Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4jig_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N SER 2.A OG no hydrogen 3.318 N/A ARG 4.A NE ASP 30.A OD1 no hydrogen 2.901 N/A ARG 4.A NH2 ALA 25.A O no hydrogen 2.879 N/A ARG 4.A NH2 TRP 29.A O no hydrogen 2.901 N/A ALA 6.A N ASP 84.A OD2 no hydrogen 3.014 N/A VAL 7.A N ASP 30.A O no hydrogen 3.007 N/A LEU 8.A N ALA 85.A O no hydrogen 3.003 N/A ILE 9.A N GLY 32.A O no hydrogen 2.899 N/A THR 10.A N VAL 87.A O no hydrogen 2.986 N/A GLY 11.A N ASN 34.A OD1 no hydrogen 3.190 N/A ALA 12.A N ASN 34.A O no hydrogen 2.831 N/A ARG 18.A N ARG 14.A O no hydrogen 3.173 N/A ARG 18.A NE THR 45.A OG1 no hydrogen 3.025 N/A ARG 18.A NH2 ALA 41.A O no hydrogen 3.104 N/A ALA 19.A N GLY 15.A O no hydrogen 3.047 N/A THR 20.A N ILE 16.A O no hydrogen 2.861 N/A THR 20.A OG1 ILE 16.A O no hydrogen 2.724 N/A ALA 21.A N GLY 17.A O no hydrogen 2.969 N/A VAL 22.A N ARG 18.A O no hydrogen 2.980 N/A LEU 23.A N ALA 19.A O no hydrogen 2.893 N/A ALA 24.A N THR 20.A O no hydrogen 2.782 N/A ALA 25.A N ALA 21.A O no hydrogen 2.980 N/A GLU 26.A N VAL 22.A O no hydrogen 3.003 N/A ARG 27.A N LEU 23.A O no hydrogen 2.958 N/A ARG 27.A N ALA 24.A O no hydrogen 3.032 N/A ARG 27.A NH2 GLU 213.A OE1 no hydrogen 2.760 N/A GLY 28.A N ALA 25.A O no hydrogen 3.034 N/A TRP 29.A N ALA 24.A O no hydrogen 2.935 N/A ASP 30.A N LYS 5.A O no hydrogen 2.787 N/A VAL 31.A N ARG 55.A O no hydrogen 2.895 N/A GLY 32.A N VAL 7.A O no hydrogen 2.807 N/A ILE 33.A N CYS 57.A O no hydrogen 2.718 N/A ASN 34.A N ILE 9.A O no hydrogen 3.015 N/A ASN 34.A ND2 VAL 59.A O no hydrogen 3.070 N/A ASN 34.A ND2 GLY 61.A O no hydrogen 3.211 N/A TYR 35.A N VAL 59.A O no hydrogen 3.407 N/A ALA 39.A N ARG 37.A O no hydrogen 2.942 N/A ALA 41.A N ASP 38.A OD1 no hydrogen 3.126 N/A ALA 42.A N ASP 38.A O no hydrogen 3.140 N/A GLU 43.A N ALA 39.A O no hydrogen 2.944 N/A LEU 44.A N ALA 40.A O no hydrogen 3.084 N/A THR 45.A N ALA 41.A O no hydrogen 2.995 N/A THR 45.A OG1 ALA 12.A O no hydrogen 3.133 N/A THR 45.A OG1 SER 13.A O no hydrogen 3.348 N/A THR 45.A OG1 ALA 41.A O no hydrogen 3.245 N/A ALA 46.A N ALA 42.A O no hydrogen 2.917 N/A GLN 47.A N GLU 43.A O no hydrogen 2.982 N/A GLN 47.A NE2 ASP 51.A OD1 no hydrogen 2.996 N/A ALA 48.A N LEU 44.A O no hydrogen 3.187 N/A VAL 49.A N THR 45.A O no hydrogen 2.874 N/A ARG 50.A N ALA 46.A O no hydrogen 2.857 N/A ARG 50.A NH2 GLU 43.A OE2 no hydrogen 3.044 N/A ARG 50.A NH2 GLN 47.A OE1 no hydrogen 2.800 N/A ASP 51.A N GLN 47.A O no hydrogen 2.793 N/A ALA 52.A N ALA 48.A O no hydrogen 3.053 N/A ALA 52.A N VAL 49.A O no hydrogen 2.987 N/A GLY 53.A N ARG 50.A O no hydrogen 2.896 N/A GLY 54.A N VAL 49.A O no hydrogen 3.000 N/A ARG 55.A N ASP 30.A OD1 no hydrogen 2.849 N/A ARG 55.A NE ASP 30.A OD2 no hydrogen 2.912 N/A ARG 55.A NH2 ASP 30.A OD2 no hydrogen 3.309 N/A ARG 55.A NH2 PHE 80.A O no hydrogen 3.380 N/A CYS 57.A N VAL 31.A O no hydrogen 3.005 N/A VAL 59.A N ILE 33.A O no hydrogen 2.779 N/A GLY 61.A N TYR 35.A O no hydrogen 2.962 N/A ASP 62.A N ASP 68.A OD2 no hydrogen 2.764 N/A ALA 64.A N ASP 62.A OD1 no hydrogen 3.145 N/A ASN 65.A N ASP 62.A O no hydrogen 2.876 N/A ASP 68.A N ASN 65.A OD1 no hydrogen 2.966 N/A VAL 69.A N ASN 65.A O no hydrogen 3.029 N/A VAL 70.A N GLU 66.A O no hydrogen 2.977 N/A ALA 71.A N ALA 67.A O no hydrogen 3.030 N/A MET 72.A N ASP 68.A O no hydrogen 2.853 N/A PHE 73.A N VAL 69.A O no hydrogen 3.166 N/A ASP 74.A N VAL 70.A O no hydrogen 2.942 N/A THR 75.A N ALA 71.A O no hydrogen 2.773 N/A THR 75.A OG1 ALA 71.A O no hydrogen 2.812 N/A VAL 76.A N MET 72.A O no hydrogen 3.156 N/A ALA 77.A N PHE 73.A O no hydrogen 3.011 N/A ALA 78.A N ASP 74.A O no hydrogen 2.921 N/A ALA 79.A N THR 75.A O no hydrogen 2.919 N/A PHE 80.A N VAL 76.A O no hydrogen 3.013 N/A GLY 81.A N ALA 77.A O no hydrogen 2.675 N/A ARG 82.A NE PHE 80.A O no hydrogen 2.878 N/A ARG 82.A NH2 PHE 80.A O no hydrogen 3.135 N/A ASP 84.A N ALA 6.A O no hydrogen 2.920 N/A LEU 86.A N ALA 139.A O no hydrogen 3.120 N/A VAL 87.A N LEU 8.A O no hydrogen 2.810 N/A ASN 88.A N VAL 141.A O no hydrogen 2.881 N/A ASN 88.A ND2 ALA 118.A O no hydrogen 3.098 N/A ASN 88.A ND2 ASN 142.A OD1 no hydrogen 2.818 N/A ASN 89.A N THR 10.A OG1 no hydrogen 2.827 N/A ASN 89.A ND2 THR 10.A O no hydrogen 3.373 N/A ASN 89.A ND2 GLY 11.A O no hydrogen 2.918 N/A ALA 90.A N THR 10.A OG1 no hydrogen 2.948 N/A SER 96.A OG TYR 156.A OH no hydrogen 3.066 N/A MET 97.A N GLU 155.A O no hydrogen 3.030 N/A ASP 101.A N PRO 98.A O no hydrogen 3.113 N/A MET 102.A N LEU 99.A O no hydrogen 2.894 N/A ARG 106.A NE ASP 158.A OD2 no hydrogen 2.610 N/A ARG 106.A NH1 PRO 95.A O no hydrogen 2.849 N/A ARG 106.A NH2 PRO 95.A O no hydrogen 3.384 N/A ARG 106.A NH2 ASP 158.A OD1 no hydrogen 3.005 N/A LEU 107.A N PRO 103.A O no hydrogen 3.232 N/A ARG 108.A N VAL 104.A O no hydrogen 2.974 N/A ARG 109.A N ASP 105.A O no hydrogen 3.037 N/A MET 110.A N ARG 106.A O no hydrogen 2.960 N/A PHE 111.A N LEU 107.A O no hydrogen 3.024 N/A ASP 112.A N ARG 108.A O no hydrogen 2.856 N/A THR 113.A N ARG 109.A O no hydrogen 3.045 N/A THR 113.A OG1 ARG 109.A O no hydrogen 2.935 N/A ASN 114.A N MET 110.A O no hydrogen 2.892 N/A ASN 114.A ND2.A MET 110.A O no hydrogen 3.375 N/A ASN 114.A ND2.B SER 162.A OG no hydrogen 3.178 N/A VAL 115.A N PHE 111.A O no hydrogen 2.795 N/A LEU 116.A N PHE 111.A O no hydrogen 2.922 N/A GLY 117.A N ASP 112.A O no hydrogen 2.759 N/A TYR 119.A N VAL 115.A O no hydrogen 2.980 N/A LEU 120.A N LEU 116.A O no hydrogen 2.823 N/A CYS 121.A N GLY 117.A O no hydrogen 2.983 N/A CYS 121.A SG GLY 117.A O no hydrogen 3.514 N/A ALA 122.A N ALA 118.A O no hydrogen 2.867 N/A ARG 123.A N TYR 119.A O no hydrogen 2.760 N/A ARG 123.A NH1 GLU 66.A OE2 no hydrogen 2.730 N/A GLU 124.A N LEU 120.A O no hydrogen 2.996 N/A ALA 125.A N CYS 121.A O no hydrogen 2.936 N/A ALA 126.A N ALA 122.A O no hydrogen 2.818 N/A ARG 127.A N ARG 123.A O no hydrogen 2.870 N/A ARG 128.A N GLU 124.A O no hydrogen 2.981 N/A ARG 128.A N ALA 125.A O no hydrogen 3.206 N/A ARG 128.A NE GLU 124.A OE1 no hydrogen 2.896 N/A ARG 128.A NH1 ASP 74.A OD1 no hydrogen 2.759 N/A ARG 128.A NH2 ASP 74.A OD1 no hydrogen 2.794 N/A ARG 128.A NH2 GLU 124.A OE1 no hydrogen 2.776 N/A LEU 129.A N ALA 125.A O no hydrogen 2.681 N/A SER 130.A N ALA 126.A O no hydrogen 3.328 N/A SER 130.A OG ALA 126.A O no hydrogen 2.650 N/A THR 131.A N HIS 180.A O no hydrogen 2.902 N/A ARG 133.A N SER 130.A O no hydrogen 3.062 N/A GLY 135.A N SER 130.A O no hydrogen 2.925 N/A ARG 136.A NE ASP 84.A OD1 no hydrogen 2.581 N/A ARG 136.A NH1 ASP 84.A OD1 no hydrogen 3.049 N/A ARG 136.A NH1 ASP 84.A OD2 no hydrogen 2.937 N/A GLY 137.A N LEU 129.A O no hydrogen 2.858 N/A GLY 138.A N GLY 181.A O no hydrogen 2.929 N/A ALA 139.A N ASP 84.A O no hydrogen 3.249 N/A ILE 140.A N ARG 183.A O no hydrogen 2.777 N/A VAL 141.A N LEU 86.A O no hydrogen 2.847 N/A ASN 142.A N ASN 185.A O no hydrogen 2.793 N/A ASN 142.A ND2 THR 170.A OG1 no hydrogen 3.033 N/A VAL 143.A N ASN 88.A O no hydrogen 2.835 N/A SER 144.A N VAL 187.A O no hydrogen 2.675 N/A SER 144.A OG LYS 163.A O no hydrogen 3.393 N/A SER 144.A OG ASP 167.A OD1 no hydrogen 2.547 N/A SER 145.A OG PRO 189.A O no hydrogen 3.485 N/A ILE 146.A N PRO 189.A O no hydrogen 2.944 N/A ALA 147.A N SER 145.A OG no hydrogen 2.925 N/A SER 148.A N SER 145.A O no hydrogen 3.066 N/A SER 148.A OG SER 145.A O no hydrogen 3.121 N/A SER 148.A OG ASP 167.A OD2 no hydrogen 2.615 N/A ARG 149.A N ILE 146.A O no hydrogen 3.032 N/A ARG 149.A NE ASP 232.A OD1 no hydrogen 3.231 N/A ARG 149.A NH1 ARG 237.A OXT no hydrogen 3.033 N/A ARG 149.A NH2 ASP 232.A OD1 no hydrogen 3.130 N/A ARG 149.A NH2 ARG 237.A O no hydrogen 2.773 N/A LEU 150.A N ILE 146.A O no hydrogen 3.052 N/A GLY 151.A N ALA 147.A O no hydrogen 2.774 N/A GLU 155.A N SER 152.A O no hydrogen 3.145 N/A TYR 156.A N SER 152.A O no hydrogen 2.986 N/A TYR 156.A N SER 152.A OG.B no hydrogen 3.007 N/A ALA 160.A N TYR 156.A O no hydrogen 2.924 N/A GLY 161.A N VAL 157.A O no hydrogen 3.027 N/A SER 162.A N ASP 158.A O no hydrogen 2.951 N/A SER 162.A OG TYR 159.A O no hydrogen 2.704 N/A LYS 163.A N TYR 159.A O no hydrogen 3.049 N/A LYS 163.A N ALA 160.A O no hydrogen 3.165 N/A LYS 163.A NZ ASN 114.A OD1.A no hydrogen 2.909 N/A LYS 163.A NZ VAL 143.A O no hydrogen 2.927 N/A GLY 164.A N ALA 160.A O no hydrogen 2.916 N/A ALA 165.A N GLY 161.A O no hydrogen 2.999 N/A VAL 166.A N SER 162.A O no hydrogen 3.221 N/A ASP 167.A N LYS 163.A O no hydrogen 2.885 N/A SER 168.A N GLY 164.A O no hydrogen 3.147 N/A SER 168.A OG GLY 164.A O no hydrogen 3.474 N/A LEU 169.A N ALA 165.A O no hydrogen 2.810 N/A THR 170.A N VAL 166.A O no hydrogen 2.992 N/A THR 170.A OG1 VAL 166.A O no hydrogen 2.789 N/A ILE 171.A N ASP 167.A O no hydrogen 3.129 N/A GLY 172.A N SER 168.A O no hydrogen 2.979 N/A LEU 173.A N LEU 169.A O no hydrogen 2.752 N/A ALA 174.A N THR 170.A O no hydrogen 3.021 N/A LYS 175.A N ILE 171.A O no hydrogen 3.346 N/A GLU 176.A N GLY 172.A O no hydrogen 2.875 N/A LEU 177.A N LEU 173.A O no hydrogen 2.794 N/A GLY 178.A N ALA 174.A O no hydrogen 2.983 N/A HIS 180.A N LEU 177.A O no hydrogen 2.908 N/A GLY 181.A N GLY 178.A O no hydrogen 3.396 N/A VAL 182.A N LEU 177.A O no hydrogen 3.287 N/A ARG 183.A N GLY 138.A O no hydrogen 3.109 N/A ARG 183.A NH1 LEU 218.A O no hydrogen 2.861 N/A ARG 183.A NH1 THR 226.A O no hydrogen 3.041 N/A ARG 183.A NH2 LEU 218.A O no hydrogen 3.101 N/A VAL 184.A N THR 227.A OG1 no hydrogen 2.914 N/A ASN 185.A N ILE 140.A O no hydrogen 2.952 N/A ASN 185.A ND2 THR 226.A O no hydrogen 2.935 N/A ALA 186.A N ALA 229.A O no hydrogen 2.918 N/A VAL 187.A N ASN 142.A O no hydrogen 3.024 N/A ARG 188.A N LEU 231.A O no hydrogen 2.860 N/A ARG 188.A NE ASP 232.A OD1 no hydrogen 2.830 N/A ARG 188.A NH1 ASP 167.A OD2 no hydrogen 2.934 N/A ARG 188.A NH2 ASP 232.A OD1 no hydrogen 3.282 N/A ARG 188.A NH2 ASP 232.A OD2 no hydrogen 2.952 N/A GLY 190.A N VAL 233.A O no hydrogen 2.954 N/A GLU 193.A N GLY 206.A O no hydrogen 2.742 N/A GLN 199.A N LEU 196.A O no hydrogen 2.757 N/A THR 200.A N GLY 197.A O no hydrogen 3.130 N/A THR 200.A OG1 GLY 197.A O no hydrogen 2.810 N/A THR 200.A OG1 ARG 204.A O no hydrogen 3.271 N/A LEU 202.A N GLY 235.A O no hydrogen 3.147 N/A GLY 203.A N THR 200.A O no hydrogen 2.789 N/A ARG 204.A NH1 ALA 205.A O no hydrogen 3.221 N/A ARG 204.A NH1 GLU 210.A OE1 no hydrogen 2.769 N/A ARG 204.A NH1 GLU 210.A OE2 no hydrogen 3.472 N/A ARG 204.A NH2 GLU 210.A OE2 no hydrogen 2.749 N/A GLY 206.A N LEU 191.A O no hydrogen 2.780 N/A GLU 207.A N GLU 210.A OE1 no hydrogen 2.844 N/A GLN 209.A NE2 GLU 213.A OE2 no hydrogen 3.542 N/A GLU 210.A N GLU 207.A O no hydrogen 2.954 N/A VAL 211.A N ALA 208.A O no hydrogen 3.023 N/A ALA 212.A N ALA 208.A O no hydrogen 2.992 N/A GLU 213.A N GLN 209.A O no hydrogen 2.912 N/A ILE 215.A N VAL 211.A O no hydrogen 3.014 N/A VAL 216.A N ALA 212.A O no hydrogen 2.843 N/A TRP 217.A N GLU 213.A O no hydrogen 3.029 N/A LEU 218.A N ALA 214.A O no hydrogen 3.127 N/A LEU 219.A N ILE 215.A O no hydrogen 3.013 N/A GLY 220.A N TRP 217.A O no hydrogen 3.059 N/A ALA 223.A N GLY 220.A O no hydrogen 3.183 N/A SER 224.A OG ASP 221.A O no hydrogen 3.418 N/A THR 226.A N ALA 223.A O no hydrogen 2.957 N/A THR 227.A OG1 VAL 184.A O no hydrogen 3.457 N/A GLY 228.A N VAL 184.A O no hydrogen 2.701 N/A ALA 229.A N ASN 185.A OD1 no hydrogen 2.935 N/A LEU 231.A N ALA 186.A O no hydrogen 2.892 N/A VAL 233.A N ARG 188.A O no hydrogen 2.845 N/A ARG 237.A N GLY 234.A O no hydrogen 3.284 N/A