Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pii_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 17.A OE1 no hydrogen 3.491 N/A MET 1.A N VAL 18.A O no hydrogen 3.082 N/A LYS 2.A NZ GLU 314.A OE2 no hydrogen 2.630 N/A ALA 3.A N LYS 16.A O no hydrogen 3.106 N/A ALA 4.A N TYR 120.A O no hydrogen 2.964 N/A VAL 5.A N LYS 14.A O no hydrogen 2.840 N/A VAL 6.A N LEU 57.A O no hydrogen 2.794 N/A LYS 10.A N ALA 45.A O no hydrogen 3.214 N/A LYS 14.A N VAL 5.A O no hydrogen 3.089 N/A LYS 16.A N ALA 3.A O no hydrogen 3.114 N/A VAL 18.A N MET 1.A O no hydrogen 2.506 N/A SER 24.A N GLU 27.A OE1 no hydrogen 2.765 N/A GLY 26.A N PRO 72.A O no hydrogen 3.262 N/A VAL 28.A N ALA 126.A O no hydrogen 2.868 N/A LEU 29.A N GLU 69.A O no hydrogen 3.060 N/A VAL 30.A N CYS 124.A O no hydrogen 3.001 N/A ARG 31.A N ILE 66.A O no hydrogen 2.839 N/A ARG 31.A NE GLU 68.A OE2 no hydrogen 2.783 N/A ARG 31.A NH1 GLU 337.A OE2 no hydrogen 3.174 N/A ARG 31.A NH2 GLU 68.A OE2 no hydrogen 3.421 N/A ILE 32.A N GLU 122.A O no hydrogen 2.914 N/A LYS 33.A N VAL 64.A O no hydrogen 2.997 N/A ALA 34.A N VAL 64.A O no hydrogen 3.016 N/A CYS 35.A N LEU 334.A O no hydrogen 2.966 N/A CYS 35.A SG GLY 36.A O no hydrogen 3.546 N/A GLY 36.A N GLU 62.A O no hydrogen 3.366 N/A VAL 37.A N VAL 332.A O no hydrogen 2.977 N/A CYS 38.A N ASP 41.A OD2 no hydrogen 3.027 N/A CYS 38.A SG HIS 61.A NE2 no hydrogen 3.290 N/A CYS 38.A SG GLU 62.A OE2 no hydrogen 3.545 N/A HIS 43.A N HIS 39.A O no hydrogen 3.072 N/A HIS 43.A ND1 ASP 48.A OD1 no hydrogen 2.888 N/A ALA 44.A N THR 40.A O no hydrogen 3.120 N/A ALA 44.A N ASP 41.A O no hydrogen 2.795 N/A ALA 45.A N ASP 41.A O no hydrogen 3.131 N/A HIS 46.A N LEU 42.A O no hydrogen 2.908 N/A GLY 47.A N HIS 43.A O no hydrogen 3.240 N/A LEU 57.A N VAL 6.A O no hydrogen 3.228 N/A ILE 58.A N ASP 117.A OD1 no hydrogen 3.275 N/A GLY 60.A N ASP 41.A OD1 no hydrogen 3.131 N/A VAL 64.A N ALA 34.A O no hydrogen 2.906 N/A GLY 65.A N VAL 83.A O no hydrogen 2.913 N/A ILE 66.A N ARG 31.A O no hydrogen 2.999 N/A VAL 67.A N ASP 81.A O no hydrogen 3.035 N/A GLU 68.A N LEU 29.A O no hydrogen 2.938 N/A GLU 69.A N LEU 29.A O no hydrogen 3.332 N/A GLY 71.A N GLU 27.A O no hydrogen 3.000 N/A VAL 74.A N GLY 71.A O no hydrogen 3.381 N/A HIS 76.A N HIS 76.A ND1 no hydrogen 2.890 N/A HIS 76.A NE2 ALA 128.A O no hydrogen 2.699 N/A LYS 78.A N ASP 81.A OD2 no hydrogen 2.831 N/A GLY 80.A N VAL 67.A O no hydrogen 2.620 N/A ASP 81.A N LYS 78.A O no hydrogen 2.993 N/A ARG 82.A NH1 PRO 135.A O no hydrogen 2.786 N/A ARG 82.A NH2 LEU 138.A O no hydrogen 2.418 N/A VAL 83.A N GLY 65.A O no hydrogen 3.033 N/A GLY 84.A N VAL 132.A O no hydrogen 2.916 N/A ILE 85.A N GLY 63.A O no hydrogen 2.828 N/A TYR 89.A OH ARG 125.A O no hydrogen 3.277 N/A SER 90.A N LYS 110.A O no hydrogen 3.336 N/A LEU 99.A N CYS 95.A O no hydrogen 3.191 N/A LEU 99.A N ASP 96.A O no hydrogen 2.927 N/A SER 100.A N ASP 96.A O no hydrogen 2.785 N/A SER 100.A N TYR 97.A O no hydrogen 3.065 N/A SER 100.A OG ASP 96.A O no hydrogen 3.169 N/A GLY 101.A N TYR 97.A O no hydrogen 3.243 N/A GLN 102.A N TYR 97.A O no hydrogen 2.835 N/A LEU 105.A N GLN 102.A O no hydrogen 2.846 N/A CYS 106.A N GLU 103.A O no hydrogen 3.192 N/A GLN 109.A N CYS 106.A O no hydrogen 2.988 N/A GLN 109.A NE2 THR 104.A O no hydrogen 3.132 N/A GLN 109.A NE2 CYS 106.A O no hydrogen 3.000 N/A LYS 110.A N SER 90.A O no hydrogen 2.988 N/A LYS 110.A N SER 90.A OG no hydrogen 3.401 N/A ASN 111.A N SER 115.A OG no hydrogen 2.979 N/A ASN 111.A ND2 TRP 87.A O no hydrogen 3.476 N/A ASN 111.A ND2 GLN 109.A OE1 no hydrogen 2.836 N/A ALA 112.A N TRP 87.A O no hydrogen 2.925 N/A TYR 114.A OH VAL 51.A O no hydrogen 2.402 N/A SER 115.A N ASN 111.A O no hydrogen 3.013 N/A SER 115.A OG ASN 111.A O no hydrogen 3.533 N/A VAL 116.A N ASN 111.A O no hydrogen 3.096 N/A GLY 118.A N ILE 58.A O no hydrogen 2.816 N/A GLY 119.A N GLY 60.A O no hydrogen 2.918 N/A TYR 120.A N PRO 59.A O no hydrogen 2.884 N/A GLU 122.A N LYS 2.A O no hydrogen 3.215 N/A TYR 123.A OH GLU 68.A OE1 no hydrogen 2.570 N/A CYS 124.A N VAL 30.A O no hydrogen 3.017 N/A CYS 124.A SG ASP 117.A O no hydrogen 3.560 N/A CYS 124.A SG GLY 118.A O no hydrogen 3.034 N/A CYS 124.A SG ARG 125.A O no hydrogen 3.579 N/A ARG 125.A NH1 THR 22.A O no hydrogen 2.904 N/A ALA 126.A N VAL 28.A O no hydrogen 2.776 N/A ALA 128.A N GLY 26.A O no hydrogen 2.942 N/A TYR 130.A N ALA 127.A O no hydrogen 2.682 N/A VAL 132.A N GLY 84.A O no hydrogen 3.227 N/A LYS 133.A NZ ASP 81.A OD2 no hydrogen 3.452 N/A ILE 134.A N ARG 82.A O no hydrogen 3.263 N/A SER 139.A OG GLU 142.A OE1 no hydrogen 3.286 N/A GLU 142.A N SER 139.A OG no hydrogen 3.124 N/A ALA 143.A N SER 139.A O no hydrogen 2.954 N/A ALA 144.A N PHE 140.A O no hydrogen 3.190 N/A ILE 146.A N ALA 143.A O no hydrogen 2.642 N/A PHE 147.A N ALA 143.A O no hydrogen 3.377 N/A PHE 147.A N ALA 144.A O no hydrogen 3.260 N/A CYS 148.A N PRO 145.A O no hydrogen 3.055 N/A CYS 148.A SG HIS 61.A NE2 no hydrogen 3.651 N/A GLY 150.A N PRO 145.A O no hydrogen 3.214 N/A VAL 151.A N ILE 146.A O no hydrogen 2.995 N/A THR 152.A N CYS 148.A O no hydrogen 2.907 N/A THR 152.A OG1 CYS 148.A O no hydrogen 2.808 N/A THR 153.A N ALA 149.A O no hydrogen 3.346 N/A THR 153.A N GLY 150.A O no hydrogen 3.126 N/A TYR 154.A N GLY 150.A O no hydrogen 2.776 N/A TYR 154.A OH GLU 294.A OE1 no hydrogen 2.320 N/A LYS 155.A N VAL 151.A O no hydrogen 2.708 N/A LYS 155.A NZ ASP 291.A OD2 no hydrogen 2.590 N/A ALA 156.A N THR 152.A O no hydrogen 3.013 N/A LEU 157.A N THR 153.A O no hydrogen 3.039 N/A LYS 158.A N TYR 154.A O no hydrogen 3.000 N/A LYS 158.A NZ ASP 291.A OD1 no hydrogen 2.813 N/A LYS 158.A NZ GLU 294.A OE1 no hydrogen 2.857 N/A VAL 159.A N LYS 155.A O no hydrogen 2.924 N/A THR 160.A N ALA 156.A O no hydrogen 3.061 N/A THR 160.A OG1 LEU 157.A O no hydrogen 2.961 N/A GLY 161.A N LYS 158.A O no hydrogen 2.959 N/A ALA 162.A N THR 160.A OG1 no hydrogen 2.899 N/A LYS 163.A N GLU 166.A OE1 no hydrogen 2.706 N/A GLY 165.A N GLY 188.A O no hydrogen 3.408 N/A GLU 166.A N LYS 163.A O no hydrogen 2.776 N/A TRP 167.A N HIS 232.A ND1 no hydrogen 2.991 N/A VAL 168.A N ASN 190.A O no hydrogen 2.921 N/A ALA 169.A N ALA 233.A O no hydrogen 2.868 N/A ILE 170.A N VAL 192.A O no hydrogen 2.733 N/A TYR 171.A N VAL 235.A O no hydrogen 2.881 N/A TYR 171.A OH SER 246.A OG no hydrogen 3.069 N/A TYR 171.A OH SER 250.A OG no hydrogen 3.324 N/A GLY 172.A N VAL 194.A O no hydrogen 2.944 N/A ILE 173.A N ASP 195.A OD2 no hydrogen 3.189 N/A HIS 178.A N GLY 174.A O no hydrogen 2.966 N/A HIS 178.A ND1 GLY 174.A O no hydrogen 2.833 N/A VAL 179.A N PHE 176.A O no hydrogen 3.040 N/A ALA 180.A N PHE 176.A O no hydrogen 2.911 N/A VAL 181.A N GLY 177.A O no hydrogen 3.047 N/A GLN 182.A NE2 HIS 178.A O no hydrogen 2.732 N/A GLN 182.A NE2 LYS 305.A O no hydrogen 2.972 N/A TYR 183.A N VAL 179.A O no hydrogen 3.047 N/A TYR 183.A OH ALA 295.A O no hydrogen 2.466 N/A ALA 184.A N ALA 180.A O no hydrogen 2.734 N/A LYS 185.A N VAL 181.A O no hydrogen 2.988 N/A LYS 185.A NZ LEU 189.A O no hydrogen 2.884 N/A LYS 185.A NZ ASP 210.A OD2 no hydrogen 2.762 N/A ALA 186.A N GLN 182.A O no hydrogen 2.855 N/A MET 187.A N TYR 183.A O no hydrogen 2.758 N/A MET 187.A N ALA 184.A O no hydrogen 3.199 N/A GLY 188.A N LYS 185.A O no hydrogen 3.015 N/A LEU 189.A N ALA 184.A O no hydrogen 2.963 N/A ASN 190.A N GLU 166.A O no hydrogen 2.982 N/A VAL 191.A N ASP 210.A OD2 no hydrogen 2.995 N/A VAL 192.A N VAL 168.A O no hydrogen 2.769 N/A ALA 193.A N LEU 211.A O no hydrogen 2.923 N/A VAL 194.A N ILE 170.A O no hydrogen 2.916 N/A ASP 195.A N VAL 213.A O no hydrogen 3.426 N/A GLY 197.A N ASP 195.A OD1 no hydrogen 2.702 N/A LEU 201.A N GLY 197.A O no hydrogen 3.215 N/A GLU 202.A N ASP 198.A O no hydrogen 2.900 N/A GLU 202.A N GLU 199.A O no hydrogen 3.158 N/A LEU 203.A N GLU 199.A O no hydrogen 3.096 N/A ALA 204.A N LYS 200.A O no hydrogen 2.719 N/A LYS 205.A N LEU 201.A O no hydrogen 3.369 N/A LYS 205.A NZ GLU 202.A OE2 no hydrogen 3.223 N/A GLU 206.A N GLU 202.A O no hydrogen 3.155 N/A LEU 207.A N LEU 203.A O no hydrogen 2.891 N/A GLY 208.A N LYS 205.A O no hydrogen 3.399 N/A ALA 209.A N ALA 204.A O no hydrogen 3.149 N/A LEU 211.A N VAL 191.A O no hydrogen 3.183 N/A VAL 213.A N ALA 193.A O no hydrogen 3.243 N/A ASN 214.A ND2 ILE 196.A O no hydrogen 1.977 N/A ASN 214.A ND2 ASP 198.A OD2 no hydrogen 3.287 N/A LYS 217.A NZ ASP 198.A OD1 no hydrogen 2.846 N/A LYS 217.A NZ ASP 198.A OD2 no hydrogen 3.249 N/A LYS 222.A N ASP 219.A OD1 no hydrogen 3.090 N/A PHE 223.A N ASP 219.A O no hydrogen 2.875 N/A MET 224.A N ALA 220.A O no hydrogen 2.941 N/A LYS 225.A N ALA 221.A O no hydrogen 2.875 N/A LYS 227.A NZ GLU 226.A OE1 no hydrogen 3.565 N/A GLY 230.A N MET 224.A O no hydrogen 2.974 N/A VAL 231.A N SER 250.A O no hydrogen 3.180 N/A HIS 232.A N TRP 167.A O no hydrogen 2.909 N/A ALA 234.A N ALA 256.A O no hydrogen 3.013 N/A VAL 235.A N ALA 169.A O no hydrogen 2.961 N/A VAL 236.A N VAL 258.A O no hydrogen 2.950 N/A THR 237.A N TYR 171.A O no hydrogen 2.915 N/A THR 237.A OG1 TYR 171.A O no hydrogen 2.351 N/A THR 237.A OG1 GLY 172.A O no hydrogen 2.792 N/A LYS 241.A NZ GLU 266.A O no hydrogen 3.436 N/A ALA 243.A N SER 240.A OG no hydrogen 3.304 N/A PHE 244.A N SER 240.A O no hydrogen 2.939 N/A GLN 245.A N LYS 241.A O no hydrogen 3.124 N/A SER 246.A N PRO 242.A O no hydrogen 3.034 N/A SER 246.A OG TYR 171.A OH no hydrogen 3.069 N/A ALA 247.A N ALA 243.A O no hydrogen 3.098 N/A TYR 248.A N PHE 244.A O no hydrogen 3.010 N/A TYR 248.A OH THR 274.A OG1 no hydrogen 3.212 N/A ASN 249.A N GLN 245.A O no hydrogen 3.055 N/A SER 250.A N ALA 247.A O no hydrogen 2.832 N/A SER 250.A OG TYR 171.A OH no hydrogen 3.324 N/A SER 250.A OG SER 246.A O no hydrogen 3.263 N/A SER 250.A OG ALA 247.A O no hydrogen 2.527 N/A ILE 251.A N ALA 247.A O no hydrogen 3.140 N/A ARG 252.A N VAL 231.A O no hydrogen 2.670 N/A ARG 252.A NE GLY 230.A O no hydrogen 2.678 N/A ARG 252.A NH2 GLY 230.A O no hydrogen 3.270 N/A ARG 253.A NE ASN 277.A OD1 no hydrogen 2.805 N/A GLY 254.A N ASN 277.A O no hydrogen 3.020 N/A GLY 255.A N ARG 252.A O no hydrogen 2.948 N/A ALA 256.A N HIS 232.A O no hydrogen 3.224 N/A CYS 257.A N LYS 280.A O no hydrogen 2.729 N/A VAL 258.A N ALA 234.A O no hydrogen 2.924 N/A LEU 259.A N ILE 282.A O no hydrogen 2.856 N/A VAL 260.A N VAL 236.A O no hydrogen 3.094 N/A THR 274.A OG1 TYR 248.A OH no hydrogen 3.212 N/A THR 274.A OG1 PRO 270.A O no hydrogen 2.235 N/A VAL 275.A N ILE 271.A O no hydrogen 2.905 N/A LEU 276.A N PHE 272.A O no hydrogen 3.003 N/A ASN 277.A N ASP 273.A O no hydrogen 2.900 N/A GLY 278.A N VAL 275.A O no hydrogen 3.195 N/A ILE 279.A N THR 274.A O no hydrogen 3.046 N/A LYS 280.A N GLY 255.A O no hydrogen 3.031 N/A LYS 280.A NZ GLY 254.A O no hydrogen 3.066 N/A LYS 280.A NZ GLY 278.A O no hydrogen 3.452 N/A ILE 282.A N CYS 257.A O no hydrogen 3.035 N/A SER 284.A N LEU 259.A O no hydrogen 3.103 N/A VAL 286.A N THR 152.A OG1 no hydrogen 3.034 N/A THR 288.A N ASP 291.A OD2 no hydrogen 2.903 N/A ARG 289.A N GLU 103.A OE2 no hydrogen 2.918 N/A ARG 289.A NE GLU 103.A OE2 no hydrogen 3.153 N/A ARG 289.A NH1 ASP 129.A O no hydrogen 3.146 N/A ARG 289.A NH2 GLU 103.A OE1 no hydrogen 2.877 N/A LYS 290.A NZ GLU 294.A OE2 no hydrogen 3.489 N/A LEU 292.A N THR 288.A O no hydrogen 2.859 N/A GLN 293.A N ARG 289.A O no hydrogen 2.764 N/A GLU 294.A N LYS 290.A O no hydrogen 3.114 N/A ALA 295.A N ASP 291.A O no hydrogen 2.972 N/A LEU 296.A N LEU 292.A O no hydrogen 2.856 N/A GLN 297.A N GLN 293.A O no hydrogen 3.083 N/A GLN 297.A NE2 GLU 301.A OE2 no hydrogen 3.192 N/A PHE 298.A N GLU 294.A O no hydrogen 3.243 N/A ALA 300.A N LEU 296.A O no hydrogen 2.895 N/A GLU 301.A N GLN 297.A O no hydrogen 3.032 N/A GLU 301.A N PHE 298.A O no hydrogen 3.099 N/A GLY 302.A N ALA 299.A O no hydrogen 2.647 N/A LYS 303.A N PHE 298.A O no hydrogen 3.005 N/A LYS 303.A NZ GLU 301.A OE1 no hydrogen 3.405 N/A LYS 305.A N GLN 182.A OE1 no hydrogen 2.740 N/A ILE 307.A N HIS 178.A NE2 no hydrogen 3.020 N/A GLU 309.A N ARG 331.A O no hydrogen 2.964 N/A GLN 311.A N VAL 333.A O no hydrogen 2.985 N/A GLN 311.A NE2 VAL 310.A O no hydrogen 3.149 N/A LYS 315.A N PRO 312.A O no hydrogen 2.966 N/A ILE 316.A N LEU 313.A O no hydrogen 3.265 N/A ASN 317.A ND2 LEU 13.A O no hydrogen 2.996 N/A VAL 319.A N LYS 315.A O no hydrogen 2.944 N/A PHE 320.A N ILE 316.A O no hydrogen 3.129 N/A ASP 321.A N ASN 317.A O no hydrogen 3.171 N/A ARG 322.A N GLU 318.A O no hydrogen 3.207 N/A ARG 322.A NH1 GLU 309.A OE2 no hydrogen 2.822 N/A ARG 322.A NH2 GLU 309.A OE1 no hydrogen 2.676 N/A ARG 322.A NH2 GLU 309.A OE2 no hydrogen 3.139 N/A MET 323.A N VAL 319.A O no hydrogen 2.859 N/A LEU 324.A N PHE 320.A O no hydrogen 2.891 N/A LYS 325.A N ASP 321.A O no hydrogen 3.294 N/A GLN 327.A N ARG 322.A O no hydrogen 2.989 N/A ARG 331.A N ILE 307.A O no hydrogen 3.001 N/A ARG 331.A NH1 GLU 62.A OE1 no hydrogen 3.112 N/A ARG 331.A NH2 GLU 62.A OE2 no hydrogen 2.537 N/A VAL 333.A N GLU 309.A O no hydrogen 3.215 N/A LEU 334.A N CYS 35.A O no hydrogen 2.911 N/A THR 335.A N GLN 311.A O no hydrogen 2.803 N/A THR 335.A OG1 GLU 337.A O no hydrogen 3.392 N/A LEU 336.A N LYS 33.A O no hydrogen 2.941 N/A