Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kvy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N CYS 112.A O no hydrogen 3.283 N/A CYS 6.A SG ALA 241.A O no hydrogen 3.127 N/A HIS 9.A N ASN 7.A OD1 no hydrogen 3.004 N/A HIS 9.A ND1 ASN 7.A OD1 no hydrogen 2.923 N/A MET 13.A N ILE 10.A O no hydrogen 3.065 N/A ASP 16.A N THR 25.A OG1 no hydrogen 2.942 N/A LEU 18.A N LEU 23.A O no hydrogen 2.726 N/A HIS 20.A N GLU 102.A OE1 no hydrogen 3.075 N/A HIS 20.A ND1 GLU 102.A OE2 no hydrogen 2.776 N/A PHE 21.A N LEU 18.A O no hydrogen 3.005 N/A SER 22.A N TYR 19.A O no hydrogen 3.244 N/A LEU 23.A N LEU 18.A O no hydrogen 3.259 N/A SER 24.A OG GLU 15.A OE1 no hydrogen 3.055 N/A SER 24.A OG SER 26.A OG no hydrogen 3.381 N/A THR 25.A N ASP 16.A O no hydrogen 3.085 N/A SER 26.A N SER 24.A OG no hydrogen 3.332 N/A SER 26.A OG GLU 15.A OE1 no hydrogen 2.570 N/A SER 26.A OG SER 24.A OG no hydrogen 3.381 N/A THR 27.A N SER 24.A O no hydrogen 3.176 N/A THR 27.A OG1 SER 24.A O no hydrogen 3.373 N/A THR 27.A OG1 HIS 28.A ND1 no hydrogen 2.774 N/A HIS 28.A ND1 THR 27.A OG1 no hydrogen 2.774 N/A MET 33.A N ASP 29.A O no hydrogen 2.956 N/A PHE 34.A N PHE 30.A O no hydrogen 2.792 N/A GLY 35.A N PRO 31.A O no hydrogen 2.950 N/A VAL 37.A N PHE 34.A O no hydrogen 2.882 N/A LYS 38.A N PRO 83.A O no hydrogen 2.847 N/A LYS 38.A NZ SER 113.A O no hydrogen 2.969 N/A PHE 39.A N PRO 83.A O no hydrogen 3.018 N/A VAL 40.A N THR 116.A O no hydrogen 2.800 N/A CYS 41.A N LEU 85.A O no hydrogen 2.840 N/A VAL 42.A N ILE 118.A O no hydrogen 2.962 N/A GLY 43.A N VAL 87.A O no hydrogen 3.108 N/A ARG 48.A N SER 45.A OG no hydrogen 3.414 N/A MET 49.A N SER 45.A O no hydrogen 2.969 N/A LYS 50.A N PRO 46.A O no hydrogen 3.039 N/A ALA 51.A N SER 47.A O no hydrogen 2.951 N/A PHE 52.A N ARG 48.A O no hydrogen 2.800 N/A ILE 53.A N MET 49.A O no hydrogen 3.170 N/A LYS 54.A N LYS 50.A O no hydrogen 3.181 N/A TYR 55.A N ALA 51.A O no hydrogen 2.865 N/A VAL 56.A N PHE 52.A O no hydrogen 2.893 N/A ALA 57.A N ILE 53.A O no hydrogen 3.001 N/A MET 58.A N LYS 54.A O no hydrogen 3.143 N/A GLU 59.A N TYR 55.A O no hydrogen 3.139 N/A LEU 60.A N VAL 56.A O no hydrogen 3.119 N/A LEU 60.A N ALA 57.A O no hydrogen 3.296 N/A GLY 61.A N MET 58.A O no hydrogen 3.227 N/A PHE 62.A N ALA 57.A O no hydrogen 2.819 N/A ILE 69.A N MET 78.A O no hydrogen 2.808 N/A CYS 70.A N ASN 68.A OD1 no hydrogen 2.913 N/A CYS 70.A SG PHE 21.A O no hydrogen 3.607 N/A GLU 71.A N ASN 68.A O no hydrogen 3.205 N/A THR 73.A N CYS 70.A O no hydrogen 3.079 N/A ARG 75.A N THR 73.A OG1 no hydrogen 3.185 N/A TYR 76.A OH SER 95.A O no hydrogen 2.585 N/A ALA 77.A N SER 88.A OG no hydrogen 2.839 N/A MET 78.A N ASN 68.A OD1 no hydrogen 3.179 N/A PHE 79.A N SER 86.A O no hydrogen 2.782 N/A LYS 80.A NZ ASP 36.A OD1 no hydrogen 3.244 N/A LYS 80.A NZ ASP 36.A OD2 no hydrogen 3.030 N/A LYS 80.A NZ GLY 82.A O no hydrogen 2.683 N/A VAL 81.A N VAL 84.A O no hydrogen 3.027 N/A VAL 84.A N VAL 81.A O no hydrogen 2.995 N/A LEU 85.A N PHE 39.A O no hydrogen 2.834 N/A SER 86.A N PHE 79.A O no hydrogen 2.763 N/A SER 86.A OG MET 49.A O no hydrogen 2.790 N/A VAL 87.A N CYS 41.A O no hydrogen 2.942 N/A SER 88.A N ALA 77.A O no hydrogen 2.983 N/A HIS 89.A N GLY 43.A O no hydrogen 2.826 N/A GLY 90.A N GLY 44.A O no hydrogen 3.155 N/A GLY 92.A N GLU 231.A OE2 no hydrogen 2.908 N/A SER 95.A OG HIS 89.A O no hydrogen 2.669 N/A ILE 96.A N GLY 92.A O no hydrogen 3.062 N/A ALA 97.A N VAL 93.A O no hydrogen 2.910 N/A ILE 98.A N PRO 94.A O no hydrogen 3.027 N/A MET 99.A N SER 95.A O no hydrogen 3.456 N/A LEU 100.A N ILE 96.A O no hydrogen 2.835 N/A HIS 101.A N ALA 97.A O no hydrogen 3.101 N/A GLU 102.A N ILE 98.A O no hydrogen 3.342 N/A LEU 103.A N MET 99.A O no hydrogen 2.821 N/A ILE 104.A N LEU 100.A O no hydrogen 2.798 N/A LYS 105.A N HIS 101.A O no hydrogen 3.257 N/A LYS 105.A NZ ASP 16.A OD1 no hydrogen 2.976 N/A LYS 105.A NZ ASP 16.A OD2 no hydrogen 3.471 N/A LEU 106.A N GLU 102.A O no hydrogen 3.007 N/A LEU 107.A N LEU 103.A O no hydrogen 2.980 N/A TYR 108.A N ILE 104.A O no hydrogen 3.056 N/A HIS 109.A N LYS 105.A O no hydrogen 2.830 N/A HIS 109.A NE2 ASP 16.A OD2 no hydrogen 2.736 N/A ALA 110.A N LEU 106.A O no hydrogen 2.948 N/A HIS 111.A N TYR 108.A O no hydrogen 2.862 N/A HIS 111.A ND1 HIS 109.A O no hydrogen 3.147 N/A CYS 112.A N LEU 107.A O no hydrogen 3.082 N/A CYS 112.A SG PHE 34.A O no hydrogen 3.118 N/A CYS 112.A SG LEU 107.A O no hydrogen 3.940 N/A GLY 114.A N ASP 1.A O no hydrogen 2.715 N/A THR 116.A N LYS 38.A O no hydrogen 2.797 N/A LEU 117.A N ARG 245.A O no hydrogen 3.034 N/A ILE 118.A N VAL 40.A O no hydrogen 2.826 N/A ARG 119.A N ALA 247.A O no hydrogen 2.978 N/A ARG 119.A NE GLU 229.A OE2 no hydrogen 2.973 N/A ARG 119.A NH2 GLU 229.A OE2 no hydrogen 3.160 N/A ILE 120.A N VAL 42.A O no hydrogen 2.835 N/A GLY 121.A N VAL 249.A O no hydrogen 2.997 N/A SER 123.A OG VAL 251.A O no hydrogen 3.208 N/A GLY 124.A N ILE 228.A O no hydrogen 2.904 N/A GLY 125.A N LEU 254.A O no hydrogen 2.872 N/A ILE 126.A N ARG 226.A O no hydrogen 2.997 N/A GLY 127.A N ASN 255.A OD1 no hydrogen 3.105 N/A GLY 131.A N THR 252.A O no hydrogen 2.843 N/A SER 132.A N GLU 129.A O no hydrogen 3.044 N/A SER 132.A OG GLU 129.A O no hydrogen 2.656 N/A VAL 133.A N PRO 182.A O no hydrogen 2.848 N/A VAL 134.A N CYS 250.A O no hydrogen 2.822 N/A ILE 135.A N VAL 184.A O no hydrogen 2.909 N/A THR 136.A N VAL 248.A O no hydrogen 2.935 N/A THR 136.A OG1 THR 188.A OG1 no hydrogen 2.636 N/A THR 136.A OG1 VAL 248.A O no hydrogen 3.547 N/A ARG 137.A N GLY 186.A O no hydrogen 2.971 N/A GLN 138.A NE2 ASP 162.A OD1 no hydrogen 2.628 N/A ALA 139.A N THR 161.A O no hydrogen 3.171 N/A VAL 140.A N THR 188.A O no hydrogen 2.846 N/A ASP 141.A N LYS 145.A O no hydrogen 2.774 N/A CYS 143.A N ASP 141.A OD2 no hydrogen 2.862 N/A PHE 144.A N ASP 141.A O no hydrogen 2.570 N/A LYS 145.A N ASP 141.A OD2 no hydrogen 3.016 N/A GLU 147.A N LYS 145.A O no hydrogen 2.837 N/A PHE 148.A N ARG 159.A O no hydrogen 2.859 N/A GLN 150.A N GLU 157.A O no hydrogen 2.800 N/A VAL 152.A N LYS 155.A O no hydrogen 2.783 N/A LYS 155.A N VAL 152.A O no hydrogen 2.849 N/A LYS 155.A NZ GLU 157.A OE2 no hydrogen 3.304 N/A ARG 156.A NH2 GLU 149.A OE1 no hydrogen 2.997 N/A GLU 157.A N GLN 150.A O no hydrogen 2.792 N/A ARG 159.A N PHE 148.A O no hydrogen 2.918 N/A THR 161.A N PRO 146.A O no hydrogen 3.238 N/A THR 161.A OG1 ALA 139.A O no hydrogen 2.605 N/A LEU 167.A N ASP 164.A OD1 no hydrogen 2.829 N/A VAL 168.A N ASP 164.A O no hydrogen 3.228 N/A GLN 169.A N GLU 165.A O no hydrogen 3.317 N/A GLU 170.A N GLN 166.A O no hydrogen 3.007 N/A LEU 171.A N LEU 167.A O no hydrogen 2.967 N/A ALA 172.A N VAL 168.A O no hydrogen 2.917 N/A ARG 173.A N GLN 169.A O no hydrogen 3.115 N/A CYS 174.A N GLU 170.A O no hydrogen 3.037 N/A CYS 174.A SG GLU 170.A O no hydrogen 3.496 N/A SER 175.A N LEU 171.A O no hydrogen 3.004 N/A SER 175.A OG THR 183.A OG1 no hydrogen 2.591 N/A ALA 176.A N ALA 172.A O no hydrogen 3.032 N/A GLU 177.A N ARG 173.A O no hydrogen 3.031 N/A LEU 178.A N CYS 174.A O no hydrogen 3.198 N/A GLY 179.A N SER 175.A O no hydrogen 3.056 N/A THR 183.A OG1 SER 175.A OG no hydrogen 2.591 N/A THR 183.A OG1 PHE 181.A O no hydrogen 3.424 N/A VAL 184.A N VAL 133.A O no hydrogen 2.876 N/A GLY 186.A N ILE 135.A O no hydrogen 3.340 N/A ASN 187.A N GLY 224.A O no hydrogen 2.935 N/A ASN 187.A ND2 GLN 138.A OE1 no hydrogen 3.267 N/A THR 188.A N GLN 138.A O no hydrogen 3.053 N/A THR 188.A OG1 THR 136.A OG1 no hydrogen 2.636 N/A THR 188.A OG1 ASN 227.A OD1 no hydrogen 2.666 N/A MET 189.A N ASN 227.A O no hydrogen 2.963 N/A CYS 190.A N VAL 140.A O no hydrogen 2.916 N/A CYS 190.A SG SER 233.A OG no hydrogen 3.317 N/A THR 191.A N GLU 229.A O no hydrogen 2.960 N/A THR 191.A OG1 ASP 193.A O no hydrogen 2.869 N/A TYR 195.A N ASP 193.A OD2 no hydrogen 2.840 N/A GLY 197.A N ASP 193.A OD2 no hydrogen 2.810 N/A GLN 198.A N TYR 195.A O no hydrogen 3.232 N/A GLN 198.A NE2 THR 191.A OG1 no hydrogen 2.871 N/A GLY 199.A N GLU 196.A O no hydrogen 3.233 N/A ARG 200.A N TYR 195.A O no hydrogen 2.826 N/A ARG 200.A NE ASP 260.A O no hydrogen 2.878 N/A ARG 200.A NH1 PHE 194.A O no hydrogen 3.093 N/A ARG 200.A NH1 GLN 198.A OE1 no hydrogen 3.133 N/A ARG 200.A NH2 ASP 260.A O no hydrogen 2.950 N/A LEU 201.A N ASP 260.A OD2 no hydrogen 2.907 N/A CYS 206.A SG ARG 200.A O no hydrogen 4.002 N/A CYS 206.A SG TYR 208.A O no hydrogen 3.623 N/A TYR 208.A OH ARG 200.A O no hydrogen 2.576 N/A THR 209.A N ASP 212.A OD2 no hydrogen 3.111 N/A ASP 212.A N THR 209.A OG1 no hydrogen 3.062 N/A LYS 213.A N THR 209.A O no hydrogen 3.115 N/A LYS 213.A NZ ARG 256.A O no hydrogen 2.974 N/A LYS 213.A NZ ASP 260.A OD1 no hydrogen 3.103 N/A GLN 214.A N GLU 210.A O no hydrogen 2.979 N/A GLN 214.A NE2 GLU 210.A OE2 no hydrogen 2.883 N/A GLN 214.A NE2 LEU 257.A O no hydrogen 3.150 N/A ASP 215.A N LYS 211.A O no hydrogen 3.121 N/A TYR 216.A N ASP 212.A O no hydrogen 3.123 N/A TYR 216.A OH PRO 142.A O no hydrogen 2.771 N/A LEU 217.A N LYS 213.A O no hydrogen 2.895 N/A ARG 218.A N GLN 214.A O no hydrogen 2.823 N/A ARG 218.A NE GLN 214.A OE1 no hydrogen 3.053 N/A ARG 218.A NH2 GLN 214.A OE1 no hydrogen 3.357 N/A ALA 219.A N ASP 215.A O no hydrogen 3.066 N/A ALA 220.A N TYR 216.A O no hydrogen 2.961 N/A TYR 221.A N LEU 217.A O no hydrogen 2.943 N/A ALA 222.A N ARG 218.A O no hydrogen 2.913 N/A ALA 223.A N ALA 219.A O no hydrogen 3.097 N/A ALA 223.A N ALA 220.A O no hydrogen 3.060 N/A GLY 224.A N TYR 221.A O no hydrogen 2.982 N/A ILE 225.A N ALA 220.A O no hydrogen 3.095 N/A ARG 226.A N ASN 187.A O no hydrogen 2.854 N/A ARG 226.A NH1 TYR 221.A O no hydrogen 2.848 N/A ARG 226.A NH1 ILE 225.A O no hydrogen 2.921 N/A ASN 227.A N ASN 187.A O no hydrogen 3.504 N/A ASN 227.A ND2 SER 123.A OG no hydrogen 3.118 N/A ILE 228.A N GLY 124.A O no hydrogen 2.768 N/A GLU 229.A N MET 189.A O no hydrogen 2.937 N/A GLU 231.A N GLU 229.A OE1 no hydrogen 3.039 N/A ALA 232.A N GLU 229.A OE1 no hydrogen 2.798 N/A PHE 235.A N GLU 231.A O no hydrogen 3.297 N/A ALA 236.A N ALA 232.A O no hydrogen 2.971 N/A ALA 237.A N SER 233.A O no hydrogen 2.960 N/A MET 238.A N VAL 234.A O no hydrogen 2.835 N/A CYS 239.A N PHE 235.A O no hydrogen 3.110 N/A CYS 239.A SG PHE 235.A O no hydrogen 3.276 N/A ASN 240.A N ALA 236.A O no hydrogen 2.867 N/A ASN 240.A ND2 ASP 162.A O no hydrogen 3.371 N/A ALA 241.A N ALA 237.A O no hydrogen 2.952 N/A CYS 242.A N MET 238.A O no hydrogen 3.053 N/A CYS 242.A SG MET 238.A O no hydrogen 3.660 N/A GLY 243.A N ASN 240.A O no hydrogen 3.038 N/A LEU 244.A N CYS 239.A O no hydrogen 2.860 N/A ALA 247.A N LEU 117.A O no hydrogen 2.957 N/A VAL 249.A N ARG 119.A O no hydrogen 2.857 N/A CYS 250.A N VAL 134.A O no hydrogen 3.062 N/A VAL 251.A N GLY 121.A O no hydrogen 3.086 N/A THR 252.A N SER 132.A O no hydrogen 2.774 N/A THR 252.A OG1 LEU 254.A O no hydrogen 3.296 N/A LEU 253.A N SER 123.A O no hydrogen 2.969 N/A ARG 256.A N GLY 125.A O no hydrogen 2.833 N/A ARG 256.A NE GLY 259.A O no hydrogen 3.172 N/A ARG 256.A NE ASP 260.A OD1 no hydrogen 3.042 N/A ARG 256.A NH1 GLN 198.A O no hydrogen 2.964 N/A ARG 256.A NH1 ASP 260.A OD1 no hydrogen 2.859 N/A ARG 256.A NH2 GLN 198.A O no hydrogen 2.857 N/A LEU 257.A N ASN 255.A OD1 no hydrogen 3.097 N/A GLU 258.A N ASN 255.A O no hydrogen 2.931 N/A LEU 269.A N PRO 265.A O no hydrogen 3.181 N/A ALA 270.A N HIS 266.A O no hydrogen 2.949 N/A GLU 271.A N ASP 267.A O no hydrogen 3.106 N/A TYR 272.A N VAL 268.A O no hydrogen 2.870 N/A GLN 273.A N LEU 269.A O no hydrogen 3.106 N/A GLN 274.A N GLU 271.A O no hydrogen 3.080 N/A ARG 275.A N TYR 272.A O no hydrogen 3.052 N/A ARG 275.A NE GLU 271.A OE1 no hydrogen 3.181 N/A ARG 275.A NH1 GLY 131.A O no hydrogen 2.712 N/A ARG 275.A NH2 GLU 271.A OE2 no hydrogen 2.908 N/A ARG 278.A N GLN 274.A O no hydrogen 2.934 N/A ARG 278.A NE GLU 180.A OE1 no hydrogen 2.831 N/A ARG 278.A NH2 GLU 180.A OE2 no hydrogen 3.126 N/A LEU 279.A N ARG 275.A O no hydrogen 3.043 N/A VAL 280.A N PRO 276.A O no hydrogen 2.955 N/A GLY 281.A N GLN 277.A O no hydrogen 2.806 N/A GLN 282.A N ARG 278.A O no hydrogen 2.907 N/A PHE 283.A N LEU 279.A O no hydrogen 3.029 N/A ILE 284.A N VAL 280.A O no hydrogen 2.950 N/A LYS 285.A N GLY 281.A O no hydrogen 3.073 N/A LYS 286.A N GLN 282.A O no hydrogen 3.042 N/A LYS 286.A NZ GLU 177.A OE1 no hydrogen 3.358 N/A ARG 287.A N PHE 283.A O no hydrogen 3.060 N/A ARG 287.A NE GLU 170.A OE1 no hydrogen 2.784 N/A ARG 287.A NH2 GLU 170.A OE2 no hydrogen 3.017 N/A LEU 288.A N ILE 284.A O no hydrogen 3.037 N/A MET 289.A N LYS 285.A O no hydrogen 2.978 N/A GLN 290.A N LYS 286.A O no hydrogen 3.085 N/A