Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4tw3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 6.A N ASP 4.A OD1 no hydrogen 2.997 N/A THR 6.A OG1 ASP 4.A OD1 no hydrogen 2.687 N/A SER 7.A N ASP 4.A O no hydrogen 3.219 N/A SER 7.A OG ASP 4.A O no hydrogen 3.266 N/A TYR 10.A N SER 7.A OG no hydrogen 2.921 N/A LYS 11.A N SER 7.A O no hydrogen 2.914 N/A ASP 12.A N ASP 8.A O no hydrogen 2.918 N/A ALA 13.A N ARG 9.A O no hydrogen 3.293 N/A TYR 14.A N TYR 10.A O no hydrogen 2.826 N/A TYR 14.A OH TYR 118.A OH no hydrogen 2.747 N/A SER 15.A N LYS 11.A O no hydrogen 2.881 N/A SER 15.A N ASP 12.A O no hydrogen 3.249 N/A SER 15.A OG ASP 12.A O no hydrogen 2.620 N/A ARG 16.A N ALA 13.A O no hydrogen 3.193 N/A ARG 16.A NE ASP 180.A OD2 no hydrogen 2.737 N/A ARG 16.A NH1 ASP 12.A OD1 no hydrogen 3.022 N/A ARG 16.A NH1 ASP 12.A OD2 no hydrogen 3.551 N/A ARG 16.A NH2 ASP 12.A OD2 no hydrogen 2.869 N/A ARG 16.A NH2 ASP 180.A OD1 no hydrogen 2.855 N/A ILE 17.A N ALA 13.A O no hydrogen 3.046 N/A ASN 18.A N TYR 14.A O no hydrogen 2.717 N/A ALA 19.A N SER 15.A O no hydrogen 3.387 N/A ILE 20.A N ARG 16.A O no hydrogen 2.935 N/A VAL 21.A N ILE 17.A O no hydrogen 3.086 N/A ILE 22.A N ASN 18.A O no hydrogen 2.994 N/A GLU 23.A N ALA 19.A O no hydrogen 2.876 N/A GLY 24.A N ILE 20.A O no hydrogen 2.802 N/A GLU 25.A N VAL 21.A O no hydrogen 2.944 N/A GLN 26.A N ILE 22.A O no hydrogen 3.040 N/A GLN 26.A NE2 ASP 30.A OD1 no hydrogen 2.995 N/A GLN 26.A NE2 ASP 30.A OD2 no hydrogen 3.532 N/A GLU 27.A N GLU 23.A O no hydrogen 2.838 N/A ALA 28.A N GLY 24.A O no hydrogen 2.821 N/A HIS 29.A N GLU 25.A O no hydrogen 2.969 N/A HIS 29.A ND1 ASP 30.A OD1 no hydrogen 2.769 N/A ASP 30.A N GLN 26.A O no hydrogen 2.975 N/A ASN 31.A N GLU 27.A O no hydrogen 2.748 N/A ASN 31.A ND2 GLN 103.A OE1 no hydrogen 2.912 N/A TYR 32.A N ALA 28.A O no hydrogen 2.949 N/A TYR 32.A OH GLU 108.A OE2 no hydrogen 2.638 N/A ILE 33.A N HIS 29.A O no hydrogen 3.142 N/A ALA 34.A N ASP 30.A O no hydrogen 2.860 N/A ILE 35.A N ASN 31.A O no hydrogen 2.890 N/A GLY 36.A N TYR 32.A O no hydrogen 3.188 N/A THR 37.A N ALA 34.A O no hydrogen 2.939 N/A THR 37.A OG1 ALA 34.A O no hydrogen 2.606 N/A LEU 38.A N ILE 35.A O no hydrogen 2.910 N/A LEU 39.A N ILE 35.A O no hydrogen 2.854 N/A ASP 41.A N ASP 41.A OD1 no hydrogen 2.720 N/A HIS 42.A N LEU 39.A O no hydrogen 2.848 N/A HIS 42.A ND1 TYR 143.A OH no hydrogen 2.761 N/A VAL 43.A N PRO 40.A O no hydrogen 3.459 N/A LEU 46.A N HIS 42.A O no hydrogen 2.865 N/A LYS 47.A N VAL 43.A O no hydrogen 2.861 N/A LYS 47.A NZ GLU 44.A OE1 no hydrogen 2.901 N/A LYS 47.A NZ GLU 44.A OE2 no hydrogen 3.456 N/A ARG 48.A N GLU 44.A O no hydrogen 3.199 N/A LEU 49.A N GLU 45.A O no hydrogen 2.987 N/A ALA 50.A N LEU 46.A O no hydrogen 2.853 N/A LYS 51.A N LYS 47.A O no hydrogen 2.905 N/A MET 52.A N ARG 48.A O no hydrogen 3.124 N/A GLU 53.A N LEU 49.A O no hydrogen 3.157 N/A MET 54.A N ALA 50.A O no hydrogen 3.114 N/A ARG 55.A N LYS 51.A O no hydrogen 3.059 N/A ARG 55.A NH2 GLY 132.A O no hydrogen 2.814 N/A ARG 55.A NH2 ASP 136.A OD2 no hydrogen 2.695 N/A HIS 56.A N MET 52.A O no hydrogen 2.887 N/A HIS 56.A ND1 GLU 25.A OE1 no hydrogen 3.132 N/A HIS 56.A NE2 ASP 136.A OD2 no hydrogen 2.742 N/A LYS 57.A N GLU 53.A O no hydrogen 2.835 N/A LYS 57.A NZ GLN 26.A OE1 no hydrogen 2.711 N/A LYS 58.A N MET 54.A O no hydrogen 2.953 N/A GLY 59.A N ARG 55.A O no hydrogen 2.964 N/A PHE 60.A N HIS 56.A O no hydrogen 2.856 N/A THR 61.A N LYS 57.A O no hydrogen 2.877 N/A THR 61.A OG1 LYS 57.A O no hydrogen 2.914 N/A ALA 62.A N LYS 58.A O no hydrogen 3.054 N/A CYS 63.A N GLY 59.A O no hydrogen 3.016 N/A CYS 63.A SG GLY 59.A O no hydrogen 3.485 N/A GLY 64.A N PHE 60.A O no hydrogen 3.262 N/A LYS 65.A N THR 61.A O no hydrogen 3.096 N/A ASN 66.A N ALA 62.A O no hydrogen 2.837 N/A LEU 67.A N CYS 63.A O no hydrogen 3.300 N/A LEU 67.A N GLY 64.A O no hydrogen 3.198 N/A GLY 68.A N LYS 65.A O no hydrogen 2.978 N/A VAL 69.A N GLY 64.A O no hydrogen 2.926 N/A ASP 72.A N SER 15.A O no hydrogen 2.902 N/A PHE 75.A N ASP 72.A OD1 no hydrogen 3.259 N/A ALA 76.A N ASP 72.A O no hydrogen 3.231 N/A ARG 77.A N MET 73.A O no hydrogen 2.900 N/A ARG 77.A NH2 ASP 74.A OD1 no hydrogen 2.764 N/A GLU 78.A N ASP 74.A O no hydrogen 3.098 N/A PHE 79.A N PHE 75.A O no hydrogen 3.011 N/A PHE 80.A N ALA 76.A O no hydrogen 3.162 N/A ALA 81.A N GLU 78.A O no hydrogen 3.133 N/A ARG 84.A N PHE 80.A O no hydrogen 2.802 N/A ARG 84.A NH1.A GLU 27.A OE2 no hydrogen 2.937 N/A ARG 84.A NH1.A ARG 77.A O no hydrogen 2.918 N/A ARG 84.A NH2.A ARG 77.A O no hydrogen 3.420 N/A ASP 85.A N ALA 81.A O no hydrogen 2.786 N/A ASN 86.A N PRO 82.A O no hydrogen 3.155 N/A ASN 86.A ND2 ASN 166.A OD1 no hydrogen 2.839 N/A PHE 87.A N LEU 83.A O no hydrogen 2.922 N/A GLN 88.A N ARG 84.A O no hydrogen 2.856 N/A THR 89.A N ASP 85.A O no hydrogen 2.904 N/A THR 89.A OG1 ASP 85.A O no hydrogen 3.042 N/A ALA 90.A N ASN 86.A O no hydrogen 3.042 N/A LEU 91.A N PHE 87.A O no hydrogen 2.857 N/A GLY 92.A N GLN 88.A O no hydrogen 2.982 N/A GLN 93.A N THR 89.A O no hydrogen 3.199 N/A GLN 93.A N ALA 90.A O no hydrogen 3.106 N/A GLY 94.A N LEU 91.A O no hydrogen 3.006 N/A LYS 95.A N ALA 90.A O no hydrogen 2.893 N/A LYS 95.A NZ GLN 93.A OE1 no hydrogen 3.227 N/A THR 96.A N GLY 94.A O no hydrogen 3.020 N/A THR 96.A OG1 GLY 94.A O no hydrogen 3.562 N/A THR 98.A N GLU 158.A OE2 no hydrogen 3.035 N/A THR 98.A OG1 GLU 158.A OE2 no hydrogen 2.664 N/A CYS 99.A N LYS 95.A O no hydrogen 3.073 N/A CYS 99.A SG PHE 87.A O no hydrogen 3.980 N/A CYS 99.A SG LYS 95.A O no hydrogen 3.655 N/A LEU 100.A N THR 96.A O no hydrogen 2.887 N/A LEU 101.A N PRO 97.A O no hydrogen 2.842 N/A ILE 102.A N THR 98.A O no hydrogen 2.897 N/A GLN 103.A N CYS 99.A O no hydrogen 2.985 N/A GLN 103.A NE2 GLU 108.A OE2 no hydrogen 3.071 N/A ALA 104.A N LEU 100.A O no hydrogen 2.801 N/A LEU 105.A N LEU 100.A O no hydrogen 3.185 N/A LEU 106.A N LEU 101.A O no hydrogen 2.859 N/A ILE 107.A N ILE 102.A O no hydrogen 2.982 N/A GLU 108.A N GLN 103.A O no hydrogen 3.211 N/A ALA 109.A N LEU 105.A O no hydrogen 2.916 N/A PHE 110.A N LEU 106.A O no hydrogen 2.969 N/A ALA 111.A N ILE 107.A O no hydrogen 2.813 N/A ILE 112.A N GLU 108.A O no hydrogen 2.828 N/A SER 113.A N ALA 109.A O no hydrogen 2.973 N/A SER 113.A OG LEU 191.A O no hydrogen 2.627 N/A ALA 114.A N PHE 110.A O no hydrogen 2.840 N/A TYR 115.A N ALA 111.A O no hydrogen 2.768 N/A TYR 115.A OH GLU 25.A OE2 no hydrogen 2.661 N/A HIS 116.A N ILE 112.A O no hydrogen 2.867 N/A HIS 116.A ND1 ASP 194.A OD2.B no hydrogen 2.730 N/A THR 117.A N SER 113.A O no hydrogen 2.951 N/A THR 117.A OG1 SER 113.A O no hydrogen 2.747 N/A TYR 118.A N ALA 114.A O no hydrogen 2.902 N/A ILE 119.A N TYR 115.A O no hydrogen 2.999 N/A VAL 121.A N TYR 118.A O no hydrogen 2.953 N/A SER 122.A N ILE 119.A O no hydrogen 3.226 N/A SER 122.A OG ILE 119.A O no hydrogen 2.716 N/A ALA 126.A N ASP 123.A OD1 no hydrogen 3.003 N/A ARG 127.A N ASP 123.A O no hydrogen 2.845 N/A ARG 127.A NE SER 122.A O no hydrogen 3.386 N/A ARG 127.A NE SER 122.A OG no hydrogen 3.308 N/A ARG 127.A NH2 SER 122.A O no hydrogen 2.881 N/A LYS 128.A N PRO 124.A O no hydrogen 3.460 N/A ILE 129.A N PHE 125.A O no hydrogen 3.291 N/A THR 130.A N ALA 126.A O no hydrogen 2.814 N/A THR 130.A OG1 ALA 126.A O no hydrogen 2.775 N/A GLU 131.A N ARG 127.A O no hydrogen 2.857 N/A GLY 132.A N LYS 128.A O no hydrogen 3.091 N/A VAL 133.A N THR 130.A O no hydrogen 3.087 N/A VAL 134.A N THR 130.A O no hydrogen 3.210 N/A GLU 137.A N VAL 133.A O no hydrogen 3.289 N/A TYR 138.A N VAL 134.A O no hydrogen 3.225 N/A THR 139.A N LYS 135.A O no hydrogen 3.226 N/A THR 139.A OG1 LYS 135.A O no hydrogen 3.371 N/A HIS 140.A N ASP 136.A O no hydrogen 3.055 N/A LEU 141.A N GLU 137.A O no hydrogen 2.922 N/A ASN 142.A N TYR 138.A O no hydrogen 2.848 N/A TYR 143.A N THR 139.A O no hydrogen 2.961 N/A TYR 143.A OH HIS 42.A ND1 no hydrogen 2.761 N/A GLY 144.A N HIS 140.A O no hydrogen 3.053 N/A GLU 145.A N LEU 141.A O no hydrogen 2.839 N/A ALA 146.A N ASN 142.A O no hydrogen 2.861 N/A TRP 147.A N TYR 143.A O no hydrogen 3.165 N/A LEU 148.A N GLY 144.A O no hydrogen 2.958 N/A LYS 149.A N GLU 145.A O no hydrogen 2.802 N/A LYS 149.A NZ GLU 205.A OE2 no hydrogen 2.976 N/A ALA 150.A N ALA 146.A O no hydrogen 3.016 N/A ASN 151.A N TRP 147.A O no hydrogen 3.053 N/A ASN 151.A N LEU 148.A O no hydrogen 3.240 N/A ASN 151.A ND2 TRP 147.A O no hydrogen 2.883 N/A SER 154.A N ASN 151.A O no hydrogen 3.108 N/A SER 154.A OG ASN 151.A O no hydrogen 2.869 N/A CYS 155.A N LEU 152.A O no hydrogen 3.109 N/A CYS 155.A SG ASN 151.A O no hydrogen 3.358 N/A ARG 156.A N.A LEU 152.A O no hydrogen 3.000 N/A ARG 156.A NE.A GLU 153.A OE1 no hydrogen 3.169 N/A ARG 156.A NE.A GLU 153.A OE2 no hydrogen 3.254 N/A ARG 156.A NH1.B GLU 153.A OE1 no hydrogen 3.027 N/A ARG 156.A NH1.B GLU 153.A OE2 no hydrogen 3.495 N/A ARG 156.A NH2.A GLU 153.A OE2 no hydrogen 2.778 N/A ARG 156.A NH2.B GLU 153.A OE2 no hydrogen 3.124 N/A LEU 159.A N CYS 155.A O no hydrogen 2.896 N/A LEU 160.A N ARG 156.A O.A no hydrogen 3.060 N/A LEU 160.A N ARG 156.A O.B no hydrogen 2.966 N/A GLU 161.A N GLU 157.A O no hydrogen 2.992 N/A ALA 162.A N GLU 158.A O no hydrogen 2.771 N/A ASN 163.A N LEU 159.A O no hydrogen 2.818 N/A ASN 163.A ND2 MET 216.A O no hydrogen 2.887 N/A ARG 164.A N.A LEU 160.A O no hydrogen 2.982 N/A ARG 164.A N.B LEU 160.A O no hydrogen 3.001 N/A ARG 164.A NH1.A GLU 161.A OE1 no hydrogen 3.430 N/A ARG 164.A NH2.B GLU 161.A OE1 no hydrogen 2.873 N/A GLU 165.A N GLU 161.A O no hydrogen 2.948 N/A ASN 166.A N ALA 162.A O no hydrogen 2.914 N/A ASN 166.A ND2 ALA 162.A O no hydrogen 2.920 N/A LEU 167.A N ASN 163.A O no hydrogen 2.832 N/A LEU 169.A N ASN 166.A O no hydrogen 2.978 N/A ILE 170.A N ASN 166.A O no hydrogen 3.237 N/A ARG 171.A N LEU 167.A O no hydrogen 3.091 N/A ARG 171.A NE ASP 175.A OD2 no hydrogen 3.227 N/A ARG 171.A NH1 ALA 220.A O no hydrogen 2.899 N/A ARG 171.A NH1 VAL 222.A O no hydrogen 2.786 N/A ARG 172.A N PRO 168.A O no hydrogen 2.910 N/A MET 173.A N LEU 169.A O no hydrogen 2.917 N/A LEU 174.A N ILE 170.A O no hydrogen 2.895 N/A ASP 175.A N ARG 171.A O no hydrogen 2.881 N/A GLN 176.A N ARG 172.A O no hydrogen 2.866 N/A VAL 177.A N MET 173.A O no hydrogen 2.945 N/A ALA 181.A N VAL 177.A O no hydrogen 2.821 N/A ALA 182.A N ALA 178.A O no hydrogen 2.862 N/A VAL 183.A N GLY 179.A O no hydrogen 3.211 N/A LEU 184.A N ASP 180.A O no hydrogen 3.154 N/A GLN 185.A N ALA 182.A O no hydrogen 2.861 N/A GLN 185.A NE2 ALA 1.A O no hydrogen 2.870 N/A MET 186.A N ALA 181.A O no hydrogen 2.968 N/A LYS 188.A NZ ASP 175.A OD1 no hydrogen 2.822 N/A GLU 189.A N ASP 187.A OD1 no hydrogen 2.929 N/A ASP 190.A N ASP 187.A O no hydrogen 3.055 N/A LEU 191.A N ASP 187.A O no hydrogen 3.205 N/A ILE 192.A N LYS 188.A O no hydrogen 2.888 N/A GLU 193.A N GLU 189.A O no hydrogen 2.953 N/A ASP 194.A N ASP 190.A O no hydrogen 2.971 N/A PHE 195.A N LEU 191.A O no hydrogen 3.075 N/A LEU 196.A N ILE 192.A O no hydrogen 2.901 N/A ILE 197.A N GLU 193.A O no hydrogen 2.962 N/A ALA 198.A N ASP 194.A O no hydrogen 3.020 N/A TYR 199.A N PHE 195.A O no hydrogen 2.892 N/A TYR 199.A OH ASN 163.A OD1 no hydrogen 2.605 N/A GLN 200.A N LEU 196.A O no hydrogen 2.764 N/A GLU 201.A N ILE 197.A O no hydrogen 2.922 N/A SER 202.A N ALA 198.A O no hydrogen 3.014 N/A SER 202.A OG.A GLU 145.A OE2 no hydrogen 2.809 N/A SER 202.A OG.A ALA 198.A O no hydrogen 3.004 N/A SER 202.A OG.B TYR 199.A O no hydrogen 2.690 N/A LEU 203.A N TYR 199.A O no hydrogen 2.966 N/A THR 204.A N GLN 200.A O no hydrogen 2.923 N/A THR 204.A OG1 GLN 200.A O no hydrogen 3.140 N/A GLU 205.A N GLU 201.A O no hydrogen 2.979 N/A ILE 206.A N SER 202.A O no hydrogen 2.921 N/A GLY 207.A N LEU 203.A O no hydrogen 3.134 N/A GLY 207.A N THR 204.A O no hydrogen 3.063 N/A PHE 208.A N LEU 203.A O no hydrogen 3.084 N/A ASN 209.A N GLU 212.A OE1 no hydrogen 2.876 N/A GLU 212.A N ASN 209.A OD1 no hydrogen 2.861 N/A ILE 213.A N ASN 209.A O no hydrogen 2.936 N/A THR 214.A N THR 210.A O no hydrogen 2.913 N/A THR 214.A OG1 THR 210.A O no hydrogen 2.831 N/A ARG 215.A N ARG 211.A O no hydrogen 2.999 N/A MET 216.A N GLU 212.A O no hydrogen 2.918 N/A ALA 217.A N ILE 213.A O no hydrogen 2.799 N/A ALA 218.A N THR 214.A O no hydrogen 3.022 N/A ALA 219.A N MET 216.A O no hydrogen 2.943 N/A ALA 220.A N ALA 217.A O no hydrogen 3.133 N/A LEU 221.A N ALA 218.A O no hydrogen 3.054 N/A VAL 222.A N ALA 219.A O no hydrogen 3.239 N/A