Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5g4k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N VAL 2.A O no hydrogen 3.039 N/A LYS 6.A NZ ASP 10.A OD1 no hydrogen 3.456 N/A LYS 6.A NZ ASP 10.A OD2 no hydrogen 2.782 N/A VAL 9.A N LYS 5.A O no hydrogen 3.071 N/A ASP 10.A N LYS 6.A O no hydrogen 2.818 N/A ASN 11.A N GLU 7.A O no hydrogen 3.313 N/A ASN 11.A N PHE 8.A O no hydrogen 3.267 N/A ASN 11.A ND2 GLU 7.A O no hydrogen 2.835 N/A SER 14.A N ASN 11.A O no hydrogen 3.103 N/A LYS 16.A N SER 14.A OG no hydrogen 3.033 N/A GLY 17.A N GLY 41.A O no hydrogen 2.962 N/A LYS 18.A N VAL 15.A O no hydrogen 3.054 N/A VAL 19.A N ASN 96.A OD1 no hydrogen 2.877 N/A ALA 20.A N LYS 43.A O no hydrogen 2.825 N/A LEU 21.A N ILE 97.A O no hydrogen 2.818 N/A VAL 22.A N PHE 45.A O no hydrogen 2.903 N/A THR 23.A N ALA 99.A O no hydrogen 2.927 N/A THR 23.A OG1 HIS 102.A ND1 no hydrogen 2.725 N/A ALA 25.A N THR 47.A O no hydrogen 3.044 N/A GLY 27.A N GLY 24.A O no hydrogen 3.037 N/A CYS 31.A N GLY 27.A O no hydrogen 2.927 N/A CYS 31.A SG GLY 27.A O no hydrogen 3.328 N/A CYS 31.A SG ALA 28.A O no hydrogen 3.645 N/A LEU 33.A N LEU 29.A O no hydrogen 2.854 N/A SER 34.A N GLY 30.A O no hydrogen 2.890 N/A SER 34.A OG GLY 30.A O no hydrogen 2.875 N/A LYS 35.A N CYS 31.A O no hydrogen 3.020 N/A LYS 35.A NZ TYR 39.A OH no hydrogen 3.202 N/A LYS 35.A NZ GLU 60.A OE2 no hydrogen 2.779 N/A LYS 35.A NZ GLU 64.A OE2 no hydrogen 2.762 N/A ALA 36.A N VAL 32.A O no hydrogen 2.902 N/A TYR 37.A N LEU 33.A O no hydrogen 2.896 N/A TYR 37.A OH SER 243.A OG no hydrogen 2.703 N/A GLY 38.A N SER 34.A O no hydrogen 3.115 N/A TYR 39.A N LYS 35.A O no hydrogen 2.779 N/A TYR 39.A OH GLU 64.A OE1 no hydrogen 2.585 N/A ALA 40.A N ALA 36.A O no hydrogen 2.948 N/A GLY 41.A N GLY 38.A O no hydrogen 2.926 N/A ALA 42.A N TYR 37.A O no hydrogen 2.959 N/A LYS 43.A N LYS 18.A O no hydrogen 2.778 N/A VAL 44.A N ASP 67.A O no hydrogen 2.926 N/A PHE 45.A N ALA 20.A O no hydrogen 2.819 N/A MET 46.A N ALA 69.A O no hydrogen 2.867 N/A THR 47.A N VAL 22.A O no hydrogen 2.929 N/A THR 47.A OG1 GLY 71.A O no hydrogen 2.749 N/A LYS 53.A N ASN 50.A OD1 no hydrogen 3.063 N/A LEU 54.A N ASN 50.A O no hydrogen 3.067 N/A GLN 55.A N GLU 51.A O no hydrogen 2.871 N/A GLN 55.A NE2 TYR 70.A OH no hydrogen 2.959 N/A ALA 56.A N LYS 52.A O no hydrogen 3.012 N/A LEU 57.A N LYS 53.A O no hydrogen 3.147 N/A GLU 58.A N LEU 54.A O no hydrogen 2.957 N/A ALA 59.A N GLN 55.A O no hydrogen 2.991 N/A GLU 60.A N ALA 56.A O no hydrogen 3.039 N/A PHE 61.A N LEU 57.A O no hydrogen 2.836 N/A LYS 62.A N GLU 58.A O no hydrogen 2.905 N/A ALA 63.A N ALA 59.A O no hydrogen 3.123 N/A GLU 64.A N PHE 61.A O no hydrogen 3.000 N/A GLY 65.A N LYS 62.A O no hydrogen 3.038 N/A ILE 66.A N PHE 61.A O no hydrogen 3.067 N/A CYS 68.A SG GLU 58.A O no hydrogen 3.848 N/A ALA 69.A N VAL 44.A O no hydrogen 2.967 N/A TYR 70.A OH GLU 51.A OE2 no hydrogen 2.864 N/A GLY 71.A N MET 46.A O no hydrogen 2.965 N/A ALA 73.A N GLY 48.A O no hydrogen 3.043 N/A ASP 74.A N GLN 80.A OE1 no hydrogen 2.821 N/A ALA 76.A N ASP 74.A OD1 no hydrogen 3.080 N/A ASP 77.A N ASP 74.A O no hydrogen 2.974 N/A GLN 80.A N ASP 77.A OD1 no hydrogen 3.126 N/A VAL 81.A N ASP 77.A O no hydrogen 2.932 N/A ASP 82.A N GLU 78.A O no hydrogen 2.898 N/A ALA 83.A N ALA 79.A O no hydrogen 3.119 N/A MET 84.A N GLN 80.A O no hydrogen 2.961 N/A ILE 85.A N VAL 81.A O no hydrogen 2.917 N/A THR 86.A N ASP 82.A O no hydrogen 3.051 N/A THR 86.A OG1 ASP 82.A O no hydrogen 3.003 N/A ALA 87.A N ALA 83.A O no hydrogen 2.978 N/A CYS 88.A N MET 84.A O no hydrogen 2.975 N/A VAL 89.A N ILE 85.A O no hydrogen 2.871 N/A ALA 90.A N THR 86.A O no hydrogen 2.896 N/A GLN 91.A N ALA 87.A O no hydrogen 3.015 N/A TYR 92.A N CYS 88.A O no hydrogen 2.886 N/A TYR 92.A OH ASP 67.A OD1 no hydrogen 3.032 N/A GLY 93.A N VAL 89.A O no hydrogen 2.724 N/A VAL 95.A N GLN 143.A OE1 no hydrogen 2.799 N/A ASN 96.A N VAL 19.A O no hydrogen 2.955 N/A ASN 96.A ND2 GLU 94.A OE1 no hydrogen 2.903 N/A ILE 97.A N VAL 19.A O no hydrogen 2.978 N/A LEU 98.A N LYS 148.A O no hydrogen 2.904 N/A ALA 99.A N LEU 21.A O no hydrogen 2.913 N/A VAL 100.A N VAL 150.A O no hydrogen 2.877 N/A THR 101.A N THR 23.A O no hydrogen 3.339 N/A THR 101.A N THR 23.A OG1 no hydrogen 3.081 N/A THR 101.A OG1 THR 23.A O no hydrogen 2.698 N/A HIS 102.A ND1 THR 23.A OG1 no hydrogen 2.725 N/A HIS 102.A NE2 SER 128.A OG no hydrogen 2.711 N/A PHE 104.A N ASP 125.A OD1 no hydrogen 2.947 N/A GLN 108.A N GLY 163.A O no hydrogen 2.917 N/A ASN 109.A N GLN 108.A OE1 no hydrogen 2.939 N/A LEU 111.A N ASN 109.A OD1 no hydrogen 2.890 N/A GLU 112.A N ASN 109.A O no hydrogen 3.044 N/A GLN 113.A NE2 THR 165.A OG1 no hydrogen 2.901 N/A ASP 117.A N SER 114.A OG no hydrogen 2.960 N/A TRP 118.A N SER 114.A O no hydrogen 2.953 N/A GLN 119.A N VAL 115.A O no hydrogen 2.828 N/A GLN 119.A NE2 GLN 119.A O no hydrogen 3.427 N/A GLN 119.A NE2 ASP 123.A OD1 no hydrogen 2.758 N/A TYR 120.A N ALA 116.A O no hydrogen 2.899 N/A ILE 121.A N ASP 117.A O no hydrogen 3.297 N/A MET 122.A N TRP 118.A O no hydrogen 3.069 N/A ASP 123.A N GLN 119.A O no hydrogen 2.807 N/A THR 124.A N TYR 120.A O no hydrogen 3.030 N/A ASP 125.A N ILE 121.A O no hydrogen 2.772 N/A CYS 126.A N MET 122.A O no hydrogen 2.856 N/A CYS 126.A SG SER 170.A O no hydrogen 3.924 N/A LYS 127.A N MET 122.A O no hydrogen 2.934 N/A SER 128.A N ASP 123.A O no hydrogen 3.314 N/A SER 128.A OG HIS 102.A NE2 no hydrogen 2.711 N/A SER 128.A OG THR 124.A O no hydrogen 2.733 N/A VAL 129.A N CYS 126.A O no hydrogen 3.006 N/A TYR 130.A N CYS 126.A O no hydrogen 3.218 N/A VAL 131.A N LYS 127.A O no hydrogen 2.911 N/A VAL 132.A N SER 128.A O no hydrogen 3.035 N/A CYS 133.A N VAL 129.A O no hydrogen 2.941 N/A CYS 133.A SG VAL 129.A O no hydrogen 3.372 N/A LYS 134.A N TYR 130.A O no hydrogen 2.886 N/A TYR 135.A N VAL 131.A O no hydrogen 3.116 N/A TYR 135.A OH GLU 78.A OE1 no hydrogen 2.615 N/A VAL 136.A N VAL 132.A O no hydrogen 2.931 N/A ALA 137.A N CYS 133.A O no hydrogen 2.829 N/A GLN 138.A N LYS 134.A O no hydrogen 2.945 N/A GLN 139.A N TYR 135.A O no hydrogen 3.137 N/A GLN 139.A NE2 GLN 143.A OE1 no hydrogen 2.916 N/A MET 140.A N VAL 136.A O no hydrogen 2.855 N/A VAL 141.A N ALA 137.A O no hydrogen 2.823 N/A ASP 142.A N GLN 138.A O no hydrogen 2.934 N/A GLN 143.A N GLN 139.A O no hydrogen 3.016 N/A GLN 143.A NE2 VAL 95.A O no hydrogen 2.858 N/A GLY 144.A N MET 140.A O no hydrogen 3.137 N/A GLY 147.A N GLY 190.A O no hydrogen 3.148 N/A LYS 148.A N ASN 96.A O no hydrogen 3.043 N/A LYS 148.A NZ SER 244.A O no hydrogen 2.916 N/A LYS 148.A NZ SER 247.A OG no hydrogen 3.145 N/A LYS 148.A NZ ASN 248.A OD1 no hydrogen 3.086 N/A ILE 149.A N ASN 192.A O no hydrogen 2.860 N/A VAL 150.A N LEU 98.A O no hydrogen 2.799 N/A VAL 151.A N ASN 194.A O no hydrogen 2.885 N/A VAL 152.A N VAL 100.A O no hydrogen 2.821 N/A THR 153.A N ILE 196.A O no hydrogen 2.818 N/A THR 153.A OG1 ASP 175.A OD1 no hydrogen 2.863 N/A THR 153.A OG1 ILE 196.A O no hydrogen 3.317 N/A GLN 155.A N PRO 198.A O no hydrogen 2.970 N/A GLN 155.A NE2 THR 199.A OG1 no hydrogen 3.006 N/A ARG 156.A N SER 154.A OG no hydrogen 2.951 N/A ARG 156.A NE ARG 159.A O no hydrogen 2.975 N/A ARG 156.A NH1 TYR 261.A OH no hydrogen 3.118 N/A ARG 156.A NH2 ARG 159.A O no hydrogen 3.503 N/A ARG 156.A NH2 GLY 160.A O no hydrogen 3.137 N/A ARG 156.A NH2 TYR 261.A OH no hydrogen 3.066 N/A SER 157.A N SER 154.A O no hydrogen 2.901 N/A SER 157.A OG SER 154.A O no hydrogen 2.895 N/A SER 157.A OG ASP 175.A OD2 no hydrogen 2.633 N/A LYS 158.A N GLN 155.A O no hydrogen 3.124 N/A ARG 159.A N GLN 155.A O no hydrogen 3.264 N/A ARG 159.A NH1 LYS 158.A O no hydrogen 2.893 N/A ARG 159.A NH2 LEU 262.A O no hydrogen 2.768 N/A TYR 164.A N MET 161.A O no hydrogen 3.028 N/A CYS 168.A N TYR 164.A O no hydrogen 2.783 N/A CYS 168.A SG ARG 156.A O no hydrogen 3.464 N/A CYS 168.A SG ARG 159.A O no hydrogen 3.571 N/A THR 169.A OG1 THR 165.A O no hydrogen 2.594 N/A SER 170.A N GLY 166.A O no hydrogen 2.987 N/A SER 170.A OG ASP 125.A OD2 no hydrogen 2.616 N/A LYS 171.A N TYR 167.A O no hydrogen 2.834 N/A LYS 171.A NZ ASP 125.A OD1 no hydrogen 3.210 N/A LYS 171.A NZ ASP 125.A OD2 no hydrogen 2.821 N/A GLY 172.A N CYS 168.A O no hydrogen 2.811 N/A GLY 173.A N THR 169.A O no hydrogen 2.875 N/A ALA 174.A N SER 170.A O no hydrogen 2.918 N/A ASP 175.A N LYS 171.A O no hydrogen 3.045 N/A MET 177.A N GLY 173.A O no hydrogen 2.814 N/A VAL 178.A N ALA 174.A O no hydrogen 2.880 N/A SER 179.A N ASP 175.A O no hydrogen 3.163 N/A SER 179.A OG ASP 175.A O no hydrogen 3.424 N/A SER 179.A OG GLY 252.A O no hydrogen 2.920 N/A SER 180.A N LEU 176.A O no hydrogen 2.971 N/A SER 180.A OG LEU 176.A O no hydrogen 3.019 N/A MET 181.A N MET 177.A O no hydrogen 2.763 N/A ALA 182.A N VAL 178.A O no hydrogen 2.951 N/A CYS 183.A N SER 179.A O no hydrogen 3.134 N/A CYS 183.A SG SER 179.A O no hydrogen 3.425 N/A ASP 184.A N SER 180.A O no hydrogen 2.914 N/A LEU 185.A N MET 181.A O no hydrogen 2.876 N/A LEU 185.A N ALA 182.A O no hydrogen 3.323 N/A SER 186.A N ALA 182.A O no hydrogen 2.977 N/A SER 186.A OG ALA 182.A O no hydrogen 3.294 N/A SER 186.A OG ILE 191.A O no hydrogen 2.736 N/A SER 186.A OG THR 251.A OG1 no hydrogen 2.694 N/A TYR 189.A N LEU 185.A O no hydrogen 3.008 N/A GLY 190.A N SER 186.A O no hydrogen 3.001 N/A ASN 192.A N GLY 147.A O no hydrogen 3.067 N/A ASN 192.A ND2 ASN 248.A O no hydrogen 2.959 N/A ASN 192.A ND2 ILE 250.A O no hydrogen 2.875 N/A VAL 193.A N THR 251.A OG1 no hydrogen 3.087 N/A ASN 194.A N ILE 149.A O no hydrogen 2.996 N/A ASN 194.A ND2 ILE 250.A O no hydrogen 2.984 N/A SER 195.A N ALA 253.A O no hydrogen 2.863 N/A SER 195.A OG ASP 175.A OD1 no hydrogen 2.963 N/A ILE 196.A N VAL 151.A O no hydrogen 3.012 N/A CYS 197.A N CYS 255.A O no hydrogen 2.742 N/A CYS 197.A SG THR 153.A OG1 no hydrogen 3.453 N/A CYS 197.A SG SER 157.A OG no hydrogen 3.705 N/A CYS 197.A SG ASP 175.A OD1 no hydrogen 3.896 N/A CYS 197.A SG ASP 175.A OD2 no hydrogen 3.715 N/A THR 199.A N CYS 257.A O no hydrogen 3.238 N/A THR 199.A OG1 GLU 224.A OE2 no hydrogen 2.702 N/A VAL 200.A N THR 199.A OG1 no hydrogen 2.772 N/A PHE 201.A N ASP 204.A OD2 no hydrogen 3.215 N/A ARG 202.A N ALA 230.A O no hydrogen 2.791 N/A ARG 202.A NE GLU 231.A OE2 no hydrogen 2.734 N/A ARG 202.A NH2 GLU 231.A OE1 no hydrogen 3.349 N/A ASP 204.A N PHE 201.A O no hydrogen 2.924 N/A LEU 205.A N ARG 202.A O no hydrogen 3.109 N/A THR 206.A OG1 SER 203.A O no hydrogen 2.900 N/A ASP 211.A N TRP 208.A O no hydrogen 3.120 N/A GLU 213.A N ASP 211.A OD1 no hydrogen 3.175 N/A SER 214.A N ASP 211.A O no hydrogen 3.010 N/A VAL 216.A N SER 214.A OG no hydrogen 3.393 N/A ASN 219.A N ALA 215.A O no hydrogen 2.774 N/A PHE 220.A N VAL 216.A O no hydrogen 3.176 N/A LEU 221.A N TYR 217.A O no hydrogen 3.027 N/A LYS 222.A N GLN 218.A O no hydrogen 2.921 N/A ARG 223.A N PHE 220.A O no hydrogen 2.790 N/A GLU 224.A N LEU 221.A O no hydrogen 3.165 N/A ILE 226.A N GLY 259.A O no hydrogen 3.035 N/A GLY 227.A N GLU 224.A O no hydrogen 2.793 N/A ARG 228.A NH1 LEU 229.A O no hydrogen 3.266 N/A ARG 228.A NH1 ASP 234.A OD2 no hydrogen 2.792 N/A ARG 228.A NH2 ASP 234.A OD1 no hydrogen 2.933 N/A ARG 228.A NH2 ASP 234.A OD2 no hydrogen 3.429 N/A ALA 230.A N VAL 200.A O no hydrogen 3.382 N/A GLU 231.A N ASP 234.A OD2 no hydrogen 2.788 N/A ASP 234.A N GLU 231.A O no hydrogen 2.862 N/A PHE 235.A N PRO 232.A O no hydrogen 3.056 N/A VAL 236.A N GLU 233.A O no hydrogen 3.360 N/A ALA 239.A N PHE 235.A O no hydrogen 2.998 N/A LEU 240.A N VAL 236.A O no hydrogen 2.878 N/A PHE 241.A N GLY 237.A O no hydrogen 2.864 N/A LEU 242.A N TYR 238.A O no hydrogen 3.010 N/A SER 243.A N LEU 240.A O no hydrogen 3.028 N/A SER 243.A OG TYR 37.A OH no hydrogen 2.703 N/A SER 243.A OG ALA 239.A O no hydrogen 2.713 N/A SER 244.A N PHE 241.A O no hydrogen 3.212 N/A SER 244.A OG MET 12.A O no hydrogen 3.234 N/A SER 244.A OG LEU 240.A O no hydrogen 3.471 N/A SER 244.A OG PHE 241.A O no hydrogen 2.935 N/A ALA 246.A N MET 12.A O no hydrogen 2.901 N/A ALA 246.A N SER 244.A OG no hydrogen 3.377 N/A SER 247.A N SER 244.A O no hydrogen 3.169 N/A SER 247.A OG PHE 241.A O no hydrogen 2.815 N/A SER 247.A OG SER 244.A O no hydrogen 3.056 N/A ASN 248.A N ASP 245.A O no hydrogen 3.123 N/A ASN 248.A ND2 ASP 245.A OD1 no hydrogen 3.341 N/A ILE 250.A N SER 247.A O no hydrogen 2.899 N/A THR 251.A OG1 SER 186.A OG no hydrogen 2.694 N/A GLY 252.A N VAL 193.A O no hydrogen 2.738 N/A ALA 253.A N ASN 194.A OD1 no hydrogen 2.995 N/A ASN 254.A ND2 ASP 175.A O no hydrogen 3.249 N/A ASN 254.A ND2 SER 195.A OG no hydrogen 2.883 N/A CYS 255.A N SER 195.A O no hydrogen 2.793 N/A CYS 257.A N CYS 197.A O no hydrogen 3.085 N/A SER 258.A N ASP 256.A OD1 no hydrogen 2.922 N/A SER 258.A OG ASP 256.A OD1 no hydrogen 2.637 N/A TYR 261.A N SER 258.A O no hydrogen 3.285 N/A LEU 262.A N SER 258.A OG no hydrogen 2.954 N/A THR 263.A N GLY 260.A O no hydrogen 3.101 N/A CYS 264.A SG ARG 223.A O no hydrogen 3.706 N/A CYS 264.A SG GLY 260.A O no hydrogen 3.412 N/A