Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ity_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 9.A NH1 TYR 297.A OH no hydrogen 3.487 N/A ARG 9.A NH2 TYR 297.A OH no hydrogen 3.552 N/A LEU 11.A N ILE 84.A O no hydrogen 2.708 N/A LYS 12.A N GLU 15.A OE1 no hydrogen 2.672 N/A PHE 16.A N GLU 13.A O no hydrogen 3.318 N/A LYS 17.A N LEU 34.A O no hydrogen 3.031 N/A LYS 17.A NZ THR 14.A O no hydrogen 3.297 N/A LYS 18.A NZ GLU 50.A OE1 no hydrogen 3.295 N/A ILE 19.A N LYS 32.A O no hydrogen 2.753 N/A LEU 22.A N VAL 30.A O no hydrogen 2.781 N/A GLY 23.A N VAL 30.A O no hydrogen 2.948 N/A VAL 30.A N GLY 23.A O no hydrogen 2.820 N/A TYR 31.A N ILE 48.A O no hydrogen 3.118 N/A GLY 33.A N VAL 46.A O no hydrogen 3.024 N/A TRP 35.A N ILE 44.A O no hydrogen 3.008 N/A ILE 36.A N GLU 15.A O no hydrogen 2.840 N/A LYS 43.A N ASP 290.A O no hydrogen 3.421 N/A LYS 43.A NZ ASP 287.A O no hydrogen 3.515 N/A LYS 43.A NZ ASP 287.A OD2 no hydrogen 3.114 N/A ILE 44.A N TRP 35.A O no hydrogen 2.768 N/A VAL 46.A N GLY 33.A O no hydrogen 3.417 N/A ALA 47.A N THR 94.A O no hydrogen 2.636 N/A LYS 49.A N LEU 92.A O no hydrogen 2.573 N/A LYS 49.A NZ GLU 66.A OE1 no hydrogen 2.831 N/A THR 55.A OG1 GLU 53.A O no hydrogen 3.073 N/A THR 55.A OG1 GLU 53.A OE2 no hydrogen 3.483 N/A THR 55.A OG1 SER 88.A O no hydrogen 3.417 N/A ALA 59.A N SER 56.A O no hydrogen 2.735 N/A LYS 61.A N LYS 58.A O no hydrogen 3.269 N/A LYS 61.A NZ ASP 65.A OD2 no hydrogen 2.820 N/A ILE 63.A N ALA 59.A O no hydrogen 3.045 N/A LEU 64.A N ASN 60.A O no hydrogen 3.292 N/A ASP 65.A N LYS 61.A O no hydrogen 3.053 N/A GLU 66.A N GLU 62.A O no hydrogen 3.330 N/A ALA 67.A N ILE 63.A O no hydrogen 2.994 N/A TYR 68.A N LEU 64.A O no hydrogen 2.878 N/A VAL 69.A N ASP 65.A O no hydrogen 3.073 N/A MET 70.A N GLU 66.A O no hydrogen 2.797 N/A ALA 71.A N ALA 67.A O no hydrogen 2.654 N/A SER 72.A N VAL 69.A O no hydrogen 2.678 N/A SER 72.A OG ASN 4.A OD1 no hydrogen 2.654 N/A SER 72.A OG TYR 68.A O no hydrogen 2.828 N/A ASP 74.A N TYR 131.A OH no hydrogen 2.815 N/A HIS 77.A N ASN 75.A OD1 no hydrogen 2.712 N/A HIS 77.A ND1 VAL 155.A O no hydrogen 3.178 N/A VAL 78.A N ASN 75.A O no hydrogen 3.022 N/A CYS 79.A N ILE 157.A O no hydrogen 3.078 N/A CYS 79.A SG ILE 157.A O no hydrogen 3.087 N/A CYS 79.A SG THR 158.A OG1 no hydrogen 3.184 N/A LEU 81.A N MET 70.A O no hydrogen 3.265 N/A LEU 82.A N ILE 93.A O no hydrogen 3.073 N/A ILE 84.A N ARG 9.A O no hydrogen 2.737 N/A CYS 85.A N GLN 91.A O no hydrogen 3.052 N/A CYS 85.A SG LEU 11.A O no hydrogen 2.488 N/A CYS 85.A SG LYS 12.A O no hydrogen 2.980 N/A THR 87.A OG1 THR 89.A O no hydrogen 2.864 N/A SER 88.A OG THR 87.A O no hydrogen 2.709 N/A GLN 91.A N CYS 85.A O no hydrogen 3.081 N/A LEU 92.A N LYS 49.A O no hydrogen 3.204 N/A ILE 93.A N GLY 83.A O no hydrogen 3.329 N/A THR 94.A N ALA 47.A O no hydrogen 2.694 N/A THR 94.A OG1 ARG 80.A O no hydrogen 3.068 N/A LEU 96.A N PRO 45.A O no hydrogen 3.255 N/A PHE 99.A N VAL 149.A O no hydrogen 3.369 N/A GLY 100.A N MET 97.A O no hydrogen 2.811 N/A LEU 102.A N VAL 147.A O no hydrogen 2.818 N/A TYR 105.A N CYS 101.A O no hydrogen 2.995 N/A VAL 106.A N LEU 102.A O no hydrogen 2.966 N/A ARG 107.A N LEU 103.A O no hydrogen 2.996 N/A ARG 107.A NE GLY 205.A O no hydrogen 2.951 N/A ARG 107.A NH2 GLY 205.A O no hydrogen 3.226 N/A GLU 108.A N ASP 104.A O no hydrogen 2.918 N/A HIS 109.A N VAL 106.A O no hydrogen 2.890 N/A ASN 112.A N HIS 109.A O no hydrogen 2.952 N/A ILE 113.A N LYS 110.A O no hydrogen 3.264 N/A SER 115.A N ASP 278.A OD2 no hydrogen 3.403 N/A SER 115.A OG PRO 269.A O no hydrogen 3.250 N/A SER 115.A OG ASP 278.A OD1 no hydrogen 2.867 N/A GLN 116.A NE2 GLN 116.A O no hydrogen 3.483 N/A GLN 116.A NE2 ASN 120.A OD1 no hydrogen 2.802 N/A GLN 116.A NE2 ALA 266.A O no hydrogen 3.195 N/A LEU 118.A N GLY 114.A O no hydrogen 3.016 N/A LEU 119.A N SER 115.A O no hydrogen 2.814 N/A ASN 120.A N GLN 116.A O no hydrogen 2.903 N/A TRP 121.A N TYR 117.A O no hydrogen 2.882 N/A TRP 121.A NE1 PRO 152.A O no hydrogen 2.634 N/A CYS 122.A N LEU 118.A O no hydrogen 3.174 N/A CYS 122.A SG LEU 118.A O no hydrogen 3.138 N/A VAL 123.A N LEU 119.A O no hydrogen 2.901 N/A GLN 124.A N ASN 120.A O no hydrogen 2.954 N/A GLN 124.A NE2 GLN 153.A O no hydrogen 2.768 N/A ILE 125.A N TRP 121.A O no hydrogen 3.008 N/A ALA 126.A N CYS 122.A O no hydrogen 3.019 N/A LYS 127.A N VAL 123.A O no hydrogen 2.981 N/A GLY 128.A N GLN 124.A O no hydrogen 2.925 N/A MET 129.A N ILE 125.A O no hydrogen 2.740 N/A ASN 130.A N ALA 126.A O no hydrogen 2.876 N/A TYR 131.A N LYS 127.A O no hydrogen 2.859 N/A LEU 132.A N GLY 128.A O no hydrogen 3.081 N/A GLU 133.A N MET 129.A O no hydrogen 2.974 N/A GLU 133.A N ASN 130.A O no hydrogen 2.994 N/A ASP 134.A N ASN 130.A O no hydrogen 2.842 N/A ARG 135.A N TYR 131.A O no hydrogen 3.078 N/A ARG 135.A NH1 SER 72.A O no hydrogen 2.363 N/A ARG 135.A NH1 TYR 131.A OH no hydrogen 2.721 N/A ARG 135.A NH2 SER 72.A O no hydrogen 2.513 N/A ARG 136.A N GLU 133.A O no hydrogen 2.649 N/A ARG 136.A NH1 GLU 1.A OE1 no hydrogen 3.080 N/A ARG 136.A NH1 GLU 1.A OE2 no hydrogen 3.149 N/A LEU 137.A N LEU 132.A O no hydrogen 2.619 N/A VAL 138.A N LYS 164.A O no hydrogen 2.641 N/A HIS 139.A N ASP 190.A OD1 no hydrogen 2.735 N/A HIS 139.A NE2 THR 158.A O no hydrogen 2.819 N/A ARG 140.A N ASP 190.A OD2 no hydrogen 3.182 N/A ARG 140.A NH1 LEU 162.A O no hydrogen 2.482 N/A ASP 141.A N HIS 139.A ND1 no hydrogen 2.728 N/A ALA 144.A N GLU 200.A OE2 no hydrogen 3.207 N/A ARG 145.A NH1 ASP 141.A OD1 no hydrogen 3.102 N/A ASN 146.A N ALA 143.A O no hydrogen 3.003 N/A ASN 146.A ND2 ASP 141.A O no hydrogen 2.451 N/A ASN 146.A ND2 ASP 141.A OD2 no hydrogen 2.879 N/A VAL 147.A N ALA 144.A O no hydrogen 3.179 N/A LEU 148.A N LYS 156.A O no hydrogen 2.678 N/A VAL 149.A N GLY 100.A O no hydrogen 2.966 N/A LYS 150.A N HIS 154.A O no hydrogen 2.882 N/A LYS 150.A NZ ASP 293.A OD2 no hydrogen 3.531 N/A LYS 150.A NZ ASP 295.A OD2 no hydrogen 2.819 N/A GLN 153.A N THR 151.A OG1 no hydrogen 2.973 N/A HIS 154.A N THR 151.A O no hydrogen 2.644 N/A HIS 154.A NE2 PRO 76.A O no hydrogen 3.134 N/A VAL 155.A N GLN 124.A OE1 no hydrogen 2.766 N/A LYS 156.A N LEU 148.A O no hydrogen 2.813 N/A LYS 156.A NZ ASP 295.A OD1 no hydrogen 2.795 N/A LYS 156.A NZ ASP 295.A OD2 no hydrogen 3.412 N/A ILE 157.A N HIS 77.A O no hydrogen 2.760 N/A ALA 163.A N PHE 160.A O no hydrogen 2.746 N/A LYS 164.A N VAL 138.A O no hydrogen 2.924 N/A LEU 166.A N ARG 136.A O no hydrogen 3.177 N/A ALA 168.A N LEU 165.A O no hydrogen 3.079 N/A LYS 173.A NZ TYR 209.A O no hydrogen 2.882 N/A LYS 173.A NZ ILE 212.A O no hydrogen 3.243 N/A TRP 174.A NE1 GLU 200.A OE2 no hydrogen 2.691 N/A MET 175.A N ILE 172.A O no hydrogen 2.945 N/A SER 179.A N ALA 176.A O no hydrogen 2.979 N/A SER 179.A OG ILE 184.A O no hydrogen 2.467 N/A ILE 180.A N ALA 176.A O no hydrogen 3.176 N/A ILE 180.A N LEU 177.A O no hydrogen 2.625 N/A LEU 181.A N LEU 177.A O no hydrogen 2.964 N/A HIS 182.A N GLU 178.A O no hydrogen 3.193 N/A ILE 184.A N GLU 178.A O no hydrogen 2.985 N/A GLN 188.A N THR 186.A OG1 no hydrogen 3.296 N/A GLN 188.A NE2 ALA 249.A O no hydrogen 3.411 N/A GLN 188.A NE2 PRO 253.A O no hydrogen 3.169 N/A SER 189.A OG THR 186.A O no hydrogen 2.662 N/A ASP 190.A N THR 186.A O no hydrogen 3.066 N/A VAL 191.A N HIS 187.A O no hydrogen 2.907 N/A TRP 192.A N GLN 188.A O no hydrogen 3.465 N/A SER 193.A N SER 189.A O no hydrogen 3.364 N/A SER 193.A OG TRP 174.A O no hydrogen 2.581 N/A SER 193.A OG SER 189.A O no hydrogen 3.225 N/A TYR 194.A N ASP 190.A O no hydrogen 2.796 N/A TYR 194.A OH CYS 122.A O no hydrogen 2.759 N/A GLY 195.A N VAL 191.A O no hydrogen 2.879 N/A VAL 196.A N TRP 192.A O no hydrogen 3.054 N/A THR 197.A N SER 193.A O no hydrogen 2.801 N/A THR 197.A OG1 SER 193.A O no hydrogen 2.684 N/A VAL 198.A N TYR 194.A O no hydrogen 2.706 N/A TRP 199.A N GLY 195.A O no hydrogen 2.872 N/A TRP 199.A NE1 PRO 228.A O no hydrogen 2.682 N/A GLU 200.A N VAL 196.A O no hydrogen 2.782 N/A LEU 201.A N THR 197.A O no hydrogen 3.039 N/A MET 202.A N VAL 198.A O no hydrogen 2.989 N/A THR 203.A N TRP 199.A O no hydrogen 3.157 N/A THR 203.A OG1 TRP 199.A O no hydrogen 3.128 N/A THR 203.A OG1 GLU 200.A O no hydrogen 3.208 N/A PHE 204.A N LEU 201.A O no hydrogen 2.909 N/A GLY 205.A N GLU 200.A O no hydrogen 2.978 N/A SER 206.A N THR 203.A OG1 no hydrogen 3.128 N/A GLU 216.A N PRO 213.A O no hydrogen 2.901 N/A ILE 217.A N ALA 214.A O no hydrogen 3.273 N/A SER 219.A N GLU 216.A O no hydrogen 2.737 N/A ILE 220.A N GLU 216.A O no hydrogen 3.096 N/A LEU 221.A N ILE 217.A O no hydrogen 2.857 N/A GLU 222.A N SER 218.A O no hydrogen 3.312 N/A LYS 223.A N SER 219.A O no hydrogen 2.764 N/A GLY 224.A N ILE 220.A O no hydrogen 3.254 N/A GLU 225.A N ILE 220.A O no hydrogen 3.411 N/A ARG 226.A NE GLU 225.A O no hydrogen 2.337 N/A GLN 229.A NE2 CYS 233.A O no hydrogen 3.051 N/A CYS 233.A N PRO 230.A O no hydrogen 2.833 N/A THR 234.A N TYR 272.A O no hydrogen 3.432 N/A THR 234.A OG1 TYR 272.A O no hydrogen 2.560 N/A VAL 237.A N THR 234.A O no hydrogen 3.242 N/A TYR 238.A N THR 234.A O no hydrogen 3.155 N/A TYR 238.A OH LEU 227.A O no hydrogen 2.291 N/A MET 239.A N ILE 235.A O no hydrogen 2.839 N/A ILE 240.A N VAL 237.A O no hydrogen 2.759 N/A MET 241.A N VAL 237.A O no hydrogen 3.101 N/A VAL 242.A N TYR 238.A O no hydrogen 2.854 N/A LYS 243.A N MET 239.A O no hydrogen 2.919 N/A CYS 244.A N ILE 240.A O no hydrogen 2.941 N/A CYS 244.A SG VAL 191.A O no hydrogen 3.630 N/A CYS 244.A SG ILE 240.A O no hydrogen 3.636 N/A TRP 245.A N VAL 242.A O no hydrogen 2.714 N/A TRP 245.A NE1 TRP 192.A O no hydrogen 3.167 N/A SER 251.A N ASP 248.A O no hydrogen 2.604 N/A SER 251.A OG ASP 248.A OD1 no hydrogen 2.826 N/A ARG 252.A N ALA 249.A O no hydrogen 2.804 N/A ARG 252.A NH1 GLU 178.A OE2 no hydrogen 3.465 N/A ARG 252.A NH1 MET 246.A O no hydrogen 2.802 N/A ARG 252.A NH2 GLU 178.A OE2 no hydrogen 2.679 N/A ARG 252.A NH2 GLN 188.A O no hydrogen 3.040 N/A LYS 254.A N GLU 257.A OE1 no hydrogen 3.288 N/A LYS 254.A NZ GLU 133.A OE1 no hydrogen 3.184 N/A LYS 254.A NZ GLN 188.A OE1 no hydrogen 3.334 N/A GLU 257.A N LYS 254.A O no hydrogen 2.715 N/A LEU 258.A N LYS 254.A O no hydrogen 2.958 N/A ILE 259.A N PHE 255.A O no hydrogen 2.693 N/A ILE 260.A N ARG 256.A O no hydrogen 3.211 N/A GLU 261.A N GLU 257.A O no hydrogen 2.690 N/A PHE 262.A N LEU 258.A O no hydrogen 3.153 N/A SER 263.A N ILE 259.A O no hydrogen 3.158 N/A LYS 264.A N ILE 260.A O no hydrogen 2.882 N/A LYS 264.A NZ GLU 261.A OE1 no hydrogen 3.257 N/A MET 265.A N GLU 261.A O no hydrogen 3.160 N/A ALA 266.A N PHE 262.A O no hydrogen 2.622 N/A ARG 267.A N LYS 264.A O no hydrogen 3.121 N/A ASP 268.A N MET 265.A O no hydrogen 3.051 N/A ARG 271.A N ASP 268.A O no hydrogen 3.087 N/A TYR 272.A N PRO 269.A O no hydrogen 3.315 N/A LEU 273.A N PRO 269.A O no hydrogen 3.100 N/A VAL 274.A N ILE 232.A O no hydrogen 2.902 N/A GLN 276.A NE2 VAL 274.A O no hydrogen 3.434 N/A VAL 291.A N MET 288.A O no hydrogen 3.088 N/A VAL 292.A N LYS 43.A O no hydrogen 3.074 N/A ASP 295.A N ASP 293.A OD2 no hydrogen 2.980 N/A GLU 296.A N ASP 293.A O no hydrogen 2.811 N/A TYR 297.A N ALA 294.A O no hydrogen 2.588 N/A TYR 297.A OH GLU 40.A OE2 no hydrogen 2.389 N/A