Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ny1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 3.A ND2 THR 108.A O no hydrogen 2.889 N/A ILE 6.A N PHE 145.A O no hydrogen 2.708 N/A TRP 8.A N GLY 143.A O no hydrogen 2.798 N/A TRP 8.A NE1 TRP 163.A O no hydrogen 3.070 N/A SER 13.A OG GLN 17.A O no hydrogen 2.771 N/A SER 13.A OG GLN 187.A O no hydrogen 3.516 N/A GLN 17.A N VAL 14.A O no hydrogen 3.022 N/A GLN 17.A NE2 ASN 15.A O no hydrogen 3.525 N/A ALA 21.A N TYR 36.A OH no hydrogen 3.027 N/A GLY 22.A N ASP 20.A OD1 no hydrogen 2.560 N/A ASN 26.A N GLY 22.A O no hydrogen 2.864 N/A ASN 26.A ND2 ASP 20.A OD1 no hydrogen 3.277 N/A ASN 26.A ND2 ASP 20.A OD2 no hydrogen 3.040 N/A SER 27.A N LYS 23.A O no hydrogen 2.904 N/A SER 27.A OG LYS 23.A O no hydrogen 3.001 N/A LEU 28.A N GLN 24.A O no hydrogen 3.140 N/A ILE 29.A N LEU 25.A O no hydrogen 3.056 N/A GLU 30.A N ASN 26.A O no hydrogen 3.148 N/A LYS 31.A N SER 27.A O no hydrogen 3.026 N/A LYS 31.A NZ GLU 147.A OE2 no hydrogen 3.086 N/A TYR 32.A N ILE 29.A O no hydrogen 2.992 N/A TYR 32.A OH GLU 147.A OE2 no hydrogen 2.685 N/A ASP 33.A N GLU 30.A O no hydrogen 3.182 N/A ALA 34.A N ILE 29.A O no hydrogen 2.756 N/A PHE 35.A N THR 160.A O no hydrogen 3.407 N/A TYR 36.A OH ASN 26.A OD1 no hydrogen 2.633 N/A GLY 38.A N GLY 191.A O no hydrogen 2.820 N/A ASN 39.A N TYR 46.A OH no hydrogen 2.986 N/A LYS 41.A N ASN 39.A OD1 no hydrogen 2.885 N/A LYS 43.A NZ GLN 217.A O no hydrogen 2.900 N/A THR 44.A N GLU 42.A O no hydrogen 2.817 N/A THR 44.A OG1 GLU 42.A OE1 no hydrogen 2.872 N/A ILE 45.A N THR 220.A O no hydrogen 2.896 N/A TYR 46.A N ALA 192.A O no hydrogen 2.886 N/A THR 48.A N TYR 194.A O no hydrogen 2.931 N/A THR 48.A OG1 TYR 194.A O no hydrogen 2.583 N/A PHE 49.A N THR 73.A O no hydrogen 2.766 N/A ASP 50.A N LEU 196.A O no hydrogen 2.966 N/A ASN 51.A N PHE 75.A O no hydrogen 2.842 N/A ASN 55.A ND2 VAL 199.A O no hydrogen 2.852 N/A GLY 56.A N GLU 54.A OE2 no hydrogen 3.211 N/A THR 58.A N GLU 54.A OE2 no hydrogen 3.049 N/A THR 58.A OG1 GLU 54.A OE1 no hydrogen 2.486 N/A THR 58.A OG1 GLU 54.A OE2 no hydrogen 3.359 N/A THR 58.A OG1 THR 198.A OG1 no hydrogen 2.766 N/A LYS 60.A NZ GLU 205.A OE2 no hydrogen 2.854 N/A VAL 61.A N TYR 57.A O no hydrogen 3.062 N/A LEU 62.A N THR 58.A O no hydrogen 2.916 N/A ASP 63.A N PRO 59.A O no hydrogen 3.018 N/A VAL 64.A N LYS 60.A O no hydrogen 2.912 N/A LEU 65.A N VAL 61.A O no hydrogen 3.014 N/A LYS 66.A N LEU 62.A O no hydrogen 3.027 N/A LYS 67.A N ASP 63.A O no hydrogen 2.904 N/A LYS 67.A NZ ASP 208.A OD1 no hydrogen 2.844 N/A LYS 67.A NZ ASP 208.A OD2 no hydrogen 3.259 N/A HIS 68.A N VAL 64.A O no hydrogen 3.105 N/A HIS 68.A NE2 ASP 208.A OD1 no hydrogen 2.742 N/A ARG 69.A N LYS 66.A O no hydrogen 2.948 N/A VAL 70.A N LEU 65.A O no hydrogen 2.830 N/A GLY 72.A N HIS 95.A ND1 no hydrogen 3.003 N/A THR 73.A N LEU 47.A O no hydrogen 3.274 N/A PHE 74.A N ILE 96.A O no hydrogen 2.755 N/A PHE 75.A N PHE 49.A O no hydrogen 2.755 N/A VAL 76.A N GLY 98.A O no hydrogen 3.122 N/A THR 77.A N ASN 51.A O no hydrogen 3.295 N/A THR 77.A OG1 GLY 52.A O no hydrogen 3.399 N/A GLY 78.A N SER 101.A O no hydrogen 3.332 N/A GLY 78.A N PHE 102.A O no hydrogen 2.891 N/A PHE 80.A N THR 77.A OG1 no hydrogen 3.347 N/A VAL 81.A N THR 77.A O no hydrogen 3.147 N/A LYS 82.A N GLY 78.A O no hydrogen 2.965 N/A ASP 83.A N HIS 79.A O no hydrogen 2.763 N/A GLN 84.A N PHE 80.A O no hydrogen 2.736 N/A GLN 84.A NE2 ASP 83.A OD2 no hydrogen 3.006 N/A ILE 88.A N GLN 84.A O no hydrogen 3.174 N/A LYS 89.A N PRO 85.A O no hydrogen 2.998 N/A LYS 89.A NZ ILE 129.A O no hydrogen 2.955 N/A ARG 90.A N GLN 86.A O no hydrogen 2.999 N/A ARG 90.A NE GLU 93.A OE1 no hydrogen 3.373 N/A ARG 90.A NE GLU 93.A OE2 no hydrogen 2.783 N/A ARG 90.A NH1 PRO 59.A O no hydrogen 3.405 N/A ARG 90.A NH1 ASP 63.A OD1 no hydrogen 3.474 N/A ARG 90.A NH2 ASP 63.A OD1 no hydrogen 2.983 N/A ARG 90.A NH2 GLU 93.A OE1 no hydrogen 2.792 N/A ARG 90.A NH2 GLU 93.A OE2 no hydrogen 3.340 N/A ASP 92.A N LYS 89.A O no hydrogen 2.824 N/A GLU 93.A N ARG 90.A O no hydrogen 2.781 N/A GLY 94.A N SER 91.A O no hydrogen 3.327 N/A ILE 96.A N GLY 72.A O no hydrogen 2.944 N/A ILE 97.A N ASP 134.A OD1 no hydrogen 2.945 N/A GLY 98.A N PHE 74.A O no hydrogen 2.660 N/A ASN 99.A N TYR 137.A O no hydrogen 2.822 N/A ASN 99.A ND2 LEU 119.A O no hydrogen 2.778 N/A HIS 100.A N VAL 76.A O no hydrogen 2.831 N/A SER 101.A N ASN 99.A OD1 no hydrogen 2.735 N/A SER 101.A OG HIS 100.A O no hydrogen 2.626 N/A PHE 102.A N GLU 118.A O no hydrogen 2.939 N/A HIS 103.A N GLU 118.A OE1 no hydrogen 2.821 N/A HIS 103.A ND1 GLU 118.A OE2 no hydrogen 2.681 N/A THR 108.A N ASP 106.A OD1 no hydrogen 2.925 N/A THR 108.A OG1 ASP 106.A OD1 no hydrogen 2.575 N/A THR 109.A N ASP 106.A O no hydrogen 3.015 N/A THR 109.A OG1 ASP 106.A O no hydrogen 2.636 N/A LYS 110.A N LEU 107.A O no hydrogen 3.049 N/A GLN 114.A N THR 111.A OG1 no hydrogen 3.283 N/A ILE 115.A N THR 111.A O no hydrogen 2.865 N/A GLN 116.A N ALA 112.A O no hydrogen 2.965 N/A ASP 117.A N ASP 113.A O no hydrogen 3.128 N/A GLU 118.A N GLN 114.A O no hydrogen 2.845 N/A LEU 119.A N ILE 115.A O no hydrogen 3.056 N/A ASP 120.A N GLN 116.A O no hydrogen 2.876 N/A SER 121.A N ASP 117.A O no hydrogen 3.002 N/A SER 121.A OG ASP 117.A O no hydrogen 2.728 N/A SER 121.A OG GLU 118.A O no hydrogen 3.110 N/A VAL 122.A N LEU 119.A O no hydrogen 3.124 N/A ASN 123.A N LEU 119.A O no hydrogen 3.477 N/A GLU 124.A N ASP 120.A O no hydrogen 2.791 N/A GLU 125.A N SER 121.A O no hydrogen 3.125 N/A VAL 126.A N VAL 122.A O no hydrogen 2.899 N/A TYR 127.A N ASN 123.A O no hydrogen 2.789 N/A LYS 128.A N GLU 124.A O no hydrogen 3.117 N/A ILE 129.A N GLU 125.A O no hydrogen 3.300 N/A ILE 129.A N VAL 126.A O no hydrogen 3.039 N/A THR 130.A N VAL 126.A O no hydrogen 2.801 N/A THR 130.A OG1 VAL 126.A O no hydrogen 3.034 N/A THR 130.A OG1 LYS 132.A O no hydrogen 3.205 N/A GLY 131.A N TYR 127.A O no hydrogen 2.587 N/A LYS 132.A N THR 130.A OG1 no hydrogen 3.014 N/A ASN 135.A ND2 ASP 225.A OD1 no hydrogen 2.822 N/A TYR 137.A OH ASP 225.A OD1 no hydrogen 2.564 N/A LEU 138.A N GLN 159.A O no hydrogen 2.780 N/A ARG 139.A N ASN 99.A O no hydrogen 3.162 N/A ARG 139.A NE VAL 161.A O no hydrogen 3.044 N/A ARG 139.A NH1 THR 48.A OG1 no hydrogen 2.877 N/A ARG 139.A NH1 ASP 50.A OD1 no hydrogen 2.907 N/A ARG 139.A NH2 THR 48.A OG1 no hydrogen 2.930 N/A ARG 139.A NH2 PHE 162.A O no hydrogen 2.850 N/A GLY 143.A N PRO 140.A O no hydrogen 2.834 N/A VAL 144.A N PRO 141.A O no hydrogen 3.124 N/A PHE 145.A N ILE 6.A O no hydrogen 2.791 N/A SER 146.A OG ASN 3.A OD1 no hydrogen 2.695 N/A TYR 148.A N PRO 2.A O no hydrogen 3.112 N/A TYR 148.A OH LYS 110.A O no hydrogen 2.835 N/A VAL 149.A N SER 146.A OG no hydrogen 3.117 N/A LEU 150.A N SER 146.A O no hydrogen 2.938 N/A LYS 151.A N GLU 147.A O no hydrogen 2.774 N/A GLU 152.A N TYR 148.A O no hydrogen 2.961 N/A THR 153.A N VAL 149.A O no hydrogen 2.971 N/A THR 153.A OG1 VAL 149.A O no hydrogen 2.716 N/A THR 153.A OG1 LEU 150.A O no hydrogen 3.212 N/A LYS 154.A N LEU 150.A O no hydrogen 3.063 N/A ARG 155.A N LYS 151.A O no hydrogen 3.005 N/A LEU 156.A N GLU 152.A O no hydrogen 3.069 N/A GLY 157.A N LYS 154.A O no hydrogen 2.909 N/A TYR 158.A N THR 153.A O no hydrogen 2.884 N/A TYR 158.A OH ASN 123.A OD1 no hydrogen 2.670 N/A GLN 159.A N LEU 136.A O no hydrogen 2.976 N/A VAL 161.A N LEU 138.A O no hydrogen 2.729 N/A PHE 162.A N PHE 35.A O no hydrogen 2.899 N/A SER 164.A N ILE 193.A O no hydrogen 2.863 N/A SER 164.A OG ILE 193.A O no hydrogen 3.385 N/A VAL 165.A N ILE 193.A O no hydrogen 3.143 N/A ASN 174.A N LYS 171.A O no hydrogen 3.161 N/A LYS 178.A NZ ASP 209.A OD2 no hydrogen 2.847 N/A LYS 179.A NZ ASP 183.A OD2 no hydrogen 2.950 N/A TYR 182.A N LYS 178.A O no hydrogen 2.879 N/A TYR 182.A OH ASP 213.A OD2 no hydrogen 2.600 N/A ASP 183.A N LYS 179.A O no hydrogen 2.843 N/A HIS 184.A N TYR 180.A O no hydrogen 3.334 N/A LYS 186.A N ASP 183.A O no hydrogen 2.920 N/A GLN 187.A N HIS 184.A O no hydrogen 2.928 N/A ALA 188.A N ILE 185.A O no hydrogen 3.391 N/A GLY 191.A N THR 44.A O no hydrogen 2.829 N/A ALA 192.A N HIS 189.A O no hydrogen 3.034 N/A ILE 193.A N SER 164.A OG no hydrogen 2.894 N/A TYR 194.A N TYR 46.A O no hydrogen 2.950 N/A LEU 195.A N VAL 165.A O no hydrogen 2.808 N/A LEU 196.A N THR 48.A O no hydrogen 2.905 N/A HIS 197.A N ASP 169.A OD2 no hydrogen 2.863 N/A THR 198.A OG1 ASN 51.A OD1 no hydrogen 3.356 N/A THR 198.A OG1 THR 58.A OG1 no hydrogen 2.766 N/A ARG 201.A NH2 GLN 175.A O no hydrogen 3.450 N/A ASN 203.A N SER 200.A O no hydrogen 3.022 N/A GLU 205.A N GLU 205.A OE1 no hydrogen 2.719 N/A ALA 206.A N ASP 202.A O no hydrogen 2.907 N/A LEU 207.A N ASN 203.A O no hydrogen 2.926 N/A ASP 208.A N ALA 204.A O no hydrogen 2.912 N/A ASP 209.A N GLU 205.A O no hydrogen 3.068 N/A ALA 210.A N ALA 206.A O no hydrogen 2.841 N/A ILE 211.A N LEU 207.A O no hydrogen 2.881 N/A THR 212.A N ASP 208.A O no hydrogen 3.090 N/A THR 212.A OG1 ASP 208.A O no hydrogen 2.860 N/A ASP 213.A N ASP 209.A O no hydrogen 2.906 N/A LEU 214.A N ALA 210.A O no hydrogen 2.786 N/A LYS 215.A N ILE 211.A O no hydrogen 2.840 N/A LYS 215.A NZ HIS 68.A O no hydrogen 2.872 N/A LYS 216.A N THR 212.A O no hydrogen 3.137 N/A GLN 217.A N ASP 213.A O no hydrogen 3.122 N/A GLY 218.A N LYS 215.A O no hydrogen 2.857 N/A TYR 219.A N LEU 214.A O no hydrogen 3.054 N/A THR 220.A N LYS 43.A O no hydrogen 2.891 N/A LYS 222.A N ILE 45.A O no hydrogen 2.958 N/A LYS 222.A NZ GLU 42.A OE1 no hydrogen 2.881 N/A LYS 222.A NZ GLU 229.A OE1 no hydrogen 3.020 N/A LYS 222.A NZ GLU 229.A OE2 no hydrogen 3.010 N/A SER 223.A N ASP 226.A OD2 no hydrogen 2.922 N/A ASP 226.A N SER 223.A OG no hydrogen 3.033 N/A LEU 227.A N SER 223.A O no hydrogen 2.894 N/A GLU 229.A N ASP 226.A O no hydrogen 2.882 N/A LYS 230.A N LEU 227.A O no hydrogen 3.094 N/A GLU 231.A N PHE 228.A O no hydrogen 2.992 N/A