Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qyb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N HIS 1.A O no hydrogen 3.105 N/A LYS 5.A NZ LEU 148.A O no hydrogen 3.419 N/A LYS 5.A NZ MET 151.A O no hydrogen 3.449 N/A LEU 6.A N MET 2.A O no hydrogen 2.696 N/A ASP 7.A N VAL 4.A O no hydrogen 3.194 N/A TYR 8.A OH HIS 150.A NE2 no hydrogen 2.960 N/A GLY 12.A N GLU 10.A O no hydrogen 2.594 N/A ALA 13.A N GLU 10.A OE2 no hydrogen 3.046 N/A LEU 19.A N GLN 15.A O no hydrogen 3.218 N/A ILE 20.A N LYS 16.A O no hydrogen 2.989 N/A THR 21.A N GLU 17.A O no hydrogen 3.019 N/A THR 21.A OG1 GLU 17.A O no hydrogen 3.089 N/A TRP 22.A N VAL 18.A O no hydrogen 3.083 N/A TRP 22.A NE1 GLY 47.A O no hydrogen 2.861 N/A ASP 23.A N LEU 19.A O no hydrogen 3.152 N/A LYS 24.A N ILE 20.A O no hydrogen 2.785 N/A LYS 25.A N THR 21.A O no hydrogen 2.926 N/A LEU 26.A N TRP 22.A O no hydrogen 2.826 N/A LEU 27.A N LYS 24.A O no hydrogen 2.897 N/A ASN 28.A N LYS 24.A O no hydrogen 2.748 N/A ASN 28.A N LYS 25.A O no hydrogen 3.043 N/A CYS 29.A N LEU 27.A O no hydrogen 2.242 N/A LYS 32.A NZ ASN 28.A O no hydrogen 2.888 N/A CYS 35.A SG ILE 33.A O no hydrogen 4.022 N/A CYS 35.A SG GLN 63.A OE1 no hydrogen 3.646 N/A ASP 39.A N ASP 36.A O no hydrogen 3.190 N/A ILE 40.A N ASP 36.A O no hydrogen 3.498 N/A HIS 41.A N MET 37.A O no hydrogen 2.697 N/A THR 42.A N GLU 38.A O no hydrogen 2.737 N/A THR 42.A OG1 GLU 46.A OE1 no hydrogen 3.158 N/A LEU 43.A N ASP 39.A O no hydrogen 2.533 N/A LEU 44.A N ILE 40.A O no hydrogen 2.825 N/A LYS 45.A N HIS 41.A O no hydrogen 2.980 N/A LYS 45.A NZ GLU 294.A OE1 no hydrogen 2.508 N/A GLU 46.A N THR 42.A O no hydrogen 2.718 N/A GLY 47.A N LEU 43.A O no hydrogen 3.011 N/A LYS 50.A NZ LEU 6.A O no hydrogen 2.994 N/A LYS 50.A NZ TYR 8.A O no hydrogen 3.259 N/A ARG 52.A N PRO 49.A O no hydrogen 2.983 N/A ARG 53.A N PRO 49.A O no hydrogen 2.654 N/A ARG 53.A NE TYR 8.A OH no hydrogen 3.466 N/A ARG 53.A NH1 ASP 235.A OD1 no hydrogen 3.010 N/A ARG 53.A NH2 TYR 8.A OH no hydrogen 3.475 N/A ILE 56.A N ARG 52.A O no hydrogen 2.979 N/A TRP 57.A N ARG 53.A O no hydrogen 3.294 N/A TRP 57.A NE1 ASP 235.A OD1 no hydrogen 2.722 N/A PHE 59.A N GLU 55.A O no hydrogen 2.763 N/A LEU 60.A N ILE 56.A O no hydrogen 2.707 N/A ALA 61.A N TRP 57.A O no hydrogen 2.946 N/A LEU 62.A N GLN 58.A O no hydrogen 2.913 N/A GLN 63.A N PHE 59.A O no hydrogen 3.038 N/A TYR 64.A N LEU 60.A O no hydrogen 2.918 N/A ARG 65.A N ALA 61.A O no hydrogen 2.678 N/A ARG 65.A NH2 ASP 166.A OD1 no hydrogen 2.394 N/A LEU 66.A N LEU 62.A O no hydrogen 3.086 N/A LEU 66.A N GLN 63.A O no hydrogen 2.584 N/A ARG 67.A N GLN 63.A O no hydrogen 2.994 N/A ASN 72.A N LEU 70.A O no hydrogen 3.047 N/A LYS 73.A N PRO 71.A O no hydrogen 2.276 N/A GLN 75.A NE2 ASN 72.A OD1 no hydrogen 3.401 N/A TYR 81.A OH GLU 153.A OE2 no hydrogen 2.698 N/A LEU 84.A N TYR 81.A O no hydrogen 2.549 N/A LEU 85.A N TYR 81.A O no hydrogen 3.123 N/A LEU 85.A N LYS 82.A O no hydrogen 2.768 N/A LYS 86.A NZ GLU 83.A OE2 no hydrogen 3.546 N/A ILE 95.A N GLN 91.A O no hydrogen 2.898 N/A ILE 95.A N GLN 92.A O no hydrogen 2.354 N/A LEU 96.A N GLN 92.A O no hydrogen 3.287 N/A VAL 97.A N HIS 93.A O no hydrogen 2.898 N/A ASP 98.A N ILE 95.A O no hydrogen 2.983 N/A LEU 99.A N LEU 96.A O no hydrogen 2.748 N/A THR 102.A N ASP 98.A O no hydrogen 3.262 N/A THR 102.A OG1 ASP 98.A O no hydrogen 2.932 N/A THR 102.A OG1 SER 141.A OG no hydrogen 3.307 N/A HIS 106.A N PHE 103.A O no hydrogen 3.235 N/A SER 110.A N PRO 107.A O no hydrogen 2.711 N/A SER 110.A OG PRO 107.A O no hydrogen 2.584 N/A GLY 114.A N VAL 111.A O no hydrogen 3.402 N/A GLN 117.A NE2 PHE 109.A O no hydrogen 3.452 N/A LEU 118.A N GLY 114.A O no hydrogen 2.740 N/A SER 119.A N PRO 115.A O no hydrogen 2.862 N/A SER 119.A OG PRO 115.A O no hydrogen 3.214 N/A SER 119.A OG GLU 153.A OE1 no hydrogen 2.942 N/A LEU 120.A N GLY 116.A O no hydrogen 2.950 N/A PHE 121.A N GLN 117.A O no hydrogen 3.038 N/A PHE 121.A N LEU 118.A O no hydrogen 2.893 N/A ASN 122.A N LEU 118.A O no hydrogen 3.031 N/A LEU 123.A N SER 119.A O no hydrogen 2.934 N/A LEU 124.A N LEU 120.A O no hydrogen 3.287 N/A LYS 125.A N PHE 121.A O no hydrogen 2.548 N/A LYS 125.A NZ GLN 87.A O no hydrogen 2.659 N/A LYS 125.A NZ THR 89.A OG1 no hydrogen 3.329 N/A ALA 126.A N ASN 122.A O no hydrogen 2.643 N/A TYR 127.A N LEU 123.A O no hydrogen 2.935 N/A TYR 127.A OH ASP 131.A OD2 no hydrogen 2.690 N/A SER 128.A N LEU 124.A O no hydrogen 3.156 N/A LEU 129.A N LYS 125.A O no hydrogen 3.164 N/A LEU 130.A N ALA 126.A O no hydrogen 2.978 N/A ASP 131.A N TYR 127.A O no hydrogen 2.949 N/A VAL 134.A N ASP 131.A O no hydrogen 2.683 N/A GLY 135.A N ASP 131.A O no hydrogen 3.004 N/A TYR 136.A OH ASP 98.A OD2 no hydrogen 3.055 N/A SER 141.A OG THR 102.A OG1 no hydrogen 3.307 N/A SER 141.A OG GLY 139.A O no hydrogen 3.471 N/A PHE 142.A N GLY 139.A O no hydrogen 2.413 N/A VAL 143.A N GLY 139.A O no hydrogen 3.483 N/A ALA 144.A N ILE 140.A O no hydrogen 2.881 N/A VAL 146.A N PHE 142.A O no hydrogen 2.897 N/A LEU 147.A N VAL 143.A O no hydrogen 3.094 N/A LEU 148.A N ALA 144.A O no hydrogen 3.042 N/A LEU 149.A N GLY 145.A O no hydrogen 2.806 N/A HIS 150.A N LEU 147.A O no hydrogen 2.974 N/A HIS 150.A ND1 VAL 146.A O no hydrogen 2.571 N/A HIS 150.A NE2 TYR 8.A OH no hydrogen 2.960 N/A MET 151.A N LEU 148.A O no hydrogen 3.398 N/A SER 152.A N GLN 155.A OE1 no hydrogen 2.770 N/A GLN 155.A N SER 152.A OG no hydrogen 2.881 N/A ALA 156.A N SER 152.A O no hydrogen 2.814 N/A PHE 157.A N GLU 153.A O no hydrogen 2.975 N/A GLU 158.A N GLU 154.A O no hydrogen 3.172 N/A MET 159.A N GLN 155.A O no hydrogen 3.065 N/A LEU 160.A N ALA 156.A O no hydrogen 2.817 N/A LYS 161.A N PHE 157.A O no hydrogen 2.962 N/A LYS 161.A NZ GLU 158.A OE2 no hydrogen 3.412 N/A PHE 162.A N GLU 158.A O no hydrogen 3.039 N/A LEU 163.A N MET 159.A O no hydrogen 2.673 N/A MET 164.A N LEU 160.A O no hydrogen 2.886 N/A TYR 165.A N LYS 161.A O no hydrogen 2.721 N/A LEU 167.A N PHE 162.A O no hydrogen 3.096 N/A GLY 168.A N TYR 165.A O no hydrogen 2.798 N/A PHE 169.A N LEU 163.A O no hydrogen 3.226 N/A PHE 169.A N MET 164.A O no hydrogen 2.692 N/A ARG 170.A N MET 164.A O no hydrogen 2.701 N/A ARG 170.A NH2 ASP 131.A OD1 no hydrogen 2.766 N/A GLN 172.A NE2 PHE 217.A O no hydrogen 3.677 N/A ARG 174.A N LYS 171.A O no hydrogen 2.685 N/A MET 177.A N ARG 174.A O no hydrogen 3.311 N/A MET 178.A N ASP 176.A OD1 no hydrogen 2.867 N/A GLN 181.A N MET 177.A O no hydrogen 3.078 N/A GLN 183.A N SER 179.A O no hydrogen 2.959 N/A MET 184.A N LEU 180.A O no hydrogen 3.054 N/A TYR 185.A N GLN 181.A O no hydrogen 3.112 N/A GLN 186.A N ILE 182.A O no hydrogen 2.870 N/A LEU 187.A N GLN 183.A O no hydrogen 2.958 N/A SER 188.A N MET 184.A O no hydrogen 2.930 N/A ARG 189.A N TYR 185.A O no hydrogen 2.720 N/A ARG 189.A NH2 ASP 193.A OD2 no hydrogen 3.209 N/A LEU 190.A N GLN 186.A O no hydrogen 2.851 N/A LEU 191.A N LEU 187.A O no hydrogen 3.066 N/A HIS 192.A N SER 188.A O no hydrogen 3.139 N/A HIS 192.A ND1 ASP 193.A OD1 no hydrogen 2.545 N/A ASP 193.A N ARG 189.A O no hydrogen 2.988 N/A TYR 194.A N LEU 191.A O no hydrogen 2.968 N/A HIS 195.A N LEU 191.A O no hydrogen 2.504 N/A TYR 199.A N HIS 195.A O no hydrogen 2.860 N/A ASN 200.A N ARG 196.A O no hydrogen 2.683 N/A HIS 201.A N ASP 197.A O no hydrogen 2.954 N/A LEU 202.A N LEU 198.A O no hydrogen 3.267 N/A GLU 203.A N TYR 199.A O no hydrogen 2.744 N/A GLU 204.A N ASN 200.A O no hydrogen 2.816 N/A GLU 206.A N GLU 203.A O no hydrogen 3.308 N/A ILE 207.A N LEU 202.A O no hydrogen 2.787 N/A LEU 211.A N SER 208.A O no hydrogen 2.793 N/A TYR 212.A N PRO 209.A O no hydrogen 2.702 N/A ALA 213.A N PRO 209.A O no hydrogen 2.812 N/A PHE 217.A N ALA 213.A O no hydrogen 2.920 N/A LEU 218.A N ALA 214.A O no hydrogen 2.828 N/A THR 219.A N PRO 215.A O no hydrogen 2.882 N/A THR 219.A OG1 PRO 215.A O no hydrogen 2.645 N/A THR 219.A OG1 SER 223.A OG no hydrogen 2.736 N/A LEU 220.A N PHE 217.A O no hydrogen 3.064 N/A PHE 221.A N TRP 216.A O no hydrogen 2.755 N/A ALA 222.A N THR 219.A O no hydrogen 3.015 N/A SER 223.A N THR 219.A OG1 no hydrogen 3.394 N/A SER 223.A OG THR 219.A OG1 no hydrogen 2.736 N/A PHE 225.A N PHE 221.A O no hydrogen 2.952 N/A GLY 228.A N GLU 9.A OE1 no hydrogen 2.677 N/A VAL 230.A N SER 226.A O no hydrogen 2.739 N/A ALA 231.A N LEU 227.A O no hydrogen 2.498 N/A ARG 232.A N GLY 228.A O no hydrogen 3.206 N/A ARG 232.A N PHE 229.A O no hydrogen 3.021 N/A ARG 232.A NH1 LEU 44.A O no hydrogen 3.000 N/A ARG 232.A NH1 ASP 235.A OD2 no hydrogen 3.068 N/A ARG 232.A NH2 LEU 44.A O no hydrogen 3.004 N/A ARG 232.A NH2 LYS 45.A O no hydrogen 3.521 N/A VAL 233.A N PHE 229.A O no hydrogen 3.044 N/A PHE 234.A N VAL 230.A O no hydrogen 3.006 N/A ASP 235.A N ALA 231.A O no hydrogen 3.264 N/A ILE 236.A N ARG 232.A O no hydrogen 3.268 N/A ILE 237.A N VAL 233.A O no hydrogen 2.933 N/A PHE 238.A N PHE 234.A O no hydrogen 2.979 N/A LEU 239.A N ILE 236.A O no hydrogen 3.057 N/A GLN 240.A N ILE 236.A O no hydrogen 2.943 N/A GLU 243.A N GLY 241.A O no hydrogen 2.092 N/A VAL 244.A N GLY 241.A O no hydrogen 2.878 N/A LYS 247.A N GLU 243.A O no hydrogen 3.097 N/A LYS 247.A NZ GLN 240.A OE1 no hydrogen 2.782 N/A LYS 247.A NZ MET 295.A O no hydrogen 3.456 N/A VAL 248.A N VAL 244.A O no hydrogen 2.904 N/A ALA 249.A N ILE 245.A O no hydrogen 2.875 N/A LEU 250.A N PHE 246.A O no hydrogen 2.624 N/A SER 251.A N LYS 247.A O no hydrogen 2.763 N/A SER 251.A OG GLN 291.A OE1 no hydrogen 3.291 N/A LEU 252.A N VAL 248.A O no hydrogen 2.643 N/A LEU 253.A N ALA 249.A O no hydrogen 2.846 N/A SER 254.A N LEU 250.A O no hydrogen 3.064 N/A SER 254.A OG SER 251.A O no hydrogen 3.463 N/A SER 255.A N LEU 252.A O no hydrogen 2.956 N/A GLN 256.A N LEU 252.A O no hydrogen 3.504 N/A LEU 259.A N GLN 256.A O no hydrogen 2.570 N/A CYS 263.A N ILE 260.A O no hydrogen 2.733 N/A CYS 263.A SG ILE 260.A O no hydrogen 3.569 N/A CYS 263.A SG ASN 268.A O no hydrogen 3.803 N/A ASN 268.A N SER 265.A O no hydrogen 2.750 N/A ILE 269.A N SER 265.A O no hydrogen 2.737 N/A PHE 272.A N ILE 269.A O no hydrogen 2.611 N/A LEU 273.A N ILE 269.A O no hydrogen 3.161 N/A LYS 274.A N VAL 270.A O no hydrogen 3.011 N/A THR 276.A N PHE 272.A O no hydrogen 2.860 N/A LEU 277.A N PHE 272.A O no hydrogen 2.653 N/A ASP 279.A N THR 276.A O no hydrogen 2.833 N/A MET 280.A N PRO 278.A O no hydrogen 2.884 N/A ASN 281.A ND2 ASN 281.A O no hydrogen 2.429 N/A GLU 284.A N ASN 281.A O no hydrogen 2.602 N/A MET 285.A N THR 282.A O no hydrogen 2.663 N/A GLU 286.A N THR 282.A O no hydrogen 2.525 N/A ILE 288.A N GLU 284.A O no hydrogen 3.366 N/A ILE 289.A N MET 285.A O no hydrogen 2.967 N/A GLN 291.A N LYS 287.A O no hydrogen 2.715 N/A VAL 292.A N ILE 288.A O no hydrogen 3.075 N/A PHE 293.A N ILE 289.A O no hydrogen 3.177 N/A GLU 294.A N THR 290.A O no hydrogen 3.116 N/A MET 295.A N VAL 292.A O no hydrogen 3.407 N/A