Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2wta_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 2.A N CYS 212.A O no hydrogen 2.617 N/A ASN 2.A ND2 GLU 211.A O no hydrogen 3.334 N/A LYS 3.A NZ GLY 42.A O no hydrogen 2.984 N/A GLN 4.A N CYS 43.A O no hydrogen 2.746 N/A ASN 7.A ND2 ASP 145.A OD1 no hydrogen 2.752 N/A SER 8.A N.A PRO 5.A O no hydrogen 3.221 N/A SER 8.A N.B PRO 5.A O no hydrogen 3.218 N/A SER 8.A OG.B PRO 5.A O no hydrogen 2.916 N/A ALA 9.A N THR 146.A O no hydrogen 2.932 N/A LEU 10.A N ASN 46.A O no hydrogen 2.923 N/A VAL 11.A N TYR 148.A O no hydrogen 2.772 N/A VAL 12.A N VAL 48.A O no hydrogen 2.809 N/A VAL 13.A N VAL 150.A O no hydrogen 2.783 N/A ASP 14.A N THR 50.A O.A no hydrogen 3.344 N/A ASP 14.A N THR 50.A O.B no hydrogen 3.093 N/A ASP 14.A N THR 50.A OG1.A no hydrogen 3.054 N/A GLN 16.A N ASP 14.A O no hydrogen 2.897 N/A GLN 16.A NE2 ASP 52.A O no hydrogen 2.923 N/A GLN 16.A NE2 ALA 95.A O no hydrogen 2.807 N/A ASN 17.A N GLU 96.A O no hydrogen 2.844 N/A ASN 17.A ND2 HIS 93.A O no hydrogen 2.910 N/A GLY 18.A N ASP 94.A O no hydrogen 2.803 N/A PHE 19.A N GLN 16.A O no hydrogen 3.255 N/A THR 20.A N ASN 17.A O no hydrogen 3.248 N/A THR 20.A OG1 GLN 16.A O no hydrogen 2.859 N/A THR 20.A OG1 ASN 17.A O no hydrogen 3.064 N/A GLY 23.A N THR 20.A O no hydrogen 2.867 N/A ASN 24.A N ASP 94.A OD1 no hydrogen 2.992 N/A ASN 24.A ND2 LYS 86.A O no hydrogen 3.495 N/A LEU 25.A N GLY 18.A O no hydrogen 2.768 N/A VAL 27.A N PHE 19.A O no hydrogen 2.975 N/A ALA 30.A N VAL 27.A O no hydrogen 3.012 N/A THR 32.A N ASP 29.A O no hydrogen 2.998 N/A THR 32.A OG1 ASP 29.A O no hydrogen 2.648 N/A ILE 34.A N ASP 31.A O no hydrogen 3.263 N/A ILE 37.A N ILE 33.A O no hydrogen 3.066 N/A ASN 38.A N ILE 34.A O no hydrogen 2.823 N/A ASN 38.A ND2 ASP 100.A O no hydrogen 2.900 N/A GLN 39.A N PRO 35.A O no hydrogen 3.054 N/A LEU 40.A N THR 36.A O no hydrogen 2.873 N/A ALA 41.A N ILE 37.A O no hydrogen 2.917 N/A GLY 42.A N GLN 39.A O no hydrogen 3.243 N/A CYS 43.A N LEU 40.A O no hydrogen 2.864 N/A CYS 43.A SG GLN 39.A O no hydrogen 3.836 N/A PHE 44.A N ALA 41.A O no hydrogen 3.145 N/A ASN 46.A ND2 GLN 6.A OE1 no hydrogen 3.181 N/A ASN 46.A ND2 SER 8.A O.A no hydrogen 3.267 N/A ASN 46.A ND2 SER 8.A O.B no hydrogen 3.041 N/A VAL 48.A N LEU 10.A O no hydrogen 2.857 N/A LEU 49.A N LEU 108.A O no hydrogen 2.876 N/A THR 50.A N.A VAL 12.A O no hydrogen 2.874 N/A THR 50.A N.B VAL 12.A O no hydrogen 2.893 N/A THR 50.A OG1.A ASP 14.A OD2 no hydrogen 2.789 N/A THR 50.A OG1.B ILE 110.A O no hydrogen 3.044 N/A GLN 51.A N ILE 110.A O no hydrogen 2.996 N/A GLN 51.A NE2 ALA 95.A O no hydrogen 2.870 N/A ASP 52.A N GLN 16.A OE1 no hydrogen 2.879 N/A TRP 53.A N LYS 112.A O no hydrogen 2.782 N/A HIS 54.A N CYS 88.A O no hydrogen 2.951 N/A HIS 54.A ND1 GLY 113.A O no hydrogen 2.808 N/A HIS 58.A N PRO 55.A O no hydrogen 3.143 N/A HIS 58.A ND1 SER 60.A OG no hydrogen 2.817 N/A HIS 58.A NE2 ILE 118.A O no hydrogen 2.965 N/A ILE 59.A N ALA 116.A O no hydrogen 2.801 N/A SER 60.A N HIS 58.A ND1 no hydrogen 3.140 N/A SER 60.A OG HIS 58.A ND1 no hydrogen 2.817 N/A PHE 61.A N HIS 58.A O no hydrogen 3.162 N/A ALA 62.A N TRP 84.A O no hydrogen 2.958 N/A ASN 64.A N PHE 61.A O no hydrogen 2.950 N/A ASN 64.A ND2 ASP 56.A O.A no hydrogen 3.308 N/A ASN 64.A ND2 ASP 56.A O.B no hydrogen 3.136 N/A ASN 64.A ND2 HIS 58.A O no hydrogen 2.868 N/A HIS 65.A N ALA 62.A O no hydrogen 3.075 N/A HIS 65.A NE2 ILE 59.A O no hydrogen 2.669 N/A LYS 68.A N HIS 65.A O no hydrogen 3.128 N/A LYS 68.A NZ THR 73.A O.A no hydrogen 3.243 N/A LYS 68.A NZ THR 73.A O.B no hydrogen 3.238 N/A GLN 69.A N GLU 72.A OE2 no hydrogen 3.259 N/A GLN 69.A NE2 LYS 68.A O no hydrogen 3.518 N/A PHE 71.A N LEU 83.A O no hydrogen 2.693 N/A GLU 72.A N GLN 69.A O no hydrogen 3.213 N/A ILE 74.A N GLN 81.A O no hydrogen 2.856 N/A LEU 76.A N GLY 79.A O no hydrogen 2.876 N/A TYR 78.A OH GLN 81.A OE1 no hydrogen 2.622 N/A GLY 79.A N LEU 76.A O no hydrogen 2.973 N/A GLN 81.A N ILE 74.A O no hydrogen 2.767 N/A GLN 81.A NE2 VAL 82.A O no hydrogen 2.869 N/A GLN 81.A NE2 ASP 119.A OD2 no hydrogen 2.994 N/A LEU 83.A N GLU 72.A O no hydrogen 2.791 N/A TRP 84.A N SER 60.A O no hydrogen 2.802 N/A TRP 84.A NE1 TYR 121.A OH no hydrogen 2.903 N/A LYS 86.A NZ ASP 56.A OD1.B no hydrogen 3.109 N/A HIS 87.A ND1 PRO 85.A O no hydrogen 2.859 N/A HIS 87.A NE2 ASP 52.A OD2 no hydrogen 3.122 N/A CYS 88.A N ASP 94.A OD2 no hydrogen 2.782 N/A CYS 88.A SG ASP 94.A O no hydrogen 3.874 N/A GLN 90.A N HIS 54.A O no hydrogen 2.834 N/A GLN 90.A NE2 TRP 53.A O no hydrogen 3.145 N/A THR 92.A N ILE 89.A O no hydrogen 3.055 N/A THR 92.A OG1 ILE 89.A O no hydrogen 2.651 N/A ALA 95.A N THR 92.A O no hydrogen 3.125 N/A GLU 96.A N HIS 93.A O no hydrogen 3.085 N/A HIS 98.A N VAL 15.A O no hydrogen 2.972 N/A ASP 100.A N HIS 98.A ND1 no hydrogen 3.045 N/A LEU 101.A N HIS 98.A O no hydrogen 2.976 N/A ASN 102.A N ASN 38.A OD1 no hydrogen 2.825 N/A ALA 106.A N ILE 103.A O no hydrogen 3.119 N/A GLN 107.A N VAL 47.A O no hydrogen 2.889 N/A GLN 107.A NE2 GLU 45.A O.A no hydrogen 2.773 N/A GLN 107.A NE2 GLU 45.A O.B no hydrogen 2.840 N/A GLN 107.A NE2 ASN 46.A OD1 no hydrogen 3.666 N/A ILE 110.A N LEU 49.A O no hydrogen 2.870 N/A ARG 111.A NE GLN 51.A OE1 no hydrogen 2.962 N/A ARG 111.A NH1 GLN 51.A OE1 no hydrogen 3.524 N/A LYS 112.A N GLN 51.A O no hydrogen 2.932 N/A LYS 112.A NZ ASP 14.A OD1 no hydrogen 2.738 N/A LYS 112.A NZ ASP 52.A OD1 no hydrogen 3.084 N/A LYS 112.A NZ SER 120.A O no hydrogen 3.340 N/A LYS 112.A NZ TYR 121.A O no hydrogen 3.205 N/A HIS 115.A ND1 GLU 126.A OE1 no hydrogen 2.842 N/A HIS 115.A ND1 GLU 126.A OE2 no hydrogen 2.968 N/A ILE 118.A N HIS 115.A O no hydrogen 3.220 N/A ASP 119.A N TYR 78.A OH no hydrogen 3.216 N/A SER 120.A N ASP 119.A OD1 no hydrogen 2.719 N/A SER 120.A OG SER 122.A O no hydrogen 2.756 N/A SER 120.A OG MET 125.A O no hydrogen 3.569 N/A SER 122.A OG TRP 160.A O no hydrogen 3.563 N/A SER 122.A OG ASP 164.A OD2 no hydrogen 2.599 N/A ALA 123.A N THR 161.A OG1 no hydrogen 3.031 N/A PHE 124.A N SER 122.A OG no hydrogen 2.925 N/A MET 125.A N SER 122.A OG no hydrogen 3.336 N/A GLU 126.A N THR 131.A O no hydrogen 2.921 N/A ALA 127.A N ASP 119.A O no hydrogen 2.800 N/A HIS 129.A N.A GLU 126.A O no hydrogen 2.990 N/A HIS 129.A N.B GLU 126.A O no hydrogen 2.943 N/A THR 130.A N ASP 128.A OD2 no hydrogen 3.085 N/A THR 131.A N ASP 128.A OD2 no hydrogen 2.880 N/A THR 131.A OG1 ASP 128.A OD1 no hydrogen 2.594 N/A THR 131.A OG1 ASP 128.A OD2 no hydrogen 3.512 N/A THR 133.A N PHE 124.A O no hydrogen 3.145 N/A THR 133.A OG1 ALA 123.A O no hydrogen 2.638 N/A LEU 135.A N THR 133.A OG1 no hydrogen 3.215 N/A TYR 138.A N GLY 134.A O no hydrogen 3.032 N/A LEU 139.A N LEU 135.A O no hydrogen 2.917 N/A LYS 140.A N.A THR 136.A O no hydrogen 2.945 N/A LYS 140.A N.B THR 136.A O no hydrogen 2.939 N/A LYS 140.A NZ.A GLN 168.A O no hydrogen 3.031 N/A LYS 140.A NZ.B GLN 168.A O no hydrogen 2.998 N/A GLU 141.A N GLY 137.A O no hydrogen 3.060 N/A ARG 142.A N TYR 138.A O no hydrogen 3.177 N/A ARG 142.A NH1 GLN 107.A OE1 no hydrogen 2.838 N/A ARG 142.A NH1 TYR 138.A OH no hydrogen 2.823 N/A ARG 142.A NH2 GLN 107.A OE1 no hydrogen 3.350 N/A GLY 143.A N LYS 140.A O.A no hydrogen 3.224 N/A GLY 143.A N LYS 140.A O.B no hydrogen 2.926 N/A ILE 144.A N LEU 139.A O no hydrogen 2.970 N/A ASP 145.A N ASN 7.A O no hydrogen 2.780 N/A THR 146.A N ASN 7.A O no hydrogen 3.135 N/A THR 146.A OG1 ASP 145.A OD1 no hydrogen 2.911 N/A VAL 147.A N.A LYS 171.A O no hydrogen 2.751 N/A VAL 147.A N.B LYS 171.A O no hydrogen 2.752 N/A TYR 148.A N ALA 9.A O no hydrogen 2.897 N/A VAL 149.A N LEU 173.A O no hydrogen 2.780 N/A VAL 150.A N VAL 11.A O no hydrogen 3.096 N/A GLY 151.A N ALA 178.A O no hydrogen 3.006 N/A ILE 152.A N VAL 13.A O no hydrogen 2.954 N/A THR 154.A N LYS 180.A O no hydrogen 2.915 N/A ASP 155.A N ASP 155.A OD1 no hydrogen 2.555 N/A PHE 156.A N ALA 153.A O no hydrogen 3.030 N/A CYS 157.A SG.A ASP 14.A OD1 no hydrogen 3.465 N/A CYS 157.A SG.A TYR 121.A O no hydrogen 3.300 N/A VAL 158.A N ALA 153.A O no hydrogen 3.004 N/A ALA 159.A N THR 154.A O no hydrogen 2.897 N/A TRP 160.A N PHE 156.A O no hydrogen 2.850 N/A THR 161.A N CYS 157.A O.A no hydrogen 3.048 N/A THR 161.A OG1 CYS 157.A O.A no hydrogen 2.679 N/A ALA 162.A N VAL 158.A O no hydrogen 2.859 N/A LEU 163.A N ALA 159.A O no hydrogen 2.842 N/A ASP 164.A N TRP 160.A O no hydrogen 2.942 N/A ALA 165.A N THR 161.A O no hydrogen 2.923 N/A VAL 166.A N ALA 162.A O no hydrogen 3.084 N/A LYS 167.A N LEU 163.A O no hydrogen 3.073 N/A GLN 168.A N ASP 164.A O no hydrogen 2.996 N/A GLN 168.A N ALA 165.A O no hydrogen 3.171 N/A GLY 169.A N VAL 166.A O no hydrogen 3.018 N/A PHE 170.A N ALA 165.A O no hydrogen 3.035 N/A LYS 171.A N ASP 145.A O no hydrogen 2.982 N/A THR 172.A OG1 PHE 170.A O no hydrogen 2.946 N/A LEU 173.A N VAL 147.A O.A no hydrogen 2.915 N/A LEU 173.A N VAL 147.A O.B no hydrogen 2.907 N/A VAL 174.A N VAL 201.A O no hydrogen 2.847 N/A ILE 175.A N VAL 149.A O no hydrogen 3.130 N/A GLU 176.A N ILE 203.A O no hydrogen 2.833 N/A ALA 178.A N ILE 175.A O no hydrogen 2.920 N/A CYS 179.A N GLU 176.A O no hydrogen 3.095 N/A CYS 179.A SG ILE 175.A O no hydrogen 3.452 N/A LYS 180.A N GLY 151.A O no hydrogen 3.162 N/A ILE 182.A N.A ASP 155.A OD1 no hydrogen 2.941 N/A ILE 182.A N.B ASP 155.A OD1 no hydrogen 2.941 N/A ASP 183.A N ASP 155.A OD2 no hydrogen 2.683 N/A LEU 184.A N.A SER 187.A OG no hydrogen 2.812 N/A LEU 184.A N.B SER 187.A OG no hydrogen 2.772 N/A SER 187.A N LEU 184.A O.A no hydrogen 2.973 N/A SER 187.A N LEU 184.A O.B no hydrogen 3.248 N/A SER 187.A OG ASP 155.A OD2 no hydrogen 2.602 N/A SER 187.A OG LEU 184.A O.A no hydrogen 3.223 N/A SER 187.A OG LEU 184.A O.B no hydrogen 3.399 N/A LEU 188.A N ASP 183.A OD1 no hydrogen 3.053 N/A GLN 190.A N GLY 186.A O no hydrogen 3.310 N/A GLN 190.A NE2 THR 194.A OG1 no hydrogen 3.097 N/A ALA 191.A N SER 187.A O no hydrogen 2.841 N/A TRP 192.A N LEU 188.A O no hydrogen 3.148 N/A GLN 193.A N GLU 189.A O.A no hydrogen 2.987 N/A GLN 193.A N GLU 189.A O.B no hydrogen 3.076 N/A THR 194.A N GLN 190.A O no hydrogen 2.857 N/A THR 194.A OG1 GLN 190.A O no hydrogen 3.089 N/A MET 195.A N ALA 191.A O no hydrogen 2.876 N/A GLN 196.A N TRP 192.A O no hydrogen 2.809 N/A GLN 197.A N GLN 193.A O no hydrogen 2.925 N/A GLN 197.A NE2 GLN 193.A OE1 no hydrogen 3.377 N/A GLN 198.A N THR 194.A O no hydrogen 3.022 N/A GLY 199.A N GLN 196.A O no hydrogen 3.074 N/A VAL 200.A N MET 195.A O no hydrogen 3.043 N/A VAL 201.A N THR 172.A O no hydrogen 2.902 N/A ARG 202.A NE GLU 176.A OE2 no hydrogen 3.022 N/A ARG 202.A NH2 GLU 176.A OE1 no hydrogen 2.823 N/A ILE 203.A N VAL 174.A O no hydrogen 2.981 N/A GLN 204.A N ASP 207.A OD2 no hydrogen 2.937 N/A GLN 204.A NE2 GLU 176.A OE2 no hydrogen 2.880 N/A SER 205.A N ASP 177.A OD2 no hydrogen 2.731 N/A SER 205.A OG ASP 177.A OD1 no hydrogen 2.453 N/A SER 205.A OG ASP 177.A OD2 no hydrogen 3.456 N/A ASP 207.A N GLN 204.A O no hydrogen 2.997 N/A LEU 208.A N.B SER 205.A O no hydrogen 3.087 N/A LEU 209.A N SER 205.A O no hydrogen 2.792 N/A ASN 210.A N THR 206.A O no hydrogen 2.994 N/A GLU 211.A N LEU 208.A O.A no hydrogen 2.995 N/A GLU 211.A N LEU 208.A O.B no hydrogen 3.009 N/A CYS 212.A N LEU 209.A O no hydrogen 3.262 N/A