Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4jrx_E.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N ALA 22.A O no hydrogen 2.805 N/A GLN 4.A NE2 TYR 87.A O no hydrogen 2.595 N/A GLN 4.A NE2 THR 103.A OG1 no hydrogen 3.122 N/A THR 5.A N GLN 20.A O no hydrogen 3.280 N/A GLN 9.A N ARG 104.A O no hydrogen 2.876 N/A GLN 9.A NE2 VAL 10.A O no hydrogen 3.699 N/A LEU 11.A N THR 106.A O no hydrogen 2.644 N/A LYS 12.A N GLN 15.A OE1 no hydrogen 3.466 N/A THR 13.A N THR 108.A O no hydrogen 2.748 N/A THR 13.A OG1 ALA 79.A O no hydrogen 3.211 N/A GLY 14.A N ALA 79.A O no hydrogen 2.899 N/A GLN 15.A N LYS 12.A O no hydrogen 2.962 N/A MET 17.A N LEU 76.A O no hydrogen 3.104 N/A LEU 19.A N LEU 74.A O no hydrogen 2.793 N/A GLN 20.A N THR 5.A O no hydrogen 2.924 N/A ALA 22.A N THR 3.A O no hydrogen 2.897 N/A GLN 23.A N ARG 70.A O no hydrogen 3.021 N/A GLN 23.A NE2 HIS 27.A O no hydrogen 3.121 N/A GLN 23.A NE2 LYS 69.A O no hydrogen 2.963 N/A MET 25.A N GLN 23.A OE1 no hydrogen 2.986 N/A HIS 27.A N GLN 23.A OE1 no hydrogen 3.136 N/A HIS 27.A ND1 SER 91.A O no hydrogen 2.815 N/A MET 30.A N SER 47.A O no hydrogen 3.086 N/A TYR 31.A N ALA 90.A O no hydrogen 2.838 N/A TRP 32.A N TYR 45.A O no hydrogen 2.946 N/A TRP 32.A NE1 PHE 72.A O no hydrogen 2.741 N/A TYR 33.A N PHE 88.A O no hydrogen 2.816 N/A ARG 34.A N ARG 42.A O no hydrogen 2.987 N/A ARG 34.A NE ASP 36.A OD2 no hydrogen 2.829 N/A ARG 34.A NH1 SER 82.A O no hydrogen 3.158 N/A ARG 34.A NH2 ASP 36.A OD1 no hydrogen 3.081 N/A ARG 34.A NH2 SER 82.A O no hydrogen 2.582 N/A GLN 35.A N VAL 86.A O no hydrogen 2.696 N/A ASP 36.A N GLY 40.A O no hydrogen 3.288 N/A MET 39.A N ASP 36.A O no hydrogen 2.863 N/A ARG 42.A N ARG 34.A O no hydrogen 2.907 N/A ARG 42.A NH2 ASP 36.A OD2 no hydrogen 2.956 N/A ILE 44.A N TRP 32.A O no hydrogen 2.769 N/A TYR 46.A N ASP 54.A O no hydrogen 2.973 N/A SER 47.A N MET 30.A O no hydrogen 2.753 N/A SER 47.A OG THR 52.A O no hydrogen 2.518 N/A SER 49.A OG ALA 48.A O no hydrogen 3.229 N/A THR 52.A N SER 49.A O no hydrogen 3.141 N/A ASP 54.A N TYR 46.A O no hydrogen 2.797 N/A GLY 56.A N ILE 44.A O no hydrogen 2.954 N/A VAL 58.A N LEU 43.A O no hydrogen 2.983 N/A TYR 62.A N PRO 59.A O no hydrogen 3.167 N/A TYR 62.A OH TYR 87.A OH no hydrogen 2.723 N/A ASN 63.A N ARG 75.A O no hydrogen 3.092 N/A SER 65.A N SER 73.A O no hydrogen 3.338 N/A ARG 66.A NE ASN 68.A O no hydrogen 3.344 N/A ARG 66.A NH1 ASN 28.A O no hydrogen 2.643 N/A ARG 66.A NH1 SER 47.A OG no hydrogen 3.027 N/A ARG 66.A NH2 HIS 27.A O no hydrogen 3.310 N/A ARG 66.A NH2 ASN 28.A O no hydrogen 3.092 N/A ARG 66.A NH2 LYS 69.A O no hydrogen 2.815 N/A ASN 68.A ND2 GLU 71.A OE1 no hydrogen 3.170 N/A LYS 69.A NZ ASN 28.A OD1 no hydrogen 2.689 N/A GLU 71.A N ASN 68.A OD1 no hydrogen 3.043 N/A PHE 72.A N CYS 21.A O no hydrogen 3.032 N/A SER 73.A N SER 65.A O no hydrogen 3.415 N/A LEU 74.A N LEU 19.A O no hydrogen 3.111 N/A ARG 75.A N ASN 63.A O no hydrogen 2.748 N/A LEU 76.A N MET 17.A O no hydrogen 2.791 N/A ALA 79.A N GLN 15.A O no hydrogen 2.702 N/A ALA 80.A N GLN 83.A OE1 no hydrogen 3.087 N/A GLN 83.A N ALA 80.A O no hydrogen 2.928 N/A GLN 83.A NE2 GLY 61.A O no hydrogen 2.927 N/A THR 84.A N PRO 81.A O no hydrogen 3.107 N/A THR 84.A OG1 PRO 81.A O no hydrogen 3.097 N/A SER 85.A N LEU 105.A O no hydrogen 3.204 N/A SER 85.A OG GLN 35.A O no hydrogen 2.832 N/A SER 85.A OG ASP 36.A OD1 no hydrogen 2.891 N/A SER 85.A OG VAL 86.A O no hydrogen 3.338 N/A VAL 86.A N GLN 35.A O no hydrogen 3.501 N/A TYR 87.A N THR 103.A O no hydrogen 2.884 N/A TYR 87.A OH TYR 62.A OH no hydrogen 2.723 N/A TYR 87.A OH GLN 83.A O no hydrogen 2.650 N/A PHE 88.A N TYR 33.A O no hydrogen 3.021 N/A CYS 89.A N GLN 4.A OE1 no hydrogen 2.895 N/A CYS 89.A SG TYR 31.A O no hydrogen 3.256 N/A ALA 90.A N TYR 31.A O no hydrogen 2.954 N/A SER 91.A N PHE 98.A O no hydrogen 3.400 N/A SER 91.A OG HIS 27.A ND1 no hydrogen 3.358 N/A SER 91.A OG SER 29.A O no hydrogen 2.680 N/A GLY 93.A N GLU 96.A O no hydrogen 2.983 N/A GLU 94.A N GLU 94.A OE1 no hydrogen 2.860 N/A GLY 100.A N CYS 89.A O no hydrogen 3.007 N/A GLN 101.A NE2 GLN 4.A O no hydrogen 3.020 N/A THR 103.A N TYR 87.A O no hydrogen 2.844 N/A THR 103.A OG1 PRO 6.A O no hydrogen 2.620 N/A ARG 104.A N LYS 7.A O no hydrogen 2.793 N/A ARG 104.A NH2 GLN 101.A O no hydrogen 2.820 N/A LEU 105.A N SER 85.A O no hydrogen 3.048 N/A THR 106.A N GLN 9.A O no hydrogen 2.785 N/A THR 106.A OG1 HIS 148.A NE2 no hydrogen 2.734 N/A VAL 107.A N THR 84.A OG1 no hydrogen 2.741 N/A THR 108.A N LEU 11.A O no hydrogen 2.740 N/A THR 108.A OG1 LEU 11.A O no hydrogen 3.486 N/A THR 108.A OG1 ASP 110.A O no hydrogen 3.442 N/A GLU 109.A N ASP 179.A OD2 no hydrogen 3.476 N/A LYS 112.A N ASP 110.A OD1 no hydrogen 3.245 N/A ASN 113.A N ASP 110.A O no hydrogen 3.212 N/A VAL 114.A N LEU 111.A O no hydrogen 2.933 N/A PHE 115.A N TYR 145.A O no hydrogen 2.814 N/A GLU 118.A N THR 142.A O no hydrogen 2.731 N/A ALA 120.A N LEU 140.A O no hydrogen 3.105 N/A PHE 122.A N VAL 138.A O no hydrogen 2.725 N/A GLU 128.A N SER 125.A O no hydrogen 3.196 N/A ILE 129.A N SER 125.A O no hydrogen 3.252 N/A SER 130.A N GLU 126.A O no hydrogen 2.816 N/A HIS 131.A N ALA 127.A O no hydrogen 3.069 N/A THR 132.A N GLU 128.A O no hydrogen 2.747 N/A THR 132.A OG1 GLU 128.A O no hydrogen 2.604 N/A GLN 133.A N ILE 129.A O no hydrogen 3.017 N/A LYS 134.A N THR 132.A OG1 no hydrogen 3.170 N/A LYS 134.A NZ THR 132.A O no hydrogen 3.337 N/A ALA 135.A N VAL 190.A O no hydrogen 2.680 N/A THR 136.A N GLU 128.A OE1 no hydrogen 2.776 N/A THR 136.A OG1 GLU 128.A OE1 no hydrogen 3.399 N/A THR 136.A OG1 GLU 128.A OE2 no hydrogen 2.707 N/A LEU 137.A N LEU 188.A O no hydrogen 2.710 N/A VAL 138.A N PHE 122.A O no hydrogen 3.018 N/A CYS 139.A N SER 186.A O no hydrogen 2.698 N/A LEU 140.A N ALA 120.A O no hydrogen 3.020 N/A ALA 141.A N LEU 184.A O no hydrogen 2.839 N/A THR 142.A N GLU 118.A O no hydrogen 2.895 N/A GLY 143.A N GLU 173.A OE2 no hydrogen 3.041 N/A PHE 144.A N TYR 182.A O no hydrogen 3.072 N/A TYR 145.A N PHE 115.A O no hydrogen 2.896 N/A GLU 150.A N GLN 207.A O no hydrogen 2.897 N/A SER 152.A N GLN 205.A O no hydrogen 2.849 N/A TRP 153.A NE1 SER 186.A OG no hydrogen 2.859 N/A TRP 154.A N ARG 203.A O no hydrogen 2.830 N/A TRP 154.A NE1 SER 152.A OG no hydrogen 2.623 N/A VAL 155.A N LYS 158.A O no hydrogen 2.706 N/A ASN 156.A N HIS 201.A O no hydrogen 2.848 N/A ASN 156.A ND2 ASN 200.A OD1 no hydrogen 3.182 N/A LYS 158.A N VAL 155.A O no hydrogen 3.288 N/A LYS 158.A NZ GLU 159.A O no hydrogen 3.353 N/A VAL 160.A N TRP 153.A O no hydrogen 2.980 N/A CYS 165.A N ARG 187.A O no hydrogen 2.949 N/A THR 166.A OG1 SER 186.A OG no hydrogen 2.725 N/A ASP 167.A N SER 185.A O no hydrogen 3.051 N/A LEU 171.A N ALA 183.A O no hydrogen 2.793 N/A LYS 172.A NZ LEU 177.A O no hydrogen 3.417 N/A GLU 173.A N ARG 181.A O no hydrogen 2.976 N/A GLN 174.A N SER 180.A OG no hydrogen 2.873 N/A LEU 177.A N GLN 174.A O no hydrogen 3.159 N/A LEU 177.A N GLN 174.A OE1 no hydrogen 3.170 N/A SER 180.A OG GLN 174.A O no hydrogen 3.133 N/A SER 180.A OG ARG 181.A O no hydrogen 3.113 N/A ARG 181.A NE GLY 143.A O no hydrogen 3.038 N/A ARG 181.A NH2 GLY 143.A O no hydrogen 3.517 N/A TYR 182.A N PHE 144.A O no hydrogen 2.585 N/A ALA 183.A N LEU 171.A O no hydrogen 2.910 N/A LEU 184.A N ALA 141.A O no hydrogen 2.659 N/A SER 185.A N ASP 167.A OD2 no hydrogen 2.880 N/A SER 185.A OG ASP 167.A OD1 no hydrogen 2.942 N/A SER 185.A OG ASP 167.A OD2 no hydrogen 2.686 N/A SER 186.A N CYS 139.A O no hydrogen 2.932 N/A SER 186.A OG CYS 165.A O no hydrogen 3.233 N/A SER 186.A OG THR 166.A OG1 no hydrogen 2.725 N/A ARG 187.A N CYS 165.A O no hydrogen 2.897 N/A ARG 187.A NH1 CYS 165.A O no hydrogen 3.378 N/A ARG 187.A NH1 ASP 167.A OD1 no hydrogen 2.905 N/A ARG 187.A NH2 ASP 167.A OD1 no hydrogen 2.986 N/A LEU 188.A N LEU 137.A O no hydrogen 2.899 N/A ARG 189.A N GLY 163.A O no hydrogen 2.681 N/A ARG 189.A NE GLU 128.A OE2 no hydrogen 2.937 N/A ARG 189.A NH1 GLU 128.A OE2 no hydrogen 2.770 N/A VAL 190.A N ALA 135.A O no hydrogen 2.876 N/A ALA 192.A N GLN 133.A O no hydrogen 3.102 N/A PHE 194.A N SER 191.A OG no hydrogen 3.147 N/A TRP 195.A N SER 191.A O no hydrogen 3.143 N/A GLN 196.A N ALA 192.A O no hydrogen 2.784 N/A ARG 199.A N ASN 197.A OD1 no hydrogen 3.175 N/A ARG 199.A NH2 ARG 199.A O no hydrogen 2.991 N/A ASN 200.A N ASN 197.A O no hydrogen 3.110 N/A ASN 200.A ND2 PHE 194.A O no hydrogen 2.646 N/A HIS 201.A N ASN 156.A OD1 no hydrogen 2.783 N/A PHE 202.A N ALA 233.A O no hydrogen 2.805 N/A ARG 203.A N TRP 154.A O no hydrogen 2.783 N/A ARG 203.A NH1 GLN 205.A OE1 no hydrogen 2.808 N/A ARG 203.A NH2 GLN 205.A OE1 no hydrogen 2.753 N/A CYS 204.A N ALA 231.A O no hydrogen 2.724 N/A GLN 205.A N SER 152.A O no hydrogen 2.849 N/A VAL 206.A N VAL 229.A O no hydrogen 2.754 N/A GLN 207.A N GLU 150.A O no hydrogen 2.978 N/A GLN 207.A NE2 PHE 208.A O no hydrogen 3.216 N/A PHE 208.A N GLN 227.A O no hydrogen 2.721 N/A TYR 209.A N HIS 148.A O no hydrogen 2.951 N/A TYR 209.A OH GLU 150.A OE1 no hydrogen 2.983 N/A GLY 210.A N THR 226.A OG1 no hydrogen 3.033 N/A LEU 211.A N PRO 224.A O no hydrogen 3.029 N/A SER 212.A N ASP 215.A OD2 no hydrogen 2.892 N/A SER 212.A OG ASP 215.A OD2 no hydrogen 3.246 N/A ASP 215.A N SER 212.A O no hydrogen 3.284 N/A TRP 217.A NE1 ARG 221.A O no hydrogen 2.840 N/A ARG 221.A NH1 LYS 112.A O no hydrogen 2.759 N/A ARG 221.A NH1 VAL 114.A O no hydrogen 2.855 N/A ARG 221.A NH2 VAL 114.A O no hydrogen 2.915 N/A LYS 223.A NZ SER 212.A O no hydrogen 2.798 N/A LYS 223.A NZ ASP 215.A O no hydrogen 2.700 N/A VAL 225.A N LYS 223.A O no hydrogen 2.766 N/A THR 226.A N LEU 211.A O no hydrogen 3.239 N/A GLN 227.A N PHE 208.A O no hydrogen 3.032 N/A GLN 227.A NE2 VAL 225.A O no hydrogen 2.974 N/A VAL 229.A N VAL 206.A O no hydrogen 2.840 N/A ALA 231.A N CYS 204.A O no hydrogen 3.042 N/A ALA 233.A N PHE 202.A O no hydrogen 2.868 N/A GLY 235.A N ASN 200.A O no hydrogen 2.863 N/A ARG 236.A N TRP 195.A O no hydrogen 3.101 N/A