Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5kdl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N THR 180.A OG1 no hydrogen 2.992 N/A LYS 3.A NZ CYS 175.A O no hydrogen 2.660 N/A LYS 3.A NZ GLU 177.A O no hydrogen 2.672 N/A LEU 4.A N LYS 158.A O no hydrogen 2.552 N/A LEU 5.A N ALA 181.A O no hydrogen 3.113 N/A LEU 6.A N PHE 160.A O no hydrogen 2.743 N/A LEU 7.A N ILE 183.A O no hydrogen 3.136 N/A LYS 14.A NZ GLY 8.A O no hydrogen 3.112 N/A LYS 14.A NZ ALA 9.A O no hydrogen 3.011 N/A SER 15.A OG THR 142.A OG1 no hydrogen 2.754 N/A SER 15.A OG ASP 161.A OD2 no hydrogen 2.712 N/A ILE 17.A N GLY 13.A O no hydrogen 3.116 N/A VAL 18.A N LYS 14.A O no hydrogen 3.224 N/A LYS 19.A N SER 15.A O no hydrogen 2.991 N/A GLN 20.A N THR 16.A O no hydrogen 2.993 N/A GLN 20.A NE2 ALA 287.A O no hydrogen 3.018 N/A GLN 20.A NE2 THR 290.A OG1 no hydrogen 3.084 N/A MET 21.A N ILE 17.A O no hydrogen 2.957 N/A LYS 22.A N VAL 18.A O no hydrogen 3.257 N/A ILE 23.A N LYS 19.A O no hydrogen 3.116 N/A ILE 24.A N GLN 20.A O no hydrogen 2.939 N/A HIS 25.A N MET 21.A O no hydrogen 3.068 N/A GLU 26.A N LYS 22.A O no hydrogen 2.842 N/A GLY 28.A N ILE 23.A O no hydrogen 3.111 N/A SER 30.A N GLU 33.A OE1 no hydrogen 3.068 N/A GLU 33.A N SER 30.A OG no hydrogen 2.988 N/A CYS 34.A N SER 30.A O no hydrogen 2.865 N/A CYS 34.A SG TYR 29.A O no hydrogen 3.730 N/A CYS 34.A SG SER 30.A O no hydrogen 3.386 N/A CYS 34.A SG PRO 130.A O no hydrogen 3.299 N/A LYS 35.A N GLU 31.A O no hydrogen 3.200 N/A GLN 36.A N GLU 33.A O no hydrogen 3.147 N/A GLN 36.A NE2 GLU 32.A O no hydrogen 3.579 N/A TYR 37.A N CYS 34.A O no hydrogen 2.895 N/A LYS 38.A N LYS 35.A O no hydrogen 3.185 N/A VAL 41.A N TYR 37.A O no hydrogen 3.003 N/A TYR 42.A N LYS 38.A O no hydrogen 3.160 N/A TYR 42.A OH ILE 123.A O no hydrogen 2.937 N/A SER 43.A N ALA 39.A O no hydrogen 2.782 N/A ASN 44.A N VAL 40.A O no hydrogen 2.865 N/A ASN 44.A ND2 ARG 139.A O no hydrogen 3.447 N/A THR 45.A N VAL 41.A O no hydrogen 3.029 N/A THR 45.A OG1 VAL 41.A O no hydrogen 2.861 N/A ILE 46.A N TYR 42.A O no hydrogen 2.980 N/A GLN 47.A N SER 43.A O no hydrogen 2.879 N/A SER 48.A N ASN 44.A O no hydrogen 2.980 N/A SER 48.A OG ASN 44.A O no hydrogen 2.760 N/A ILE 49.A N THR 45.A O no hydrogen 3.098 N/A ILE 50.A N ILE 46.A O no hydrogen 2.901 N/A ALA 51.A N GLN 47.A O no hydrogen 2.921 N/A ILE 52.A N SER 48.A O no hydrogen 3.069 N/A ILE 52.A N ILE 49.A O no hydrogen 3.263 N/A ILE 53.A N ILE 49.A O no hydrogen 3.283 N/A ARG 54.A N ILE 50.A O no hydrogen 3.035 N/A ALA 55.A N ALA 51.A O no hydrogen 3.097 N/A MET 56.A N ILE 52.A O no hydrogen 3.049 N/A LEU 59.A N ALA 55.A O no hydrogen 2.710 N/A ILE 61.A N MET 56.A O no hydrogen 3.160 N/A GLY 64.A N ASP 94.A OD1 no hydrogen 3.030 N/A ASP 65.A N ASP 94.A OD2 no hydrogen 3.287 N/A ALA 67.A N ASP 65.A OD2 no hydrogen 2.506 N/A ARG 68.A N ASP 65.A O no hydrogen 3.056 N/A ALA 69.A N ALA 66.A O no hydrogen 3.306 N/A ASP 70.A N ALA 67.A O no hydrogen 3.301 N/A ALA 72.A N ARG 68.A O no hydrogen 2.764 N/A ARG 73.A N ALA 69.A O no hydrogen 2.981 N/A ARG 73.A NE ASP 70.A OD1 no hydrogen 3.418 N/A GLN 74.A N ASP 70.A O no hydrogen 2.851 N/A LEU 75.A N ASP 71.A O no hydrogen 2.740 N/A PHE 76.A N ALA 72.A O no hydrogen 3.376 N/A VAL 77.A N ARG 73.A O no hydrogen 3.264 N/A LEU 78.A N GLN 74.A O no hydrogen 3.087 N/A ALA 79.A N LEU 75.A O no hydrogen 3.160 N/A LEU 84.A N THR 81.A OG1 no hydrogen 3.242 N/A ALA 85.A N THR 81.A O no hydrogen 3.066 N/A GLY 86.A N ALA 82.A O no hydrogen 3.182 N/A VAL 87.A N GLU 83.A O no hydrogen 3.000 N/A ILE 88.A N LEU 84.A O no hydrogen 2.955 N/A LYS 89.A N ALA 85.A O no hydrogen 2.885 N/A ARG 90.A N GLY 86.A O no hydrogen 3.203 N/A ARG 90.A NE ASP 71.A OD1 no hydrogen 3.485 N/A ARG 90.A NE ASP 71.A OD2 no hydrogen 2.741 N/A ARG 90.A NH2 ASP 71.A OD1 no hydrogen 3.005 N/A LEU 91.A N VAL 87.A O no hydrogen 3.001 N/A TRP 92.A N ILE 88.A O no hydrogen 2.741 N/A TRP 92.A NE1 ASN 118.A OD1 no hydrogen 2.598 N/A LYS 93.A N LYS 89.A O no hydrogen 2.891 N/A ASP 94.A N LEU 91.A O no hydrogen 3.236 N/A GLY 96.A N ASP 94.A OD1 no hydrogen 2.692 N/A VAL 97.A N ASP 94.A OD1 no hydrogen 3.268 N/A GLN 98.A N ASP 94.A O no hydrogen 2.953 N/A ALA 99.A N SER 95.A O no hydrogen 2.935 N/A CYS 100.A N GLY 96.A O no hydrogen 3.048 N/A CYS 100.A SG ILE 52.A O no hydrogen 3.464 N/A CYS 100.A SG TYR 107.A OH no hydrogen 3.537 N/A PHE 101.A N VAL 97.A O no hydrogen 2.812 N/A ASN 102.A N GLN 98.A O no hydrogen 3.128 N/A ARG 103.A N CYS 100.A O no hydrogen 2.993 N/A ARG 103.A NE GLU 106.A OE1 no hydrogen 2.603 N/A ARG 103.A NH2 GLU 106.A OE1 no hydrogen 2.879 N/A ARG 103.A NH2 GLU 106.A OE2 no hydrogen 3.321 N/A SER 104.A N PHE 101.A O no hydrogen 3.007 N/A SER 104.A OG PHE 101.A O no hydrogen 3.158 N/A GLU 106.A N ARG 103.A O no hydrogen 2.899 N/A TYR 107.A N SER 104.A O no hydrogen 2.898 N/A TYR 107.A OH CYS 100.A O no hydrogen 2.885 N/A GLN 108.A NE2 VAL 194.A O no hydrogen 2.805 N/A ASN 110.A ND2 GLN 47.A OE1 no hydrogen 3.506 N/A SER 112.A OG ARG 137.A O no hydrogen 2.874 N/A ALA 113.A N ASN 110.A O no hydrogen 3.132 N/A TYR 115.A OH ASP 134.A OD1 no hydrogen 2.557 N/A TYR 116.A N SER 112.A O no hydrogen 3.264 N/A TYR 116.A OH ASP 134.A O no hydrogen 2.675 N/A LEU 117.A N ALA 113.A O no hydrogen 3.034 N/A ASN 118.A N ALA 114.A O no hydrogen 2.807 N/A ASP 119.A N TYR 116.A O no hydrogen 3.006 N/A LEU 120.A N LEU 117.A O no hydrogen 3.188 N/A ARG 122.A NH1 ASP 134.A OD1 no hydrogen 3.514 N/A ARG 122.A NH1 ASP 134.A OD2 no hydrogen 2.695 N/A ARG 122.A NH2 ASP 119.A OD2 no hydrogen 3.047 N/A ARG 122.A NH2 ASP 134.A OD1 no hydrogen 3.280 N/A ILE 123.A N ASP 119.A O no hydrogen 3.075 N/A ALA 124.A N LEU 120.A O no hydrogen 2.628 N/A TYR 128.A OH ASP 134.A OD2 no hydrogen 2.938 N/A THR 131.A N ASP 134.A OD2 no hydrogen 3.149 N/A ASP 134.A N THR 131.A OG1 no hydrogen 3.020 N/A VAL 135.A N THR 131.A O no hydrogen 2.879 N/A LEU 136.A N GLN 132.A O no hydrogen 3.050 N/A ARG 137.A N GLN 133.A O no hydrogen 2.955 N/A THR 138.A N VAL 135.A O no hydrogen 3.042 N/A THR 138.A OG1 VAL 135.A O no hydrogen 2.471 N/A ARG 139.A N ASN 44.A OD1 no hydrogen 2.834 N/A ARG 139.A NE GLU 11.A OE2 no hydrogen 2.805 N/A THR 142.A OG1 SER 15.A OG no hydrogen 2.754 N/A GLY 144.A N GLU 168.A OE1 no hydrogen 3.008 N/A VAL 146.A N ASP 161.A O no hydrogen 2.985 N/A THR 148.A N MET 159.A O no hydrogen 2.876 N/A THR 148.A OG1 GLU 147.A O no hydrogen 2.980 N/A PHE 150.A N PHE 157.A O no hydrogen 3.402 N/A PHE 152.A N LEU 155.A O no hydrogen 2.517 N/A LEU 155.A N PHE 152.A O no hydrogen 2.813 N/A PHE 157.A N PHE 150.A O no hydrogen 2.753 N/A LYS 158.A N VAL 2.A O no hydrogen 2.578 N/A MET 159.A N THR 148.A O no hydrogen 2.815 N/A PHE 160.A N LEU 4.A O no hydrogen 2.702 N/A ASP 161.A N VAL 146.A O no hydrogen 2.853 N/A ARG 166.A N GLU 197.A OE2 no hydrogen 3.362 N/A ARG 166.A NE GLU 206.A OE2 no hydrogen 2.691 N/A ARG 166.A NH2 GLU 206.A OE1 no hydrogen 2.834 N/A ARG 166.A NH2 GLU 206.A OE2 no hydrogen 3.182 N/A GLU 168.A N GLN 165.A O no hydrogen 2.960 N/A ARG 169.A N ARG 166.A O no hydrogen 3.229 N/A ARG 169.A NE GLY 164.A O no hydrogen 2.451 N/A ARG 169.A NH1 GLU 206.A OE2 no hydrogen 2.577 N/A ARG 169.A NH2 GLY 164.A O no hydrogen 2.955 N/A LYS 171.A N GLU 168.A O no hydrogen 2.964 N/A TRP 172.A N ARG 169.A O no hydrogen 3.199 N/A TRP 172.A NE1 GLY 163.A O no hydrogen 2.634 N/A HIS 174.A N LYS 171.A O no hydrogen 3.222 N/A CYS 175.A N TRP 172.A O no hydrogen 3.047 N/A CYS 175.A SG TRP 172.A O no hydrogen 3.929 N/A PHE 176.A N ILE 173.A O no hydrogen 3.224 N/A THR 180.A N LYS 3.A O no hydrogen 2.927 N/A ALA 181.A N LYS 3.A O no hydrogen 3.233 N/A ILE 182.A N SER 224.A O no hydrogen 3.135 N/A ILE 183.A N LEU 5.A O no hydrogen 2.924 N/A PHE 184.A N ILE 226.A O no hydrogen 2.692 N/A CYS 185.A N LEU 7.A O no hydrogen 2.912 N/A CYS 185.A SG ILE 183.A O no hydrogen 4.002 N/A VAL 186.A N PHE 228.A O no hydrogen 2.689 N/A LEU 188.A N ASN 230.A O no hydrogen 2.787 N/A ASP 190.A N ALA 187.A O no hydrogen 3.328 N/A TYR 191.A OH SER 242.A O no hydrogen 2.899 N/A LEU 193.A N ASP 190.A O no hydrogen 3.322 N/A LEU 195.A N MET 201.A O no hydrogen 3.022 N/A GLU 197.A N GLU 197.A OE1 no hydrogen 2.637 N/A GLU 200.A N ASP 198.A OD1 no hydrogen 3.024 N/A ASN 202.A ND2 TYR 191.A O no hydrogen 2.872 N/A ARG 203.A N LEU 193.A O no hydrogen 3.267 N/A ARG 203.A NE VAL 194.A O no hydrogen 2.752 N/A ARG 203.A NH2 GLN 108.A OE1 no hydrogen 3.103 N/A HIS 205.A N ASN 202.A OD1 no hydrogen 2.794 N/A HIS 205.A NE2 CYS 247.A O no hydrogen 2.750 N/A GLU 206.A N ASN 202.A O no hydrogen 2.966 N/A SER 207.A N ARG 203.A O no hydrogen 2.916 N/A MET 208.A N MET 204.A O no hydrogen 2.861 N/A LYS 209.A N HIS 205.A O no hydrogen 2.987 N/A LEU 210.A N GLU 206.A O no hydrogen 3.043 N/A PHE 211.A N SER 207.A O no hydrogen 2.939 N/A ASP 212.A N MET 208.A O no hydrogen 2.861 N/A SER 213.A N LYS 209.A O no hydrogen 3.126 N/A SER 213.A OG LYS 209.A O no hydrogen 2.980 N/A ILE 214.A N LEU 210.A O no hydrogen 2.877 N/A CYS 215.A N PHE 211.A O no hydrogen 2.609 N/A ASN 216.A N ASP 212.A O no hydrogen 3.130 N/A ASN 216.A ND2 ASP 212.A O no hydrogen 3.323 N/A ASN 216.A ND2 ASP 212.A OD2 no hydrogen 3.462 N/A ASN 216.A ND2 LEU 271.A O no hydrogen 2.776 N/A ASN 217.A N ILE 214.A O no hydrogen 3.044 N/A TRP 219.A N ASN 217.A OD1 no hydrogen 2.151 N/A PHE 220.A N ASN 217.A OD1 no hydrogen 3.179 N/A THR 221.A OG1 LYS 218.A O no hydrogen 3.490 N/A THR 223.A OG1 VAL 179.A O no hydrogen 2.752 N/A ILE 226.A N ILE 182.A O no hydrogen 2.759 N/A LEU 227.A N TYR 281.A O no hydrogen 2.760 N/A PHE 228.A N PHE 184.A O no hydrogen 2.711 N/A LEU 229.A N HIS 283.A O no hydrogen 2.919 N/A ASN 230.A N VAL 186.A O no hydrogen 2.497 N/A ASN 230.A ND2 SER 12.A O no hydrogen 3.077 N/A LYS 231.A NZ GLU 11.A O no hydrogen 2.451 N/A LYS 231.A NZ ASP 111.A OD1 no hydrogen 3.395 N/A LYS 231.A NZ ASP 111.A OD2 no hydrogen 2.932 N/A LYS 232.A N THR 285.A O no hydrogen 3.314 N/A PHE 235.A N LYS 231.A O no hydrogen 2.899 N/A GLU 236.A N LYS 232.A O no hydrogen 2.850 N/A GLU 237.A N ASP 233.A O no hydrogen 3.236 N/A LYS 238.A N LEU 234.A O no hydrogen 2.772 N/A LYS 238.A NZ SER 189.A O no hydrogen 2.766 N/A LYS 238.A NZ ASP 192.A OD1 no hydrogen 2.152 N/A ILE 239.A N PHE 235.A O no hydrogen 2.818 N/A LYS 241.A N LYS 238.A O no hydrogen 2.777 N/A SER 242.A N LYS 238.A O no hydrogen 3.058 N/A SER 242.A OG ASP 192.A OD2 no hydrogen 3.131 N/A LEU 244.A N ASN 255.A OD1 no hydrogen 2.997 N/A ILE 246.A N PRO 243.A O no hydrogen 3.386 N/A CYS 247.A N LEU 244.A O no hydrogen 3.079 N/A CYS 247.A SG ASN 202.A OD1 no hydrogen 3.712 N/A CYS 247.A SG HIS 205.A NE2 no hydrogen 3.424 N/A TYR 248.A N LEU 244.A O no hydrogen 3.188 N/A GLU 250.A N GLU 250.A OE2 no hydrogen 3.234 N/A TYR 251.A N TYR 248.A O no hydrogen 3.482 N/A TYR 251.A OH SER 254.A O no hydrogen 2.518 N/A SER 254.A OG GLU 259.A OE1 no hydrogen 2.868 N/A ALA 260.A N THR 256.A O no hydrogen 2.791 N/A ALA 261.A N TYR 257.A O no hydrogen 2.903 N/A ALA 262.A N GLU 258.A O no hydrogen 3.036 N/A TYR 263.A N GLU 259.A O no hydrogen 3.104 N/A ILE 264.A N ALA 260.A O no hydrogen 3.075 N/A GLN 265.A N ALA 261.A O no hydrogen 3.008 N/A CYS 266.A N ALA 262.A O no hydrogen 3.156 N/A GLN 267.A N TYR 263.A O no hydrogen 3.019 N/A PHE 268.A N ILE 264.A O no hydrogen 3.086 N/A GLU 269.A N GLN 265.A O no hydrogen 2.864 N/A ASP 270.A N CYS 266.A O no hydrogen 2.898 N/A LEU 271.A N PHE 268.A O no hydrogen 3.140 N/A ASN 272.A N GLU 269.A O no hydrogen 3.246 N/A ASN 272.A ND2 ARG 274.A O no hydrogen 3.374 N/A ASN 272.A ND2 LYS 278.A O no hydrogen 2.885 N/A LYS 273.A N ASN 216.A OD1 no hydrogen 2.718 N/A LYS 278.A N ARG 274.A O no hydrogen 2.893 N/A LYS 278.A NZ PHE 220.A O no hydrogen 3.229 N/A LYS 278.A NZ THR 223.A O no hydrogen 2.404 N/A TYR 281.A N ILE 225.A O no hydrogen 2.993 N/A THR 282.A OG1 GLN 265.A OE1 no hydrogen 2.769 N/A HIS 283.A N LEU 227.A O no hydrogen 2.891 N/A THR 285.A N LEU 229.A O no hydrogen 3.010 N/A THR 285.A OG1 ASN 230.A OD1 no hydrogen 2.984 N/A CYS 286.A N ASN 292.A OD1 no hydrogen 2.998 N/A CYS 286.A SG THR 288.A OG1 no hydrogen 3.245 N/A ALA 287.A N ASN 230.A OD1 no hydrogen 2.976 N/A ASP 289.A N CYS 286.A O no hydrogen 2.792 N/A THR 290.A OG1 GLN 20.A OE1 no hydrogen 2.871 N/A ASN 292.A N ASP 289.A OD2 no hydrogen 3.236 N/A VAL 293.A N ASP 289.A O no hydrogen 2.875 N/A GLN 294.A N THR 290.A O no hydrogen 2.830 N/A ALA 295.A N LYS 291.A O no hydrogen 3.226 N/A ALA 296.A N ASN 292.A O no hydrogen 3.024 N/A ALA 297.A N VAL 293.A O no hydrogen 2.674 N/A ALA 298.A N GLN 294.A O no hydrogen 3.092 N/A PHE 299.A N ALA 295.A O no hydrogen 3.035 N/A VAL 300.A N ALA 296.A O no hydrogen 2.729 N/A PHE 301.A N ALA 297.A O no hydrogen 2.684 N/A ASP 302.A N ALA 298.A O no hydrogen 2.963 N/A ALA 303.A N PHE 299.A O no hydrogen 3.213 N/A VAL 304.A N VAL 300.A O no hydrogen 3.022 N/A THR 305.A N PHE 301.A O no hydrogen 2.733 N/A THR 305.A OG1 PHE 301.A O no hydrogen 2.940 N/A ASP 306.A N ASP 302.A O no hydrogen 2.957 N/A VAL 307.A N VAL 304.A O no hydrogen 3.009 N/A