Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2j61_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A OG1 CYS 1.A O no hydrogen 3.464 N/A ARG 6.A N ASP 10.A OD2 no hydrogen 3.031 N/A CYS 8.A SG TRP 45.A O no hydrogen 3.475 N/A CYS 8.A SG THR 46.A OG1 no hydrogen 3.198 N/A LYS 9.A NZ ASP 13.A OD1 no hydrogen 2.946 N/A ASP 10.A N THR 7.A OG1 no hydrogen 3.061 N/A LEU 11.A N THR 7.A O no hydrogen 3.122 N/A LEU 12.A N CYS 8.A O no hydrogen 2.694 N/A ASP 13.A N LYS 9.A O no hydrogen 2.860 N/A ARG 14.A N ASP 10.A O no hydrogen 3.071 N/A ARG 14.A N LEU 11.A O no hydrogen 3.157 N/A ARG 14.A NH2 GLY 4.A O no hydrogen 2.670 N/A GLY 15.A N LEU 12.A O no hydrogen 2.609 N/A HIS 16.A N LEU 11.A O no hydrogen 2.918 N/A GLY 20.A N CYS 36.A O no hydrogen 3.057 N/A TRP 21.A NE1 ARG 72.A O no hydrogen 2.835 N/A HIS 22.A N VAL 34.A O no hydrogen 2.782 N/A HIS 22.A ND1 GLY 20.A O no hydrogen 3.117 N/A ILE 24.A N LEU 32.A O no hydrogen 2.848 N/A TYR 25.A N PRO 5.A O no hydrogen 2.784 N/A LEU 26.A N ARG 30.A O no hydrogen 2.557 N/A CYS 29.A N LEU 26.A O no hydrogen 2.854 N/A ARG 30.A N ASP 28.A OD1 no hydrogen 2.893 N/A ARG 30.A NH1 ASN 82.A OD1 no hydrogen 3.154 N/A ARG 30.A NH2 ASN 82.A OD1 no hydrogen 3.294 N/A LEU 32.A N ILE 24.A O no hydrogen 2.795 N/A VAL 34.A N HIS 22.A O no hydrogen 2.685 N/A CYS 36.A N GLY 20.A O no hydrogen 2.897 N/A CYS 36.A SG HIS 22.A ND1 no hydrogen 3.830 N/A ASP 37.A N TRP 45.A O no hydrogen 2.834 N/A MET 38.A N SER 19.A OG no hydrogen 3.042 N/A ASP 39.A N ASP 37.A OD1 no hydrogen 3.014 N/A THR 40.A N ASP 37.A OD1 no hydrogen 3.229 N/A THR 40.A OG1 ASP 37.A OD2 no hydrogen 2.641 N/A GLY 43.A N THR 40.A O no hydrogen 2.866 N/A TRP 45.A N ASP 37.A O no hydrogen 3.130 N/A TRP 45.A NE1 THR 40.A O no hydrogen 2.801 N/A THR 46.A N VAL 213.A O no hydrogen 3.100 N/A VAL 47.A N LEU 35.A O no hydrogen 2.691 N/A PHE 48.A N MET 211.A O no hydrogen 2.833 N/A GLN 49.A NE2 ASN 179.A OD1 no hydrogen 3.196 N/A ARG 50.A N PHE 76.A O no hydrogen 3.247 N/A ARG 50.A NE GLY 74.A O no hydrogen 3.328 N/A ARG 50.A NH1 GLU 210.A OE2 no hydrogen 2.900 N/A ARG 51.A N SER 209.A O no hydrogen 3.153 N/A ARG 51.A NH1 LEU 178.A O no hydrogen 3.002 N/A ARG 51.A NH1 GLY 180.A O no hydrogen 3.015 N/A ARG 51.A NH2 GLY 180.A O no hydrogen 3.146 N/A VAL 52.A N GLU 75.A OE1 no hydrogen 2.988 N/A ASP 53.A N GLU 75.A OE1 no hydrogen 2.976 N/A GLY 54.A N GLU 75.A OE1 no hydrogen 2.676 N/A SER 55.A N ASP 53.A OD1 no hydrogen 2.873 N/A SER 55.A OG ASP 53.A OD1 no hydrogen 2.418 N/A SER 55.A OG ASP 53.A OD2 no hydrogen 3.335 N/A VAL 56.A N GLU 75.A OE2 no hydrogen 2.886 N/A TYR 59.A N ASP 57.A OD1 no hydrogen 3.197 N/A ARG 60.A NE ASP 57.A O no hydrogen 2.615 N/A ARG 60.A NH2 ASP 57.A O no hydrogen 3.514 N/A TRP 62.A N ASP 150.A OD1 no hydrogen 2.599 N/A TRP 62.A NE1 GLU 118.A OE2 no hydrogen 3.211 N/A THR 64.A N ASP 61.A OD2 no hydrogen 2.660 N/A THR 64.A OG1 ASP 61.A OD2 no hydrogen 3.039 N/A TYR 65.A N ASP 61.A O no hydrogen 3.171 N/A TYR 65.A OH PHE 58.A O no hydrogen 2.307 N/A LYS 66.A N TRP 62.A O no hydrogen 2.735 N/A LYS 66.A NZ ASP 81.A OD1 no hydrogen 3.323 N/A LYS 66.A NZ ASP 81.A OD2 no hydrogen 2.668 N/A LYS 66.A NZ GLU 118.A OE1 no hydrogen 2.627 N/A GLN 67.A N ALA 63.A O no hydrogen 3.169 N/A GLY 68.A N THR 64.A O no hydrogen 3.186 N/A PHE 69.A N TRP 77.A O no hydrogen 2.970 N/A SER 71.A N GLU 75.A O no hydrogen 2.605 N/A LEU 73.A N SER 71.A OG no hydrogen 2.838 N/A GLY 74.A N SER 71.A O no hydrogen 3.164 N/A PHE 76.A N ARG 50.A O no hydrogen 3.113 N/A TRP 77.A N PHE 69.A O no hydrogen 2.840 N/A LEU 78.A N PHE 48.A O no hydrogen 2.854 N/A ASN 80.A N TYR 65.A O no hydrogen 2.807 N/A ASP 81.A N LYS 66.A O no hydrogen 3.344 N/A ASN 82.A ND2 LEU 78.A O no hydrogen 2.644 N/A ILE 83.A N GLY 79.A O no hydrogen 2.821 N/A HIS 84.A N ASN 80.A O no hydrogen 3.016 N/A ALA 85.A N ASP 81.A O no hydrogen 2.614 N/A LEU 86.A N ASN 82.A O no hydrogen 2.844 N/A THR 87.A N ILE 83.A O no hydrogen 3.121 N/A THR 87.A N HIS 84.A O no hydrogen 3.080 N/A THR 87.A OG1 ILE 83.A O no hydrogen 3.038 N/A LEU 94.A N TYR 110.A O no hydrogen 3.211 N/A ARG 95.A N LYS 212.A O no hydrogen 2.685 N/A ARG 95.A NE ASP 97.A OD1 no hydrogen 3.108 N/A ARG 95.A NE TYR 105.A OH.A no hydrogen 3.203 N/A ARG 95.A NH2 TYR 105.A OH.A no hydrogen 3.073 N/A THR 96.A N ALA 108.A O no hydrogen 3.196 N/A ASP 97.A N GLU 210.A O no hydrogen 2.776 N/A LEU 98.A N GLN 106.A O no hydrogen 2.877 N/A VAL 99.A N VAL 208.A O no hydrogen 3.049 N/A PHE 101.A N TYR 204.A OH no hydrogen 2.973 N/A GLU 102.A N ASP 100.A OD1 no hydrogen 2.131 N/A ASP 103.A N ASP 100.A O no hydrogen 3.104 N/A ASN 104.A ND2 ASP 100.A OD2 no hydrogen 3.046 N/A TYR 105.A OH.A ASP 97.A OD1 no hydrogen 1.883 N/A GLN 106.A N LEU 98.A O no hydrogen 3.036 N/A ALA 108.A N THR 96.A O no hydrogen 2.998 N/A LYS 109.A N GLU 131.A O no hydrogen 2.642 N/A LYS 109.A NZ ASP 41.A OD2 no hydrogen 2.347 N/A TYR 110.A N LEU 94.A O no hydrogen 3.203 N/A TYR 110.A OH ASP 136.A OD1 no hydrogen 2.532 N/A ARG 111.A N ALA 128.A O no hydrogen 3.086 N/A PHE 113.A N SER 92.A O no hydrogen 2.590 N/A ARG 114.A N VAL 125.A O no hydrogen 3.324 N/A ALA 116.A N ASN 123.A O no hydrogen 2.969 N/A GLU 120.A N ASP 117.A OD2 no hydrogen 3.201 N/A LYS 121.A N GLU 118.A O no hydrogen 2.649 N/A LYS 121.A NZ GLN 151.A OE1 no hydrogen 2.611 N/A TYR 122.A N ASP 117.A O no hydrogen 3.006 N/A TYR 122.A OH ASP 81.A OD1 no hydrogen 2.846 N/A ASN 123.A N GLU 120.A O no hydrogen 3.068 N/A ASN 123.A ND2 ASN 143.A O no hydrogen 2.764 N/A ASN 123.A ND2 ASN 143.A OD1 no hydrogen 3.610 N/A LEU 124.A N GLN 144.A O no hydrogen 2.824 N/A VAL 125.A N ARG 114.A O no hydrogen 3.082 N/A GLY 127.A N SER 112.A O no hydrogen 2.963 N/A VAL 130.A N LYS 109.A O no hydrogen 2.299 N/A GLU 131.A N LYS 109.A O no hydrogen 3.349 N/A ALA 134.A N PHE 107.A O no hydrogen 3.009 N/A GLY 135.A N GLY 132.A O no hydrogen 3.172 N/A SER 137.A OG SER 198.A OG no hydrogen 2.503 N/A LEU 138.A N ASP 136.A OD1 no hydrogen 2.950 N/A THR 139.A N ASP 136.A OD1 no hydrogen 2.658 N/A THR 139.A OG1 ASP 136.A OD1 no hydrogen 2.765 N/A THR 139.A OG1 ASP 136.A OD2 no hydrogen 1.998 N/A HIS 141.A N LEU 138.A O no hydrogen 3.170 N/A HIS 141.A ND1 TRP 169.A O no hydrogen 2.170 N/A ASN 142.A N THR 139.A O no hydrogen 2.667 N/A ASN 142.A ND2 LEU 126.A O no hydrogen 2.648 N/A ASN 143.A N LEU 124.A O no hydrogen 3.132 N/A GLN 144.A N HIS 141.A O no hydrogen 3.288 N/A PHE 146.A N LYS 121.A O no hydrogen 2.976 N/A SER 147.A N TRP 168.A O no hydrogen 2.801 N/A THR 148.A N GLN 151.A O no hydrogen 3.152 N/A THR 148.A OG1 ASP 150.A OD1 no hydrogen 2.887 N/A GLN 151.A N THR 148.A O no hydrogen 2.608 N/A ASN 153.A N SER 147.A OG no hydrogen 3.354 N/A ASN 153.A ND2 PHE 146.A O no hydrogen 3.347 N/A ASN 153.A ND2 GLN 151.A OE1 no hydrogen 3.448 N/A ASP 154.A N ASP 152.A OD1 no hydrogen 2.623 N/A ASN 156.A N ASP 154.A OD2 no hydrogen 2.746 N/A CYS 160.A N ASP 154.A OD1 no hydrogen 2.605 N/A CYS 160.A SG ASP 154.A OD1 no hydrogen 3.166 N/A CYS 160.A SG LYS 171.A O no hydrogen 3.650 N/A MET 163.A N ASN 159.A O no hydrogen 2.905 N/A PHE 164.A N CYS 160.A O no hydrogen 2.723 N/A GLN 165.A N ALA 161.A O no hydrogen 2.460 N/A TRP 168.A N SER 147.A O no hydrogen 3.280 N/A TRP 168.A NE1 SER 176.A OG no hydrogen 2.714 N/A TRP 169.A NE1 TYR 122.A O no hydrogen 3.098 N/A TYR 170.A OH ASN 177.A OD1 no hydrogen 2.384 N/A LYS 171.A NZ ASN 142.A O no hydrogen 3.122 N/A THR 175.A N HIS 141.A NE2 no hydrogen 3.331 N/A ASN 177.A N ASN 195.A O no hydrogen 2.629 N/A ASN 177.A ND2 PHE 164.A O no hydrogen 3.250 N/A ASN 177.A ND2 GLY 193.A O no hydrogen 2.621 N/A ASN 179.A ND2 ALA 167.A O no hydrogen 3.352 N/A GLY 180.A N ASN 177.A O no hydrogen 2.686 N/A ARG 181.A N ASN 192.A O no hydrogen 2.982 N/A TYR 182.A OH LYS 207.A O no hydrogen 2.338 N/A LEU 183.A N SER 205.A OG no hydrogen 3.314 N/A GLY 185.A N SER 205.A O no hydrogen 3.055 N/A HIS 187.A N ASN 203.A O no hydrogen 2.527 N/A HIS 187.A ND1 SER 189.A O no hydrogen 3.022 N/A HIS 187.A ND1 SER 189.A OG no hydrogen 2.674 N/A HIS 187.A NE2 ASN 195.A OD1 no hydrogen 2.929 N/A SER 189.A OG HIS 187.A ND1 no hydrogen 2.674 N/A SER 189.A OG ASN 192.A OD1 no hydrogen 2.676 N/A ALA 191.A N TYR 202.A O no hydrogen 2.906 N/A ASN 192.A N ASN 192.A OD1 no hydrogen 2.471 N/A ILE 194.A N SER 205.A OG no hydrogen 2.729 N/A TRP 196.A NE1 GLY 135.A O no hydrogen 3.033 N/A LYS 197.A N THR 175.A O no hydrogen 2.553 N/A SER 198.A N SER 137.A OG no hydrogen 2.826 N/A SER 198.A OG ALA 134.A O no hydrogen 2.584 N/A SER 198.A OG SER 137.A OG no hydrogen 2.503 N/A GLY 199.A N TRP 196.A O no hydrogen 2.650 N/A LYS 200.A N TRP 196.A O no hydrogen 2.725 N/A GLY 201.A N TRP 196.A O no hydrogen 3.373 N/A GLY 201.A N LYS 197.A O no hydrogen 2.850 N/A TYR 202.A OH HIS 174.A O no hydrogen 2.828 N/A SER 205.A N GLY 185.A O no hydrogen 3.049 N/A SER 205.A OG ARG 181.A O no hydrogen 3.066 N/A TYR 206.A N ILE 194.A O no hydrogen 3.331 N/A TYR 206.A OH GLN 106.A OE1 no hydrogen 3.406 N/A LYS 207.A N VAL 99.A O no hydrogen 2.868 N/A VAL 208.A N VAL 99.A O no hydrogen 2.853 N/A SER 209.A N ARG 51.A O no hydrogen 3.041 N/A SER 209.A OG GLN 49.A OE1 no hydrogen 2.859 N/A GLU 210.A N ASP 97.A O no hydrogen 2.630 N/A MET 211.A N GLN 49.A O no hydrogen 3.266 N/A LYS 212.A N ARG 95.A O no hydrogen 2.877 N/A LYS 212.A NZ ASP 37.A OD2 no hydrogen 2.915 N/A LYS 212.A NZ GLU 210.A OE1 no hydrogen 2.736 N/A VAL 213.A N THR 46.A O no hydrogen 3.291 N/A ARG 214.A NH1 ASP 41.A O no hydrogen 2.781 N/A ARG 214.A NH1 GLY 43.A O no hydrogen 2.968 N/A ARG 214.A NH2 GLU 93.A OE1 no hydrogen 3.209 N/A ALA 216.A N THR 91.A O no hydrogen 3.112 N/A