Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3u60_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N GLU 22.A OE2 no hydrogen 2.673 N/A THR 3.A OG1 GLU 22.A OE1 no hydrogen 2.352 N/A THR 3.A OG1 GLU 22.A OE2 no hydrogen 3.014 N/A ASN 5.A N LYS 14.A O no hydrogen 2.892 N/A ASN 5.A ND2 GLN 13.A O no hydrogen 3.334 N/A LYS 7.A N GLU 8.A OE1 no hydrogen 3.301 N/A GLU 12.A N ILE 10.A O no hydrogen 2.929 N/A LYS 14.A NZ GLU 183.A OE1 no hydrogen 3.527 N/A LYS 14.A NZ GLU 183.A OE2 no hydrogen 3.206 N/A TYR 15.A OH GLU 183.A OE1 no hydrogen 2.273 N/A SER 18.A N THR 3.A OG1 no hydrogen 3.322 N/A SER 18.A N GLU 22.A OE1 no hydrogen 2.986 N/A CYS 23.A SG THR 19.A O no hydrogen 3.715 N/A ALA 27.A N ASP 164.A OD1 no hydrogen 3.475 N/A LYS 30.A N PRO 26.A O no hydrogen 2.991 N/A LYS 30.A NZ ILE 20.A O no hydrogen 3.287 N/A LYS 30.A NZ ASP 21.A O no hydrogen 2.672 N/A LYS 30.A NZ CYS 23.A O no hydrogen 2.904 N/A GLU 31.A N ALA 27.A O no hydrogen 2.977 N/A THR 32.A N PHE 28.A O no hydrogen 2.899 N/A PHE 33.A N ASP 29.A O no hydrogen 3.011 N/A LYS 34.A N LYS 30.A O no hydrogen 2.792 N/A LYS 34.A NZ ASP 21.A OD2 no hydrogen 3.228 N/A SER 35.A N GLU 31.A O no hydrogen 2.856 N/A ILE 36.A N THR 32.A O no hydrogen 3.150 N/A THR 37.A N PHE 33.A O no hydrogen 2.984 N/A THR 37.A OG1 PHE 33.A O no hydrogen 3.434 N/A THR 37.A OG1 LYS 34.A O no hydrogen 3.006 N/A SER 38.A N LYS 34.A O no hydrogen 2.895 N/A LYS 39.A N SER 35.A O no hydrogen 3.365 N/A GLY 40.A N THR 37.A O no hydrogen 3.298 N/A LYS 41.A NZ GLN 101.A OE1 no hydrogen 3.421 N/A ILE 45.A N ILE 134.A O no hydrogen 2.940 N/A ILE 46.A N ARG 153.A O no hydrogen 3.014 N/A LEU 47.A N ILE 136.A O no hydrogen 2.913 N/A HIS 48.A N ILE 155.A O no hydrogen 3.253 N/A SER 51.A OG PRO 52.A O no hydrogen 3.549 N/A THR 54.A OG1 SER 51.A O no hydrogen 3.393 N/A LYS 56.A NZ THR 54.A OG1 no hydrogen 3.307 N/A VAL 59.A N GLY 55.A O no hydrogen 2.804 N/A ALA 60.A N LYS 56.A O no hydrogen 3.013 N/A ALA 62.A N THR 58.A O no hydrogen 3.038 N/A LEU 63.A N VAL 59.A O no hydrogen 2.863 N/A CYS 64.A N ALA 60.A O no hydrogen 3.384 N/A CYS 64.A SG ALA 60.A O no hydrogen 3.922 N/A HIS 65.A N LYS 61.A O no hydrogen 2.948 N/A ASP 66.A N ALA 62.A O no hydrogen 2.898 N/A VAL 67.A N LEU 63.A O no hydrogen 3.329 N/A ASN 68.A N HIS 65.A O no hydrogen 3.364 N/A ALA 69.A N CYS 64.A O no hydrogen 2.994 N/A ASP 70.A N GLN 101.A O no hydrogen 2.797 N/A MET 72.A N VAL 103.A O no hydrogen 3.052 N/A VAL 74.A N VAL 105.A O no hydrogen 2.795 N/A GLY 76.A N ASP 107.A O no hydrogen 2.619 N/A SER 77.A N ASN 75.A OD1 no hydrogen 3.199 N/A ASP 78.A N ASN 75.A O no hydrogen 2.926 N/A CYS 79.A N GLY 76.A O no hydrogen 2.810 N/A LYS 80.A N ASP 78.A O no hydrogen 3.206 N/A PHE 83.A N LYS 80.A O no hydrogen 2.873 N/A VAL 84.A N LYS 80.A O no hydrogen 3.242 N/A ARG 85.A N ILE 81.A O no hydrogen 2.972 N/A ARG 85.A NH1 ASP 82.A OD1 no hydrogen 3.016 N/A GLY 86.A N ASP 82.A O no hydrogen 2.968 N/A LEU 88.A N PHE 83.A O no hydrogen 3.250 N/A THR 89.A N VAL 84.A O no hydrogen 3.140 N/A THR 89.A OG1 VAL 84.A O no hydrogen 2.751 N/A THR 89.A OG1 ARG 85.A O no hydrogen 3.242 N/A PHE 91.A N PRO 87.A O no hydrogen 3.109 N/A ALA 92.A N LEU 88.A O no hydrogen 2.759 N/A SER 93.A N THR 89.A O no hydrogen 2.966 N/A SER 93.A OG THR 89.A O no hydrogen 2.903 N/A SER 93.A OG ASN 90.A O no hydrogen 3.161 N/A ALA 94.A N ASN 90.A O no hydrogen 2.826 N/A SER 96.A OG ASP 98.A OD1 no hydrogen 3.406 N/A SER 96.A OG ARG 100.A O no hydrogen 2.985 N/A ASP 98.A N ASP 98.A OD1 no hydrogen 2.206 N/A ARG 100.A N SER 96.A OG no hydrogen 2.781 N/A ARG 100.A NE ASP 98.A OD2 no hydrogen 2.376 N/A ARG 100.A NH1 ALA 69.A O no hydrogen 3.095 N/A LYS 102.A NZ ASP 70.A OD2 no hydrogen 2.861 N/A VAL 103.A N ASP 70.A O no hydrogen 2.927 N/A ILE 104.A N SER 133.A O no hydrogen 2.966 N/A VAL 105.A N MET 72.A O no hydrogen 2.860 N/A ILE 106.A N ILE 135.A O no hydrogen 2.954 N/A ASP 107.A N VAL 74.A O no hydrogen 2.844 N/A PHE 109.A N THR 137.A O no hydrogen 3.013 N/A ALA 115.A N SER 112.A O no hydrogen 3.247 N/A SER 117.A OG CYS 79.A O no hydrogen 3.010 N/A GLN 118.A N LEU 114.A O no hydrogen 2.878 N/A GLN 118.A NE2 GLY 143.A O no hydrogen 2.770 N/A ARG 119.A N ALA 115.A O no hydrogen 2.997 N/A HIS 120.A N GLU 116.A O no hydrogen 3.138 N/A LEU 121.A N SER 117.A O no hydrogen 2.870 N/A ARG 122.A N ARG 119.A O no hydrogen 2.690 N/A ARG 122.A NE PRO 147.A O no hydrogen 2.720 N/A ARG 122.A NH1 ARG 122.A O no hydrogen 3.389 N/A SER 123.A OG HIS 120.A O no hydrogen 3.158 N/A MET 125.A N LEU 121.A O no hydrogen 2.950 N/A ALA 127.A N SER 123.A O no hydrogen 3.232 N/A TYR 128.A N PHE 124.A O no hydrogen 3.001 N/A SER 129.A OG GLU 126.A O no hydrogen 3.341 N/A ASN 131.A ND2 ALA 92.A O no hydrogen 2.263 N/A ASN 131.A ND2 SER 93.A O no hydrogen 3.495 N/A CYS 132.A N TYR 128.A O no hydrogen 3.355 N/A SER 133.A N LYS 102.A O no hydrogen 3.022 N/A SER 133.A OG ILE 42.A O no hydrogen 2.543 N/A ILE 134.A N HIS 44.A ND1 no hydrogen 3.015 N/A ILE 135.A N ILE 104.A O no hydrogen 3.023 N/A ILE 136.A N ILE 45.A O no hydrogen 2.798 N/A THR 137.A N ILE 106.A O no hydrogen 2.978 N/A ALA 138.A N LEU 47.A O no hydrogen 2.847 N/A ASN 140.A N ASP 110.A OD2 no hydrogen 2.646 N/A GLY 143.A N ASN 140.A O no hydrogen 3.196 N/A ILE 144.A N ILE 141.A O no hydrogen 2.469 N/A ILE 145.A N GLN 118.A OE1 no hydrogen 2.720 N/A LEU 148.A N ILE 145.A O no hydrogen 3.032 N/A GLN 149.A N ILE 145.A O no hydrogen 3.420 N/A GLN 149.A NE2 ILE 144.A O no hydrogen 2.920 N/A SER 150.A N LYS 146.A O no hydrogen 2.958 N/A CYS 152.A N GLN 149.A O no hydrogen 3.349 N/A CYS 152.A SG LEU 148.A O no hydrogen 3.162 N/A ARG 153.A N HIS 44.A O no hydrogen 3.146 N/A ILE 155.A N ILE 46.A O no hydrogen 2.773 N/A THR 156.A OG1 HIS 48.A NE2 no hydrogen 3.027 N/A PHE 157.A N HIS 48.A O no hydrogen 2.830 N/A THR 161.A OG1 GLU 163.A OE1 no hydrogen 3.455 N/A ASP 164.A N THR 161.A OG1 no hydrogen 3.047 N/A LYS 165.A N THR 161.A O no hydrogen 2.977 N/A ILE 166.A N ASP 162.A O no hydrogen 3.404 N/A GLU 167.A N GLU 163.A O no hydrogen 2.862 N/A MET 168.A N ASP 164.A O no hydrogen 2.532 N/A MET 169.A N LYS 165.A O no hydrogen 2.996 N/A LYS 170.A N ILE 166.A O no hydrogen 3.346 N/A GLN 171.A N GLU 167.A O no hydrogen 2.861 N/A GLN 171.A NE2 GLU 167.A OE2 no hydrogen 3.048 N/A MET 172.A N MET 168.A O no hydrogen 2.839 N/A ILE 173.A N MET 169.A O no hydrogen 2.888 N/A ARG 174.A N LYS 170.A O no hydrogen 2.904 N/A ARG 175.A N GLN 171.A O no hydrogen 2.998 N/A ARG 175.A NH2 TYR 15.A O no hydrogen 3.176 N/A ARG 175.A NH2 GLU 22.A OE2 no hydrogen 3.146 N/A LEU 176.A N MET 172.A O no hydrogen 2.902 N/A THR 177.A N ILE 173.A O no hydrogen 2.922 N/A THR 177.A OG1 ILE 173.A O no hydrogen 2.807 N/A GLU 178.A N ARG 174.A O no hydrogen 3.026 N/A ILE 179.A N ARG 175.A O no hydrogen 2.881 N/A CYS 180.A N LEU 176.A O no hydrogen 2.918 N/A CYS 180.A SG LEU 176.A O no hydrogen 3.783 N/A LYS 181.A N THR 177.A O no hydrogen 3.087 N/A HIS 182.A N GLU 178.A O no hydrogen 3.254 N/A GLU 183.A N ILE 179.A O no hydrogen 3.055 N/A GLU 183.A N CYS 180.A O no hydrogen 3.262 N/A GLY 184.A N CYS 180.A O no hydrogen 3.120 N/A GLY 184.A N LYS 181.A O no hydrogen 3.314 N/A ILE 185.A N CYS 180.A O no hydrogen 3.074 N/A ALA 186.A N GLY 218.A O no hydrogen 2.854 N/A ALA 188.A N LEU 220.A O no hydrogen 2.795 N/A ASP 189.A N LEU 220.A O no hydrogen 3.160 N/A LYS 191.A N ASP 189.A OD1 no hydrogen 3.400 N/A LYS 191.A NZ ASP 189.A OD1 no hydrogen 3.165 N/A VAL 192.A N ASP 189.A O no hydrogen 3.209 N/A VAL 193.A N MET 190.A O no hydrogen 2.979 N/A ALA 194.A N MET 190.A O no hydrogen 3.256 N/A ALA 195.A N LYS 191.A O no hydrogen 3.034 N/A LEU 196.A N VAL 192.A O no hydrogen 3.012 N/A VAL 197.A N VAL 193.A O no hydrogen 3.273 N/A LYS 198.A N ALA 194.A O no hydrogen 3.261 N/A LYS 199.A N ALA 195.A O no hydrogen 2.852 N/A LYS 199.A NZ GLU 210.A OE1 no hydrogen 3.355 N/A ASN 200.A N LEU 196.A O no hydrogen 3.505 N/A ASN 200.A ND2 GLU 210.A OE1 no hydrogen 3.455 N/A PHE 204.A N GLY 53.A O no hydrogen 2.715 N/A LYS 206.A N ASP 203.A OD1 no hydrogen 3.178 N/A THR 207.A N ASP 203.A O no hydrogen 3.319 N/A ILE 208.A N PHE 204.A O no hydrogen 3.206 N/A GLY 209.A N ARG 205.A O no hydrogen 2.862 N/A GLU 210.A N LYS 206.A O no hydrogen 2.749 N/A ASP 212.A N ILE 208.A O no hydrogen 3.417 N/A SER 213.A N GLU 210.A O no hydrogen 2.789 N/A SER 213.A OG GLY 209.A O no hydrogen 3.385 N/A SER 213.A OG GLU 210.A O no hydrogen 2.824 N/A TYR 214.A N GLU 210.A O no hydrogen 3.096 N/A TYR 214.A OH LEU 227.A O no hydrogen 3.035 N/A SER 215.A N ASP 212.A O no hydrogen 3.385 N/A SER 215.A OG ASP 212.A O no hydrogen 2.994 N/A SER 216.A OG SER 213.A O no hydrogen 3.077 N/A GLY 218.A N SER 215.A O no hydrogen 2.641 N/A LEU 220.A N ALA 186.A O no hydrogen 2.787 N/A ILE 224.A N ASP 221.A O no hydrogen 2.974 N/A ILE 224.A N ASP 221.A OD1 no hydrogen 3.179 N/A LEU 225.A N ASP 221.A O no hydrogen 3.223 N/A LEU 227.A N ILE 224.A O no hydrogen 2.961 N/A VAL 228.A N ILE 224.A O no hydrogen 2.982 N/A THR 229.A N LEU 225.A O no hydrogen 3.045 N/A THR 229.A OG1 LEU 225.A O no hydrogen 3.235 N/A VAL 238.A N ILE 235.A O no hydrogen 2.909 N/A LEU 239.A N ILE 235.A O no hydrogen 3.389 N/A GLU 240.A N ASP 236.A O no hydrogen 2.929 N/A SER 241.A N ASP 237.A O no hydrogen 3.209 N/A SER 241.A OG ASP 237.A O no hydrogen 2.815 N/A LEU 242.A N VAL 238.A O no hydrogen 2.747 N/A LYS 243.A N LEU 239.A O no hydrogen 3.185 N/A ASN 244.A N GLU 240.A O no hydrogen 3.021 N/A LYS 245.A N LEU 242.A O no hydrogen 2.794 N/A ARG 251.A N VAL 247.A O no hydrogen 2.461 N/A ALA 252.A N LYS 248.A O no hydrogen 2.970 N/A ALA 252.A N GLN 249.A O no hydrogen 2.945 N/A LEU 253.A N GLN 249.A O no hydrogen 2.952 N/A ALA 254.A N LEU 250.A O no hydrogen 3.269 N/A LYS 256.A NZ ASP 237.A OD2 no hydrogen 2.736 N/A LYS 256.A NZ TYR 257.A OH no hydrogen 3.052 N/A TYR 257.A N LEU 253.A O no hydrogen 3.438 N/A TYR 257.A OH ASP 237.A OD1 no hydrogen 2.995 N/A ALA 258.A N ALA 254.A O no hydrogen 3.098 N/A TYR 261.A OH ASN 291.A OD1 no hydrogen 2.554 N/A PHE 264.A N ASP 260.A O no hydrogen 3.473 N/A VAL 265.A N TYR 261.A O no hydrogen 2.908 N/A LYS 267.A N TRP 263.A O no hydrogen 3.054 N/A LEU 268.A N PHE 264.A O no hydrogen 2.928 N/A ALA 269.A N VAL 265.A O no hydrogen 3.125 N/A GLU 270.A N GLY 266.A O no hydrogen 3.108 N/A GLU 271.A N LYS 267.A O no hydrogen 2.624 N/A ILE 272.A N LEU 268.A O no hydrogen 2.864 N/A TYR 273.A N ALA 269.A O no hydrogen 3.102 N/A SER 274.A OG GLU 271.A O no hydrogen 2.901 N/A ARG 275.A N ILE 272.A O no hydrogen 2.839 N/A THR 277.A N GLN 317.A O no hydrogen 3.336 N/A GLN 279.A N GLN 279.A OE1 no hydrogen 2.317 N/A SER 280.A N THR 277.A O no hydrogen 2.762 N/A SER 280.A OG GLN 317.A O no hydrogen 3.142 N/A ILE 281.A N THR 277.A O no hydrogen 3.021 N/A ILE 281.A N PRO 278.A O no hydrogen 3.305 N/A ARG 283.A N GLN 279.A O no hydrogen 3.435 N/A MET 284.A N SER 280.A O no hydrogen 2.862 N/A TYR 285.A N ILE 281.A O no hydrogen 3.132 N/A GLU 286.A N ILE 282.A O no hydrogen 3.407 N/A ILE 287.A N ARG 283.A O no hydrogen 2.900 N/A VAL 288.A N MET 284.A O no hydrogen 2.923 N/A GLY 289.A N TYR 285.A O no hydrogen 2.645 N/A GLU 290.A N GLU 286.A O no hydrogen 3.156 N/A ASN 291.A N ILE 287.A O no hydrogen 3.180 N/A ASN 291.A ND2 HIS 304.A O no hydrogen 3.213 N/A ASN 292.A N VAL 288.A O no hydrogen 2.908 N/A GLN 293.A N GLY 289.A O no hydrogen 3.033 N/A TYR 294.A N GLU 290.A O no hydrogen 3.285 N/A HIS 295.A N ASN 291.A O no hydrogen 3.230 N/A HIS 295.A N ASN 292.A O no hydrogen 3.271 N/A ILE 297.A N TYR 294.A O no hydrogen 2.818 N/A ALA 298.A N TYR 294.A O no hydrogen 3.120 N/A LEU 303.A N ASN 300.A OD1 no hydrogen 3.116 N/A HIS 304.A N ASN 300.A O no hydrogen 3.151 N/A HIS 304.A NE2 ASN 291.A O no hydrogen 2.728 N/A LEU 305.A N THR 301.A O no hydrogen 3.125 N/A ALA 306.A N GLU 302.A O no hydrogen 3.090 N/A TYR 307.A N LEU 303.A O no hydrogen 2.787 N/A LEU 308.A N HIS 304.A O no hydrogen 3.298 N/A PHE 309.A N LEU 305.A O no hydrogen 3.088 N/A ILE 310.A N ALA 306.A O no hydrogen 3.035 N/A GLN 311.A N TYR 307.A O no hydrogen 3.137 N/A LEU 312.A N LEU 308.A O no hydrogen 3.072 N/A ALA 313.A N PHE 309.A O no hydrogen 2.840 N/A CYS 314.A N ILE 310.A O no hydrogen 3.435 N/A CYS 314.A SG ILE 310.A O no hydrogen 2.987 N/A GLU 315.A N GLN 311.A O no hydrogen 3.326 N/A MET 316.A N LEU 312.A O no hydrogen 2.959 N/A GLN 317.A N SER 280.A OG no hydrogen 3.099 N/A