Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3i5v_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 1.A N TYR 182.A OH no hydrogen 3.243 N/A LEU 2.A N TYR 182.A OH no hydrogen 3.416 N/A LYS 3.A N ASP 39.A OD2 no hydrogen 3.441 N/A LYS 3.A NZ ASN 37.A O no hydrogen 3.217 N/A LEU 4.A N ALA 282.A O no hydrogen 3.079 N/A VAL 5.A N VAL 40.A O no hydrogen 3.116 N/A SER 6.A N ILE 280.A O no hydrogen 3.042 N/A HIS 7.A N ILE 42.A O no hydrogen 2.998 N/A HIS 7.A ND1 TYR 34.A OH no hydrogen 2.723 N/A HIS 7.A NE2 HIS 277.A O no hydrogen 2.791 N/A ASN 8.A ND2 GLU 45.A OE2 no hydrogen 3.102 N/A ASN 8.A ND2 ASP 186.A OD2 no hydrogen 3.275 N/A VAL 9.A N ASN 44.A O no hydrogen 2.883 N/A TYR 10.A N ASN 8.A OD1 no hydrogen 3.177 N/A MET 11.A N GLU 45.A O no hydrogen 2.729 N/A THR 14.A N ASP 48.A OD2 no hydrogen 3.391 N/A THR 14.A OG1 ASP 48.A OD2 no hydrogen 2.812 N/A VAL 15.A N SER 13.A OG no hydrogen 3.273 N/A TYR 17.A N SER 13.A O no hydrogen 2.725 N/A ARG 25.A N GLY 21.A O no hydrogen 2.928 N/A ARG 25.A NE TRP 20.A O no hydrogen 2.966 N/A ARG 25.A NH1 VAL 9.A O no hydrogen 2.764 N/A ARG 25.A NH1 TYR 10.A O no hydrogen 3.181 N/A ARG 25.A NH1 PHE 274.A O no hydrogen 3.486 N/A ARG 25.A NH2 TYR 10.A O no hydrogen 2.948 N/A ARG 25.A NH2 TRP 20.A O no hydrogen 2.858 N/A ALA 26.A N GLN 22.A O no hydrogen 3.061 N/A ASP 27.A N TYR 23.A O no hydrogen 3.335 N/A ASP 27.A N LYS 24.A O no hydrogen 2.949 N/A LEU 28.A N LYS 24.A O no hydrogen 3.026 N/A ILE 29.A N ARG 25.A O no hydrogen 2.757 N/A GLY 30.A N ALA 26.A O no hydrogen 3.116 N/A GLN 31.A N ASP 27.A O no hydrogen 2.884 N/A SER 32.A N ILE 29.A O no hydrogen 3.250 N/A SER 32.A OG ILE 29.A O no hydrogen 2.741 N/A SER 33.A N GLU 259.A OE1 no hydrogen 2.989 N/A SER 33.A N GLU 259.A OE2 no hydrogen 3.328 N/A TYR 34.A OH HIS 7.A ND1 no hydrogen 2.723 N/A LYS 36.A NZ SER 32.A O no hydrogen 3.205 N/A ASN 37.A N GLU 62.A OE2 no hydrogen 3.041 N/A ASN 38.A N TYR 63.A OH no hydrogen 2.851 N/A ASP 39.A N LYS 3.A O no hydrogen 2.782 N/A VAL 40.A N LYS 3.A O no hydrogen 3.441 N/A VAL 41.A N VAL 97.A O no hydrogen 2.927 N/A ILE 42.A N VAL 5.A O no hydrogen 2.741 N/A PHE 43.A N ALA 95.A O no hydrogen 2.945 N/A ASN 44.A N HIS 7.A O no hydrogen 2.842 N/A ASN 44.A ND2 THR 141.A O no hydrogen 3.481 N/A ALA 46.A N GLY 93.A O no hydrogen 3.120 N/A ASP 48.A N MET 11.A O no hydrogen 2.804 N/A ALA 51.A N ASP 48.A OD1 no hydrogen 2.893 N/A SER 52.A N ASP 48.A O no hydrogen 3.074 N/A SER 52.A OG ASP 48.A O no hydrogen 2.769 N/A SER 52.A OG ASN 49.A O no hydrogen 3.021 N/A ASP 53.A N ASN 49.A O no hydrogen 3.084 N/A LYS 54.A N GLY 50.A O no hydrogen 3.156 N/A LEU 55.A N ALA 51.A O no hydrogen 2.839 N/A LEU 56.A N SER 52.A O no hydrogen 2.975 N/A SER 57.A N ASP 53.A O no hydrogen 3.098 N/A SER 57.A OG ASP 53.A O no hydrogen 2.916 N/A SER 57.A OG LYS 54.A O no hydrogen 3.326 N/A ASN 58.A N LYS 54.A O no hydrogen 2.771 N/A ASN 58.A N LEU 55.A O no hydrogen 3.193 N/A ASN 58.A ND2 ASP 27.A OD1 no hydrogen 3.523 N/A ASN 58.A ND2 GLN 31.A OE1 no hydrogen 3.543 N/A VAL 59.A N LEU 56.A O no hydrogen 3.324 N/A TYR 63.A N VAL 59.A O no hydrogen 2.884 N/A TYR 63.A OH ILE 35.A O no hydrogen 2.604 N/A TYR 65.A N SER 98.A O no hydrogen 3.150 N/A GLN 66.A NE2 LEU 56.A O no hydrogen 2.920 N/A GLN 66.A NE2 TYR 63.A O no hydrogen 2.879 N/A THR 67.A N ILE 96.A O no hydrogen 3.036 N/A THR 67.A OG1 PRO 68.A O no hydrogen 2.882 N/A THR 67.A OG1 ILE 96.A O no hydrogen 3.565 N/A LEU 70.A N VAL 94.A O no hydrogen 2.701 N/A GLY 71.A N GLN 107.A OE1 no hydrogen 3.086 N/A ARG 72.A N VAL 69.A O no hydrogen 2.968 N/A ARG 72.A NE ASP 91.A OD2 no hydrogen 2.677 N/A ARG 72.A NH2 SER 52.A OG no hydrogen 2.953 N/A ARG 72.A NH2 ASP 91.A OD2 no hydrogen 3.534 N/A SER 73.A OG SER 75.A O no hydrogen 3.062 N/A ASP 78.A N LYS 105.A O no hydrogen 2.967 N/A GLU 81.A N GLN 107.A O no hydrogen 2.773 N/A SER 83.A N VAL 109.A O no hydrogen 3.226 N/A ALA 89.A N ASP 119.A OD1 no hydrogen 3.265 N/A GLU 90.A N ASP 119.A O no hydrogen 3.358 N/A GLY 92.A N LEU 70.A O no hydrogen 2.712 N/A ALA 95.A N PHE 43.A O no hydrogen 3.480 N/A ILE 96.A N THR 67.A OG1 no hydrogen 3.226 N/A VAL 97.A N VAL 41.A O no hydrogen 2.935 N/A SER 98.A OG TYR 100.A O no hydrogen 2.753 N/A LYS 99.A N ASP 39.A O no hydrogen 2.926 N/A TYR 100.A N SER 98.A OG no hydrogen 2.863 N/A LYS 103.A N LYS 128.A O no hydrogen 2.957 N/A LYS 105.A NZ GLN 66.A O no hydrogen 3.171 N/A GLN 107.A N LYS 79.A O no hydrogen 3.209 N/A GLN 107.A NE2 SER 73.A O no hydrogen 3.033 N/A GLN 107.A NE2 THR 80.A OG1 no hydrogen 3.030 N/A HIS 108.A N PHE 124.A O no hydrogen 2.974 N/A HIS 108.A NE2 GLU 165.A OE1 no hydrogen 2.963 N/A VAL 109.A N GLU 81.A O no hydrogen 3.343 N/A PHE 110.A N LYS 122.A O no hydrogen 2.997 N/A LYS 111.A N GLU 165.A OE2 no hydrogen 3.321 N/A LYS 111.A NZ HIS 108.A NE2 no hydrogen 3.090 N/A LYS 111.A NZ GLU 165.A OE1 no hydrogen 3.340 N/A CYS 114.A N GLN 144.A OE1 no hydrogen 3.113 N/A PHE 116.A N ASP 147.A OD2 no hydrogen 3.227 N/A ASN 118.A N GLY 115.A O no hydrogen 3.208 N/A ASP 119.A N PHE 116.A O no hydrogen 2.901 N/A SER 120.A OG PHE 116.A O no hydrogen 3.497 N/A ASN 121.A N ASP 91.A O no hydrogen 2.976 N/A LYS 122.A NZ ASP 117.A OD2 no hydrogen 2.902 N/A LYS 122.A NZ THR 143.A O no hydrogen 2.956 N/A PHE 124.A N HIS 108.A O no hydrogen 2.767 N/A VAL 125.A N GLY 140.A O no hydrogen 2.781 N/A TYR 126.A N ILE 106.A O no hydrogen 2.970 N/A TYR 126.A OH HIS 137.A ND1 no hydrogen 2.662 N/A LYS 128.A N GLU 104.A O no hydrogen 3.090 N/A GLU 130.A N PRO 101.A O no hydrogen 2.895 N/A LYS 131.A N LYS 134.A O no hydrogen 2.935 N/A LYS 131.A NZ ASP 1.A O no hydrogen 3.184 N/A LYS 134.A N LYS 131.A O no hydrogen 3.087 N/A VAL 136.A N ILE 129.A O no hydrogen 2.956 N/A HIS 137.A N THR 180.A O no hydrogen 3.123 N/A HIS 137.A ND1 TYR 126.A OH no hydrogen 2.662 N/A HIS 137.A NE2 GLU 179.A OE2 no hydrogen 2.926 N/A VAL 138.A N THR 127.A O no hydrogen 2.937 N/A ILE 139.A N TYR 182.A O no hydrogen 2.948 N/A GLY 140.A N VAL 125.A O no hydrogen 3.107 N/A THR 141.A N GLY 184.A O no hydrogen 2.985 N/A THR 141.A OG1 GLY 123.A O no hydrogen 3.459 N/A HIS 142.A N THR 141.A OG1 no hydrogen 2.724 N/A THR 143.A N ASP 186.A O no hydrogen 3.161 N/A THR 143.A OG1 LEU 187.A O no hydrogen 2.764 N/A GLN 144.A N GLN 162.A OE1 no hydrogen 2.842 N/A GLN 144.A NE2 CYS 114.A O no hydrogen 2.826 N/A GLN 144.A NE2 SER 145.A O no hydrogen 3.504 N/A SER 145.A N ASP 117.A OD2 no hydrogen 3.228 N/A SER 145.A OG ASP 117.A OD2 no hydrogen 3.473 N/A ARG 149.A N ASP 147.A OD1 no hydrogen 2.796 N/A CYS 150.A SG ASP 147.A O no hydrogen 3.962 N/A ALA 152.A N HIS 154.A ND1 no hydrogen 3.416 N/A ARG 156.A N GLY 153.A O no hydrogen 3.037 N/A ARG 156.A NH2 ASP 198.A OD2 no hydrogen 3.121 N/A LYS 157.A N GLY 153.A O no hydrogen 3.254 N/A ILE 158.A N HIS 154.A O no hydrogen 2.781 N/A ARG 159.A N ASP 155.A O no hydrogen 3.026 N/A ARG 159.A NE GLU 195.A OE1 no hydrogen 2.935 N/A ARG 159.A NH1 GLN 144.A O no hydrogen 2.756 N/A ARG 159.A NH2 ASP 155.A OD1 no hydrogen 3.430 N/A ARG 159.A NH2 GLU 195.A OE1 no hydrogen 3.331 N/A ARG 159.A NH2 GLU 195.A OE2 no hydrogen 3.409 N/A ALA 160.A N ARG 156.A O no hydrogen 3.155 N/A GLU 161.A N LYS 157.A O no hydrogen 3.214 N/A GLN 162.A N ILE 158.A O no hydrogen 2.852 N/A GLN 162.A NE2 SER 112.A O no hydrogen 3.144 N/A MET 163.A N ARG 159.A O no hydrogen 2.907 N/A LYS 164.A N ALA 160.A O no hydrogen 3.011 N/A GLU 165.A N GLU 161.A O no hydrogen 2.900 N/A ILE 166.A N GLN 162.A O no hydrogen 3.160 N/A SER 167.A N MET 163.A O no hydrogen 3.143 N/A SER 167.A OG MET 163.A O no hydrogen 3.261 N/A SER 167.A OG LYS 164.A O no hydrogen 2.912 N/A SER 167.A OG ASN 202.A O no hydrogen 2.795 N/A ASP 168.A N LYS 164.A O no hydrogen 2.891 N/A PHE 169.A N GLU 165.A O no hydrogen 2.978 N/A VAL 170.A N ILE 166.A O no hydrogen 3.095 N/A LYS 171.A N SER 167.A O no hydrogen 3.244 N/A LYS 172.A N ASP 168.A O no hydrogen 3.126 N/A LYS 172.A NZ GLU 81.A OE2 no hydrogen 3.402 N/A LYS 173.A N VAL 170.A O no hydrogen 3.332 N/A ASN 174.A N LYS 171.A O no hydrogen 3.483 N/A GLU 179.A N PRO 176.A O no hydrogen 3.331 N/A THR 180.A OG1 LYS 247.A O no hydrogen 3.175 N/A TYR 182.A N HIS 137.A O no hydrogen 2.865 N/A ILE 183.A N PHE 241.A O no hydrogen 2.964 N/A GLY 184.A N ILE 139.A O no hydrogen 2.956 N/A GLY 185.A N TYR 239.A O no hydrogen 2.896 N/A LEU 187.A N LEU 237.A O no hydrogen 3.126 N/A ASN 188.A N ASP 186.A OD1 no hydrogen 3.047 N/A ASN 188.A ND2 THR 143.A O no hydrogen 2.744 N/A LYS 191.A N HIS 236.A O no hydrogen 3.186 N/A THR 193.A OG1 ASN 190.A O no hydrogen 2.973 N/A PHE 196.A N THR 193.A OG1 no hydrogen 3.315 N/A LYS 197.A N THR 193.A O no hydrogen 3.121 N/A ASP 198.A N PRO 194.A O no hydrogen 3.363 N/A MET 199.A N GLU 195.A O no hydrogen 2.806 N/A LEU 200.A N PHE 196.A O no hydrogen 3.212 N/A ASN 202.A N ASP 198.A O no hydrogen 2.858 N/A LEU 203.A N MET 199.A O no hydrogen 2.825 N/A ASN 204.A N LYS 201.A O no hydrogen 3.319 N/A VAL 205.A N LEU 200.A O no hydrogen 2.711 N/A ASN 206.A ND2 GLN 248.A OE1 no hydrogen 2.918 N/A TYR 210.A OH ASP 207.A OD2 no hydrogen 2.659 N/A ALA 211.A N ASN 254.A O no hydrogen 2.816 N/A HIS 213.A ND1 SER 215.A O no hydrogen 3.333 N/A SER 215.A OG TRP 217.A O no hydrogen 3.305 N/A SER 215.A OG GLU 235.A O no hydrogen 3.210 N/A THR 216.A N GLU 235.A O no hydrogen 2.740 N/A TRP 217.A N GLU 235.A O no hydrogen 2.981 N/A GLN 220.A N ASP 218.A OD2 no hydrogen 2.997 N/A SER 221.A N ASP 218.A O no hydrogen 3.259 N/A SER 221.A OG ASP 218.A OD1 no hydrogen 2.663 N/A SER 221.A OG TYR 278.A OH no hydrogen 3.003 N/A ASN 222.A N ASP 218.A O no hydrogen 2.826 N/A ASN 222.A ND2 SER 275.A O no hydrogen 3.456 N/A SER 223.A N ASP 273.A OD1 no hydrogen 2.669 N/A SER 223.A OG ASN 272.A OD1 no hydrogen 2.828 N/A SER 223.A OG ASP 273.A OD1 no hydrogen 2.825 N/A LYS 226.A N ASN 222.A O no hydrogen 2.672 N/A TYR 227.A N SER 223.A O no hydrogen 3.147 N/A ASN 228.A N ILE 224.A O no hydrogen 2.907 N/A TYR 229.A N ALA 225.A O no hydrogen 3.077 N/A GLY 232.A N TYR 229.A O no hydrogen 3.408 N/A GLU 235.A N TRP 217.A O no hydrogen 3.042 N/A HIS 236.A N ASN 190.A OD1 no hydrogen 3.023 N/A TYR 239.A N GLY 185.A O no hydrogen 3.150 N/A TYR 239.A OH VAL 189.A O no hydrogen 2.695 N/A PHE 241.A N ILE 183.A O no hydrogen 2.726 N/A THR 242.A OG1 GLN 248.A OE1 no hydrogen 2.925 N/A ASP 243.A N VAL 181.A O no hydrogen 3.044 N/A LYS 244.A N ASN 204.A O no hydrogen 2.922 N/A LYS 244.A NZ ASN 206.A OD1 no hydrogen 3.444 N/A ASP 245.A N ASP 243.A OD2 no hydrogen 3.076 N/A HIS 246.A N ASP 243.A O no hydrogen 3.284 N/A HIS 246.A ND1 ASP 243.A OD2 no hydrogen 2.863 N/A HIS 246.A NE2 ILE 175.A O no hydrogen 2.808 N/A GLN 248.A NE2 ASP 243.A O no hydrogen 2.901 N/A GLN 248.A NE2 HIS 246.A O no hydrogen 3.071 N/A LYS 250.A NZ LYS 285.A OXT no hydrogen 3.191 N/A VAL 253.A N TYR 283.A O no hydrogen 3.047 N/A ASN 254.A N LEU 209.A O no hydrogen 3.069 N/A ASN 254.A ND2 ILE 240.A O no hydrogen 3.650 N/A GLU 255.A N LYS 281.A O no hydrogen 2.833 N/A VAL 256.A N ALA 211.A O no hydrogen 3.080 N/A VAL 257.A N PRO 279.A O no hydrogen 2.913 N/A LYS 260.A NZ SER 221.A O no hydrogen 2.586 N/A TRP 264.A N TYR 271.A O no hydrogen 3.026 N/A VAL 266.A N TYR 269.A O no hydrogen 2.987 N/A GLY 268.A N ASP 265.A OD2 no hydrogen 2.693 N/A TYR 271.A N TRP 264.A O no hydrogen 3.368 N/A ASN 272.A N SER 223.A OG no hydrogen 3.270 N/A SER 275.A OG ASN 8.A O no hydrogen 2.646 N/A SER 275.A OG ASP 276.A OD2 no hydrogen 3.443 N/A HIS 277.A N SER 275.A OG no hydrogen 3.271 N/A HIS 277.A ND1 ASP 238.A OD2 no hydrogen 3.060 N/A TYR 278.A N THR 216.A O no hydrogen 3.025 N/A TYR 278.A OH SER 221.A OG no hydrogen 3.003 N/A ILE 280.A N SER 6.A O no hydrogen 3.158 N/A LYS 281.A N GLU 255.A O no hydrogen 2.711 N/A LYS 281.A NZ TYR 34.A O no hydrogen 3.040 N/A ALA 282.A N LEU 4.A O no hydrogen 3.100 N/A TYR 283.A N VAL 253.A O no hydrogen 3.392 N/A TYR 283.A OH GLU 255.A OE1 no hydrogen 2.819 N/A LYS 285.A N GLN 251.A O no hydrogen 3.101 N/A