Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1upl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N ALA 1.A O no hydrogen 3.130 N/A LYS 5.A NZ GLU 9.A OE1 no hydrogen 2.569 N/A ASN 6.A N ASP 2.A O no hydrogen 2.846 N/A LEU 7.A N ILE 3.A O no hydrogen 3.100 N/A LYS 8.A N VAL 4.A O no hydrogen 3.258 N/A GLU 9.A N LYS 5.A O no hydrogen 2.758 N/A SER 10.A N ASN 6.A O no hydrogen 2.631 N/A SER 10.A OG ALA 21.A O no hydrogen 3.387 N/A VAL 12.A N GLU 9.A O no hydrogen 3.332 N/A GLU 14.A N ALA 11.A O no hydrogen 3.154 N/A LYS 15.A N VAL 12.A O no hydrogen 3.375 N/A ALA 21.A N LYS 17.A O no hydrogen 2.896 N/A THR 22.A N ALA 18.A O no hydrogen 2.633 N/A THR 22.A OG1 ALA 18.A O no hydrogen 2.708 N/A GLU 23.A N GLU 19.A O no hydrogen 2.889 N/A GLU 24.A N LYS 20.A O no hydrogen 3.069 N/A VAL 25.A N ALA 21.A O no hydrogen 2.772 N/A SER 26.A N THR 22.A O no hydrogen 3.524 N/A SER 26.A OG THR 22.A O no hydrogen 3.001 N/A LYS 27.A N GLU 23.A O no hydrogen 3.017 N/A ASN 28.A N GLU 24.A O no hydrogen 2.867 N/A LEU 29.A N VAL 25.A O no hydrogen 2.830 N/A VAL 30.A N SER 26.A O no hydrogen 2.714 N/A ALA 31.A N LYS 27.A O no hydrogen 2.742 N/A LYS 32.A NZ ASP 73.A OD1 no hydrogen 3.524 N/A GLU 33.A N VAL 30.A O no hydrogen 2.852 N/A ILE 34.A N ALA 31.A O no hydrogen 2.750 N/A LEU 35.A N LYS 32.A O no hydrogen 2.878 N/A ALA 44.A N GLU 41.A O no hydrogen 2.922 N/A GLN 45.A N ALA 42.A O no hydrogen 2.899 N/A LEU 46.A N VAL 43.A O no hydrogen 3.418 N/A GLN 48.A N ALA 44.A O no hydrogen 3.048 N/A GLU 49.A N GLN 45.A O no hydrogen 2.936 N/A LEU 50.A N LEU 46.A O no hydrogen 2.845 N/A TYR 51.A N ALA 47.A O no hydrogen 2.963 N/A TYR 51.A OH THR 92.A OG1 no hydrogen 2.906 N/A ASN 52.A N GLN 48.A O no hydrogen 3.050 N/A ASN 52.A N GLU 49.A O no hydrogen 3.215 N/A SER 53.A N GLU 49.A O no hydrogen 3.127 N/A SER 53.A N LEU 50.A O no hydrogen 3.325 N/A SER 53.A OG GLU 49.A O no hydrogen 3.394 N/A SER 53.A OG LEU 50.A O no hydrogen 2.489 N/A GLY 54.A N TYR 51.A O no hydrogen 3.421 N/A LEU 55.A N SER 53.A OG no hydrogen 3.326 N/A THR 58.A N GLY 54.A O no hydrogen 3.286 N/A THR 58.A OG1 GLY 54.A O no hydrogen 3.465 N/A LEU 59.A N LEU 55.A O no hydrogen 2.834 N/A VAL 60.A N LEU 56.A O no hydrogen 3.381 N/A ALA 61.A N SER 57.A O no hydrogen 2.563 N/A LEU 63.A N VAL 60.A O no hydrogen 3.159 N/A LEU 65.A N ASP 62.A O no hydrogen 2.734 N/A ILE 66.A N LEU 63.A O no hydrogen 3.163 N/A GLY 70.A N ASP 67.A OD1 no hydrogen 3.396 N/A LYS 71.A N ASP 67.A O no hydrogen 2.840 N/A LYS 72.A NZ PHE 68.A O no hydrogen 3.389 N/A ASP 73.A N GLU 69.A O no hydrogen 3.086 N/A VAL 74.A N GLY 70.A O no hydrogen 2.934 N/A ALA 75.A N LYS 71.A O no hydrogen 3.203 N/A GLN 76.A N LYS 72.A O no hydrogen 2.846 N/A ILE 77.A N ASP 73.A O no hydrogen 2.574 N/A PHE 78.A N VAL 74.A O no hydrogen 2.716 N/A ASN 79.A N ALA 75.A O no hydrogen 2.882 N/A ASN 79.A ND2 ILE 120.A O no hydrogen 3.349 N/A ASN 80.A N GLN 76.A O no hydrogen 2.990 N/A ASN 80.A ND2 LEU 35.A O no hydrogen 3.475 N/A ILE 81.A N ILE 77.A O no hydrogen 2.910 N/A LEU 82.A N PHE 78.A O no hydrogen 3.032 N/A ARG 83.A N ASN 79.A O no hydrogen 3.135 N/A ARG 83.A N ASN 80.A O no hydrogen 3.296 N/A GLN 85.A N ASN 39.A O no hydrogen 3.171 N/A ILE 86.A N ARG 89.A O no hydrogen 3.288 N/A THR 92.A OG1 TYR 51.A OH no hydrogen 2.906 N/A THR 92.A OG1 ILE 81.A O no hydrogen 2.842 N/A GLU 94.A N THR 90.A O no hydrogen 3.323 N/A TYR 95.A N PRO 91.A O no hydrogen 2.808 N/A TYR 95.A OH TYR 51.A O no hydrogen 3.372 N/A ILE 96.A N THR 92.A O no hydrogen 2.831 N/A CYS 97.A N VAL 93.A O no hydrogen 3.020 N/A CYS 97.A SG VAL 93.A O no hydrogen 3.799 N/A THR 98.A N TYR 95.A O no hydrogen 2.549 N/A THR 98.A OG1 TYR 95.A O no hydrogen 2.531 N/A GLN 99.A N ILE 96.A O no hydrogen 2.913 N/A ILE 102.A N GLN 99.A O no hydrogen 2.917 N/A LEU 103.A N GLN 100.A O no hydrogen 3.060 N/A PHE 104.A N GLN 100.A O no hydrogen 3.277 N/A LEU 106.A N LEU 103.A O no hydrogen 2.932 N/A LYS 107.A N PHE 104.A O no hydrogen 3.124 N/A LYS 107.A NZ GLU 110.A OE1 no hydrogen 2.789 N/A GLY 108.A N LEU 105.A O no hydrogen 2.941 N/A TYR 109.A N LEU 106.A O no hydrogen 3.138 N/A TYR 109.A OH ASP 156.A OD2 no hydrogen 2.612 N/A TYR 109.A OH THR 160.A OG1 no hydrogen 2.695 N/A GLU 110.A N LYS 107.A O no hydrogen 3.044 N/A SER 111.A N GLY 108.A O no hydrogen 2.767 N/A ILE 114.A N SER 111.A O no hydrogen 2.913 N/A ALA 115.A N SER 111.A O no hydrogen 2.756 N/A CYS 118.A N ILE 114.A O no hydrogen 3.004 N/A CYS 118.A SG ILE 114.A O no hydrogen 3.512 N/A GLY 119.A N ALA 115.A O no hydrogen 3.120 N/A ILE 120.A N LEU 116.A O no hydrogen 3.249 N/A ARG 122.A N GLY 119.A O no hydrogen 2.692 N/A ARG 122.A NH1 ASP 156.A OD2 no hydrogen 2.579 N/A ARG 122.A NH1 THR 160.A OG1 no hydrogen 2.672 N/A ARG 122.A NH2 ASP 156.A OD1 no hydrogen 2.621 N/A ARG 122.A NH2 ASP 156.A OD2 no hydrogen 3.156 N/A GLU 123.A N ILE 120.A O no hydrogen 3.265 N/A ILE 125.A N LEU 121.A O no hydrogen 3.044 N/A ARG 126.A N GLU 123.A O no hydrogen 3.406 N/A ARG 126.A NH1 GLU 123.A OE1 no hydrogen 2.755 N/A HIS 127.A N CYS 124.A O no hydrogen 2.731 N/A LEU 130.A N HIS 127.A O no hydrogen 2.912 N/A ALA 131.A N HIS 127.A O no hydrogen 3.088 N/A LYS 132.A N GLU 128.A O no hydrogen 2.828 N/A ILE 133.A N PRO 129.A O no hydrogen 3.333 N/A ILE 133.A N LEU 130.A O no hydrogen 3.039 N/A ILE 134.A N LEU 130.A O no hydrogen 3.068 N/A ILE 134.A N ALA 131.A O no hydrogen 2.925 N/A LEU 135.A N ALA 131.A O no hydrogen 2.771 N/A TRP 136.A N LYS 132.A O no hydrogen 3.199 N/A SER 137.A N ILE 134.A O no hydrogen 3.372 N/A SER 137.A OG ILE 134.A O no hydrogen 3.029 N/A GLN 139.A N SER 137.A OG no hydrogen 3.210 N/A PHE 140.A N SER 137.A O no hydrogen 3.127 N/A TYR 141.A N GLU 138.A O no hydrogen 3.291 N/A ASP 142.A N GLN 139.A O no hydrogen 2.929 N/A PHE 143.A N PHE 140.A O no hydrogen 2.986 N/A PHE 144.A N TYR 141.A O no hydrogen 3.279 N/A ARG 145.A N ASP 142.A O no hydrogen 2.927 N/A TYR 146.A N ASP 142.A O no hydrogen 2.953 N/A TYR 146.A OH GLU 110.A OE2 no hydrogen 2.275 N/A VAL 147.A N PHE 143.A O no hydrogen 2.674 N/A GLU 148.A N ARG 145.A O no hydrogen 3.162 N/A THR 150.A OG1 ASP 152.A OD2 no hydrogen 2.649 N/A ILE 153.A N THR 150.A OG1 no hydrogen 3.358 N/A ALA 154.A N THR 150.A O no hydrogen 3.263 N/A SER 155.A N PHE 151.A O no hydrogen 3.055 N/A SER 155.A N ASP 152.A O no hydrogen 3.041 N/A ASP 156.A N ASP 152.A O no hydrogen 3.009 N/A ALA 157.A N ILE 153.A O no hydrogen 2.735 N/A PHE 158.A N ALA 154.A O no hydrogen 3.097 N/A ALA 159.A N SER 155.A O no hydrogen 3.224 N/A THR 160.A N ASP 156.A O no hydrogen 3.259 N/A THR 160.A OG1 TYR 109.A OH no hydrogen 2.695 N/A THR 160.A OG1 ASP 156.A O no hydrogen 3.286 N/A PHE 161.A N ALA 157.A O no hydrogen 2.808 N/A LYS 162.A N PHE 158.A O no hydrogen 2.670 N/A LYS 162.A NZ GLU 208.A OE1 no hydrogen 3.218 N/A ASP 163.A N ALA 159.A O no hydrogen 2.938 N/A LEU 164.A N THR 160.A O no hydrogen 2.996 N/A LEU 165.A N PHE 161.A O no hydrogen 3.312 N/A LEU 165.A N LYS 162.A O no hydrogen 2.917 N/A THR 166.A N ASP 163.A O no hydrogen 3.014 N/A THR 166.A OG1 LYS 162.A O no hydrogen 3.499 N/A ARG 167.A N ASP 163.A O no hydrogen 2.759 N/A ARG 167.A NE ASP 163.A OD1 no hydrogen 2.779 N/A ARG 167.A NE ASP 163.A OD2 no hydrogen 2.901 N/A ARG 167.A NH2 ASP 163.A OD2 no hydrogen 2.569 N/A LYS 169.A NZ ASP 212.A OD1 no hydrogen 2.870 N/A SER 172.A N HIS 168.A O no hydrogen 2.971 N/A SER 172.A OG LEU 165.A O no hydrogen 2.385 N/A ALA 173.A N LYS 169.A O no hydrogen 2.721 N/A GLU 174.A N LEU 170.A O no hydrogen 3.003 N/A PHE 175.A N LEU 171.A O no hydrogen 2.702 N/A LEU 176.A N SER 172.A O no hydrogen 2.879 N/A GLU 177.A N ALA 173.A O no hydrogen 3.032 N/A GLU 177.A N GLU 174.A O no hydrogen 3.250 N/A GLN 178.A N GLU 174.A O no hydrogen 3.188 N/A HIS 179.A ND1 PHE 175.A O no hydrogen 2.886 N/A ARG 182.A NH1 GLU 138.A OE2 no hydrogen 2.438 N/A ARG 182.A NH2 GLU 138.A OE1 no hydrogen 2.422 N/A ARG 182.A NH2 GLU 138.A OE2 no hydrogen 2.929 N/A PHE 183.A N HIS 179.A O no hydrogen 2.829 N/A PHE 184.A N TYR 180.A O no hydrogen 2.990 N/A SER 185.A N ASP 181.A O no hydrogen 3.030 N/A GLU 186.A N ARG 182.A O no hydrogen 3.098 N/A TYR 187.A N PHE 183.A O no hydrogen 2.824 N/A TYR 187.A OH SER 202.A O no hydrogen 2.574 N/A GLU 188.A N PHE 184.A O no hydrogen 2.905 N/A LYS 189.A N SER 185.A O no hydrogen 3.463 N/A LEU 190.A N GLU 186.A O no hydrogen 3.425 N/A LEU 191.A N TYR 187.A O no hydrogen 3.017 N/A HIS 192.A N GLU 188.A O no hydrogen 3.180 N/A HIS 192.A N LYS 189.A O no hydrogen 3.203 N/A HIS 192.A ND1 GLU 188.A O no hydrogen 3.183 N/A SER 193.A N LEU 190.A O no hydrogen 3.029 N/A ASN 195.A N SER 193.A OG no hydrogen 2.864 N/A THR 198.A N ASN 195.A OD1 no hydrogen 2.897 N/A LYS 199.A N ASN 195.A O no hydrogen 3.086 N/A LYS 199.A NZ LEU 191.A O no hydrogen 3.081 N/A LYS 199.A NZ SER 193.A O no hydrogen 2.834 N/A ARG 200.A N TYR 196.A O no hydrogen 3.126 N/A GLN 201.A N VAL 197.A O no hydrogen 2.926 N/A SER 202.A N THR 198.A O no hydrogen 3.122 N/A SER 202.A OG THR 198.A O no hydrogen 2.665 N/A LEU 203.A N LYS 199.A O no hydrogen 2.798 N/A LYS 204.A N ARG 200.A O no hydrogen 3.050 N/A LEU 205.A N GLN 201.A O no hydrogen 2.955 N/A LEU 206.A N SER 202.A O no hydrogen 2.860 N/A GLY 207.A N LEU 203.A O no hydrogen 3.130 N/A GLU 208.A N LYS 204.A O no hydrogen 3.182 N/A LEU 209.A N LEU 205.A O no hydrogen 2.669 N/A LEU 210.A N LEU 206.A O no hydrogen 2.888 N/A LEU 211.A N GLY 207.A O no hydrogen 2.982 N/A ASP 212.A N LEU 209.A O no hydrogen 3.457 N/A HIS 214.A N ASP 212.A OD2 no hydrogen 2.664 N/A ASN 215.A N ASP 212.A O no hydrogen 2.867 N/A ASN 215.A ND2 LEU 209.A O no hydrogen 2.772 N/A THR 219.A OG1 PHE 216.A O no hydrogen 3.430 N/A LYS 220.A N THR 217.A O no hydrogen 3.049 N/A TYR 221.A N ILE 218.A O no hydrogen 3.149 N/A SER 223.A N LYS 220.A O no hydrogen 2.855 N/A SER 223.A OG LYS 220.A O no hydrogen 2.441 N/A ASN 227.A N LYS 224.A O no hydrogen 2.648 N/A ASN 227.A ND2 TYR 221.A O no hydrogen 2.872 N/A LEU 228.A N LYS 224.A O no hydrogen 3.297 N/A LYS 229.A N PRO 225.A O no hydrogen 3.009 N/A LEU 230.A N GLU 226.A O no hydrogen 3.149 N/A LEU 232.A N LEU 230.A O no hydrogen 3.033 N/A ARG 234.A N ASN 231.A O no hydrogen 3.099 N/A ASP 235.A N LEU 232.A O no hydrogen 3.326 N/A SER 237.A N ASP 235.A OD2 no hydrogen 3.026 N/A ASN 239.A ND2 TYR 196.A OH no hydrogen 2.984 N/A ILE 240.A N SER 237.A O no hydrogen 2.922 N/A ILE 240.A N SER 237.A OG no hydrogen 3.413 N/A GLN 241.A N SER 237.A O no hydrogen 3.052 N/A GLN 241.A NE2 ASP 235.A O no hydrogen 2.361 N/A PHE 242.A N ARG 238.A O no hydrogen 3.127 N/A GLU 243.A N ASN 239.A O no hydrogen 3.256 N/A ALA 244.A N ILE 240.A O no hydrogen 2.823 N/A PHE 245.A N GLN 241.A O no hydrogen 2.944 N/A HIS 246.A N GLU 243.A O no hydrogen 2.991 N/A VAL 247.A N ALA 244.A O no hydrogen 3.180 N/A PHE 248.A N ALA 244.A O no hydrogen 2.776 N/A LYS 249.A N PHE 245.A O no hydrogen 2.770 N/A LYS 249.A NZ HIS 246.A ND1 no hydrogen 2.936 N/A VAL 250.A N VAL 247.A O no hydrogen 2.949 N/A VAL 252.A N PHE 248.A O no hydrogen 3.495 N/A ALA 253.A N LYS 249.A O no hydrogen 3.206 N/A ASN 254.A ND2 ASN 256.A O no hydrogen 2.707 N/A ASN 256.A N ASN 254.A OD1 no hydrogen 3.150 N/A LYS 257.A NZ VAL 252.A O no hydrogen 2.745 N/A LYS 257.A NZ ASN 254.A O no hydrogen 2.813 N/A GLN 259.A NE2 ASP 263.A OD2 no hydrogen 2.853 N/A LEU 262.A N THR 258.A O no hydrogen 2.873 N/A ASP 263.A N GLN 259.A O no hydrogen 2.960 N/A ILE 264.A N PRO 260.A O no hydrogen 3.177 N/A LEU 265.A N ILE 261.A O no hydrogen 3.270 N/A LEU 266.A N LEU 262.A O no hydrogen 2.979 N/A LYS 267.A N ASP 263.A O no hydrogen 2.662 N/A ASN 268.A N ILE 264.A O no hydrogen 3.185 N/A ASN 268.A N LEU 265.A O no hydrogen 3.174 N/A ASN 268.A ND2 ILE 264.A O no hydrogen 2.886 N/A GLN 269.A N LEU 266.A O no hydrogen 3.291 N/A GLN 269.A NE2 ILE 300.A O no hydrogen 3.302 N/A LEU 272.A N ASN 268.A O no hydrogen 2.771 N/A ILE 273.A N GLN 269.A O no hydrogen 3.070 N/A GLU 274.A N ALA 270.A O no hydrogen 3.149 N/A PHE 275.A N LYS 271.A O no hydrogen 2.933 N/A LEU 276.A N LEU 272.A O no hydrogen 2.810 N/A SER 277.A N ILE 273.A O no hydrogen 2.856 N/A SER 277.A OG ILE 273.A O no hydrogen 2.780 N/A LYS 278.A N PHE 275.A O no hydrogen 2.975 N/A PHE 279.A N LEU 276.A O no hydrogen 3.015 N/A GLN 280.A NE2 ARG 238.A O no hydrogen 2.914 N/A GLN 280.A NE2 GLN 241.A OE1 no hydrogen 3.643 N/A ASN 281.A ND2 SER 277.A O no hydrogen 2.973 N/A ARG 283.A N GLN 280.A O no hydrogen 3.198 N/A ARG 283.A NE GLN 280.A OE1 no hydrogen 2.420 N/A ARG 283.A NH2 GLN 280.A OE1 no hydrogen 2.718 N/A THR 284.A OG1 ASP 282.A O no hydrogen 3.507 N/A PHE 289.A N ASP 286.A OD1 no hydrogen 3.203 N/A ASN 290.A N ASP 286.A O no hydrogen 3.099 N/A ASN 290.A ND2 ARG 283.A O no hydrogen 3.233 N/A ASP 291.A N GLU 287.A O no hydrogen 2.916 N/A GLU 292.A N GLN 288.A O no hydrogen 2.886 N/A LYS 293.A N PHE 289.A O no hydrogen 3.007 N/A LYS 293.A NZ PHE 279.A O no hydrogen 2.989 N/A THR 294.A N ASN 290.A O no hydrogen 2.933 N/A TYR 295.A N ASP 291.A O no hydrogen 2.860 N/A LEU 296.A N GLU 292.A O no hydrogen 2.828 N/A VAL 297.A N LYS 293.A O no hydrogen 3.001 N/A LYS 298.A N THR 294.A O no hydrogen 3.428 N/A LYS 298.A NZ ASP 302.A OD2 no hydrogen 2.396 N/A GLN 299.A N TYR 295.A O no hydrogen 2.877 N/A ILE 300.A N LEU 296.A O no hydrogen 2.692 N/A ARG 301.A N VAL 297.A O no hydrogen 2.879 N/A ASP 302.A N LYS 298.A O no hydrogen 2.482 N/A ASP 302.A N GLN 299.A O no hydrogen 2.717 N/A LEU 303.A N ILE 300.A O no hydrogen 2.889 N/A