Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ibt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A NE2 GLU 13.A OE1 no hydrogen 3.425 N/A ASN 4.A ND2 THR 8.A O no hydrogen 3.148 N/A VAL 5.A N THR 8.A O no hydrogen 2.736 N/A THR 10.A OG1 ASP 52.A OD2 no hydrogen 2.715 N/A TYR 11.A N GLN 1.A O no hydrogen 2.494 N/A SER 12.A N CYS 50.A O no hydrogen 3.037 N/A SER 14.A N VAL 48.A O no hydrogen 2.928 N/A SER 14.A OG GLU 13.A O no hydrogen 3.030 N/A HIS 18.A N ASP 16.A OD1 no hydrogen 3.274 N/A THR 21.A OG1 ALA 19.A O no hydrogen 3.410 N/A THR 21.A OG1 HIS 47.A ND1 no hydrogen 3.248 N/A LEU 22.A N HIS 47.A O no hydrogen 2.941 N/A PHE 23.A N GLN 88.A O no hydrogen 2.968 N/A LEU 24.A N ILE 49.A O no hydrogen 2.889 N/A LEU 25.A N VAL 89.A O no hydrogen 2.858 N/A SER 26.A OG GLY 27.A O no hydrogen 2.620 N/A GLY 27.A N GLN 30.A OE1 no hydrogen 2.604 N/A CYS 29.A N HIS 56.A NE2 no hydrogen 2.754 N/A GLN 30.A NE2 HIS 162.A NE2 no hydrogen 3.617 N/A HIS 32.A ND1 ASP 31.A OD2 no hydrogen 2.999 N/A ARG 33.A NE ASP 31.A OD2 no hydrogen 2.853 N/A LEU 34.A N ASP 31.A O no hydrogen 2.989 N/A PHE 35.A N HIS 32.A O no hydrogen 2.799 N/A LYS 36.A N ARG 33.A O no hydrogen 3.278 N/A LYS 36.A NZ ASP 158.A OD1 no hydrogen 3.464 N/A ASN 37.A ND2 ASP 158.A OD2 no hydrogen 2.812 N/A ASN 37.A ND2 LEU 242.A O no hydrogen 3.358 N/A ALA 39.A N PHE 35.A O no hydrogen 2.874 N/A LEU 42.A N LEU 38.A O no hydrogen 3.192 N/A ARG 44.A NE ASP 45.A OD1 no hydrogen 3.244 N/A ARG 44.A NE ASP 45.A OD2 no hydrogen 3.496 N/A ARG 44.A NH2 ASP 45.A OD2 no hydrogen 3.065 N/A ASP 45.A N LEU 42.A O no hydrogen 3.360 N/A PHE 46.A N LEU 42.A O no hydrogen 3.063 N/A HIS 47.A N PRO 20.A O no hydrogen 2.818 N/A HIS 47.A NE2 GLU 13.A OE2 no hydrogen 2.592 N/A VAL 48.A N SER 14.A O no hydrogen 2.950 N/A ILE 49.A N LEU 22.A O no hydrogen 3.140 N/A CYS 50.A N SER 12.A O no hydrogen 2.967 N/A ASP 52.A N THR 10.A O no hydrogen 3.050 N/A TRP 53.A NE1 SER 26.A O no hydrogen 3.008 N/A ARG 54.A NE ASP 74.A OD1 no hydrogen 3.286 N/A ARG 54.A NH2 ASP 74.A OD1 no hydrogen 2.968 N/A HIS 56.A N TRP 53.A O no hydrogen 2.699 N/A HIS 56.A ND1 ARG 54.A O no hydrogen 2.866 N/A GLN 60.A N ASP 57.A O no hydrogen 2.736 N/A THR 61.A N ASP 57.A OD1 no hydrogen 3.447 N/A THR 61.A OG1 ASP 57.A OD1 no hydrogen 3.527 N/A THR 61.A OG1 ASP 57.A OD2 no hydrogen 2.718 N/A THR 70.A N ASP 67.A O no hydrogen 3.170 N/A THR 70.A OG1 ASP 67.A O no hydrogen 3.182 N/A GLN 73.A N GLN 69.A O no hydrogen 3.262 N/A GLN 73.A NE2 GLN 104.A OE1 no hydrogen 3.128 N/A ASP 74.A N THR 70.A O no hydrogen 2.785 N/A LEU 75.A N LEU 71.A O no hydrogen 3.101 N/A LEU 76.A N ALA 72.A O no hydrogen 2.941 N/A ALA 77.A N GLN 73.A O no hydrogen 2.957 N/A PHE 78.A N LEU 75.A O no hydrogen 3.023 N/A ILE 79.A N LEU 75.A O no hydrogen 3.208 N/A ALA 81.A N ALA 77.A O no hydrogen 3.385 N/A LYS 82.A N PHE 78.A O no hydrogen 3.046 N/A LYS 82.A NZ TYR 11.A OH no hydrogen 3.343 N/A GLY 83.A N ASP 80.A O no hydrogen 2.808 N/A ILE 84.A N ILE 79.A O no hydrogen 2.651 N/A GLN 88.A N THR 21.A O no hydrogen 2.975 N/A SER 90.A N ILE 114.A O no hydrogen 2.979 N/A THR 91.A N LEU 25.A O no hydrogen 2.910 N/A SER 92.A N ILE 116.A O no hydrogen 2.758 N/A GLY 94.A N THR 91.A O no hydrogen 2.718 N/A CYS 95.A N SER 92.A O no hydrogen 3.227 N/A CYS 95.A SG SER 90.A OG no hydrogen 3.287 N/A CYS 95.A SG SER 92.A O no hydrogen 2.837 N/A ASN 98.A N GLY 94.A O no hydrogen 3.074 N/A ASN 98.A ND2 SER 90.A OG no hydrogen 2.804 N/A ILE 99.A N CYS 95.A O no hydrogen 2.757 N/A ASP 100.A N TRP 96.A O no hydrogen 3.136 N/A VAL 101.A N VAL 97.A O no hydrogen 3.102 N/A VAL 101.A N ASN 98.A O no hydrogen 3.023 N/A CYS 102.A N ASN 98.A O no hydrogen 3.019 N/A CYS 102.A SG ASN 98.A O no hydrogen 3.852 N/A CYS 102.A SG ASN 98.A OD1 no hydrogen 3.920 N/A GLU 103.A N ILE 99.A O no hydrogen 2.944 N/A GLN 104.A N ASP 100.A O no hydrogen 2.675 N/A LEU 105.A N VAL 101.A O no hydrogen 2.928 N/A ARG 109.A NH1 ARG 85.A O no hydrogen 2.331 N/A LYS 112.A NZ PHE 255.A O no hydrogen 2.899 N/A THR 113.A N GLU 201.A O no hydrogen 3.058 N/A THR 113.A OG1 ASN 98.A OD1 no hydrogen 2.516 N/A ILE 115.A N CYS 203.A O no hydrogen 3.012 N/A ILE 116.A N SER 90.A O no hydrogen 2.755 N/A ASP 117.A N ILE 205.A O no hydrogen 2.694 N/A TRP 118.A N HIS 204.A NE2 no hydrogen 3.032 N/A LEU 120.A N TYR 214.A OH no hydrogen 2.508 N/A PHE 126.A N HIS 123.A ND1 no hydrogen 3.185 N/A TRP 127.A N HIS 123.A O no hydrogen 3.256 N/A GLN 128.A N PRO 124.A O no hydrogen 3.216 N/A GLN 129.A N GLY 125.A O no hydrogen 3.167 N/A GLN 129.A NE2 SER 145.A OG no hydrogen 2.626 N/A LEU 130.A N PHE 126.A O no hydrogen 2.927 N/A ALA 131.A N TRP 127.A O no hydrogen 3.289 N/A GLU 132.A N GLN 128.A O no hydrogen 2.731 N/A GLY 133.A N GLN 129.A O no hydrogen 2.852 N/A GLN 134.A N ALA 131.A O no hydrogen 2.848 N/A GLN 134.A NE2 LEU 130.A O no hydrogen 3.181 N/A GLN 134.A NE2 GLU 181.A OE1 no hydrogen 2.699 N/A HIS 135.A N GLU 132.A O no hydrogen 3.123 N/A THR 137.A N HIS 135.A ND1 no hydrogen 3.196 N/A GLU 138.A N HIS 135.A O no hydrogen 2.995 N/A GLY 142.A N TYR 139.A O no hydrogen 3.036 N/A ARG 143.A N TYR 139.A O no hydrogen 2.753 N/A GLN 144.A N VAL 140.A O no hydrogen 2.571 N/A GLN 144.A NE2 GLN 144.A O no hydrogen 3.681 N/A SER 145.A N ALA 141.A O no hydrogen 3.077 N/A PHE 147.A N ARG 143.A O no hydrogen 3.351 N/A ASP 148.A N GLN 144.A O no hydrogen 3.038 N/A GLU 149.A N SER 145.A O no hydrogen 3.352 N/A TRP 150.A N PHE 146.A O no hydrogen 2.570 N/A ALA 151.A N PHE 147.A O no hydrogen 2.771 N/A GLU 152.A N GLU 149.A O no hydrogen 2.873 N/A THR 153.A N GLU 152.A OE2 no hydrogen 2.689 N/A THR 153.A OG1 GLU 152.A OE2 no hydrogen 2.513 N/A THR 154.A N ALA 151.A O no hydrogen 3.436 N/A THR 154.A OG1 ALA 151.A O no hydrogen 2.725 N/A THR 154.A OG1 THR 237.A OG1 no hydrogen 3.302 N/A LEU 160.A N ASN 156.A O no hydrogen 2.894 N/A ASN 161.A N ALA 157.A O no hydrogen 2.835 N/A HIS 162.A N ASP 158.A O no hydrogen 3.136 N/A LEU 163.A N VAL 159.A O no hydrogen 2.980 N/A ARG 164.A N ASN 161.A O no hydrogen 3.160 N/A ASN 165.A N HIS 162.A O no hydrogen 3.316 N/A GLU 166.A N HIS 162.A O no hydrogen 3.014 N/A TRP 168.A N GLU 166.A O no hydrogen 3.187 N/A GLN 174.A N GLY 171.A O no hydrogen 2.972 N/A ARG 175.A N GLU 172.A O no hydrogen 3.267 N/A CYS 177.A N TRP 173.A O no hydrogen 3.312 N/A CYS 177.A SG TRP 173.A O no hydrogen 3.232 N/A ARG 178.A N GLN 174.A O no hydrogen 2.954 N/A ARG 178.A NH2 ASP 65.A OD2 no hydrogen 2.586 N/A ARG 178.A NH2 GLU 179.A OE2 no hydrogen 2.989 N/A GLU 179.A N ARG 175.A O no hydrogen 2.781 N/A ILE 180.A N ALA 176.A O no hydrogen 2.813 N/A GLU 181.A N CYS 177.A O no hydrogen 2.842 N/A ALA 182.A N ARG 178.A O no hydrogen 2.669 N/A ASN 183.A N GLU 179.A O no hydrogen 3.045 N/A TYR 184.A N ILE 180.A O no hydrogen 3.082 N/A TYR 184.A OH LEU 119.A O no hydrogen 2.898 N/A ARG 185.A N GLU 181.A O no hydrogen 3.286 N/A THR 186.A N ALA 182.A O no hydrogen 2.939 N/A THR 186.A N ASN 183.A O no hydrogen 3.092 N/A THR 186.A OG1 ALA 182.A O no hydrogen 3.008 N/A TRP 187.A N ASN 183.A O no hydrogen 2.980 N/A GLY 188.A N TYR 184.A O no hydrogen 2.597 N/A ASP 192.A N SER 189.A OG no hydrogen 2.983 N/A ARG 193.A N SER 189.A O no hydrogen 2.868 N/A ARG 193.A NH1 GLU 103.A OE1 no hydrogen 2.616 N/A ARG 193.A NH2 GLU 103.A OE1 no hydrogen 2.665 N/A SER 195.A N ARG 193.A O no hydrogen 3.054 N/A SER 195.A OG ASP 192.A O no hydrogen 3.537 N/A SER 195.A OG ARG 193.A O no hydrogen 2.758 N/A LYS 199.A NZ ASP 194.A O no hydrogen 2.536 N/A LYS 199.A NZ LEU 196.A O no hydrogen 2.796 N/A GLU 201.A N PRO 111.A O no hydrogen 2.978 N/A ILE 202.A N TRP 227.A O no hydrogen 2.729 N/A CYS 203.A N THR 113.A O no hydrogen 3.189 N/A CYS 203.A SG HIS 229.A O no hydrogen 3.495 N/A HIS 204.A N HIS 229.A O no hydrogen 2.960 N/A ILE 205.A N ILE 115.A O no hydrogen 2.951 N/A TYR 206.A N ARG 231.A O no hydrogen 3.168 N/A SER 207.A N ASP 117.A OD1 no hydrogen 3.042 N/A SER 207.A OG ILE 233.A O no hydrogen 2.946 N/A GLN 208.A N ASP 117.A OD1 no hydrogen 3.279 N/A SER 211.A N PRO 209.A O no hydrogen 2.753 N/A TYR 214.A N SER 211.A OG no hydrogen 3.174 N/A ARG 215.A N SER 211.A O no hydrogen 3.018 N/A ARG 215.A NE HIS 232.A NE2 no hydrogen 3.241 N/A ARG 215.A NH1 GLN 212.A OE1 no hydrogen 3.470 N/A GLN 216.A N GLN 212.A O no hydrogen 2.967 N/A LEU 217.A N ASP 213.A O no hydrogen 2.711 N/A GLN 218.A N TYR 214.A O no hydrogen 3.281 N/A GLN 218.A N ARG 215.A O no hydrogen 3.254 N/A GLN 218.A NE2 HIS 204.A ND1 no hydrogen 2.673 N/A LEU 219.A N ARG 215.A O no hydrogen 3.301 N/A GLU 220.A N GLN 216.A O no hydrogen 3.000 N/A PHE 221.A N LEU 217.A O no hydrogen 2.918 N/A ALA 222.A N GLN 218.A O no hydrogen 2.808 N/A ALA 223.A N LEU 219.A O no hydrogen 3.147 N/A ALA 223.A N GLU 220.A O no hydrogen 3.129 N/A GLY 224.A N PHE 221.A O no hydrogen 2.957 N/A PHE 228.A N HIS 225.A O no hydrogen 2.961 N/A HIS 229.A NE2 GLU 201.A OE1 no hydrogen 3.124 N/A ARG 231.A N HIS 204.A O no hydrogen 2.654 N/A ILE 233.A N TYR 206.A O no hydrogen 3.070 N/A GLY 235.A N ILE 233.A O no hydrogen 2.820 N/A ARG 236.A N GLU 243.A OE2 no hydrogen 3.296 N/A THR 237.A N GLU 243.A OE1 no hydrogen 3.116 N/A HIS 238.A N TRP 150.A O no hydrogen 3.106 N/A HIS 238.A ND1 ASP 117.A OD2 no hydrogen 2.860 N/A LEU 242.A N PHE 239.A O no hydrogen 2.861 N/A GLU 243.A N PHE 239.A O no hydrogen 2.880 N/A ASN 244.A N PRO 240.A O no hydrogen 2.845 N/A VAL 248.A N ASN 244.A O no hydrogen 3.077 N/A ALA 249.A N PRO 245.A O no hydrogen 2.919 N/A GLN 250.A N VAL 246.A O no hydrogen 3.291 N/A GLN 250.A N ALA 247.A O no hydrogen 2.983 N/A GLN 250.A NE2 GLU 254.A OE2 no hydrogen 2.645 N/A ALA 251.A N ALA 247.A O no hydrogen 3.170 N/A ILE 252.A N VAL 248.A O no hydrogen 2.969 N/A ARG 253.A N ALA 249.A O no hydrogen 2.866 N/A ARG 253.A NE GLN 250.A OE1 no hydrogen 3.119 N/A ARG 253.A NH1 ASP 45.A OD2 no hydrogen 3.177 N/A GLU 254.A N GLN 250.A O no hydrogen 2.875 N/A PHE 255.A N ALA 251.A O no hydrogen 2.795 N/A LEU 256.A N ILE 252.A O no hydrogen 2.873 N/A