Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2pmi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A N GLU 19.A O no hydrogen 3.166 N/A TYR 4.A N LEU 17.A O no hydrogen 2.666 N/A GLY 6.A N VAL 15.A O no hydrogen 3.191 N/A ASN 8.A N VAL 13.A O no hydrogen 2.897 N/A THR 11.A N ASN 8.A OD1 no hydrogen 2.668 N/A VAL 15.A N GLY 6.A O no hydrogen 2.629 N/A ALA 16.A N PHE 64.A O no hydrogen 2.833 N/A LEU 17.A N TYR 4.A O no hydrogen 2.555 N/A LYS 18.A N LEU 62.A O no hydrogen 3.183 N/A LYS 18.A NZ GLU 35.A OE1 no hydrogen 3.448 N/A LYS 18.A NZ GLU 35.A OE2 no hydrogen 3.425 N/A GLU 19.A N THR 2.A O no hydrogen 2.551 N/A VAL 20.A N LEU 60.A O no hydrogen 2.595 N/A LEU 22.A N ASN 58.A O no hydrogen 2.536 N/A GLY 27.A N SER 24.A O no hydrogen 2.551 N/A ILE 33.A N PRO 29.A O no hydrogen 3.032 N/A ARG 34.A N SER 30.A O no hydrogen 2.744 N/A GLU 35.A N THR 31.A O no hydrogen 2.784 N/A ILE 36.A N ALA 32.A O no hydrogen 2.794 N/A SER 37.A N ILE 33.A O no hydrogen 2.969 N/A LEU 38.A N ARG 34.A O no hydrogen 3.073 N/A MET 39.A N GLU 35.A O no hydrogen 2.951 N/A LYS 40.A N ILE 36.A O no hydrogen 3.379 N/A GLU 41.A N LEU 38.A O no hydrogen 2.737 N/A LEU 42.A N MET 39.A O no hydrogen 2.969 N/A ASN 46.A N HIS 44.A ND1 no hydrogen 2.808 N/A ASN 46.A ND2 LEU 129.A O no hydrogen 2.792 N/A VAL 48.A N LEU 131.A O no hydrogen 3.200 N/A ARG 49.A N GLU 65.A OE1 no hydrogen 2.662 N/A TYR 51.A N VAL 63.A O no hydrogen 2.702 N/A ILE 54.A N THR 61.A O no hydrogen 2.781 N/A HIS 55.A N HIS 55.A ND1 no hydrogen 2.856 N/A LYS 59.A N THR 56.A O no hydrogen 2.810 N/A LEU 60.A N VAL 20.A O no hydrogen 2.719 N/A THR 61.A N ILE 54.A O no hydrogen 3.222 N/A LEU 62.A N LYS 18.A O no hydrogen 2.920 N/A VAL 63.A N ASP 52.A O no hydrogen 2.816 N/A PHE 64.A N ALA 16.A O no hydrogen 3.011 N/A GLU 65.A N ARG 49.A O no hydrogen 2.985 N/A LEU 71.A N LEU 121.A O no hydrogen 3.017 N/A LYS 73.A N ASP 70.A OD1 no hydrogen 2.621 N/A TYR 74.A N ASP 70.A O no hydrogen 2.453 N/A MET 75.A N LEU 71.A O no hydrogen 3.260 N/A ASP 76.A N LYS 72.A O no hydrogen 3.158 N/A SER 77.A N LYS 73.A O no hydrogen 3.087 N/A SER 77.A OG LYS 73.A O no hydrogen 2.558 N/A SER 77.A OG TYR 74.A O no hydrogen 3.287 N/A ARG 78.A N TYR 74.A O no hydrogen 3.448 N/A ARG 78.A NE GLY 86.A O no hydrogen 3.075 N/A THR 79.A N MET 75.A O no hydrogen 2.985 N/A THR 79.A OG1 THR 83.A O no hydrogen 2.479 N/A ASN 82.A ND2 ARG 78.A O no hydrogen 3.325 N/A THR 83.A OG1 ASN 82.A O no hydrogen 2.475 N/A LEU 87.A N MET 184.A O no hydrogen 2.862 N/A LEU 89.A N GLU 246.A OE2 no hydrogen 3.172 N/A ASN 90.A N GLU 88.A OE1 no hydrogen 2.831 N/A VAL 92.A N GLU 88.A O no hydrogen 2.932 N/A LYS 93.A N LEU 89.A O no hydrogen 2.943 N/A LYS 93.A NZ TRP 278.A O no hydrogen 2.951 N/A LYS 93.A NZ GLU 281.A OE2 no hydrogen 2.946 N/A TYR 94.A N ASN 90.A O no hydrogen 3.131 N/A PHE 95.A N LEU 91.A O no hydrogen 3.238 N/A GLN 96.A N VAL 92.A O no hydrogen 3.277 N/A GLN 96.A NE2 CYS 177.A O no hydrogen 3.142 N/A TRP 97.A N LYS 93.A O no hydrogen 3.013 N/A GLN 98.A N TYR 94.A O no hydrogen 3.082 N/A GLN 98.A NE2 LEU 129.A O no hydrogen 3.093 N/A LEU 99.A N PHE 95.A O no hydrogen 2.987 N/A LEU 100.A N GLN 96.A O no hydrogen 3.139 N/A GLN 101.A N TRP 97.A O no hydrogen 3.157 N/A GLY 102.A N GLN 98.A O no hydrogen 2.924 N/A LEU 103.A N LEU 99.A O no hydrogen 3.102 N/A ALA 104.A N LEU 100.A O no hydrogen 2.614 N/A PHE 105.A N GLN 101.A O no hydrogen 3.126 N/A CYS 106.A N GLY 102.A O no hydrogen 3.072 N/A CYS 106.A SG GLY 102.A O no hydrogen 3.587 N/A HIS 107.A N LEU 103.A O no hydrogen 2.896 N/A HIS 107.A NE2 ASP 173.A OD2 no hydrogen 2.895 N/A GLU 108.A N ALA 104.A O no hydrogen 3.178 N/A ASN 109.A N PHE 105.A O no hydrogen 3.271 N/A ASN 109.A N CYS 106.A O no hydrogen 2.982 N/A LYS 110.A N HIS 107.A O no hydrogen 2.822 N/A ILE 111.A N CYS 106.A O no hydrogen 3.018 N/A LEU 112.A N ARG 138.A O no hydrogen 3.102 N/A HIS 113.A N ASP 173.A OD2 no hydrogen 2.768 N/A HIS 113.A NE2 GLY 132.A O no hydrogen 2.554 N/A ARG 114.A N ASP 173.A OD1 no hydrogen 2.809 N/A ARG 114.A NH1 LEU 136.A O no hydrogen 3.202 N/A ASP 115.A N HIS 113.A ND1 no hydrogen 3.086 N/A ASN 120.A N LYS 117.A O no hydrogen 2.681 N/A ASN 120.A ND2 GLY 132.A O no hydrogen 3.444 N/A LEU 121.A N PRO 118.A O no hydrogen 3.279 N/A ILE 123.A N ASN 69.A O no hydrogen 2.846 N/A ASN 124.A N GLN 128.A O no hydrogen 3.177 N/A ASN 124.A ND2 GLN 128.A OE1 no hydrogen 2.857 N/A LYS 125.A N ASP 68.A OD2 no hydrogen 2.565 N/A GLY 127.A N ASN 124.A O no hydrogen 2.709 N/A GLN 128.A N ASN 124.A OD1 no hydrogen 2.736 N/A LYS 130.A N LEU 122.A O no hydrogen 2.873 N/A LYS 130.A NZ GLU 65.A OE1 no hydrogen 3.201 N/A LYS 130.A NZ GLU 65.A OE2 no hydrogen 2.556 N/A LEU 131.A N ASN 46.A O no hydrogen 3.402 N/A GLY 132.A N ASN 120.A O no hydrogen 2.989 N/A ALA 137.A N PHE 134.A O no hydrogen 3.238 N/A ARG 138.A N LEU 112.A O no hydrogen 3.208 N/A ARG 138.A NH2 ILE 142.A O no hydrogen 3.522 N/A ILE 142.A N ALA 139.A O no hydrogen 3.053 N/A VAL 144.A N ILE 142.A O no hydrogen 2.709 N/A THR 146.A OG1 ARG 166.A O no hydrogen 3.564 N/A TRP 155.A NE1 GLY 193.A O no hydrogen 2.890 N/A TYR 156.A OH GLU 183.A OE1 no hydrogen 2.607 N/A ARG 157.A N LEU 154.A O no hydrogen 3.243 N/A ARG 157.A NH1 ARG 114.A O no hydrogen 3.257 N/A ARG 157.A NH2 SER 149.A O no hydrogen 2.906 N/A LEU 162.A N ALA 158.A O no hydrogen 3.043 N/A MET 163.A N ASP 160.A O no hydrogen 2.977 N/A GLY 164.A N VAL 161.A O no hydrogen 3.213 N/A SER 165.A N ASP 160.A O no hydrogen 3.175 N/A ARG 166.A NH1 THR 146.A O no hydrogen 3.054 N/A ILE 172.A N SER 169.A O no hydrogen 3.339 N/A ASP 173.A N THR 170.A O no hydrogen 3.080 N/A TRP 175.A N SER 171.A O no hydrogen 3.484 N/A SER 176.A OG TYR 156.A O no hydrogen 3.145 N/A CYS 177.A N ASP 173.A O no hydrogen 3.212 N/A CYS 177.A SG ASP 173.A O no hydrogen 3.277 N/A GLY 178.A N ILE 174.A O no hydrogen 3.026 N/A CYS 179.A N TRP 175.A O no hydrogen 3.016 N/A CYS 179.A SG TRP 155.A O no hydrogen 3.835 N/A CYS 179.A SG TRP 175.A O no hydrogen 3.659 N/A ILE 180.A N SER 176.A O no hydrogen 2.666 N/A LEU 181.A N CYS 177.A O no hydrogen 2.942 N/A ALA 182.A N GLY 178.A O no hydrogen 3.074 N/A GLU 183.A N CYS 179.A O no hydrogen 2.968 N/A MET 184.A N ILE 180.A O no hydrogen 2.982 N/A ILE 185.A N LEU 181.A O no hydrogen 3.000 N/A THR 186.A N ALA 182.A O no hydrogen 2.955 N/A THR 186.A OG1 ALA 182.A O no hydrogen 3.180 N/A GLY 187.A N GLU 183.A O no hydrogen 2.621 N/A LYS 188.A N THR 186.A OG1 no hydrogen 3.359 N/A GLY 193.A N PHE 191.A O no hydrogen 2.725 N/A THR 194.A OG1 GLU 198.A OE1 no hydrogen 3.261 N/A GLU 198.A N ASN 195.A OD1 no hydrogen 2.653 N/A GLN 199.A N ASN 195.A O no hydrogen 2.873 N/A GLN 199.A NE2 PHE 191.A O no hydrogen 2.593 N/A LEU 200.A N ASP 196.A O no hydrogen 3.347 N/A LYS 201.A N GLU 197.A O no hydrogen 3.284 N/A LYS 201.A NZ ASP 205.A OD1 no hydrogen 3.124 N/A LYS 201.A NZ ASP 205.A OD2 no hydrogen 3.313 N/A LEU 202.A N GLU 198.A O no hydrogen 3.056 N/A ILE 203.A N GLN 199.A O no hydrogen 2.889 N/A PHE 204.A N LEU 200.A O no hydrogen 2.931 N/A ASP 205.A N LYS 201.A O no hydrogen 2.662 N/A MET 207.A N ILE 203.A O no hydrogen 2.978 N/A GLY 208.A N PHE 204.A O no hydrogen 2.617 N/A THR 209.A N ARG 231.A O no hydrogen 3.268 N/A SER 213.A N ASN 211.A OD1 no hydrogen 2.780 N/A LEU 214.A N ASN 211.A O no hydrogen 2.664 N/A LEU 214.A N ASN 211.A OD1 no hydrogen 2.769 N/A TRP 215.A N ASN 211.A O no hydrogen 2.813 N/A VAL 218.A N TRP 215.A O no hydrogen 3.133 N/A THR 219.A N PRO 216.A O no hydrogen 3.318 N/A THR 219.A OG1 PRO 216.A O no hydrogen 3.087 N/A LYS 220.A N SER 217.A O no hydrogen 2.828 N/A LYS 220.A NZ SER 217.A OG no hydrogen 2.875 N/A LEU 221.A N VAL 218.A O no hydrogen 3.010 N/A LYS 223.A N MET 163.A O no hydrogen 2.904 N/A TYR 224.A N LEU 221.A O no hydrogen 2.987 N/A ASN 227.A ND2 ASN 225.A OD1 no hydrogen 3.120 N/A ASN 227.A ND2 ASN 227.A O no hydrogen 2.849 N/A ARG 231.A N THR 209.A OG1 no hydrogen 3.417 N/A ARG 231.A NE GLN 229.A O no hydrogen 3.072 N/A ARG 231.A NH1 ASP 205.A OD1 no hydrogen 2.862 N/A ARG 231.A NH2 GLN 229.A O no hydrogen 3.415 N/A ARG 234.A N ILE 206.A O no hydrogen 3.011 N/A GLN 238.A N ASP 235.A OD1 no hydrogen 3.319 N/A VAL 239.A N LEU 236.A O no hydrogen 2.769 N/A LEU 240.A N LEU 236.A O no hydrogen 3.014 N/A HIS 243.A N LEU 240.A O no hydrogen 2.508 N/A HIS 243.A ND1 HIS 243.A O no hydrogen 2.576 N/A THR 244.A N GLN 241.A O no hydrogen 2.789 N/A LEU 252.A N ASP 249.A OD2 no hydrogen 3.342 N/A ASP 254.A N GLY 250.A O no hydrogen 2.990 N/A PHE 255.A N ASN 251.A O no hydrogen 2.686 N/A LEU 256.A N LEU 252.A O no hydrogen 2.662 N/A HIS 257.A N MET 253.A O no hydrogen 2.751 N/A GLY 258.A N ASP 254.A O no hydrogen 2.924 N/A LEU 259.A N PHE 255.A O no hydrogen 3.181 N/A LEU 260.A N LEU 256.A O no hydrogen 3.155 N/A ASN 263.A ND2 LEU 214.A O no hydrogen 2.720 N/A MET 266.A N ASN 263.A O no hydrogen 2.700 N/A ARG 267.A N PRO 264.A O no hydrogen 2.560 N/A ARG 267.A NH2 ASP 160.A OD1 no hydrogen 3.000 N/A LEU 268.A N GLY 258.A O no hydrogen 2.944 N/A GLN 272.A N SER 269.A OG no hydrogen 2.995 N/A ALA 273.A N SER 269.A O no hydrogen 2.582 N/A LEU 274.A N ALA 270.A O no hydrogen 2.909 N/A HIS 275.A N GLN 272.A O no hydrogen 2.836 N/A HIS 276.A N ALA 273.A O no hydrogen 2.930 N/A HIS 276.A NE2 ASP 254.A OD1 no hydrogen 3.089 N/A TRP 278.A N HIS 276.A ND1 no hydrogen 2.929 N/A PHE 279.A N HIS 276.A O no hydrogen 2.943 N/A ALA 280.A N PRO 277.A O no hydrogen 2.999 N/A TYR 282.A N PHE 279.A O no hydrogen 2.966 N/A TYR 283.A N ALA 280.A O no hydrogen 2.710 N/A TYR 283.A OH LEU 274.A O no hydrogen 2.893 N/A