Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3r8b_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N ASN 181.A OD1 no hydrogen 2.776 N/A GLN 2.A N SER 182.A O no hydrogen 2.862 N/A GLN 2.A NE2 TRP 184.A O no hydrogen 3.691 N/A LYS 6.A N GLU 9.A OE1 no hydrogen 2.907 N/A GLU 9.A N LYS 6.A O no hydrogen 3.035 N/A HIS 11.A N ASP 186.A OD2 no hydrogen 2.840 N/A HIS 11.A ND1 MET 188.A O no hydrogen 2.956 N/A LYS 12.A NZ ASP 8.A OD1 no hydrogen 3.554 N/A SER 13.A N GLU 170.A O no hydrogen 2.736 N/A SER 13.A OG ASN 166.A OD1 no hydrogen 3.191 N/A SER 13.A OG TYR 169.A O no hydrogen 2.859 N/A SER 13.A OG GLU 170.A O no hydrogen 3.363 N/A SER 13.A OG GLU 170.A OE1 no hydrogen 3.398 N/A SER 14.A N GLU 170.A OE1 no hydrogen 3.066 N/A SER 14.A OG GLU 170.A OE1 no hydrogen 3.243 N/A SER 14.A OG GLU 170.A OE2 no hydrogen 2.718 N/A LYS 15.A N LYS 12.A O no hydrogen 2.916 N/A PHE 16.A N SER 13.A O no hydrogen 3.147 N/A THR 17.A N GLY 192.A O no hydrogen 3.088 N/A THR 17.A OG1 GLY 192.A O no hydrogen 3.277 N/A MET 20.A N ASN 165.A O no hydrogen 3.156 N/A GLU 21.A N PHE 164.A O no hydrogen 2.777 N/A ASN 22.A N LEU 19.A O no hydrogen 3.089 N/A ASN 22.A ND2 LEU 19.A O no hydrogen 3.381 N/A MET 23.A N MET 20.A O no hydrogen 2.803 N/A LYS 24.A N MET 20.A O no hydrogen 2.859 N/A VAL 25.A N GLU 21.A O no hydrogen 3.001 N/A LEU 26.A N MET 23.A O no hydrogen 3.085 N/A TYR 27.A N LYS 24.A O no hydrogen 3.125 N/A TYR 27.A OH TYR 204.A OH no hydrogen 2.724 N/A ASP 28.A N VAL 25.A O no hydrogen 3.295 N/A ASN 30.A N ASP 28.A OD1 no hydrogen 2.796 N/A HIS 31.A ND1 TYR 149.A OH no hydrogen 2.898 N/A VAL 32.A N GLY 85.A O no hydrogen 2.971 N/A ALA 34.A N VAL 83.A O no hydrogen 2.950 N/A ASN 36.A N ASP 82.A OD1 no hydrogen 2.783 N/A VAL 37.A N VAL 81.A O no hydrogen 2.872 N/A LYS 38.A NZ SER 39.A O no hydrogen 3.157 N/A ILE 40.A N ILE 49.A O no hydrogen 2.923 N/A ASP 41.A N ILE 49.A O no hydrogen 3.283 N/A GLN 42.A N ASP 41.A OD2 no hydrogen 2.577 N/A GLN 42.A NE2 LEU 44.A O no hydrogen 3.479 N/A GLN 42.A NE2 ASP 47.A O no hydrogen 3.257 N/A PHE 43.A N ASP 47.A OD1 no hydrogen 2.754 N/A LEU 44.A N ASP 47.A OD2 no hydrogen 2.889 N/A ASP 47.A N LEU 44.A O no hydrogen 3.253 N/A LEU 48.A N VAL 65.A O no hydrogen 2.812 N/A ILE 49.A N ASP 41.A O no hydrogen 2.781 N/A TYR 50.A N VAL 63.A O no hydrogen 2.933 N/A LYS 53.A NZ ASP 61.A OD1 no hydrogen 3.372 N/A ASP 54.A N TYR 60.A O no hydrogen 2.691 N/A LYS 56.A NZ ASN 30.A OD1 no hydrogen 3.355 N/A LEU 57.A N ASP 54.A OD1 no hydrogen 3.109 N/A GLY 58.A N ASP 54.A O no hydrogen 3.151 N/A ASN 59.A N ASP 54.A OD2 no hydrogen 2.882 N/A ASP 61.A N ARG 97.A O no hydrogen 2.717 N/A ASN 62.A N ARG 97.A O no hydrogen 3.439 N/A VAL 63.A N TYR 50.A O no hydrogen 2.843 N/A ARG 64.A N THR 99.A O no hydrogen 3.074 N/A ARG 64.A NE ASP 47.A OD2 no hydrogen 2.953 N/A VAL 65.A N LEU 48.A O no hydrogen 2.856 N/A GLU 66.A N MET 101.A O no hydrogen 3.048 N/A PHE 67.A N PHE 46.A O no hydrogen 2.776 N/A LYS 68.A N ASN 205.A O no hydrogen 2.920 N/A LYS 70.A NZ ASP 74.A OD1 no hydrogen 3.113 N/A LYS 70.A NZ ASP 74.A OD2 no hydrogen 2.980 N/A LEU 72.A N ASN 69.A OD1 no hydrogen 2.976 N/A ASP 74.A N LYS 70.A O no hydrogen 2.796 N/A LYS 75.A N ASP 71.A O no hydrogen 2.749 N/A TYR 76.A N LEU 72.A O no hydrogen 3.293 N/A LYS 77.A N ALA 73.A O no hydrogen 2.964 N/A LYS 77.A NZ GLN 42.A OE1 no hydrogen 2.718 N/A ASP 78.A N SER 39.A OG no hydrogen 3.216 N/A LYS 79.A N TYR 76.A O no hydrogen 3.160 N/A LYS 79.A NZ LYS 75.A O no hydrogen 3.236 N/A VAL 81.A N VAL 37.A O no hydrogen 2.893 N/A ASP 82.A N THR 106.A O no hydrogen 2.789 N/A VAL 83.A N ALA 34.A O no hydrogen 2.947 N/A PHE 84.A N GLY 104.A O no hydrogen 2.808 N/A GLY 85.A N VAL 32.A O no hydrogen 2.929 N/A ALA 86.A N GLN 145.A OE1 no hydrogen 3.042 N/A ASN 87.A ND2 TYR 89.A OH no hydrogen 3.129 N/A ASN 87.A ND2 THR 99.A OG1 no hydrogen 2.627 N/A TYR 88.A N CYS 100.A O no hydrogen 2.887 N/A ARG 97.A NH1 GLY 58.A O no hydrogen 2.751 N/A LYS 98.A NZ PHE 94.A O no hydrogen 3.074 N/A THR 99.A OG1 TYR 88.A O no hydrogen 3.078 N/A CYS 100.A N TYR 88.A O no hydrogen 3.088 N/A MET 101.A N ARG 64.A O no hydrogen 2.843 N/A TYR 102.A OH SER 198.A O no hydrogen 2.953 N/A TYR 102.A OH SER 198.A OG no hydrogen 2.924 N/A GLY 103.A N GLU 66.A O no hydrogen 3.014 N/A VAL 105.A N ASN 207.A OD1 no hydrogen 2.891 N/A THR 106.A N ASP 82.A O no hydrogen 3.070 N/A HIS 108.A N TYR 80.A O no hydrogen 3.062 N/A HIS 108.A ND1 ASP 82.A OD1 no hydrogen 2.997 N/A ASN 111.A N HIS 108.A O no hydrogen 3.251 N/A ASN 111.A ND2 GLU 107.A O no hydrogen 3.497 N/A ASN 111.A ND2 LYS 141.A O no hydrogen 3.020 N/A GLN 112.A NE2 ASP 82.A OD2 no hydrogen 2.970 N/A GLN 112.A NE2 HIS 108.A O no hydrogen 2.761 N/A LEU 113.A N ASN 138.A O no hydrogen 2.883 N/A ARG 117.A N THR 137.A O no hydrogen 2.783 N/A ARG 117.A NH1 SER 212.A OG no hydrogen 2.885 N/A ILE 119.A N VAL 135.A O no hydrogen 2.949 N/A THR 120.A OG1 ASP 134.A OD2 no hydrogen 2.948 N/A VAL 121.A N PHE 133.A O no hydrogen 2.695 N/A ARG 122.A N ILE 217.A O no hydrogen 2.986 N/A ARG 122.A NE ASN 129.A OD1 no hydrogen 3.196 N/A ARG 122.A NH2 ASN 129.A OD1 no hydrogen 3.018 N/A VAL 123.A N LEU 131.A O no hydrogen 2.834 N/A PHE 124.A N VAL 219.A O no hydrogen 2.782 N/A GLU 125.A N LYS 128.A O no hydrogen 3.029 N/A ASP 126.A N LEU 221.A O no hydrogen 2.753 N/A LYS 128.A N GLU 125.A O no hydrogen 3.126 N/A ASN 129.A ND2 VAL 123.A O no hydrogen 3.259 N/A ASN 129.A ND2 LEU 131.A O no hydrogen 3.004 N/A ASN 129.A ND2 SER 132.A OG no hydrogen 3.308 N/A PHE 133.A N VAL 121.A O no hydrogen 3.024 N/A VAL 135.A N ILE 119.A O no hydrogen 2.977 N/A THR 137.A N ARG 117.A O no hydrogen 3.087 N/A THR 137.A OG1 GLU 146.A OE2 no hydrogen 3.522 N/A LYS 139.A N THR 137.A OG1 no hydrogen 3.328 N/A LYS 139.A NZ GLU 146.A OE1 no hydrogen 2.583 N/A LYS 139.A NZ GLU 146.A OE2 no hydrogen 3.148 N/A LYS 140.A N ASN 111.A O no hydrogen 2.779 N/A LYS 141.A N ASN 111.A OD1 no hydrogen 2.605 N/A LYS 141.A NZ ASP 211.A OD2 no hydrogen 2.820 N/A VAL 142.A N VAL 210.A O no hydrogen 2.967 N/A ALA 144.A N LYS 208.A O no hydrogen 2.998 N/A GLN 145.A NE2 TYR 102.A O no hydrogen 2.759 N/A GLU 146.A N THR 143.A OG1 no hydrogen 3.072 N/A LEU 147.A N THR 143.A O no hydrogen 3.419 N/A ASP 148.A N ALA 144.A O no hydrogen 2.719 N/A TYR 149.A N GLN 145.A O no hydrogen 2.811 N/A TYR 149.A OH ASP 28.A O no hydrogen 2.726 N/A TYR 149.A OH ASN 30.A O no hydrogen 3.408 N/A TYR 149.A OH HIS 31.A ND1 no hydrogen 2.898 N/A LEU 150.A N GLU 146.A O no hydrogen 2.967 N/A THR 151.A N LEU 147.A O no hydrogen 2.954 N/A THR 151.A OG1 LEU 147.A O no hydrogen 2.666 N/A ARG 152.A N ASP 148.A O no hydrogen 2.814 N/A ARG 152.A NE ASP 148.A OD1 no hydrogen 2.837 N/A ARG 152.A NH1 TYR 162.A OH no hydrogen 2.994 N/A ARG 152.A NH1 TYR 200.A OH no hydrogen 2.852 N/A ARG 152.A NH2 ASP 148.A OD1 no hydrogen 3.499 N/A ARG 152.A NH2 ASP 148.A OD2 no hydrogen 2.927 N/A ARG 152.A NH2 TYR 200.A OH no hydrogen 3.050 N/A HIS 153.A N TYR 149.A O no hydrogen 2.913 N/A HIS 153.A ND1 TYR 27.A O no hydrogen 3.057 N/A TYR 154.A N LEU 150.A O no hydrogen 3.324 N/A LEU 155.A N THR 151.A O no hydrogen 3.128 N/A VAL 156.A N ARG 152.A O no hydrogen 2.790 N/A LYS 157.A N HIS 153.A O no hydrogen 3.196 N/A LYS 157.A NZ ASP 29.A OD1 no hydrogen 2.963 N/A LYS 157.A NZ HIS 153.A NE2 no hydrogen 2.887 N/A ASN 158.A N TYR 154.A O no hydrogen 2.878 N/A ASN 158.A ND2 TYR 154.A O no hydrogen 3.073 N/A LYS 159.A N LEU 155.A O no hydrogen 2.831 N/A LYS 160.A N VAL 156.A O no hydrogen 3.121 N/A LEU 161.A N LEU 155.A O no hydrogen 3.379 N/A TYR 162.A OH MET 187.A O no hydrogen 2.523 N/A GLU 163.A N ASN 166.A O no hydrogen 2.998 N/A ASN 166.A ND2 SER 13.A O no hydrogen 3.170 N/A ASN 166.A ND2 PHE 16.A O no hydrogen 3.322 N/A SER 167.A OG LEU 161.A O no hydrogen 2.756 N/A SER 167.A OG TYR 169.A O no hydrogen 3.243 N/A TYR 169.A N SER 167.A OG no hydrogen 2.937 N/A TYR 169.A OH GLU 125.A OE2 no hydrogen 3.331 N/A GLU 170.A N THR 222.A O no hydrogen 2.821 N/A THR 171.A OG1 THR 222.A OG1 no hydrogen 2.639 N/A TYR 173.A N TYR 220.A O no hydrogen 2.950 N/A ILE 174.A N TYR 185.A O no hydrogen 3.024 N/A LYS 175.A N GLU 218.A O no hydrogen 2.730 N/A LYS 175.A NZ ASP 4.A OD1 no hydrogen 2.939 N/A LYS 175.A NZ ASP 4.A OD2 no hydrogen 2.939 N/A PHE 176.A N PHE 183.A O no hydrogen 2.817 N/A ILE 177.A N LYS 216.A O no hydrogen 2.899 N/A GLU 178.A N ASN 181.A O no hydrogen 2.948 N/A PHE 183.A N PHE 176.A O no hydrogen 3.244 N/A TRP 184.A NE1 PRO 3.A O no hydrogen 2.781 N/A TYR 185.A N ILE 174.A O no hydrogen 2.999 N/A MET 187.A N GLY 172.A O no hydrogen 2.817 N/A MET 188.A N ASP 186.A OD1 no hydrogen 3.098 N/A GLY 192.A N LYS 15.A O no hydrogen 3.160 N/A GLN 197.A NE2 ASN 22.A O no hydrogen 2.794 N/A SER 198.A OG TYR 102.A OH no hydrogen 2.924 N/A LYS 199.A N ASP 196.A OD1 no hydrogen 3.354 N/A TYR 200.A N ASP 196.A O no hydrogen 2.905 N/A TYR 200.A OH ASP 186.A O no hydrogen 2.495 N/A LEU 201.A N GLN 197.A O no hydrogen 2.944 N/A MET 202.A N SER 198.A O no hydrogen 3.177 N/A MET 202.A N LYS 199.A O no hydrogen 3.263 N/A MET 203.A N TYR 200.A O no hydrogen 3.282 N/A TYR 204.A N LEU 201.A O no hydrogen 2.975 N/A TYR 204.A OH TYR 27.A OH no hydrogen 2.724 N/A TYR 204.A OH ASP 148.A OD2 no hydrogen 2.313 N/A ASN 205.A N MET 202.A O no hydrogen 2.962 N/A ASN 207.A N TYR 204.A O no hydrogen 3.191 N/A ASN 207.A ND2 VAL 105.A O no hydrogen 2.784 N/A LYS 208.A N ASP 206.A OD1 no hydrogen 2.973 N/A VAL 210.A N VAL 142.A O no hydrogen 2.762 N/A ASP 211.A N GLU 178.A OE2 no hydrogen 2.833 N/A SER 212.A N LYS 140.A O no hydrogen 2.974 N/A SER 212.A OG LYS 139.A O no hydrogen 2.891 N/A SER 212.A OG LYS 140.A O no hydrogen 3.014 N/A ASP 214.A N ASP 211.A OD1 no hydrogen 3.324 N/A LYS 216.A N ILE 177.A O no hydrogen 2.808 N/A LYS 216.A NZ ILE 177.A O no hydrogen 3.511 N/A ILE 217.A N THR 120.A O no hydrogen 3.273 N/A GLU 218.A N LYS 175.A O no hydrogen 2.885 N/A VAL 219.A N ARG 122.A O no hydrogen 2.833 N/A TYR 220.A N TYR 173.A O no hydrogen 2.965 N/A TYR 220.A OH GLU 218.A OE1 no hydrogen 2.563 N/A LEU 221.A N PHE 124.A O no hydrogen 2.829 N/A THR 222.A N THR 171.A O no hydrogen 3.040 N/A THR 222.A OG1 THR 171.A OG1 no hydrogen 2.639 N/A THR 223.A N ASP 126.A OD1 no hydrogen 2.887 N/A THR 223.A OG1 ASP 126.A OD1 no hydrogen 3.285 N/A THR 223.A OG1 ASP 126.A OD2 no hydrogen 2.721 N/A