Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2jaq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ASN 67.A OD1 no hydrogen 2.862 N/A ILE 3.A N ILE 68.A O no hydrogen 2.673 N/A ALA 4.A N ILE 115.A O no hydrogen 2.913 N/A ILE 5.A N PHE 70.A O no hydrogen 2.840 N/A PHE 6.A N ILE 117.A O no hydrogen 2.720 N/A GLY 7.A N GLU 76.A OE1 no hydrogen 3.075 N/A ALA 11.A N THR 8.A O no hydrogen 3.142 N/A LYS 13.A NZ GLY 7.A O no hydrogen 2.927 N/A LYS 13.A NZ THR 8.A O no hydrogen 3.091 N/A ILE 16.A N GLY 12.A O no hydrogen 2.951 N/A SER 17.A N LYS 13.A O no hydrogen 2.849 N/A SER 17.A OG LYS 13.A O no hydrogen 2.709 N/A ALA 18.A N SER 14.A O no hydrogen 3.040 N/A GLU 19.A N THR 15.A O no hydrogen 3.012 N/A ILE 20.A N ILE 16.A O no hydrogen 2.890 N/A SER 21.A N SER 17.A O no hydrogen 2.814 N/A SER 21.A OG TYR 26.A O no hydrogen 2.835 N/A LYS 22.A N ALA 18.A O no hydrogen 2.933 N/A LYS 23.A N GLU 19.A O no hydrogen 3.391 N/A LEU 24.A N ILE 20.A O no hydrogen 2.944 N/A GLY 25.A N SER 21.A O no hydrogen 2.599 N/A PHE 29.A N ILE 69.A O no hydrogen 2.622 N/A LYS 30.A NZ ASP 71.A OD2 no hydrogen 2.709 N/A GLU 35.A N PRO 32.A O no hydrogen 3.261 N/A ASN 36.A N VAL 33.A O no hydrogen 3.276 N/A TYR 38.A N ASN 36.A OD1 no hydrogen 2.990 N/A PHE 39.A N ASN 36.A O no hydrogen 3.241 N/A GLN 41.A N TYR 38.A O no hydrogen 3.247 N/A TYR 42.A N TYR 38.A O no hydrogen 2.942 N/A TYR 42.A N PHE 39.A O no hydrogen 3.303 N/A THR 49.A N ASP 45.A O no hydrogen 3.038 N/A THR 49.A N LEU 46.A O no hydrogen 3.069 N/A THR 49.A OG1 GLN 41.A O no hydrogen 3.547 N/A THR 49.A OG1 ASP 45.A O no hydrogen 2.759 N/A VAL 50.A N LEU 46.A O no hydrogen 2.871 N/A MET 53.A N THR 49.A O no hydrogen 2.953 N/A GLN 54.A N VAL 50.A O no hydrogen 2.771 N/A GLN 54.A NE2 TYR 42.A OH no hydrogen 3.219 N/A ILE 55.A N PHE 51.A O no hydrogen 3.060 N/A TYR 56.A N LYS 52.A O no hydrogen 3.081 N/A MET 57.A N MET 53.A O no hydrogen 2.875 N/A LEU 58.A N GLN 54.A O no hydrogen 3.193 N/A THR 59.A N ILE 55.A O no hydrogen 3.002 N/A THR 59.A OG1 ILE 55.A O no hydrogen 2.964 N/A ALA 60.A N TYR 56.A O no hydrogen 2.969 N/A ARG 61.A N MET 57.A O no hydrogen 3.037 N/A ARG 61.A NE ASP 77.A OD2 no hydrogen 3.467 N/A ARG 61.A NH2 ASP 77.A OD1 no hydrogen 3.286 N/A SER 62.A N LEU 58.A O no hydrogen 3.031 N/A SER 62.A OG LEU 58.A O no hydrogen 2.717 N/A LYS 63.A N THR 59.A O no hydrogen 3.110 N/A GLN 64.A N ALA 60.A O no hydrogen 3.263 N/A GLN 64.A NE2 LYS 30.A O no hydrogen 2.575 N/A LEU 65.A N SER 62.A O no hydrogen 2.956 N/A LYS 66.A N SER 62.A O no hydrogen 3.207 N/A ILE 68.A N MET 1.A O no hydrogen 3.006 N/A ILE 69.A N GLU 27.A O no hydrogen 3.024 N/A PHE 70.A N ILE 3.A O no hydrogen 2.628 N/A ASP 71.A N PHE 29.A O no hydrogen 2.886 N/A ARG 72.A N ILE 5.A O no hydrogen 2.991 N/A ARG 72.A NH1 TYR 153.A OH no hydrogen 3.208 N/A THR 73.A N GLU 76.A OE2 no hydrogen 2.962 N/A THR 73.A OG1 GLU 76.A OE2 no hydrogen 2.975 N/A GLU 76.A N THR 73.A O no hydrogen 3.250 N/A ILE 79.A N GLU 76.A O no hydrogen 2.969 N/A PHE 80.A N ASP 77.A O no hydrogen 3.022 N/A LYS 82.A N PRO 78.A O no hydrogen 2.953 N/A LYS 82.A NZ ASP 86.A OD2 no hydrogen 3.394 N/A LYS 82.A NZ ASN 152.A OD1 no hydrogen 3.332 N/A VAL 83.A N ILE 79.A O no hydrogen 3.040 N/A ASN 84.A N PHE 80.A O no hydrogen 3.270 N/A ASN 84.A ND2 PHE 80.A O no hydrogen 2.864 N/A TYR 85.A N MET 81.A O no hydrogen 2.952 N/A TYR 85.A OH GLN 92.A OE1 no hydrogen 2.553 N/A ASP 86.A N LYS 82.A O no hydrogen 2.843 N/A LEU 87.A N VAL 83.A O no hydrogen 3.049 N/A ASN 88.A N TYR 85.A O no hydrogen 3.204 N/A ASN 89.A N ASN 84.A O no hydrogen 2.588 N/A ASN 89.A ND2 ASN 84.A OD1 no hydrogen 2.799 N/A VAL 90.A N ASN 84.A O no hydrogen 3.164 N/A ASP 94.A N ASP 91.A OD1 no hydrogen 2.864 N/A TYR 95.A N ASP 91.A O no hydrogen 3.044 N/A ASN 96.A N GLN 92.A O no hydrogen 2.813 N/A THR 97.A N THR 93.A O no hydrogen 2.876 N/A THR 97.A OG1 THR 93.A O no hydrogen 2.873 N/A TYR 98.A N ASP 94.A O no hydrogen 3.073 N/A ILE 99.A N TYR 95.A O no hydrogen 2.833 N/A ASP 100.A N ASN 96.A O no hydrogen 2.838 N/A PHE 101.A N THR 97.A O no hydrogen 2.769 N/A TYR 102.A N TYR 98.A O no hydrogen 2.519 N/A ASN 103.A N ILE 99.A O no hydrogen 3.213 N/A ASN 103.A ND2 ILE 99.A O no hydrogen 2.802 N/A ASN 104.A N ASP 100.A O no hydrogen 2.771 N/A ASN 104.A ND2 ASP 100.A O no hydrogen 3.242 N/A VAL 105.A N PHE 101.A O no hydrogen 3.012 N/A VAL 106.A N PHE 101.A O no hydrogen 3.211 N/A LEU 107.A N TYR 102.A O no hydrogen 2.745 N/A ASN 109.A N VAL 105.A O no hydrogen 2.994 N/A ASN 109.A ND2 VAL 106.A O no hydrogen 2.698 N/A ASP 114.A N LYS 2.A O no hydrogen 2.861 N/A VAL 116.A N PRO 165.A O no hydrogen 2.911 N/A ILE 117.A N ALA 4.A O no hydrogen 2.645 N/A TYR 118.A N PHE 167.A O no hydrogen 3.033 N/A TYR 118.A OH GLU 154.A OE1 no hydrogen 2.567 N/A LEU 119.A N PHE 6.A O no hydrogen 2.872 N/A ARG 120.A N TYR 118.A O no hydrogen 3.002 N/A ARG 120.A N VAL 169.A O no hydrogen 3.041 N/A ARG 120.A NE GLU 154.A OE1 no hydrogen 2.924 N/A ARG 120.A NE GLU 154.A OE2 no hydrogen 3.373 N/A ARG 120.A NH2 GLU 154.A OE2 no hydrogen 2.932 N/A SER 122.A N GLU 172.A OE2 no hydrogen 2.888 N/A SER 122.A OG GLU 172.A OE2 no hydrogen 2.534 N/A THR 123.A OG1 GLU 147.A OE1 no hydrogen 2.659 N/A THR 125.A N SER 122.A OG no hydrogen 3.385 N/A THR 125.A OG1 SER 122.A OG no hydrogen 3.127 N/A THR 125.A OG1 GLU 172.A OE1 no hydrogen 2.483 N/A THR 125.A OG1 GLU 172.A OE2 no hydrogen 3.019 N/A ALA 126.A N SER 122.A O no hydrogen 3.022 N/A ILE 127.A N THR 123.A O no hydrogen 2.745 N/A SER 128.A N LYS 124.A O no hydrogen 3.060 N/A SER 128.A OG THR 125.A O no hydrogen 3.397 N/A ARG 129.A N THR 125.A O no hydrogen 2.938 N/A ARG 129.A NH1 GLY 10.A O no hydrogen 3.351 N/A ARG 129.A NH1 ALA 171.A O no hydrogen 3.314 N/A ARG 129.A NH2 ALA 171.A O no hydrogen 2.614 N/A ILE 130.A N ALA 126.A O no hydrogen 2.989 N/A LYS 131.A N ILE 127.A O no hydrogen 2.808 N/A LYS 132.A N SER 128.A O no hydrogen 2.930 N/A ARG 133.A N ARG 129.A O no hydrogen 3.026 N/A ARG 133.A NH1 GLU 138.A OE1 no hydrogen 2.789 N/A GLY 134.A N ILE 130.A O no hydrogen 3.046 N/A ARG 135.A NE GLU 138.A OE1 no hydrogen 3.346 N/A ARG 135.A NE GLU 138.A OE2 no hydrogen 3.076 N/A ARG 135.A NH2 GLU 138.A OE2 no hydrogen 2.646 N/A SER 136.A OG GLU 137.A OE1 no hydrogen 3.235 N/A GLU 137.A N GLU 137.A OE1 no hydrogen 2.835 N/A LEU 139.A N ARG 135.A O no hydrogen 3.153 N/A LEU 140.A N GLU 137.A O no hydrogen 3.440 N/A GLU 147.A N GLU 143.A O no hydrogen 2.859 N/A THR 148.A N GLU 144.A O no hydrogen 2.944 N/A THR 148.A OG1 GLU 144.A O no hydrogen 2.598 N/A LEU 149.A N TYR 145.A O no hydrogen 2.999 N/A ASN 150.A N TRP 146.A O no hydrogen 2.949 N/A ASN 150.A ND2 VAL 121.A O no hydrogen 2.826 N/A ASN 150.A ND2 THR 123.A OG1 no hydrogen 2.964 N/A LYS 151.A N GLU 147.A O no hydrogen 3.173 N/A ASN 152.A N THR 148.A O no hydrogen 2.953 N/A ASN 152.A ND2 THR 148.A O no hydrogen 3.174 N/A TYR 153.A N LEU 149.A O no hydrogen 2.802 N/A TYR 153.A OH GLU 76.A OE1 no hydrogen 2.437 N/A GLU 154.A N ASN 150.A O no hydrogen 2.969 N/A GLU 155.A N LYS 151.A O no hydrogen 3.019 N/A PHE 156.A N ASN 152.A O no hydrogen 2.996 N/A TYR 157.A N TYR 153.A O no hydrogen 3.132 N/A LYS 158.A N GLU 154.A O no hydrogen 2.967 N/A GLN 159.A N GLU 155.A O no hydrogen 3.000 N/A ASN 160.A N PHE 156.A O no hydrogen 2.993 N/A ASN 160.A N TYR 157.A O no hydrogen 3.289 N/A ASN 160.A ND2 PHE 156.A O no hydrogen 2.706 N/A ASP 163.A N ASN 160.A O no hydrogen 2.967 N/A PHE 166.A N PHE 164.A O no hydrogen 2.844 N/A PHE 167.A N VAL 116.A O no hydrogen 2.984 N/A VAL 169.A N TYR 118.A O no hydrogen 2.865 N/A ALA 171.A N ARG 120.A O no hydrogen 2.865 N/A GLU 172.A N ASP 170.A OD1 no hydrogen 3.010 N/A LEU 173.A N ASP 170.A O no hydrogen 3.286 N/A THR 177.A OG1 ASP 174.A OD1 no hydrogen 3.022 N/A GLN 178.A N ASP 174.A O no hydrogen 3.033 N/A GLN 178.A NE2 LEU 173.A O no hydrogen 2.750 N/A ILE 179.A N VAL 175.A O no hydrogen 2.860 N/A GLU 180.A N LYS 176.A O no hydrogen 3.038 N/A LEU 181.A N THR 177.A O no hydrogen 2.873 N/A ILE 182.A N GLN 178.A O no hydrogen 2.874 N/A MET 183.A N ILE 179.A O no hydrogen 2.814 N/A ASN 184.A N GLU 180.A O no hydrogen 3.012 N/A LYS 185.A N LEU 181.A O no hydrogen 3.131 N/A LEU 186.A N ILE 182.A O no hydrogen 2.825 N/A ASN 187.A N MET 183.A O no hydrogen 2.881 N/A SER 188.A N ASN 184.A O no hydrogen 3.190 N/A SER 188.A OG LYS 185.A O no hydrogen 2.960 N/A ILE 189.A N LEU 186.A O no hydrogen 3.141 N/A