Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1xi3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NH1 LYS 149.A O no hydrogen 2.950 N/A ARG 3.A NH2 ASP 172.A OD2 no hydrogen 3.005 N/A LYS 5.A N ASN 1.A O no hydrogen 3.140 N/A LEU 6.A N LEU 2.A O no hydrogen 3.070 N/A LEU 8.A N THR 32.A OG1 no hydrogen 3.065 N/A TYR 9.A N ILE 174.A O no hydrogen 2.928 N/A TYR 9.A OH TYR 122.A OH no hydrogen 2.684 N/A VAL 10.A N ALA 33.A O no hydrogen 2.946 N/A ILE 11.A N VAL 176.A O no hydrogen 3.058 N/A THR 12.A N GLN 35.A O no hydrogen 2.937 N/A THR 12.A OG1 ARG 37.A O no hydrogen 3.421 N/A ARG 14.A NE GLU 19.A OE2 no hydrogen 2.808 N/A ARG 14.A NH1 GLU 45.A OE2 no hydrogen 2.934 N/A ARG 14.A NH2 GLU 19.A OE1 no hydrogen 3.110 N/A ARG 14.A NH2 GLU 19.A OE2 no hydrogen 3.409 N/A ARG 14.A NH2 GLU 45.A OE2 no hydrogen 2.883 N/A ARG 15.A N ASP 13.A OD1 no hydrogen 2.959 N/A ARG 15.A NE ASP 13.A OD1 no hydrogen 2.934 N/A ARG 15.A NE ASP 13.A OD2 no hydrogen 3.311 N/A ARG 15.A NH2 ASP 13.A OD2 no hydrogen 2.947 N/A LEU 16.A N ASP 13.A O no hydrogen 2.857 N/A LYS 17.A N ASP 13.A O no hydrogen 3.000 N/A SER 22.A N PRO 18.A O no hydrogen 3.165 N/A SER 22.A OG PRO 18.A O no hydrogen 2.782 N/A SER 22.A OG GLU 19.A O no hydrogen 3.280 N/A VAL 23.A N GLU 19.A O no hydrogen 2.840 N/A ARG 24.A N VAL 20.A O no hydrogen 3.168 N/A GLU 25.A N GLU 21.A O no hydrogen 3.395 N/A ALA 26.A N SER 22.A O no hydrogen 2.885 N/A LEU 27.A N VAL 23.A O no hydrogen 2.843 N/A GLU 28.A N ARG 24.A O no hydrogen 2.883 N/A GLY 29.A N GLU 25.A O no hydrogen 2.891 N/A GLY 30.A N LEU 27.A O no hydrogen 3.022 N/A ALA 31.A N ALA 26.A O no hydrogen 3.005 N/A THR 32.A N LEU 8.A O no hydrogen 2.884 N/A THR 32.A OG1 LYS 5.A O no hydrogen 2.671 N/A THR 32.A OG1 LEU 8.A O no hydrogen 3.209 N/A ALA 33.A N LEU 8.A O no hydrogen 3.281 N/A ILE 34.A N LEU 63.A O no hydrogen 2.860 N/A GLN 35.A N VAL 10.A O no hydrogen 2.920 N/A GLN 35.A NE2 TYR 9.A OH no hydrogen 2.991 N/A MET 36.A N PHE 65.A O no hydrogen 2.875 N/A ARG 37.A N THR 12.A OG1 no hydrogen 2.974 N/A ARG 44.A NH2.B GLU 48.A OE2 no hydrogen 3.135 N/A MET 46.A N PRO 42.A O no hydrogen 3.092 N/A TYR 47.A N THR 43.A O no hydrogen 2.896 N/A GLU 48.A N ARG 44.A O no hydrogen 2.910 N/A ILE 49.A N GLU 45.A O no hydrogen 2.932 N/A GLY 50.A N MET 46.A O no hydrogen 2.842 N/A LYS 51.A N TYR 47.A O no hydrogen 2.915 N/A THR 52.A N GLU 48.A O no hydrogen 3.310 N/A THR 52.A OG1 GLU 48.A O no hydrogen 3.410 N/A LEU 53.A N ILE 49.A O no hydrogen 2.879 N/A ARG 54.A N GLY 50.A O no hydrogen 2.802 N/A ARG 54.A NE ARG 54.A O no hydrogen 2.909 N/A ARG 54.A NE THR 57.A OG1 no hydrogen 3.414 N/A ARG 54.A NH1 ASP 77.A O no hydrogen 2.955 N/A ARG 54.A NH1 ASP 79.A OD1 no hydrogen 3.281 N/A ARG 54.A NH1 ASP 79.A OD2 no hydrogen 3.084 N/A ARG 54.A NH2 THR 57.A OG1 no hydrogen 2.938 N/A ARG 54.A NH2 ASP 79.A OD2 no hydrogen 3.021 N/A GLN 55.A N LYS 51.A O no hydrogen 3.091 N/A LEU 56.A N THR 52.A O no hydrogen 3.000 N/A THR 57.A N LEU 53.A O no hydrogen 2.896 N/A THR 57.A OG1 LEU 53.A O no hydrogen 2.936 N/A THR 57.A OG1 ARG 54.A O no hydrogen 2.939 N/A ARG 58.A N ARG 54.A O no hydrogen 3.149 N/A ARG 58.A NH2 ASP 77.A OD1 no hydrogen 2.943 N/A GLU 59.A N GLN 55.A O no hydrogen 3.052 N/A TYR 60.A N LEU 56.A O no hydrogen 3.259 N/A TYR 60.A N THR 57.A O no hydrogen 3.074 N/A TYR 60.A OH GLU 28.A OE2 no hydrogen 2.311 N/A ASP 61.A N ARG 58.A O no hydrogen 3.119 N/A ALA 62.A N THR 57.A O no hydrogen 2.914 N/A LEU 63.A N THR 32.A O no hydrogen 3.073 N/A PHE 64.A N ASP 79.A OD2 no hydrogen 2.821 N/A PHE 65.A N ILE 34.A O no hydrogen 2.803 N/A VAL 66.A N GLY 80.A O no hydrogen 3.073 N/A ASP 67.A N MET 36.A O no hydrogen 2.962 N/A ASP 68.A N GLN 82.A O no hydrogen 2.738 N/A ARG 69.A N ASP 67.A O no hydrogen 2.741 N/A ARG 69.A NE ASP 71.A OD1 no hydrogen 2.846 N/A ARG 69.A NE ASP 71.A OD2 no hydrogen 3.433 N/A ARG 69.A NH2 THR 43.A OG1 no hydrogen 2.885 N/A ARG 69.A NH2 ASP 71.A OD2 no hydrogen 2.766 N/A ALA 73.A N ARG 69.A O no hydrogen 3.028 N/A LEU 74.A N VAL 70.A O no hydrogen 2.831 N/A ALA 75.A N ASP 71.A O no hydrogen 2.901 N/A VAL 76.A N VAL 72.A O no hydrogen 2.959 N/A ASP 77.A N LEU 74.A O no hydrogen 3.186 N/A ALA 78.A N ALA 73.A O no hydrogen 2.967 N/A ASP 79.A N PHE 64.A O no hydrogen 2.799 N/A GLY 80.A N PHE 64.A O no hydrogen 3.256 N/A VAL 81.A N ILE 101.A O no hydrogen 2.940 N/A GLN 82.A N VAL 66.A O no hydrogen 2.956 N/A GLN 82.A NE2 SER 105.A OG no hydrogen 2.999 N/A LEU 83.A N GLY 103.A O no hydrogen 2.759 N/A GLY 84.A N ASP 87.A OD1 no hydrogen 2.783 N/A ASP 87.A N GLY 84.A O no hydrogen 2.940 N/A GLU 91.A N GLU 91.A OE1 no hydrogen 2.794 N/A VAL 92.A N PRO 89.A O no hydrogen 3.020 N/A ALA 93.A N PRO 89.A O no hydrogen 2.924 N/A LYS 94.A N ILE 90.A O no hydrogen 2.973 N/A GLU 95.A N GLU 91.A O no hydrogen 3.171 N/A ILE 96.A N VAL 92.A O no hydrogen 3.081 N/A ALA 97.A N ALA 93.A O no hydrogen 2.854 N/A LEU 100.A N ALA 97.A O no hydrogen 3.248 N/A ILE 101.A N ASP 79.A O no hydrogen 2.937 N/A ILE 102.A N ASP 121.A OD1 no hydrogen 2.839 N/A GLY 103.A N VAL 81.A O no hydrogen 2.917 N/A ALA 104.A N TYR 122.A O no hydrogen 2.996 N/A SER 105.A N LEU 83.A O no hydrogen 2.861 N/A VAL 106.A N GLY 124.A O no hydrogen 2.964 N/A TYR 107.A N GLU 111.A OE2 no hydrogen 2.919 N/A GLU 111.A N SER 108.A OG no hydrogen 3.030 N/A ALA 112.A N SER 108.A O no hydrogen 2.918 N/A LEU 113.A N LEU 109.A O no hydrogen 2.938 N/A GLU 114.A N GLU 110.A O no hydrogen 2.982 N/A ALA 115.A N GLU 111.A O no hydrogen 2.846 N/A GLU 116.A N ALA 112.A O no hydrogen 3.027 N/A LYS 117.A N LEU 113.A O no hydrogen 2.829 N/A LYS 118.A N GLU 114.A O no hydrogen 2.954 N/A GLY 119.A N GLU 116.A O no hydrogen 2.980 N/A ALA 120.A N ALA 115.A O no hydrogen 3.066 N/A ASP 121.A N ILE 102.A O no hydrogen 2.736 N/A TYR 122.A N ILE 102.A O no hydrogen 3.248 N/A TYR 122.A OH TYR 9.A OH no hydrogen 2.684 N/A TYR 122.A OH GLN 82.A OE1 no hydrogen 2.545 N/A LEU 123.A N PRO 151.A O no hydrogen 2.938 N/A GLY 124.A N ALA 104.A O no hydrogen 2.779 N/A ALA 125.A N VAL 153.A O no hydrogen 2.876 N/A GLY 126.A N VAL 106.A O no hydrogen 3.189 N/A SER 127.A N ARG 134.A O no hydrogen 2.946 N/A SER 127.A OG.A PHE 129.A O no hydrogen 2.459 N/A VAL 128.A N ILE 155.A O no hydrogen 2.863 N/A PHE 129.A N GLY 156.A O no hydrogen 3.019 N/A ARG 134.A N ASP 132.A OD2 no hydrogen 3.151 N/A ARG 134.A NE ASP 132.A OD1 no hydrogen 3.246 N/A ARG 134.A NE ASP 132.A OD2 no hydrogen 3.046 N/A ARG 134.A NH1 GLU 111.A OE1 no hydrogen 2.886 N/A ARG 134.A NH2 GLU 111.A OE1 no hydrogen 3.182 N/A ARG 134.A NH2 GLU 111.A OE2 no hydrogen 3.531 N/A ARG 134.A NH2 ASP 132.A OD1 no hydrogen 2.890 N/A ILE 136.A N SER 127.A O no hydrogen 2.668 N/A LEU 141.A N GLY 137.A O no hydrogen 2.867 N/A ARG 142.A N LEU 138.A O no hydrogen 2.866 N/A ARG 142.A NE GLU 146.A OE1 no hydrogen 2.720 N/A ARG 142.A NH1 THR 169.A O no hydrogen 2.866 N/A LYS 143.A N GLU 139.A O no hydrogen 3.005 N/A ILE 144.A N GLY 140.A O no hydrogen 3.107 N/A VAL 145.A N LEU 141.A O no hydrogen 3.047 N/A GLU 146.A N ARG 142.A O no hydrogen 2.886 N/A SER 147.A N ILE 144.A O no hydrogen 2.955 N/A SER 147.A OG LYS 143.A O no hydrogen 2.595 N/A VAL 148.A N ILE 144.A O no hydrogen 3.143 N/A LYS 149.A N GLU 116.A OE2 no hydrogen 2.762 N/A VAL 152.A N ASP 172.A OD1 no hydrogen 2.919 N/A VAL 153.A N LEU 123.A O no hydrogen 2.773 N/A ALA 154.A N GLY 173.A O no hydrogen 3.011 N/A ILE 155.A N ALA 125.A O no hydrogen 2.990 N/A ASN 159.A N ASN 162.A OD1 no hydrogen 2.845 N/A LYS 160.A NZ GLU 192.A OE1 no hydrogen 2.557 N/A LYS 160.A NZ GLU 192.A OE2 no hydrogen 3.287 N/A ASP 161.A N ASN 159.A OD1 no hydrogen 2.974 N/A ASN 162.A N ASN 159.A O no hydrogen 3.196 N/A ASN 162.A N ASN 159.A OD1 no hydrogen 3.348 N/A ASN 162.A ND2 GLY 157.A O no hydrogen 2.938 N/A ALA 163.A N ASN 159.A O no hydrogen 2.839 N/A VAL 166.A N ASN 162.A O no hydrogen 3.039 N/A LEU 167.A N ALA 163.A O no hydrogen 2.848 N/A LYS 168.A N ARG 164.A O no hydrogen 2.917 N/A THR 169.A N VAL 166.A O no hydrogen 2.997 N/A THR 169.A OG1 VAL 166.A O no hydrogen 2.681 N/A GLY 170.A N LEU 167.A O no hydrogen 3.109 N/A ASP 172.A N VAL 152.A O no hydrogen 2.849 N/A ILE 174.A N LYS 7.A O no hydrogen 3.042 N/A ALA 175.A N ALA 154.A O no hydrogen 2.803 N/A VAL 176.A N TYR 9.A O no hydrogen 2.963 N/A VAL 180.A N ILE 177.A O no hydrogen 3.118 N/A MET 181.A N ILE 177.A O no hydrogen 2.786 N/A GLY 182.A N SER 178.A O no hydrogen 2.873 N/A ALA 183.A N VAL 180.A O no hydrogen 3.157 N/A LYS 188.A N ASP 185.A OD2 no hydrogen 3.227 N/A ALA 189.A N ASP 185.A O no hydrogen 3.088 N/A THR 190.A N VAL 186.A O no hydrogen 3.058 N/A THR 190.A OG1 VAL 186.A O no hydrogen 2.770 N/A GLU 191.A N ARG 187.A O no hydrogen 2.842 N/A GLU 192.A N LYS 188.A O no hydrogen 3.040 N/A LEU 193.A N ALA 189.A O no hydrogen 3.230 N/A ARG 194.A N THR 190.A O no hydrogen 2.806 N/A ARG 194.A NE GLU 198.A OE2 no hydrogen 2.907 N/A ARG 194.A NH1 GLY 30.A O no hydrogen 2.701 N/A ARG 194.A NH2 GLU 198.A OE2 no hydrogen 3.055 N/A LYS 195.A N GLU 191.A O no hydrogen 2.999 N/A ILE 196.A N GLU 192.A O no hydrogen 3.136 N/A VAL 197.A N LEU 193.A O no hydrogen 2.881 N/A GLU 198.A N ARG 194.A O no hydrogen 2.888 N/A GLU 199.A N LYS 195.A O no hydrogen 2.825 N/A VAL 200.A N ILE 196.A O no hydrogen 2.988 N/A LEU 201.A N VAL 197.A O no hydrogen 2.917 N/A GLY 202.A N GLU 198.A O no hydrogen 2.749 N/A