Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1icr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A N ASP 1.A OD1 no hydrogen 2.920 N/A VAL 5.A N ASP 1.A O no hydrogen 3.289 N/A ALA 6.A N ILE 2.A O no hydrogen 2.932 N/A LEU 7.A N ILE 3.A O no hydrogen 2.938 N/A LYS 8.A N SER 4.A O no hydrogen 2.883 N/A ARG 9.A N VAL 5.A O no hydrogen 2.953 N/A HIS 10.A NE2 ASP 197.A OD2 no hydrogen 2.617 N/A THR 12.A N ALA 160.A O no hydrogen 3.007 N/A THR 12.A OG1 ALA 160.A O no hydrogen 3.452 N/A LYS 13.A N ASP 197.A OD1 no hydrogen 2.979 N/A ASP 16.A N HIS 192.A O no hydrogen 2.845 N/A SER 18.A N ASP 16.A OD1 no hydrogen 2.948 N/A SER 18.A OG ASP 16.A OD1 no hydrogen 2.627 N/A LYS 19.A N ASP 16.A O no hydrogen 3.067 N/A LEU 21.A N SER 78.A OG no hydrogen 3.001 N/A THR 22.A N GLN 25.A OE1 no hydrogen 2.919 N/A GLN 25.A N THR 22.A OG1 no hydrogen 3.056 N/A GLN 25.A NE2 LEU 156.A O no hydrogen 3.694 N/A ALA 26.A N THR 22.A O no hydrogen 2.949 N/A GLU 27.A N PRO 23.A O no hydrogen 3.243 N/A GLN 28.A N GLU 24.A O no hydrogen 2.842 N/A ILE 29.A N GLN 25.A O no hydrogen 2.952 N/A LYS 30.A NZ GLU 27.A OE1 no hydrogen 2.991 N/A THR 31.A N GLU 27.A O no hydrogen 3.029 N/A THR 31.A OG1 GLU 27.A O no hydrogen 3.265 N/A LEU 32.A N GLN 28.A O no hydrogen 3.028 N/A LEU 33.A N ILE 29.A O no hydrogen 3.140 N/A GLN 34.A N LYS 30.A O no hydrogen 3.032 N/A TYR 35.A N THR 31.A O no hydrogen 2.925 N/A SER 36.A OG PRO 37.A O no hydrogen 3.086 N/A SER 39.A N GLN 141.A OE1 no hydrogen 2.820 N/A THR 40.A OG1 SER 39.A O no hydrogen 2.531 N/A ASN 41.A N SER 38.A O no hydrogen 2.799 N/A ASN 41.A ND2 GLU 101.A OE1 no hydrogen 2.861 N/A SER 42.A N SER 39.A O no hydrogen 2.942 N/A SER 42.A OG SER 39.A O no hydrogen 2.693 N/A GLN 43.A N SER 38.A OG no hydrogen 2.951 N/A GLN 43.A NE2 ASN 41.A O no hydrogen 3.010 N/A TRP 45.A N GLN 43.A O no hydrogen 2.820 N/A HIS 46.A N CYS 84.A O no hydrogen 3.023 N/A ILE 48.A N VAL 82.A O no hydrogen 3.075 N/A ALA 50.A N VAL 80.A O no hydrogen 2.807 N/A GLY 55.A N THR 52.A OG1 no hydrogen 2.851 N/A LYS 56.A N THR 52.A O no hydrogen 2.907 N/A LYS 56.A NZ ALA 77.A O no hydrogen 2.826 N/A LYS 56.A NZ SER 78.A O no hydrogen 3.065 N/A ALA 57.A N GLU 53.A O no hydrogen 2.978 N/A ARG 58.A N GLU 54.A O no hydrogen 3.044 N/A ARG 58.A NE GLU 174.A OE1 no hydrogen 2.784 N/A ARG 58.A NH2 GLU 174.A O no hydrogen 2.914 N/A VAL 59.A N GLY 55.A O no hydrogen 3.241 N/A ALA 60.A N LYS 56.A O no hydrogen 2.827 N/A LYS 61.A N ARG 58.A O no hydrogen 3.431 N/A LYS 61.A NZ GLU 174.A OE2 no hydrogen 2.751 N/A SER 62.A N VAL 59.A O no hydrogen 3.035 N/A SER 62.A OG VAL 59.A O no hydrogen 2.705 N/A ALA 63.A N ALA 60.A O no hydrogen 3.022 N/A TYR 67.A N ALA 64.A O no hydrogen 2.862 N/A VAL 68.A N GLY 65.A O no hydrogen 3.414 N/A ASN 70.A N TYR 67.A O no hydrogen 2.903 N/A ASN 70.A ND2 GLY 165.A O no hydrogen 2.778 N/A GLU 71.A N VAL 68.A O no hydrogen 3.084 N/A ARG 72.A NE ASP 76.A OD1 no hydrogen 3.355 N/A ARG 72.A NE ASP 76.A OD2 no hydrogen 2.852 N/A ARG 72.A NH2 ASP 76.A OD1 no hydrogen 2.954 N/A LYS 73.A NZ ASN 70.A OD1 no hydrogen 2.695 N/A MET 74.A N ASN 70.A O no hydrogen 3.349 N/A LEU 75.A N GLU 71.A O no hydrogen 3.069 N/A LEU 75.A N ARG 72.A O no hydrogen 3.204 N/A ASP 76.A N ARG 72.A O no hydrogen 2.783 N/A ALA 77.A N LYS 73.A O no hydrogen 3.333 N/A SER 78.A OG HIS 79.A ND1 no hydrogen 2.813 N/A HIS 79.A N VAL 190.A O no hydrogen 2.958 N/A HIS 79.A ND1 SER 78.A OG no hydrogen 2.813 N/A VAL 80.A N ALA 50.A O no hydrogen 2.841 N/A VAL 81.A N VAL 188.A O no hydrogen 2.989 N/A VAL 82.A N ILE 48.A O no hydrogen 2.776 N/A PHE 83.A N VAL 186.A O no hydrogen 2.773 N/A CYS 84.A N HIS 46.A O no hydrogen 2.875 N/A CYS 84.A SG VAL 82.A O no hydrogen 3.879 N/A ALA 85.A N THR 183.A O no hydrogen 2.966 N/A LYS 86.A N PRO 44.A O no hydrogen 3.055 N/A LYS 86.A NZ ALA 88.A O no hydrogen 3.216 N/A LYS 86.A NZ ASP 90.A OD2 no hydrogen 2.870 N/A THR 87.A N GLY 181.A O no hydrogen 2.990 N/A THR 87.A OG1 GLY 181.A O no hydrogen 3.346 N/A MET 89.A N ASP 134.A OD1 no hydrogen 3.226 N/A TRP 93.A N ASP 90.A O no hydrogen 3.187 N/A TRP 93.A N ASP 90.A OD1 no hydrogen 2.915 N/A TRP 93.A NE1 SER 42.A O no hydrogen 2.871 N/A LEU 94.A N ASP 90.A O no hydrogen 3.229 N/A LYS 95.A N ASP 91.A O no hydrogen 2.812 N/A LYS 95.A NZ ASP 99.A OD1 no hydrogen 2.843 N/A LEU 96.A N VAL 92.A O no hydrogen 2.987 N/A VAL 97.A N TRP 93.A O no hydrogen 3.023 N/A VAL 98.A N LEU 94.A O no hydrogen 3.228 N/A ASP 99.A N LYS 95.A O no hydrogen 2.947 N/A GLN 100.A N LEU 96.A O no hydrogen 3.039 N/A GLN 100.A NE2 ASP 104.A OD1 no hydrogen 3.405 N/A GLN 100.A NE2 ASP 104.A OD2 no hydrogen 2.945 N/A GLU 101.A N VAL 97.A O no hydrogen 2.986 N/A ASP 102.A N VAL 98.A O no hydrogen 2.953 N/A ALA 103.A N ASP 99.A O no hydrogen 2.899 N/A ASP 104.A N GLN 100.A O no hydrogen 2.919 N/A GLY 105.A N ASP 102.A O no hydrogen 3.011 N/A ARG 106.A N GLU 101.A O no hydrogen 3.087 N/A ARG 106.A NE GLU 101.A OE2 no hydrogen 3.081 N/A ALA 112.A N THR 109.A OG1 no hydrogen 3.095 N/A LYS 113.A N THR 109.A O no hydrogen 3.266 N/A LYS 113.A NZ ASP 99.A OD2 no hydrogen 2.931 N/A LYS 113.A NZ ASP 102.A OD2 no hydrogen 2.962 N/A ALA 114.A N PRO 110.A O no hydrogen 2.934 N/A ALA 115.A N GLU 111.A O no hydrogen 2.893 N/A ASN 116.A N ALA 112.A O no hydrogen 3.059 N/A ASP 117.A N LYS 113.A O no hydrogen 2.905 N/A LYS 118.A N ALA 114.A O no hydrogen 2.894 N/A GLY 119.A N ALA 115.A O no hydrogen 2.992 N/A ARG 120.A N ASN 116.A O no hydrogen 3.058 N/A ARG 120.A NE THR 40.A O no hydrogen 2.774 N/A ARG 120.A NH1 ASN 116.A OD1 no hydrogen 2.800 N/A ARG 120.A NH2 THR 40.A O no hydrogen 3.008 N/A ARG 120.A NH2 ASN 116.A OD1 no hydrogen 2.987 N/A LYS 121.A N ASP 117.A O no hydrogen 2.949 N/A LYS 121.A NZ ASP 91.A OD1 no hydrogen 3.557 N/A PHE 122.A N LYS 118.A O no hydrogen 2.917 N/A PHE 123.A N GLY 119.A O no hydrogen 3.376 N/A ALA 124.A N ARG 120.A O no hydrogen 2.958 N/A ASP 125.A N LYS 121.A O no hydrogen 2.836 N/A MET 126.A N PHE 122.A O no hydrogen 3.134 N/A HIS 127.A N PHE 123.A O no hydrogen 3.157 N/A HIS 127.A ND1 ASP 133.A OD2 no hydrogen 2.729 N/A ARG 128.A N ALA 124.A O no hydrogen 2.803 N/A ARG 128.A NH1 ASP 91.A OD1 no hydrogen 3.104 N/A LYS 129.A N ASP 125.A O no hydrogen 2.651 N/A ASP 130.A N ASP 125.A O no hydrogen 3.343 N/A ASP 130.A N MET 126.A O no hydrogen 3.278 N/A LEU 131.A N MET 126.A O no hydrogen 2.844 N/A ASP 133.A N HIS 127.A O no hydrogen 2.908 N/A TRP 137.A N ASP 133.A O no hydrogen 2.822 N/A MET 138.A N ASP 134.A O no hydrogen 2.902 N/A ALA 139.A N ALA 135.A O no hydrogen 3.108 N/A LYS 140.A N GLU 136.A O no hydrogen 2.912 N/A LYS 140.A NZ GLU 136.A OE2 no hydrogen 3.421 N/A GLN 141.A N TRP 137.A O no hydrogen 3.364 N/A GLN 141.A NE2 TRP 137.A O no hydrogen 3.160 N/A VAL 142.A N MET 138.A O no hydrogen 3.192 N/A TYR 143.A N ALA 139.A O no hydrogen 2.989 N/A TYR 143.A OH GLU 164.A OE2 no hydrogen 2.591 N/A LEU 144.A N LYS 140.A O no hydrogen 3.009 N/A ASN 145.A N GLN 141.A O no hydrogen 3.021 N/A ASN 145.A ND2 LEU 33.A O no hydrogen 3.037 N/A VAL 146.A N VAL 142.A O no hydrogen 2.909 N/A GLY 147.A N TYR 143.A O no hydrogen 2.972 N/A ASN 148.A N LEU 144.A O no hydrogen 3.033 N/A PHE 149.A N ASN 145.A O no hydrogen 2.819 N/A LEU 150.A N VAL 146.A O no hydrogen 2.876 N/A LEU 151.A N GLY 147.A O no hydrogen 3.409 N/A GLY 152.A N ASN 148.A O no hydrogen 2.940 N/A VAL 153.A N PHE 149.A O no hydrogen 2.874 N/A ALA 154.A N LEU 150.A O no hydrogen 3.221 N/A ALA 155.A N LEU 151.A O no hydrogen 2.963 N/A LEU 156.A N GLY 152.A O no hydrogen 3.090 N/A LEU 156.A N VAL 153.A O no hydrogen 3.026 N/A GLY 157.A N ALA 154.A O no hydrogen 2.950 N/A LEU 158.A N VAL 153.A O no hydrogen 2.972 N/A ASP 159.A N GLY 191.A O no hydrogen 2.802 N/A VAL 161.A N PRO 189.A O no hydrogen 3.247 N/A ILE 163.A N VAL 187.A O no hydrogen 2.759 N/A PHE 166.A N GLU 164.A O no hydrogen 2.958 N/A ASP 167.A N SER 62.A O no hydrogen 2.816 N/A ILE 170.A N ASP 167.A OD1 no hydrogen 3.115 N/A LEU 171.A N ASP 167.A O no hydrogen 3.073 N/A ASP 172.A N ALA 168.A O no hydrogen 2.792 N/A ALA 173.A N ALA 169.A O no hydrogen 3.003 N/A GLU 174.A N ILE 170.A O no hydrogen 2.974 N/A PHE 175.A N LEU 171.A O no hydrogen 3.194 N/A PHE 175.A N ASP 172.A O no hydrogen 3.286 N/A GLY 176.A N ALA 173.A O no hydrogen 3.297 N/A LEU 177.A N ASP 172.A O no hydrogen 2.980 N/A GLY 181.A N LYS 178.A O no hydrogen 2.930 N/A TYR 182.A N LEU 177.A O no hydrogen 2.933 N/A THR 183.A N ALA 85.A O no hydrogen 2.968 N/A THR 183.A OG1 ASP 172.A OD1 no hydrogen 2.801 N/A SER 184.A N ASP 172.A OD2 no hydrogen 2.868 N/A SER 184.A OG ASP 172.A OD2 no hydrogen 2.898 N/A LEU 185.A N PHE 83.A O no hydrogen 2.859 N/A VAL 186.A N PHE 83.A O no hydrogen 3.441 N/A VAL 187.A N ILE 163.A O no hydrogen 3.012 N/A VAL 188.A N VAL 81.A O no hydrogen 2.689 N/A VAL 190.A N HIS 79.A O no hydrogen 2.618 N/A GLY 191.A N ASP 159.A O no hydrogen 2.879 N/A HIS 193.A N ASP 159.A OD1 no hydrogen 2.750 N/A HIS 193.A ND1 ASP 159.A OD1 no hydrogen 2.681 N/A SER 194.A N ALA 14.A O no hydrogen 3.030 N/A SER 194.A OG GLU 196.A OE1 no hydrogen 3.520 N/A ASP 197.A N SER 194.A O no hydrogen 3.010 N/A ASN 199.A N ASP 197.A OD1 no hydrogen 3.121 N/A ASN 199.A ND2 SER 11.A O no hydrogen 2.894 N/A ALA 200.A N ASP 197.A O no hydrogen 3.143 N/A THR 201.A OG1 PHE 198.A O no hydrogen 3.536 N/A LYS 204.A NZ ARG 9.A O no hydrogen 2.645 N/A ARG 206.A NH1 SER 205.A O no hydrogen 2.952 N/A ILE 211.A N PRO 208.A O no hydrogen 3.060 N/A THR 212.A N PRO 208.A O no hydrogen 3.357 N/A THR 212.A OG1 PRO 208.A O no hydrogen 3.561 N/A LEU 213.A N GLN 209.A O no hydrogen 2.838 N/A