Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3l6n_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 4.A N VAL 2.A O no hydrogen 2.972 N/A VAL 6.A N LYS 19.A O no hydrogen 2.960 N/A GLU 8.A N ILE 17.A O no hydrogen 2.944 N/A ILE 11.A N.A LEU 15.A O no hydrogen 2.768 N/A ILE 11.A N.B LEU 15.A O no hydrogen 2.762 N/A LYS 12.A NZ LYS 150.A O no hydrogen 2.949 N/A ASN 14.A N LYS 12.A O no hydrogen 2.799 N/A ASN 14.A ND2 GLU 128.A OE2 no hydrogen 3.063 N/A LEU 15.A N ILE 11.A O.A no hydrogen 3.272 N/A LEU 15.A N ILE 11.A O.B no hydrogen 3.222 N/A HIS 16.A N TYR 35.A O no hydrogen 2.812 N/A HIS 16.A ND1 ASN 14.A O no hydrogen 3.066 N/A TYR 18.A N SER 33.A O no hydrogen 2.860 N/A TYR 18.A OH ASP 46.A O no hydrogen 2.706 N/A LYS 19.A N VAL 6.A O no hydrogen 2.754 N/A LYS 19.A NZ SER 30.A OG.B no hydrogen 3.365 N/A LYS 19.A NZ ASN 32.A OD1 no hydrogen 2.759 N/A THR 20.A N ALA 31.A O no hydrogen 3.020 N/A GLY 22.A N TYR 29.A O no hydrogen 2.977 N/A PHE 24.A N LYS 27.A O no hydrogen 2.888 N/A LYS 27.A N PHE 24.A O no hydrogen 3.203 N/A TYR 29.A N GLY 22.A O no hydrogen 2.779 N/A ALA 31.A N THR 20.A O no hydrogen 2.877 N/A ASN 32.A N GLY 199.A O no hydrogen 2.706 N/A ASN 32.A ND2 PRO 198.A O no hydrogen 2.926 N/A ASN 32.A ND2 ASP 201.A O no hydrogen 2.871 N/A SER 33.A N TYR 18.A O no hydrogen 2.802 N/A MET 34.A N PHE 45.A O no hydrogen 3.099 N/A TYR 35.A N HIS 16.A O no hydrogen 2.832 N/A TYR 35.A OH HIS 65.A NE2 no hydrogen 2.825 N/A LEU 36.A N VAL 43.A O no hydrogen 2.824 N/A VAL 37.A N ASN 14.A O no hydrogen 2.905 N/A THR 38.A N GLY 41.A O no hydrogen 2.974 N/A THR 38.A OG1 GLY 41.A O no hydrogen 2.806 N/A LYS 39.A N GLY 126.A O no hydrogen 2.889 N/A LYS 40.A N THR 38.A OG1 no hydrogen 3.019 N/A GLY 41.A N THR 38.A O no hydrogen 3.198 N/A VAL 42.A N PRO 68.A O no hydrogen 2.785 N/A VAL 43.A N LEU 36.A O no hydrogen 2.911 N/A LEU 44.A N ALA 71.A O no hydrogen 2.846 N/A PHE 45.A N MET 34.A O no hydrogen 2.781 N/A ASP 46.A N PHE 73.A O no hydrogen 2.803 N/A VAL 47.A N ARG 81.A O.A no hydrogen 3.117 N/A VAL 47.A N ARG 81.A O.B no hydrogen 3.115 N/A TRP 49.A N THR 20.A OG1 no hydrogen 3.001 N/A LYS 51.A NZ ASP 84.A OD2 no hydrogen 3.563 N/A GLN 53.A N GLU 50.A O no hydrogen 2.908 N/A GLN 53.A NE2 VAL 2.A O no hydrogen 2.989 N/A GLN 53.A NE2 ASP 4.A OD2 no hydrogen 2.844 N/A TYR 54.A N LYS 51.A O no hydrogen 3.208 N/A GLN 55.A NE2 ASP 59.A OD1 no hydrogen 2.916 N/A LEU 57.A N GLN 53.A O no hydrogen 2.989 N/A MET 58.A N.A TYR 54.A O no hydrogen 3.133 N/A MET 58.A N.B TYR 54.A O no hydrogen 3.132 N/A ASP 59.A N GLN 55.A O no hydrogen 2.840 N/A THR 60.A N SER 56.A O.A no hydrogen 2.949 N/A THR 60.A N SER 56.A O.B no hydrogen 2.961 N/A THR 60.A OG1 SER 56.A O.A no hydrogen 3.029 N/A THR 60.A OG1 SER 56.A O.B no hydrogen 3.044 N/A ILE 61.A N LEU 57.A O no hydrogen 2.908 N/A LYS 62.A N MET 58.A O.A no hydrogen 2.930 N/A LYS 62.A N MET 58.A O.B no hydrogen 2.932 N/A LYS 62.A NZ ASN 66.A O no hydrogen 3.457 N/A LYS 62.A NZ ASN 66.A OD1 no hydrogen 2.980 N/A LYS 63.A N ASP 59.A O no hydrogen 3.019 N/A ARG 64.A N THR 60.A O no hydrogen 2.939 N/A HIS 65.A N ILE 61.A O no hydrogen 2.859 N/A HIS 65.A NE2 TYR 35.A OH no hydrogen 2.825 N/A ASN 66.A N LYS 62.A O no hydrogen 2.738 N/A VAL 70.A N VAL 42.A O no hydrogen 2.832 N/A VAL 72.A N LYS 94.A O no hydrogen 2.963 N/A PHE 73.A N LEU 44.A O no hydrogen 2.776 N/A ALA 74.A N TYR 96.A O no hydrogen 2.934 N/A THR 75.A N ASP 46.A OD1 no hydrogen 2.828 N/A THR 75.A OG1 ASP 46.A OD1 no hydrogen 3.324 N/A THR 75.A OG1 ASP 46.A OD2 no hydrogen 2.648 N/A HIS 76.A NE2 HIS 78.A ND1 no hydrogen 3.132 N/A HIS 78.A NE2 GLU 173.A OE1 no hydrogen 2.794 N/A ARG 81.A N.A HIS 78.A O no hydrogen 2.902 N/A ARG 81.A N.B HIS 78.A O no hydrogen 2.895 N/A ARG 81.A NE.A ASP 80.A O no hydrogen 2.833 N/A ARG 81.A NE.B ASP 80.A OD2 no hydrogen 2.926 N/A ARG 81.A NH1.B ASN 32.A O no hydrogen 3.024 N/A ARG 81.A NH1.B ASP 46.A OD2 no hydrogen 3.185 N/A ARG 81.A NH2.A ASN 32.A O no hydrogen 2.740 N/A ARG 81.A NH2.A ASP 80.A O no hydrogen 3.499 N/A ARG 81.A NH2.B ASP 80.A OD2 no hydrogen 3.144 N/A ARG 81.A NH2.B GLY 199.A O no hydrogen 2.712 N/A ALA 82.A N HIS 76.A O no hydrogen 3.186 N/A GLY 83.A N HIS 78.A O no hydrogen 3.300 N/A ASP 84.A N TYR 54.A OH no hydrogen 2.896 N/A SER 86.A N ASP 84.A OD1 no hydrogen 3.056 N/A SER 86.A OG ASP 84.A OD1 no hydrogen 2.640 N/A SER 86.A OG ASP 84.A OD2 no hydrogen 3.194 N/A PHE 87.A N ASP 84.A O no hydrogen 3.305 N/A PHE 88.A N LEU 85.A O no hydrogen 3.093 N/A ASN 89.A N LEU 85.A O no hydrogen 2.874 N/A ASN 89.A ND2 THR 112.A O no hydrogen 2.978 N/A ASN 90.A N SER 86.A O no hydrogen 2.811 N/A LYS 91.A N PHE 88.A O no hydrogen 3.077 N/A LYS 91.A NZ GLN 55.A OE1 no hydrogen 3.031 N/A GLY 92.A N ASN 89.A O no hydrogen 2.968 N/A ILE 93.A N PHE 88.A O no hydrogen 3.030 N/A THR 95.A N THR 114.A OG1 no hydrogen 3.378 N/A THR 95.A OG1 ASN 89.A OD1 no hydrogen 2.663 N/A TYR 96.A N VAL 72.A O no hydrogen 2.716 N/A ALA 97.A N GLU 115.A O no hydrogen 3.291 N/A THR 98.A OG1 THR 101.A OG1 no hydrogen 3.108 N/A THR 101.A N THR 98.A OG1 no hydrogen 3.032 N/A THR 101.A OG1 THR 98.A OG1 no hydrogen 3.108 N/A THR 101.A OG1 ASP 142.A OD2 no hydrogen 2.675 N/A ASN 102.A N THR 98.A O no hydrogen 2.970 N/A ASN 102.A ND2 SER 113.A OG no hydrogen 2.851 N/A GLU 103.A N ALA 99.A O no hydrogen 2.917 N/A PHE 104.A N LYS 100.A O no hydrogen 3.086 N/A LEU 105.A N THR 101.A O no hydrogen 2.902 N/A LYS 106.A N ASN 102.A O no hydrogen 2.916 N/A LYS 107.A N GLU 103.A O no hydrogen 3.026 N/A ASP 108.A N PHE 104.A O no hydrogen 2.931 N/A GLY 109.A N LYS 106.A O no hydrogen 3.020 N/A LYS 110.A N LEU 105.A O no hydrogen 2.781 N/A LYS 110.A NZ SER 77.A O no hydrogen 3.506 N/A LYS 110.A NZ ASP 79.A OD2 no hydrogen 3.054 N/A SER 113.A N ASN 102.A OD1 no hydrogen 2.922 N/A SER 113.A OG GLU 115.A O no hydrogen 2.711 N/A THR 114.A N THR 95.A O no hydrogen 3.203 N/A THR 114.A N THR 95.A OG1 no hydrogen 2.995 N/A THR 114.A OG1 GLU 115.A OE1 no hydrogen 2.959 N/A GLU 115.A N THR 95.A O no hydrogen 2.834 N/A ILE 117.A N ALA 97.A O no hydrogen 2.923 N/A LYS 118.A N TYR 123.A OH.A no hydrogen 2.888 N/A GLY 120.A N VAL 132.A O no hydrogen 2.744 N/A TYR 123.A N.A PHE 130.A O no hydrogen 2.774 N/A TYR 123.A N.B PHE 130.A O no hydrogen 2.782 N/A TYR 123.A OH.B TYR 96.A OH no hydrogen 2.502 N/A ILE 125.A N GLU 128.A O no hydrogen 3.047 N/A GLU 128.A N ILE 125.A O no hydrogen 2.917 N/A PHE 130.A N TYR 123.A O.A no hydrogen 2.963 N/A PHE 130.A N TYR 123.A O.B no hydrogen 3.010 N/A VAL 131.A N.A TRP 147.A O no hydrogen 2.931 N/A VAL 131.A N.B TRP 147.A O no hydrogen 2.953 N/A ASP 133.A N VAL 145.A O no hydrogen 2.844 N/A GLY 138.A N THR 140.A O no hydrogen 2.983 N/A THR 140.A N ASN 143.A OD1 no hydrogen 3.115 N/A THR 140.A OG1 ASP 142.A OD1 no hydrogen 2.742 N/A ASN 143.A ND2 GLY 136.A O no hydrogen 3.113 N/A ASN 143.A ND2 ASN 143.A O no hydrogen 2.737 N/A VAL 144.A N THR 75.A O no hydrogen 3.031 N/A VAL 145.A N ASP 133.A O no hydrogen 2.929 N/A VAL 146.A N ASP 155.A O no hydrogen 3.019 N/A TRP 147.A N VAL 131.A O.A no hydrogen 2.810 N/A TRP 147.A N VAL 131.A O.B no hydrogen 2.956 N/A PHE 148.A N VAL 153.A O no hydrogen 3.013 N/A TYR 151.A N PHE 148.A O no hydrogen 2.965 N/A TYR 151.A OH GLU 128.A OE1 no hydrogen 2.698 N/A LEU 154.A N LEU 195.A O no hydrogen 2.909 N/A ASP 155.A N VAL 146.A O no hydrogen 2.744 N/A GLY 156.A N ILE 197.A O no hydrogen 2.798 N/A GLY 157.A N ASP 155.A OD1 no hydrogen 3.326 N/A CYS 158.A SG.A ASP 80.A OD2 no hydrogen 3.550 N/A CYS 158.A SG.A HIS 200.A NE2.A no hydrogen 3.552 N/A CYS 158.A SG.B ASP 80.A OD2 no hydrogen 3.853 N/A VAL 160.A N GLY 157.A O no hydrogen 3.064 N/A LYS 161.A N THR 212.A OG1 no hydrogen 2.853 N/A LYS 161.A NZ LEU 168.A O no hydrogen 3.217 N/A SER 162.A OG SER 164.A OG.B no hydrogen 2.869 N/A SER 162.A OG GLU 202.A O no hydrogen 2.567 N/A ASN 163.A N HIS 208.A ND1 no hydrogen 2.959 N/A ASN 163.A ND2 LYS 204.A O no hydrogen 2.974 N/A ASN 163.A ND2 GLY 206.A O no hydrogen 2.763 N/A SER 164.A N.A SER 162.A OG no hydrogen 3.054 N/A SER 164.A N.B SER 162.A OG no hydrogen 3.043 N/A SER 164.A OG.A ASN 163.A OD1 no hydrogen 2.999 N/A SER 164.A OG.B SER 162.A OG no hydrogen 2.869 N/A ALA 165.A N SER 162.A O no hydrogen 2.931 N/A GLY 169.A N ASP 167.A OD1 no hydrogen 3.094 N/A ALA 174.A N ILE 171.A O no hydrogen 3.089 N/A ASN 175.A N GLY 138.A O no hydrogen 2.808 N/A ASN 175.A ND2 GLU 137.A OE1 no hydrogen 2.911 N/A GLN 178.A N ASN 175.A OD1 no hydrogen 3.111 N/A GLN 178.A NE2 GLU 177.A OE1 no hydrogen 2.687 N/A TRP 179.A N ASN 175.A O no hydrogen 2.971 N/A TRP 179.A NE1 LEU 159.A O no hydrogen 2.819 N/A THR 182.A N GLN 178.A O no hydrogen 2.877 N/A THR 182.A OG1 GLU 137.A O no hydrogen 2.638 N/A THR 182.A OG1 GLN 178.A O no hydrogen 3.263 N/A ILE 183.A N TRP 179.A O no hydrogen 2.863 N/A ASN 184.A N PRO 180.A O no hydrogen 2.828 N/A LYS 185.A N LYS 181.A O no hydrogen 3.025 N/A LEU 186.A N THR 182.A O no hydrogen 2.968 N/A LYS 187.A N ILE 183.A O no hydrogen 2.840 N/A LYS 187.A NZ GLU 210.A OE2 no hydrogen 2.717 N/A ALA 188.A N ASN 184.A O no hydrogen 3.080 N/A LYS 189.A N LYS 185.A O no hydrogen 3.009 N/A LYS 189.A N LEU 186.A O no hydrogen 3.066 N/A TYR 190.A N LEU 186.A O no hydrogen 2.953 N/A TYR 190.A OH ASP 133.A OD1 no hydrogen 2.369 N/A ALA 193.A N TYR 190.A O no hydrogen 3.225 N/A THR 194.A N ASN 152.A O no hydrogen 2.903 N/A THR 194.A OG1 ASN 152.A O no hydrogen 3.394 N/A ILE 197.A N LEU 154.A O no hydrogen 2.847 N/A GLY 199.A N GLY 157.A O no hydrogen 2.868 N/A GLY 199.A N VAL 160.A O no hydrogen 3.428 N/A HIS 200.A ND1.A SER 30.A O.A no hydrogen 3.055 N/A HIS 200.A NE2.B ASP 80.A OD2 no hydrogen 2.838 N/A ASP 201.A N SER 30.A O.B no hydrogen 3.159 N/A GLU 202.A N SER 164.A OG.B no hydrogen 3.333 N/A TRP 203.A NE1 GLU 8.A OE2 no hydrogen 2.880 N/A HIS 208.A NE2 TRP 203.A O no hydrogen 2.808 N/A HIS 211.A N GLY 207.A O no hydrogen 3.075 N/A HIS 211.A ND1 SER 162.A O no hydrogen 3.176 N/A THR 212.A N HIS 208.A O no hydrogen 2.890 N/A THR 212.A OG1 LYS 161.A O no hydrogen 3.263 N/A THR 212.A OG1 HIS 208.A O no hydrogen 2.817 N/A LEU 213.A N VAL 209.A O no hydrogen 3.192 N/A GLU 214.A N GLU 210.A O no hydrogen 3.082 N/A LEU 215.A N HIS 211.A O no hydrogen 2.948 N/A LEU 216.A N THR 212.A O no hydrogen 3.028 N/A ASN 217.A N LEU 213.A O no hydrogen 3.032 N/A LYS 218.A N GLU 214.A O no hydrogen 3.014 N/A