Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5jff_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A N ASP 1.A OD1 no hydrogen 2.660 N/A LEU 4.A N ASP 1.A O no hydrogen 3.182 N/A TYR 5.A N ILE 9.A O no hydrogen 3.083 N/A MET 10.A N GLN 19.A OE1 no hydrogen 3.272 N/A ARG 11.A N TYR 3.A O no hydrogen 2.819 N/A ARG 11.A NH1 PRO 2.A O no hydrogen 2.968 N/A ASN 12.A N TYR 5.A OH no hydrogen 3.308 N/A ASN 12.A ND2 MET 10.A O no hydrogen 3.038 N/A ASN 12.A ND2 ILE 16.A O no hydrogen 2.975 N/A ARG 13.A N ILE 60.A O no hydrogen 2.819 N/A ARG 13.A NH1 ASP 62.A OD1 no hydrogen 2.964 N/A LEU 14.A N ASN 12.A OD1 no hydrogen 3.015 N/A ILE 16.A N ASN 12.A OD1 no hydrogen 3.109 N/A GLN 19.A NE2 GLU 23.A OE1 no hydrogen 2.973 N/A GLN 20.A N GLN 20.A OE1 no hydrogen 2.892 N/A GLN 20.A NE2 GLN 18.A OE1 no hydrogen 2.621 N/A LEU 22.A N GLN 18.A O no hydrogen 3.101 N/A GLU 23.A N GLN 19.A O no hydrogen 2.910 N/A GLN 24.A N GLN 20.A O no hydrogen 3.090 N/A GLN 24.A NE2 GLU 28.A OE2 no hydrogen 3.109 N/A ALA 25.A N ARG 21.A O no hydrogen 2.922 N/A ALA 26.A N LEU 22.A O no hydrogen 2.916 N/A TYR 27.A N GLU 23.A O no hydrogen 2.898 N/A GLU 28.A N GLN 24.A O no hydrogen 3.060 N/A MET 29.A N ALA 25.A O no hydrogen 2.877 N/A THR 30.A N ALA 26.A O no hydrogen 2.860 N/A THR 30.A OG1 ALA 26.A O no hydrogen 2.685 N/A THR 30.A OG1 TYR 27.A O no hydrogen 3.228 N/A ALA 31.A N TYR 27.A O no hydrogen 3.227 N/A LEU 32.A N GLU 28.A O no hydrogen 3.171 N/A ARG 33.A N MET 29.A O no hydrogen 2.919 N/A ARG 33.A NE ASP 59.A OD2 no hydrogen 2.804 N/A ARG 33.A NH2 ASP 59.A OD1 no hydrogen 2.942 N/A ARG 33.A NH2 ASP 59.A OD2 no hydrogen 3.549 N/A ALA 34.A N THR 30.A O no hydrogen 2.832 N/A ALA 35.A N ALA 31.A O no hydrogen 3.266 N/A THR 36.A N ARG 33.A O no hydrogen 2.896 N/A THR 36.A OG1 ARG 33.A O no hydrogen 2.615 N/A ILE 37.A N ALA 34.A O no hydrogen 3.472 N/A ARG 44.A NE PRO 41.A O no hydrogen 2.961 N/A ARG 44.A NH1 GLN 141.A OE1 no hydrogen 2.709 N/A ARG 44.A NH2 LEU 39.A O no hydrogen 3.057 N/A ARG 44.A NH2 PRO 41.A O no hydrogen 2.910 N/A ARG 44.A NH2 GLN 141.A OE1 no hydrogen 3.116 N/A ARG 45.A NE GLU 97.A OE1 no hydrogen 3.084 N/A ARG 45.A NH2 GLU 97.A OE2 no hydrogen 2.920 N/A HIS 48.A NE2 GLN 141.A OE1 no hydrogen 2.880 N/A LEU 49.A N ARG 45.A O no hydrogen 3.345 N/A ARG 50.A N LEU 46.A O no hydrogen 2.985 N/A ARG 50.A NE GLY 65.A O no hydrogen 2.825 N/A THR 51.A N PRO 47.A O no hydrogen 2.913 N/A THR 51.A OG1 PRO 47.A O no hydrogen 3.187 N/A ILE 52.A N HIS 48.A O no hydrogen 3.100 N/A HIS 53.A N LEU 49.A O no hydrogen 3.213 N/A HIS 53.A NE2 VAL 129.A O no hydrogen 2.774 N/A ARG 54.A N.A ARG 50.A O no hydrogen 2.898 N/A ARG 54.A N.B ARG 50.A O no hydrogen 2.899 N/A GLN 55.A N THR 51.A O no hydrogen 2.952 N/A LEU 56.A N ILE 52.A O no hydrogen 2.939 N/A TYR 57.A N HIS 53.A O no hydrogen 3.050 N/A GLN 58.A NE2 GLN 55.A O no hydrogen 3.006 N/A ILE 60.A N TYR 57.A O no hydrogen 2.850 N/A PHE 61.A N TYR 57.A O no hydrogen 3.093 N/A ALA 64.A N PHE 61.A O no hydrogen 3.134 N/A GLY 65.A N HIS 53.A ND1 no hydrogen 2.999 N/A GLN 66.A N TRP 63.A O no hydrogen 2.862 N/A ARG 68.A N PRO 126.A O no hydrogen 2.829 N/A ARG 68.A NE HIS 125.A O no hydrogen 2.804 N/A ARG 68.A NH1 VAL 70.A O no hydrogen 2.901 N/A ARG 68.A NH1 CYS 80.A O no hydrogen 3.079 N/A ARG 68.A NH2 CYS 80.A O no hydrogen 2.872 N/A ARG 68.A NH2 LEU 124.A O no hydrogen 2.865 N/A ARG 68.A NH2 HIS 125.A O no hydrogen 3.031 N/A GLU 69.A N TYR 3.A OH no hydrogen 2.894 N/A GLN 74.A N THR 77.A O no hydrogen 2.910 N/A THR 77.A N GLN 74.A O no hydrogen 3.197 N/A PHE 79.A N ILE 72.A O no hydrogen 3.009 N/A CYS 80.A N VAL 123.A O no hydrogen 2.881 N/A CYS 80.A SG HIS 81.A O no hydrogen 3.464 N/A CYS 80.A SG GLU 88.A OE2 no hydrogen 3.361 N/A HIS 81.A ND1 ASP 71.A OD2 no hydrogen 2.791 N/A PHE 82.A N ASP 71.A OD1 no hydrogen 2.830 N/A TYR 84.A N HIS 81.A O no hydrogen 2.895 N/A ILE 85.A N PHE 82.A O no hydrogen 3.225 N/A GLU 88.A N TYR 84.A O no hydrogen 2.944 N/A GLY 89.A N ILE 85.A O no hydrogen 2.728 N/A ASN 90.A N GLU 86.A O no hydrogen 2.948 N/A ALA 91.A N LYS 87.A O no hydrogen 3.050 N/A LEU 92.A N GLU 88.A O no hydrogen 2.990 N/A MET 93.A N GLY 89.A O no hydrogen 2.944 N/A GLN 94.A N ASN 90.A O no hydrogen 2.940 N/A GLN 94.A NE2 GLU 98.A OE2 no hydrogen 3.215 N/A ASP 95.A N ALA 91.A O no hydrogen 3.005 N/A LEU 96.A N LEU 92.A O no hydrogen 3.060 N/A GLU 97.A N MET 93.A O no hydrogen 2.912 N/A GLU 98.A N GLN 94.A O no hydrogen 2.848 N/A GLU 99.A N ASP 95.A O no hydrogen 3.072 N/A GLU 99.A N LEU 96.A O no hydrogen 3.087 N/A GLY 100.A N GLU 97.A O no hydrogen 2.829 N/A TYR 101.A N LEU 96.A O no hydrogen 3.017 N/A LEU 102.A N GLU 99.A O no hydrogen 3.152 N/A VAL 103.A N GLY 100.A O no hydrogen 3.256 N/A LYS 107.A NZ SER 180.A O no hydrogen 2.900 N/A LYS 107.A NZ VAL 183.A O no hydrogen 3.050 N/A LYS 109.A NZ GLU 112.A OE2 no hydrogen 3.094 N/A PHE 110.A N GLU 106.A O no hydrogen 2.986 N/A VAL 111.A N LYS 107.A O no hydrogen 2.929 N/A GLU 112.A N ALA 108.A O no hydrogen 3.054 N/A ARG 113.A N LYS 109.A O no hydrogen 2.978 N/A ARG 113.A NE GLU 99.A OE1 no hydrogen 2.852 N/A ARG 113.A NE GLU 99.A OE2 no hydrogen 3.463 N/A ARG 113.A NH1 GLU 99.A OE2 no hydrogen 2.879 N/A LEU 114.A N PHE 110.A O no hydrogen 2.746 N/A ALA 115.A N VAL 111.A O no hydrogen 2.935 N/A HIS 116.A N GLU 112.A O no hydrogen 3.233 N/A TYR 117.A N ARG 113.A O no hydrogen 2.909 N/A TYR 117.A OH GLU 99.A OE2 no hydrogen 2.525 N/A TYR 118.A N LEU 114.A O no hydrogen 2.790 N/A CYS 119.A N ALA 115.A O no hydrogen 2.906 N/A GLU 120.A N HIS 116.A O no hydrogen 3.068 N/A ILE 121.A N TYR 117.A O no hydrogen 2.986 N/A ASN 122.A N TYR 118.A O no hydrogen 2.871 N/A VAL 123.A N CYS 119.A O no hydrogen 3.174 N/A LEU 124.A N GLU 120.A O no hydrogen 3.158 N/A HIS 125.A N ILE 121.A O no hydrogen 3.049 N/A PHE 127.A N SER 131.A OG no hydrogen 2.824 N/A ARG 128.A NE ASP 1.A OD2 no hydrogen 3.130 N/A ARG 128.A NH1 ARG 128.A O no hydrogen 2.949 N/A ARG 128.A NH2 ASP 1.A OD2 no hydrogen 3.139 N/A SER 131.A OG PHE 127.A O no hydrogen 2.968 N/A ALA 134.A N GLY 130.A O no hydrogen 3.033 N/A GLN 135.A N SER 131.A O no hydrogen 2.926 N/A GLN 135.A NE2 ASN 122.A OD1 no hydrogen 3.470 N/A ARG 136.A N GLY 132.A O no hydrogen 3.011 N/A ARG 136.A NH1 TYR 118.A OH no hydrogen 3.023 N/A ILE 137.A N LEU 133.A O no hydrogen 3.088 N/A PHE 138.A N ALA 134.A O no hydrogen 3.002 N/A PHE 139.A N GLN 135.A O no hydrogen 3.038 N/A GLU 140.A N ARG 136.A O no hydrogen 2.832 N/A GLN 141.A N ILE 137.A O no hydrogen 3.038 N/A LEU 142.A N PHE 138.A O no hydrogen 2.991 N/A ALA 143.A N PHE 139.A O no hydrogen 2.848 N/A ILE 144.A N GLU 140.A O no hydrogen 3.367 N/A HIS 145.A N GLN 141.A O no hydrogen 3.075 N/A HIS 145.A NE2 GLY 40.A O no hydrogen 2.821 N/A ALA 146.A N LEU 142.A O no hydrogen 2.915 N/A GLY 147.A N ILE 144.A O no hydrogen 3.145 N/A TYR 148.A N ALA 143.A O no hydrogen 2.781 N/A TYR 148.A OH LEU 105.A O no hydrogen 2.633 N/A GLN 149.A N SER 184.A O no hydrogen 2.824 N/A SER 151.A N VAL 182.A O no hydrogen 2.947 N/A TRP 152.A NE1 GLU 140.A OE2 no hydrogen 2.818 N/A GLN 153.A N SER 151.A OG no hydrogen 3.317 N/A ILE 155.A N TRP 152.A O no hydrogen 3.431 N/A LYS 157.A NZ ASN 161.A OD1 no hydrogen 3.419 N/A TRP 160.A N GLU 156.A O no hydrogen 2.877 N/A ASN 161.A N LYS 157.A O no hydrogen 2.857 N/A GLN 162.A N GLU 158.A O no hydrogen 2.929 N/A ALA 163.A N ALA 159.A O no hydrogen 2.869 N/A ASN 164.A N TRP 160.A O no hydrogen 3.021 N/A ASN 164.A ND2 TRP 160.A O no hydrogen 3.087 N/A GLN 165.A N ASN 161.A O no hydrogen 3.021 N/A SER 166.A N.A GLN 162.A O no hydrogen 2.869 N/A SER 166.A N.B GLN 162.A O no hydrogen 2.864 N/A SER 166.A OG.A GLN 162.A O no hydrogen 3.303 N/A SER 166.A OG.B GLN 162.A O no hydrogen 3.327 N/A SER 166.A OG.B ALA 163.A O no hydrogen 3.005 N/A SER 166.A OG.B ASP 171.A O no hydrogen 3.180 N/A GLY 167.A N ALA 163.A O no hydrogen 2.947 N/A ALA 168.A N ASN 164.A O no hydrogen 2.951 N/A MET 169.A N GLN 165.A O no hydrogen 3.180 N/A MET 169.A N SER 166.A O.A no hydrogen 3.245 N/A MET 169.A N SER 166.A O.B no hydrogen 3.260 N/A GLY 170.A N GLY 167.A O no hydrogen 3.044 N/A ASP 171.A N SER 166.A O.A no hydrogen 2.950 N/A ASP 171.A N SER 166.A O.B no hydrogen 2.961 N/A THR 173.A N ASP 171.A OD1 no hydrogen 3.111 N/A THR 173.A OG1 ASP 171.A OD1 no hydrogen 2.630 N/A GLN 176.A N LEU 172.A O no hydrogen 2.835 N/A MET 177.A N.A THR 173.A O no hydrogen 2.945 N/A MET 177.A N.B THR 173.A O no hydrogen 2.939 N/A ILE 178.A N ALA 174.A O no hydrogen 3.076 N/A PHE 179.A N LEU 175.A O no hydrogen 2.910 N/A SER 180.A N GLN 176.A O no hydrogen 2.798 N/A SER 180.A OG GLN 176.A O no hydrogen 3.119 N/A LYS 181.A N ILE 178.A O no hydrogen 3.029 N/A VAL 182.A N ILE 178.A O no hydrogen 2.901 N/A VAL 183.A N PHE 179.A O no hydrogen 2.917 N/A SER 184.A N GLN 149.A O no hydrogen 2.970 N/A GLU 185.A N GLU 188.A OE1 no hydrogen 3.085 N/A ALA 186.A N GLY 147.A O no hydrogen 2.971 N/A GLY 187.A N GLN 149.A OE1 no hydrogen 2.678 N/A