogen 3.167 N/A SER 69.A OG THR 62.A OG1 no hydrogen 2.756 N/A PHE 70.A N VAL 43.A O no hydrogen 3.073 N/A THR 72.A N ILE 45.A O no hydrogen 3.136 N/A ASP 73.A N GLU 81.A OE1 no hydrogen 2.725 N/A ASP 75.A N PRO 47.A O no hydrogen 2.831 N/A GLY 78.A N PRO 74.A O no hydrogen 2.936 N/A TYR 79.A N ASP 75.A O no hydrogen 2.828 N/A TYR 80.A N VAL 76.A O no hydrogen 2.928 N/A GLU 81.A N SER 77.A O no hydrogen 2.928 N/A ALA 82.A N GLY 78.A O no hydrogen 2.823 N/A VAL 83.A N TYR 79.A O no hydrogen 3.011 N/A GLN 84.A N TYR 80.A O no hydrogen 2.967 N/A ASN 85.A N GLU 81.A O no hydrogen 3.008 N/A GLY 86.A N VAL 83.A O no hydrogen 3.087 N/A ALA 87.A N ALA 82.A O no hydrogen 3.201 N/A GLU 88.A N LYS 42.A O no hydrogen 2.833 N/A ILE 89.A N LYS 42.A O no hydrogen 3.109 N/A ILE 90.A N HIS 100.A O no hydrogen 2.759 N/A LEU 91.A N GLY 44.A O no hydrogen 2.924 N/A ASP 93.A N THR 96.A O no hydrogen 2.898 N/A ASP 94.A N SER 50.A OG no hydrogen 3.310 N/A ARG 95.A N ASP 93.A OD1 no hydrogen 3.096 N/A THR 96.A N ASP 93.A OD1 no hydrogen 2.873 N/A ALA 99.A N ALA 107.A O no hydrogen 3.105 N/A HIS 100.A N ILE 90.A O no hydrogen 2.753 N/A ASN 101.A N LYS 106.A O no hydrogen 2.838 N/A ASN 101.A ND2 GLU 88.A O no hydrogen 3.321 N/A LEU 102.A N GLU 88.A O no hydrogen 2.677 N/A LYS 103.A NZ GLU 88.A OE2 no hydrogen 3.448 N/A ASN 104.A ND2 VAL 245.A O no hydrogen 2.771 N/A GLY 105.A N ASN 101.A O no hydrogen 2.987 N/A LYS 106.A N ASN 104.A OD1 no hydrogen 2.827 N/A ASN 109.A N PHE 97.A O no hydrogen 2.815 N/A GLN 110.A N ASN 108.A OD1 no hydrogen 2.931 N/A CYS 112.A N ASN 108.A O no hydrogen 3.292 N/A CYS 112.A SG ASN 108.A O no hydrogen 3.484 N/A CYS 112.A SG SER 244.A OG no hydrogen 3.634 N/A THR 113.A N ASN 109.A O no hydrogen 2.838 N/A THR 113.A OG1 ASN 109.A O no hydrogen 2.604 N/A GLY 114.A N GLN 110.A O no hydrogen 3.089 N/A ILE 115.A N PRO 111.A O no hydrogen 2.861 N/A ILE 116.A N CYS 112.A O no hydrogen 3.064 N/A TYR 117.A N THR 113.A O no hydrogen 3.061 N/A ALA 118.A N GLY 114.A O no hydrogen 3.057 N/A GLU 119.A N ILE 115.A O no hydrogen 2.791 N/A ILE 120.A N ILE 116.A O no hydrogen 2.891 N/A ALA 121.A N TYR 117.A O no hydrogen 3.087 N/A SER 122.A N ALA 118.A O no hydrogen 2.867 N/A SER 122.A OG GLU 119.A O no hydrogen 2.784 N/A ARG 123.A N GLU 119.A O no hydrogen 3.082 N/A ARG 123.A N ILE 120.A O no hydrogen 3.255 N/A ARG 123.A NH2 GLU 119.A OE1 no hydrogen 3.013 N/A TYR 124.A N ALA 121.A O no hydrogen 3.166 N/A TYR 124.A OH ASN 206.A O no hydrogen 2.471 N/A TYR 124.A OH GLN 229.A OE1 no hydrogen 2.601 N/A LEU 125.A N VAL 21.A O no hydrogen 2.925 N/A ALA 127.A N TYR 124.A O no hydrogen 3.285 N/A ASP 131.A N SER 129.A OG no hydrogen 3.112 N/A VAL 132.A N ARG 154.A O no hydrogen 2.976 N/A LEU 133.A N ILE 187.A O no hydrogen 3.065 N/A VAL 134.A N TYR 156.A O no hydrogen 2.771 N/A VAL 135.A N PHE 189.A O no hydrogen 2.884 N/A GLY 136.A N TYR 158.A O no hydrogen 2.833 N/A LEU 137.A N ASP 159.A OD2 no hydrogen 2.660 N/A PHE 142.A N GLY 138.A O no hydrogen 2.934 N/A GLY 144.A N VAL 140.A O no hydrogen 3.292 N/A ALA 145.A N GLY 141.A O no hydrogen 2.777 N/A GLU 146.A N PHE 142.A O no hydrogen 2.885 N/A HIS 147.A N PRO 143.A O no hydrogen 2.939 N/A HIS 147.A NE2 GLU 119.A OE2 no hydrogen 2.686 N/A LEU 148.A N GLY 144.A O no hydrogen 3.011 N/A VAL 149.A N ALA 145.A O no hydrogen 2.987 N/A GLN 150.A N GLU 146.A O no hydrogen 3.047 N/A LYS 151.A N HIS 147.A O no hydrogen 3.148 N/A LYS 151.A N LEU 148.A O no hydrogen 3.193 N/A LYS 151.A NZ GLU 119.A OE1 no hydrogen 3.372 N/A LYS 151.A NZ GLU 119.A OE2 no hydrogen 2.981 N/A LYS 151.A NZ SER 122.A OG no hydrogen 2.760 N/A ASP 152.A N VAL 149.A O no hydrogen 2.826 N/A PHE 153.A N LEU 148.A O no hydrogen 3.248 N/A ARG 154.A N LYS 130.A O no hydrogen 2.808 N/A ARG 154.A NE TYR 156.A OH no hydrogen 3.312 N/A TYR 156.A N VAL 132.A O no hydrogen 2.848 N/A GLY 157.A N ILE 175.A O no hydrogen 2.877 N/A TYR 158.A N VAL 134.A O no hydrogen 2.835 N/A ASP 161.A N ASP 159.A OD1 no hydrogen 2.882 N/A GLU 162.A N GLU 162.A OE2 no hydrogen 2.909 N/A THR 163.A N ASP 161.A OD1 no hydrogen 2.761 N/A LEU 165.A N ASP 161.A O no hydrogen 3.183 N/A GLU 166.A N GLU 162.A O no hydrogen 2.868 N/A ARG 167.A N THR 163.A O no hydrogen 3.070 N/A ARG 167.A NH1 LEU 137.A O no hydrogen 3.092 N/A ALA 168.A N LEU 164.A O no hydrogen 3.118 N/A THR 169.A N LEU 165.A O no hydrogen 2.862 N/A THR 169.A OG1 LEU 165.A O no hydrogen 3.182 N/A SER 170.A N GLU 166.A O no hydrogen 2.918 N/A SER 170.A OG GLU 166.A O no hydrogen 3.207 N/A ASN 171.A N ARG 167.A O no hydrogen 2.792 N/A LEU 172.A N ALA 168.A O no hydrogen 2.875 N/A GLY 173.A N THR 169.A O no hydrogen 3.036 N/A ILE 175.A N VAL 155.A O no hydrogen 2.879 N/A PHE 177.A N GLY 157.A O no hydrogen 2.788 N/A ALA 180.A N ASP 178.A OD1 no hydrogen 3.113 N/A ASN 181.A N ASP 178.A O no hydrogen 2.842 N/A LYS 183.A NZ ASP 131.A OD2 no hydrogen 2.778 N/A LYS 184.A NZ ALA 201.A O no hydrogen 3.082 N/A LYS 184.A NZ LEU 203.A O no hydrogen 2.866 N/A PHE 185.A N VAL 202.A O no hydrogen 2.880 N/A ILE 188.A N VAL 208.A O no hydrogen 2.937 N/A PHE 189.A N LEU 133.A O no hydrogen 2.737 N/A GLU 190.A N SER 210.A O no hydrogen 2.997 N/A ALA 191.A N VAL 135.A O no hydrogen 2.763 N/A THR 192.A N GLU 190.A OE2 no hydrogen 3.066 N/A THR 197.A N ALA 217.A O no hydrogen 2.948 N/A THR 197.A OG1 GLU 190.A OE1 no hydrogen 2.600 N/A ILE 198.A N ALA 217.A O no hydrogen 3.350 N/A VAL 202.A N PRO 199.A O no hydrogen 3.120 N/A LEU 203.A N GLU 200.A O no hydrogen 3.109 N/A SER 204.A OG PHE 185.A O no hydrogen 2.865 N/A ASN 206.A N TYR 226.A O no hydrogen 2.831 N/A CYS 207.A SG SER 204.A O no hydrogen 3.240 N/A VAL 208.A N SER 186.A O no hydrogen 3.094 N/A LEU 209.A N GLN 229.A O no hydrogen 2.928 N/A SER 210.A N ILE 188.A O no hydrogen 2.830 N/A SER 210.A OG TYR 117.A O no hydrogen 2.861 N/A THR 211.A N ILE 231.A O no hydrogen 2.788 N/A THR 211.A OG1 GLU 190.A O no hydrogen 2.770 N/A THR 211.A OG1 GLU 190.A OE2 no hydrogen 2.938 N/A GLY 213.A N THR 211.A OG1 no hydrogen 3.049 N/A CYS 216.A SG ILE 218.A O no hydrogen 3.755 N/A LEU 222.A N SER 219.A OG no hydrogen 3.098 N/A ARG 223.A N SER 219.A O no hydrogen 3.066 N/A ARG 223.A NH2 GLU 220.A OE1 no hydrogen 3.488 N/A ASP 224.A N GLU 220.A O no hydrogen 3.068 N/A LYS 225.A N GLU 221.A O no hydrogen 2.928 N/A LYS 225.A NZ GLU 200.A OE1 no hydrogen 2.923 N/A TYR 226.A N LEU 222.A O no hydrogen 3.056 N/A TYR 226.A OH GLU 200.A OE1 no hydrogen 3.002 N/A GLU 227.A N ASP 224.A O no hydrogen 3.142 N/A VAL 228.A N ARG 223.A O no hydrogen 2.938 N/A GLN 229.A N CYS 207.A O no hydrogen 2.846 N/A ILE 231.A N LEU 209.A O no hydrogen 2.808 N/A LEU 235.A N GLU 233.A OE1 no hydrogen 3.267 N/A LEU 235.A N GLU 233.A OE2 no hydrogen 3.024 N/A GLY 236.A N GLU 233.A OE1 no hydrogen 2.722 N/A ILE 237.A N GLU 233.A OE2 no hydrogen 2.930 N/A THR 239.A N LEU 235.A O no hydrogen 3.109 N/A THR 239.A OG1 LEU 235.A O no hydrogen 2.599 N/A ALA 240.A N GLY 236.A O no hydrogen 2.944 N/A SER 241.A N ILE 237.A O no hydrogen 3.006 N/A SER 241.A OG TYR 34.A OH no hydrogen 2.726 N/A SER 241.A OG CYS 112.A O no hydrogen 2.786 N/A TYR 243.A N ALA 240.A O no hydrogen 2.857 N/A SER 244.A N SER 241.A O no hydrogen 2.884 N/A VAL 245.A N LEU 242.A O no hydrogen 3.359 N/A