Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3rii_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 3.A NE1 SER 124.A O no hydrogen 2.973 N/A CYS 4.A N ASN 134.A OD1 no hydrogen 2.852 N/A CYS 4.A SG ASN 134.A OD1 no hydrogen 3.588 N/A SER 7.A N ASP 144.A OD1 no hydrogen 2.715 N/A SER 7.A OG GLU 143.A OE2 no hydrogen 2.796 N/A VAL 11.A N ASP 8.A OD2 no hydrogen 2.976 N/A PHE 12.A N ASP 8.A O no hydrogen 2.822 N/A THR 13.A N PRO 9.A O no hydrogen 2.838 N/A THR 13.A OG1 PRO 9.A O no hydrogen 3.023 N/A GLU 14.A N GLY 10.A O no hydrogen 3.041 N/A LEU 15.A N VAL 11.A O no hydrogen 2.974 N/A ILE 16.A N PHE 12.A O no hydrogen 3.096 N/A LYS 17.A N THR 13.A O no hydrogen 3.137 N/A LYS 17.A NZ GLU 14.A OE1 no hydrogen 3.048 N/A LYS 17.A NZ GLU 14.A OE2 no hydrogen 3.553 N/A GLY 18.A N GLU 14.A O no hydrogen 2.734 N/A PHE 19.A N LEU 15.A O no hydrogen 3.000 N/A PHE 19.A N ILE 16.A O no hydrogen 3.247 N/A GLY 20.A N LYS 17.A O no hydrogen 2.902 N/A CYS 21.A N ILE 16.A O no hydrogen 3.219 N/A CYS 21.A SG HIS 100.A O no hydrogen 3.429 N/A ARG 22.A N HIS 100.A O no hydrogen 2.956 N/A ARG 22.A NH1 LYS 17.A O no hydrogen 3.102 N/A ARG 22.A NH1 CYS 21.A O no hydrogen 2.991 N/A GLN 25.A N VAL 206.A O no hydrogen 2.765 N/A GLN 25.A NE2 SER 207.A O no hydrogen 3.624 N/A VAL 26.A N THR 13.A OG1 no hydrogen 2.907 N/A GLU 27.A N ALA 204.A O no hydrogen 3.087 N/A ILE 29.A N LEU 203.A O no hydrogen 2.797 N/A ASN 36.A N GLU 33.A O no hydrogen 2.874 N/A ASN 36.A ND2 SER 31.A O no hydrogen 2.713 N/A GLU 38.A N PRO 34.A O no hydrogen 3.386 N/A GLU 38.A N GLU 38.A OE1 no hydrogen 2.684 N/A LEU 40.A N PHE 37.A O no hydrogen 3.137 N/A HIS 44.A N ILE 205.A O no hydrogen 2.712 N/A GLY 45.A N ILE 205.A O no hydrogen 3.414 N/A LEU 46.A N TYR 151.A O no hydrogen 2.924 N/A PHE 48.A N VAL 149.A O no hydrogen 2.917 N/A LEU 49.A N ASN 202.A O no hydrogen 3.055 N/A PHE 50.A N HIS 147.A O no hydrogen 3.022 N/A LYS 51.A N ARG 200.A O no hydrogen 3.142 N/A LYS 51.A NZ GLU 142.A OE2 no hydrogen 2.606 N/A VAL 63.A N PRO 168.A O no hydrogen 2.868 N/A ARG 67.A N ASP 65.A OD1 no hydrogen 2.864 N/A ARG 67.A NE ASP 65.A OD1 no hydrogen 3.024 N/A ARG 67.A NE ASP 65.A OD2 no hydrogen 3.050 N/A ARG 67.A NH1 TYR 159.A OH no hydrogen 3.021 N/A ARG 67.A NH1 ASP 170.A OD2 no hydrogen 2.770 N/A ARG 67.A NH2 ASP 65.A OD2 no hydrogen 2.896 N/A LEU 68.A N ASP 65.A O no hydrogen 3.093 N/A ASP 69.A N SER 66.A O no hydrogen 3.000 N/A THR 70.A N ARG 67.A O no hydrogen 2.881 N/A ILE 71.A N ARG 67.A O no hydrogen 3.023 N/A PHE 72.A N ASN 93.A OD1 no hydrogen 2.837 N/A LYS 75.A N ALA 117.A O no hydrogen 3.037 N/A LYS 75.A NZ GLY 163.A O no hydrogen 3.241 N/A LYS 75.A NZ ARG 165.A O no hydrogen 2.906 N/A LYS 75.A NZ GLU 166.A OE2 no hydrogen 3.230 N/A GLN 76.A N GLY 163.A O no hydrogen 2.902 N/A GLN 76.A NE2 ASN 79.A OD1 no hydrogen 3.469 N/A ASN 80.A ND2 TRP 3.A O no hydrogen 2.878 N/A ALA 81.A N ILE 78.A O no hydrogen 2.955 N/A SER 82.A N ASN 79.A O no hydrogen 3.117 N/A SER 82.A OG GLN 76.A OE1 no hydrogen 2.919 N/A THR 84.A OG1 HIS 133.A ND1 no hydrogen 2.786 N/A GLN 85.A N ALA 81.A O no hydrogen 2.867 N/A ALA 86.A N SER 82.A O no hydrogen 2.976 N/A ILE 87.A N ALA 83.A O no hydrogen 2.902 N/A VAL 88.A N THR 84.A O no hydrogen 2.812 N/A SER 89.A N GLN 85.A O no hydrogen 2.945 N/A SER 89.A OG GLN 85.A O no hydrogen 2.599 N/A VAL 90.A N ALA 86.A O no hydrogen 3.215 N/A LEU 91.A N ILE 87.A O no hydrogen 3.093 N/A LEU 92.A N VAL 88.A O no hydrogen 2.771 N/A ASN 93.A N VAL 90.A O no hydrogen 3.179 N/A ASN 93.A ND2 PHE 72.A O no hydrogen 2.924 N/A ASN 93.A ND2 SER 89.A O no hydrogen 2.676 N/A CYS 94.A N LEU 91.A O no hydrogen 3.180 N/A CYS 94.A SG HIS 44.A ND1 no hydrogen 3.730 N/A GLN 97.A NE2 ASP 98.A OD1 no hydrogen 3.134 N/A ASP 98.A N HIS 96.A ND1 no hydrogen 3.102 N/A VAL 99.A N HIS 96.A O no hydrogen 3.005 N/A HIS 100.A N ARG 22.A O no hydrogen 2.926 N/A THR 104.A OG1 PHE 19.A O no hydrogen 3.542 N/A SER 106.A N GLY 102.A O no hydrogen 3.004 N/A SER 106.A OG GLY 102.A O no hydrogen 2.692 N/A GLU 107.A N GLU 103.A O no hydrogen 2.950 N/A PHE 108.A N THR 104.A O no hydrogen 3.118 N/A LYS 109.A N LEU 105.A O no hydrogen 2.858 N/A LYS 109.A NZ LEU 92.A O no hydrogen 3.229 N/A GLU 110.A N SER 106.A O no hydrogen 3.061 N/A PHE 111.A N GLU 107.A O no hydrogen 2.923 N/A SER 112.A N PHE 108.A O no hydrogen 2.976 N/A SER 112.A OG PHE 108.A O no hydrogen 2.772 N/A PHE 115.A N SER 112.A O no hydrogen 2.897 N/A LYS 119.A NZ SER 112.A O no hydrogen 3.484 N/A LYS 119.A NZ GLN 113.A O no hydrogen 3.537 N/A LYS 119.A NZ PHE 115.A O no hydrogen 2.767 N/A GLY 120.A N ALA 117.A O no hydrogen 3.035 N/A LEU 121.A N ALA 118.A O no hydrogen 3.023 N/A LEU 123.A N LYS 119.A O no hydrogen 2.958 N/A SER 124.A N GLY 120.A O no hydrogen 2.944 N/A SER 124.A OG.A GLY 120.A O no hydrogen 3.258 N/A SER 124.A OG.A LEU 121.A O no hydrogen 2.973 N/A SER 124.A OG.B GLY 120.A O no hydrogen 2.774 N/A ASN 125.A N LEU 121.A O no hydrogen 2.943 N/A ASN 125.A ND2 LEU 121.A O no hydrogen 2.827 N/A SER 126.A N LEU 123.A O no hydrogen 3.068 N/A ILE 129.A N SER 126.A OG no hydrogen 3.354 N/A ARG 130.A N SER 126.A O no hydrogen 2.910 N/A ARG 130.A NH1 GLU 2.A O no hydrogen 3.416 N/A ARG 130.A NH2 ASP 127.A OD1 no hydrogen 3.217 N/A GLN 131.A N ASP 127.A O no hydrogen 2.946 N/A VAL 132.A N VAL 128.A O no hydrogen 3.056 N/A HIS 133.A N ILE 129.A O no hydrogen 2.957 N/A HIS 133.A ND1 THR 84.A OG1 no hydrogen 2.786 N/A HIS 133.A NE2 CYS 4.A O no hydrogen 2.789 N/A ASN 134.A N ARG 130.A O no hydrogen 2.877 N/A ASN 134.A ND2 GLU 2.A O no hydrogen 2.606 N/A SER 135.A N GLN 131.A O no hydrogen 3.093 N/A PHE 136.A N HIS 133.A O no hydrogen 2.983 N/A ALA 137.A N ASN 134.A O no hydrogen 3.220 N/A ARG 138.A N LEU 5.A O no hydrogen 2.892 N/A ARG 138.A NE ASP 144.A OD2 no hydrogen 2.858 N/A ARG 138.A NH2 ASP 144.A OD2 no hydrogen 2.590 N/A ASP 144.A N LYS 141.A O no hydrogen 3.181 N/A ALA 145.A N GLU 142.A O no hydrogen 3.199 N/A PHE 146.A N GLU 143.A O no hydrogen 3.038 N/A HIS 147.A N PHE 50.A O no hydrogen 2.919 N/A HIS 147.A NE2 ASP 162.A OD1 no hydrogen 2.683 N/A PHE 148.A N SER 82.A OG no hydrogen 3.047 N/A VAL 149.A N PHE 48.A O no hydrogen 2.895 N/A SER 150.A N LEU 161.A O no hydrogen 3.072 N/A TYR 151.A N LEU 46.A O no hydrogen 2.857 N/A VAL 152.A N TYR 159.A O no hydrogen 2.961 N/A VAL 154.A N ARG 157.A O no hydrogen 2.840 N/A GLY 156.A N GLN 176.A OE1 no hydrogen 2.973 N/A ARG 157.A N VAL 154.A O no hydrogen 3.188 N/A ARG 157.A NE ASP 170.A OD1 no hydrogen 3.409 N/A ARG 157.A NE ASP 170.A OD2 no hydrogen 3.070 N/A ARG 157.A NH2 ASP 170.A OD1 no hydrogen 3.112 N/A ARG 157.A NH2 ASP 170.A OD2 no hydrogen 3.200 N/A LEU 158.A N GLY 172.A O no hydrogen 2.857 N/A TYR 159.A N VAL 152.A O no hydrogen 2.904 N/A GLU 160.A N ILE 169.A O no hydrogen 2.929 N/A LEU 161.A N SER 150.A O no hydrogen 2.757 N/A LEU 164.A N ASP 162.A OD1 no hydrogen 2.924 N/A ARG 165.A N ASP 162.A O no hydrogen 2.794 N/A ARG 165.A NH1 GLU 56.A O no hydrogen 3.026 N/A ARG 165.A NH2 GLU 56.A O no hydrogen 3.172 N/A ILE 169.A N GLU 160.A O no hydrogen 2.843 N/A ASP 170.A N SER 61.A O no hydrogen 2.889 N/A LEU 171.A N LEU 158.A O no hydrogen 2.792 N/A GLY 172.A N ASP 170.A OD1 no hydrogen 2.690 N/A CYS 174.A N GLY 156.A O no hydrogen 2.871 N/A GLN 176.A NE2 PRO 153.A O no hydrogen 3.300 N/A ASP 177.A N ASN 175.A OD1 no hydrogen 2.954 N/A ASP 178.A N ASN 175.A OD1 no hydrogen 3.336 N/A TRP 179.A NE1 VAL 43.A O no hydrogen 2.903 N/A SER 181.A OG ASP 178.A OD1 no hydrogen 3.396 N/A ALA 182.A N TRP 179.A O no hydrogen 2.946 N/A VAL 183.A N TRP 179.A O no hydrogen 3.297 N/A ARG 184.A N ILE 180.A O no hydrogen 3.107 N/A ARG 184.A NE LEU 32.A O no hydrogen 2.689 N/A ILE 187.A N VAL 183.A O no hydrogen 2.991 N/A GLU 188.A N ARG 184.A O no hydrogen 2.757 N/A LYS 189.A N PRO 185.A O no hydrogen 3.030 N/A ARG 190.A N VAL 186.A O no hydrogen 3.129 N/A ARG 190.A NE TYR 194.A OH no hydrogen 2.942 N/A ARG 190.A NH1 GLU 56.A OE1 no hydrogen 3.079 N/A ARG 190.A NH1 TYR 194.A OH no hydrogen 3.314 N/A ARG 190.A NH2 TYR 151.A OH no hydrogen 2.853 N/A ARG 190.A NH2 GLU 160.A OE2 no hydrogen 2.909 N/A ILE 191.A N ILE 187.A O no hydrogen 2.812 N/A GLN 192.A N GLU 188.A O no hydrogen 2.943 N/A LYS 193.A N LYS 189.A O no hydrogen 3.096 N/A TYR 194.A N ARG 190.A O no hydrogen 2.941 N/A TYR 194.A OH GLU 56.A OE1 no hydrogen 3.155 N/A TYR 194.A OH GLU 56.A OE2 no hydrogen 2.532 N/A SER 195.A N ILE 191.A O no hydrogen 2.880 N/A SER 195.A OG ILE 191.A O no hydrogen 2.999 N/A GLU 196.A N GLN 192.A O no hydrogen 3.107 N/A GLY 197.A N LYS 193.A O no hydrogen 3.014 N/A GLU 198.A N SER 195.A O no hydrogen 3.323 N/A ILE 199.A N TYR 194.A O no hydrogen 2.730 N/A ARG 200.A NE GLU 142.A OE1 no hydrogen 3.010 N/A ARG 200.A NH1 GLU 142.A OE2 no hydrogen 3.065 N/A ASN 202.A N LEU 49.A O no hydrogen 2.826 N/A ASN 202.A ND2 GLU 28.A OE2 no hydrogen 2.777 N/A ASN 202.A ND2 GLU 143.A OE2 no hydrogen 3.055 N/A LEU 203.A N ASN 202.A OD1 no hydrogen 2.801 N/A ALA 204.A N GLU 27.A O no hydrogen 2.797 N/A ILE 205.A N GLY 45.A O no hydrogen 2.749 N/A VAL 206.A N GLN 25.A O no hydrogen 2.826 N/A SER 207.A N PRO 42.A O no hydrogen 3.172 N/A SER 207.A OG HIS 44.A NE2 no hydrogen 3.309 N/A ASP 208.A N GLY 23.A O no hydrogen 2.993 N/A