Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ygj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 2.A SG GLU 1.A O no hydrogen 3.491 N/A ARG 3.A N ASP 75.A OD2 no hydrogen 2.892 N/A ARG 3.A NH1 ASP 33.A OD2 no hydrogen 2.678 N/A ARG 3.A NH2 ASP 33.A OD2 no hydrogen 3.333 N/A VAL 4.A N GLU 31.A O no hydrogen 2.768 N/A LEU 5.A N TYR 76.A O no hydrogen 2.825 N/A SER 6.A N ASP 33.A O no hydrogen 2.745 N/A ILE 7.A N LEU 78.A O no hydrogen 2.944 N/A GLN 8.A N VAL 35.A O no hydrogen 3.211 N/A GLN 8.A NE2 SER 6.A OG no hydrogen 3.204 N/A HIS 10.A N VAL 38.A O no hydrogen 3.011 N/A VAL 12.A N PHE 40.A O no hydrogen 2.981 N/A ARG 13.A N SER 41.A O no hydrogen 3.056 N/A TYR 15.A N GLU 287.A OE2 no hydrogen 3.248 N/A GLY 17.A N ASP 232.A OD2 no hydrogen 2.642 N/A ASN 18.A N SER 9.A O no hydrogen 2.615 N/A ASN 18.A ND2 SER 6.A OG no hydrogen 2.590 N/A ARG 19.A N VAL 16.A O no hydrogen 2.826 N/A ARG 19.A NE GLY 14.A O no hydrogen 3.113 N/A ALA 20.A N VAL 16.A O no hydrogen 3.221 N/A ALA 21.A N GLY 17.A O no hydrogen 3.182 N/A ALA 21.A N ASN 18.A O no hydrogen 3.263 N/A THR 22.A N ASN 18.A O no hydrogen 2.927 N/A THR 22.A OG1 ASN 18.A O no hydrogen 2.654 N/A LEU 25.A N ALA 21.A O no hydrogen 3.234 N/A GLN 26.A N THR 22.A O no hydrogen 2.785 N/A VAL 27.A N PHE 23.A O no hydrogen 2.841 N/A LEU 28.A N PRO 24.A O no hydrogen 2.797 N/A GLY 29.A N GLN 26.A O no hydrogen 3.116 N/A PHE 30.A N LEU 25.A O no hydrogen 2.749 N/A GLU 31.A N CYS 2.A O no hydrogen 2.848 N/A ASP 33.A N VAL 4.A O no hydrogen 2.770 N/A VAL 35.A N SER 6.A O no hydrogen 2.912 N/A SER 37.A N GLN 8.A O no hydrogen 2.994 N/A GLN 39.A N GLN 52.A O no hydrogen 2.934 N/A PHE 40.A N HIS 10.A O no hydrogen 3.257 N/A SER 41.A N LYS 50.A O no hydrogen 2.935 N/A GLY 45.A N HIS 43.A ND1 no hydrogen 3.029 N/A TYR 46.A N HIS 43.A O no hydrogen 3.247 N/A TYR 46.A OH GLU 287.A OE1 no hydrogen 2.323 N/A GLN 52.A N GLN 39.A O no hydrogen 3.049 N/A LEU 54.A N SER 37.A O no hydrogen 2.816 N/A ASN 55.A N GLU 58.A OE2 no hydrogen 3.442 N/A SER 56.A OG SER 86.A OG no hydrogen 3.097 N/A GLU 58.A N ASN 55.A OD1 no hydrogen 2.721 N/A LEU 59.A N ASN 55.A O no hydrogen 3.104 N/A GLN 60.A N SER 56.A O no hydrogen 3.337 N/A GLU 61.A N ASP 57.A O no hydrogen 2.857 N/A LEU 62.A N GLU 58.A O no hydrogen 3.200 N/A TYR 63.A N LEU 59.A O no hydrogen 3.165 N/A TYR 63.A OH GLU 97.A OE2 no hydrogen 2.954 N/A ASP 64.A N GLN 60.A O no hydrogen 2.770 N/A GLY 65.A N GLU 61.A O no hydrogen 2.973 N/A LEU 66.A N LEU 62.A O no hydrogen 3.055 N/A LYS 67.A N TYR 63.A O no hydrogen 2.663 N/A LEU 68.A N ASP 64.A O no hydrogen 2.650 N/A ASN 69.A N GLY 65.A O no hydrogen 3.364 N/A HIS 70.A N LYS 67.A O no hydrogen 2.792 N/A VAL 71.A N LEU 66.A O no hydrogen 3.106 N/A GLN 73.A NE2 HIS 70.A O no hydrogen 2.505 N/A TYR 74.A OH ASP 33.A OD2 no hydrogen 2.462 N/A ASP 75.A N ARG 3.A O no hydrogen 2.992 N/A TYR 76.A N ARG 3.A O no hydrogen 3.264 N/A TYR 76.A OH HIS 243.A ND1 no hydrogen 3.092 N/A VAL 77.A N VAL 106.A O no hydrogen 3.036 N/A LEU 78.A N LEU 5.A O no hydrogen 2.946 N/A THR 79.A N VAL 108.A O no hydrogen 3.212 N/A THR 79.A OG1 TYR 107.A OH no hydrogen 2.982 N/A THR 82.A OG1 GLY 80.A O no hydrogen 2.925 N/A ARG 83.A NH1 TYR 81.A OH no hydrogen 3.166 N/A ARG 83.A NH1 TYR 124.A O no hydrogen 3.143 N/A LYS 85.A NZ LYS 85.A O no hydrogen 3.334 N/A SER 86.A OG SER 56.A OG no hydrogen 3.097 N/A PHE 87.A N ASP 84.A OD2 no hydrogen 2.716 N/A LEU 88.A N ASP 84.A O no hydrogen 3.049 N/A ALA 89.A N LYS 85.A O no hydrogen 2.937 N/A MET 90.A N SER 86.A O no hydrogen 2.978 N/A VAL 91.A N PHE 87.A O no hydrogen 3.047 N/A VAL 92.A N LEU 88.A O no hydrogen 3.123 N/A ASP 93.A N ALA 89.A O no hydrogen 3.324 N/A ILE 94.A N MET 90.A O no hydrogen 3.123 N/A VAL 95.A N VAL 91.A O no hydrogen 2.952 N/A GLN 96.A N VAL 92.A O no hydrogen 2.929 N/A GLU 97.A N ASP 93.A O no hydrogen 3.006 N/A LEU 98.A N ILE 94.A O no hydrogen 2.842 N/A LYS 99.A N VAL 95.A O no hydrogen 3.053 N/A LYS 99.A NZ VAL 140.A O no hydrogen 2.963 N/A LYS 99.A NZ ASP 142.A OD1 no hydrogen 3.497 N/A LYS 99.A NZ ASP 142.A OD2 no hydrogen 3.196 N/A GLN 100.A N GLU 97.A O no hydrogen 3.147 N/A GLN 101.A N GLU 97.A O no hydrogen 3.060 N/A ASN 102.A ND2 GLN 101.A O no hydrogen 3.634 N/A VAL 106.A N ASP 75.A O no hydrogen 2.950 N/A TYR 107.A N ASP 142.A OD2 no hydrogen 2.677 N/A TYR 107.A OH THR 79.A OG1 no hydrogen 2.982 N/A VAL 108.A N VAL 77.A O no hydrogen 2.769 N/A CYS 109.A N ILE 143.A O no hydrogen 2.659 N/A ASP 110.A N THR 79.A O no hydrogen 3.158 N/A VAL 112.A N ASP 110.A O no hydrogen 2.610 N/A MET 113.A N GLU 150.A OE2 no hydrogen 2.914 N/A GLY 114.A N GLU 150.A OE2 no hydrogen 3.431 N/A TYR 124.A N MET 113.A O no hydrogen 2.771 N/A VAL 125.A N MET 113.A O no hydrogen 3.481 N/A ASP 127.A N ASP 127.A OD2 no hydrogen 2.300 N/A LEU 129.A N PRO 126.A O no hydrogen 3.260 N/A TYR 133.A N LEU 129.A O no hydrogen 2.991 N/A ARG 134.A N LEU 130.A O no hydrogen 2.906 N/A GLU 135.A N PRO 131.A O no hydrogen 2.486 N/A LYS 136.A N VAL 132.A O no hydrogen 2.774 N/A VAL 137.A N VAL 132.A O no hydrogen 2.806 N/A VAL 138.A N TYR 133.A O no hydrogen 2.814 N/A VAL 140.A N VAL 137.A O no hydrogen 3.045 N/A ALA 141.A N VAL 138.A O no hydrogen 2.618 N/A ASP 142.A N TYR 107.A O no hydrogen 2.924 N/A ILE 143.A N TYR 107.A O no hydrogen 3.215 N/A ILE 144.A N THR 179.A O no hydrogen 3.354 N/A THR 145.A N CYS 109.A O no hydrogen 3.026 N/A ASN 147.A N GLU 150.A OE1 no hydrogen 2.764 N/A GLN 148.A NE2 GLU 152.A OE2 no hydrogen 3.223 N/A ALA 151.A N ASN 147.A O no hydrogen 2.860 N/A GLU 152.A N GLN 148.A O no hydrogen 2.803 N/A LEU 153.A N PHE 149.A O no hydrogen 3.181 N/A LEU 154.A N GLU 150.A O no hydrogen 2.977 N/A THR 155.A N ALA 151.A O no hydrogen 3.137 N/A THR 155.A N GLU 152.A O no hydrogen 2.792 N/A THR 155.A OG1 ALA 151.A O no hydrogen 3.145 N/A THR 155.A OG1 GLU 152.A O no hydrogen 3.068 N/A THR 155.A OG1 ARG 157.A O no hydrogen 3.536 N/A GLY 156.A N GLU 152.A O no hydrogen 2.622 N/A GLY 156.A N LEU 153.A O no hydrogen 3.042 N/A ARG 157.A N THR 155.A OG1 no hydrogen 3.407 N/A ARG 157.A NE GLU 164.A OE1 no hydrogen 3.480 N/A ILE 159.A N GLU 152.A OE2 no hydrogen 2.505 N/A GLU 164.A N SER 161.A OG no hydrogen 3.354 N/A ALA 165.A N GLN 162.A O no hydrogen 2.963 N/A LEU 166.A N GLN 162.A O no hydrogen 3.032 N/A LEU 166.A N GLU 163.A O no hydrogen 3.132 N/A GLU 167.A N GLU 163.A O no hydrogen 3.313 N/A VAL 168.A N GLU 164.A O no hydrogen 3.276 N/A MET 169.A N ALA 165.A O no hydrogen 3.311 N/A ASP 170.A N LEU 166.A O no hydrogen 2.855 N/A MET 171.A N GLU 167.A O no hydrogen 3.066 N/A LEU 172.A N VAL 168.A O no hydrogen 2.829 N/A HIS 173.A N MET 169.A O no hydrogen 2.836 N/A HIS 173.A ND1 PRO 177.A O no hydrogen 2.669 N/A HIS 173.A NE2 SER 201.A OG no hydrogen 2.722 N/A SER 174.A N ASP 170.A O no hydrogen 3.259 N/A SER 174.A OG ASP 170.A O no hydrogen 3.381 N/A MET 175.A N LEU 172.A O no hydrogen 2.693 N/A GLY 176.A N HIS 173.A O no hydrogen 2.970 N/A THR 179.A N ASP 142.A O no hydrogen 3.115 N/A VAL 180.A N SER 201.A O no hydrogen 3.169 N/A VAL 181.A N ILE 144.A O no hydrogen 3.265 N/A ILE 182.A N LEU 199.A O no hydrogen 2.387 N/A THR 183.A N PRO 146.A O no hydrogen 3.052 N/A SER 185.A OG MET 197.A O no hydrogen 3.567 N/A ASN 186.A N GLN 148.A OE1 no hydrogen 2.569 N/A ARG 191.A N SER 189.A OG no hydrogen 3.287 N/A GLY 192.A N SER 189.A O no hydrogen 2.946 N/A TYR 195.A N GLY 192.A O no hydrogen 3.157 N/A LEU 196.A N MET 220.A O no hydrogen 2.776 N/A ALA 198.A N MET 218.A O no hydrogen 2.924 N/A LEU 199.A N ILE 182.A O no hydrogen 2.850 N/A SER 201.A OG HIS 173.A NE2 no hydrogen 2.722 N/A GLN 202.A N GLN 214.A O no hydrogen 2.913 N/A ARG 203.A N ASP 178.A O no hydrogen 2.922 N/A ARG 203.A NH2 SER 174.A OG no hydrogen 3.410 N/A THR 204.A N VAL 212.A O no hydrogen 2.541 N/A SER 210.A OG PRO 207.A O no hydrogen 3.371 N/A GLN 214.A N GLN 202.A O no hydrogen 3.165 N/A ILE 216.A N GLY 200.A O no hydrogen 2.913 N/A MET 218.A N ALA 198.A O no hydrogen 2.894 N/A MET 220.A N LEU 196.A O no hydrogen 3.066 N/A HIS 221.A ND1 LYS 222.A O no hydrogen 3.361 N/A LYS 222.A N ASP 194.A O no hydrogen 2.974 N/A ALA 225.A N VAL 223.A O no hydrogen 2.640 N/A LEU 233.A N GLY 229.A O no hydrogen 3.070 N/A PHE 234.A N THR 230.A O no hydrogen 2.971 N/A ALA 235.A N GLY 231.A O no hydrogen 3.132 N/A ALA 236.A N ASP 232.A O no hydrogen 3.250 N/A MET 237.A N LEU 233.A O no hydrogen 3.318 N/A LEU 238.A N PHE 234.A O no hydrogen 2.791 N/A LEU 239.A N ALA 235.A O no hydrogen 2.984 N/A ALA 240.A N ALA 236.A O no hydrogen 3.190 N/A TRP 241.A N MET 237.A O no hydrogen 2.797 N/A THR 242.A N LEU 238.A O no hydrogen 2.792 N/A THR 242.A OG1 LEU 238.A O no hydrogen 2.828 N/A THR 242.A OG1 LEU 239.A O no hydrogen 3.150 N/A HIS 243.A N LEU 239.A O no hydrogen 3.289 N/A HIS 243.A ND1 TYR 76.A OH no hydrogen 3.092 N/A LYS 244.A N ALA 240.A O no hydrogen 3.394 N/A HIS 245.A N TRP 241.A O no hydrogen 2.701 N/A ASN 248.A N HIS 245.A O no hydrogen 3.196 N/A LYS 250.A NZ GLU 254.A OE1 no hydrogen 2.962 N/A LYS 250.A NZ GLU 254.A OE2 no hydrogen 3.062 N/A ALA 252.A N ASN 248.A O no hydrogen 3.139 N/A CYS 253.A N LEU 249.A O no hydrogen 2.871 N/A CYS 253.A SG LEU 249.A O no hydrogen 3.693 N/A GLU 254.A N LYS 250.A O no hydrogen 3.215 N/A LYS 255.A N VAL 251.A O no hydrogen 3.043 N/A LYS 255.A NZ HIS 245.A NE2 no hydrogen 2.656 N/A THR 256.A N ALA 252.A O no hydrogen 2.971 N/A THR 256.A OG1 ALA 252.A O no hydrogen 2.791 N/A VAL 257.A N CYS 253.A O no hydrogen 2.854 N/A SER 258.A N GLU 254.A O no hydrogen 2.871 N/A SER 258.A OG GLU 254.A O no hydrogen 2.953 N/A ALA 259.A N LYS 255.A O no hydrogen 3.119 N/A MET 260.A N THR 256.A O no hydrogen 2.984 N/A HIS 261.A N VAL 257.A O no hydrogen 3.001 N/A HIS 262.A N SER 258.A O no hydrogen 3.130 N/A HIS 262.A NE2 GLU 301.A O no hydrogen 2.959 N/A VAL 263.A N ALA 259.A O no hydrogen 3.110 N/A LEU 264.A N MET 260.A O no hydrogen 3.034 N/A GLN 265.A N HIS 261.A O no hydrogen 2.916 N/A ARG 266.A N HIS 262.A O no hydrogen 3.139 N/A ARG 266.A NH1 ASP 296.A OD1 no hydrogen 3.224 N/A ARG 266.A NH2 ASP 296.A OD1 no hydrogen 2.823 N/A THR 267.A N VAL 263.A O no hydrogen 2.813 N/A THR 267.A OG1 VAL 263.A O no hydrogen 2.309 N/A ILE 268.A N LEU 264.A O no hydrogen 3.007 N/A LYS 269.A N GLN 265.A O no hydrogen 3.188 N/A CYS 270.A N ARG 266.A O no hydrogen 3.387 N/A ALA 271.A N THR 267.A O no hydrogen 2.949 N/A LYS 272.A N ILE 268.A O no hydrogen 3.228 N/A ALA 273.A N LYS 269.A O no hydrogen 2.652 N/A SER 275.A N LYS 272.A O no hydrogen 2.810 N/A SER 275.A OG VAL 279.A O no hydrogen 3.365 N/A VAL 279.A N GLY 276.A O no hydrogen 3.332 N/A LEU 286.A N SER 282.A O no hydrogen 2.970 N/A GLN 292.A N GLN 292.A OE1 no hydrogen 2.728 N/A SER 293.A N ARG 289.A O no hydrogen 3.240 N/A SER 293.A N MET 290.A O no hydrogen 2.902 N/A SER 293.A OG ARG 289.A O no hydrogen 2.736 N/A ILE 297.A N SER 293.A O no hydrogen 2.788 N/A GLU 298.A N LYS 294.A O no hydrogen 2.753 N/A SER 299.A N LYS 295.A O no hydrogen 2.569 N/A VAL 303.A N SER 258.A OG no hydrogen 3.409 N/A ALA 306.A N GLU 254.A OE2 no hydrogen 3.240 N/A THR 307.A N ARG 217.A O no hydrogen 2.932 N/A LEU 309.A N ARG 215.A O no hydrogen 2.508 N/A