Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2iwc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N HIS 2.A O no hydrogen 3.163 N/A HIS 6.A N MET 3.A O no hydrogen 2.863 N/A VAL 7.A N MET 3.A O no hydrogen 3.184 N/A GLN 8.A N SER 4.A O no hydrogen 2.805 N/A GLN 9.A N ALA 5.A O no hydrogen 2.974 N/A ASP 10.A N VAL 7.A O no hydrogen 3.194 N/A LYS 11.A N GLN 8.A O no hydrogen 3.435 N/A TYR 12.A N LYS 54.A O no hydrogen 2.854 N/A VAL 16.A N THR 14.A OG1 no hydrogen 3.047 N/A LYS 19.A N TYR 45.A O no hydrogen 2.880 N/A LEU 21.A N ILE 47.A O no hydrogen 2.699 N/A GLN 23.A N GLN 23.A OE1 no hydrogen 2.761 N/A LEU 24.A N LEU 21.A O no hydrogen 3.217 N/A ALA 25.A N ASN 22.A O no hydrogen 3.195 N/A TYR 27.A N LEU 24.A O no hydrogen 2.925 N/A PHE 28.A N ALA 25.A O no hydrogen 2.912 N/A LYS 29.A N PRO 26.A O no hydrogen 3.376 N/A PHE 31.A N PHE 28.A O no hydrogen 2.951 N/A ASP 32.A N LYS 231.A O no hydrogen 2.830 N/A SER 34.A N HIS 229.A O no hydrogen 2.924 N/A SER 34.A OG TYR 48.A O no hydrogen 2.856 N/A SER 34.A OG ASN 49.A O no hydrogen 3.344 N/A PHE 35.A N TYR 48.A O no hydrogen 3.253 N/A VAL 36.A N ALA 227.A O no hydrogen 2.888 N/A LEU 37.A N SER 46.A O no hydrogen 2.825 N/A TYR 38.A N TYR 225.A O no hydrogen 2.841 N/A ASN 39.A N ALA 44.A O no hydrogen 2.872 N/A GLU 40.A N THR 223.A O no hydrogen 2.931 N/A ARG 41.A N ASN 222.A OD1 no hydrogen 2.791 N/A ARG 41.A NH2 GLU 42.A OE2 no hydrogen 2.958 N/A GLU 42.A N ASN 39.A OD1 no hydrogen 3.166 N/A GLN 43.A N GLU 40.A O no hydrogen 3.066 N/A ALA 44.A N ASN 39.A O no hydrogen 3.103 N/A TYR 45.A OH ASN 161.A OD1 no hydrogen 2.523 N/A SER 46.A N LEU 37.A O no hydrogen 2.753 N/A ILE 47.A N LYS 19.A O no hydrogen 2.909 N/A TYR 48.A N PHE 35.A O no hydrogen 2.957 N/A ASN 49.A ND2 GLY 33.A O no hydrogen 2.915 N/A GLU 52.A N ASN 49.A OD1 no hydrogen 3.421 N/A SER 53.A N ASN 49.A O no hydrogen 2.913 N/A SER 53.A OG GLU 50.A O no hydrogen 2.692 N/A LYS 54.A N GLU 50.A O no hydrogen 3.285 N/A LYS 54.A N PRO 51.A O no hydrogen 3.206 N/A LYS 54.A NZ THR 14.A O no hydrogen 3.235 N/A LYS 54.A NZ GLU 50.A OE2 no hydrogen 2.623 N/A ARG 56.A N ASP 10.A O no hydrogen 2.966 N/A ARG 56.A NE GLU 158.A OE1 no hydrogen 2.977 N/A ARG 56.A NH1 GLU 158.A OE2 no hydrogen 2.950 N/A ARG 56.A NH2 GLN 9.A O no hydrogen 2.708 N/A TYR 57.A N ILE 154.A O no hydrogen 2.837 N/A TYR 57.A OH GLU 52.A OE1 no hydrogen 2.527 N/A TYR 57.A OH GLU 52.A OE2 no hydrogen 3.367 N/A SER 58.A OG ASN 60.A OD1 no hydrogen 3.292 N/A SER 58.A OG TRP 147.A O no hydrogen 2.858 N/A ASN 60.A N SER 58.A OG no hydrogen 3.317 N/A ASN 60.A ND2 GLU 149.A OE2 no hydrogen 3.081 N/A SER 61.A OG SER 109.A OG no hydrogen 3.324 N/A THR 62.A N PRO 59.A O no hydrogen 3.140 N/A THR 62.A OG1 PRO 59.A O no hydrogen 2.751 N/A TYR 63.A N ASN 60.A O no hydrogen 3.161 N/A TYR 63.A OH TYR 146.A OH no hydrogen 2.947 N/A LYS 64.A N SER 61.A O no hydrogen 3.094 N/A LYS 64.A NZ SER 109.A OG no hydrogen 2.848 N/A LYS 64.A NZ ASN 111.A OD1 no hydrogen 3.164 N/A TYR 66.A N TYR 63.A O no hydrogen 3.093 N/A LEU 67.A N TYR 63.A O no hydrogen 3.131 N/A ALA 68.A N LYS 64.A O no hydrogen 2.983 N/A LEU 69.A N ILE 65.A O no hydrogen 3.329 N/A MET 70.A N TYR 66.A O no hydrogen 2.770 N/A ALA 71.A N LEU 67.A O no hydrogen 3.080 N/A PHE 72.A N ALA 68.A O no hydrogen 2.955 N/A ASP 73.A N LEU 69.A O no hydrogen 2.860 N/A GLN 74.A N MET 70.A O no hydrogen 2.883 N/A ASN 75.A N PHE 72.A O no hydrogen 2.915 N/A LEU 76.A N ALA 71.A O no hydrogen 2.764 N/A LEU 77.A N ALA 71.A O no hydrogen 3.064 N/A SER 78.A N HIS 81.A O no hydrogen 3.160 N/A HIS 81.A N SER 78.A O no hydrogen 2.823 N/A GLN 84.A N GLN 100.A O no hydrogen 2.882 N/A GLN 84.A NE2 TYR 113.A O no hydrogen 2.976 N/A TRP 86.A N ASP 99.A OD1 no hydrogen 2.783 N/A TRP 86.A NE1 HIS 89.A O no hydrogen 2.781 N/A HIS 89.A N ASP 87.A OD1 no hydrogen 3.115 N/A TYR 91.A N ASN 97.A OD1 no hydrogen 2.681 N/A GLU 95.A N GLU 95.A OE1 no hydrogen 2.821 N/A TRP 96.A N PHE 93.A O no hydrogen 2.920 N/A TRP 96.A NE1 TYR 108.A O no hydrogen 2.949 N/A ASN 97.A N LYS 94.A O no hydrogen 2.925 N/A ASN 97.A ND2 TYR 91.A O no hydrogen 3.189 N/A GLN 98.A NE2 GLU 95.A O no hydrogen 3.157 N/A GLN 100.A N GLN 84.A O no hydrogen 2.987 N/A GLN 100.A NE2 GLU 95.A O no hydrogen 2.817 N/A GLN 100.A NE2 TRP 96.A O no hydrogen 3.574 N/A GLN 100.A NE2 GLN 98.A O no hydrogen 2.870 N/A ASN 101.A N SER 104.A OG no hydrogen 3.107 N/A LEU 102.A N THR 82.A OG1 no hydrogen 3.245 N/A SER 104.A N ASN 101.A OD1 no hydrogen 2.842 N/A SER 104.A OG GLN 100.A OE1 no hydrogen 2.722 N/A SER 104.A OG ASN 101.A O no hydrogen 3.472 N/A SER 104.A OG ASN 101.A OD1 no hydrogen 3.399 N/A SER 105.A N ASN 101.A O no hydrogen 3.040 N/A SER 105.A OG ASN 101.A O no hydrogen 3.129 N/A SER 105.A OG LEU 102.A O no hydrogen 3.105 N/A SER 105.A OG TYR 114.A OH no hydrogen 2.667 N/A MET 106.A N LEU 102.A O no hydrogen 3.111 N/A LYS 107.A N ASN 103.A O no hydrogen 3.048 N/A TYR 108.A N SER 104.A O no hydrogen 2.874 N/A SER 109.A N MET 106.A O no hydrogen 3.254 N/A SER 109.A OG SER 61.A OG no hydrogen 3.324 N/A VAL 110.A N SER 105.A O no hydrogen 2.864 N/A TRP 112.A NE1 TRP 96.A O no hydrogen 2.907 N/A TYR 113.A N VAL 110.A O no hydrogen 3.148 N/A TYR 113.A OH THR 82.A O no hydrogen 2.562 N/A TYR 114.A N ASN 111.A O no hydrogen 2.935 N/A TYR 114.A OH SER 105.A OG no hydrogen 2.667 N/A GLU 115.A N ASN 111.A O no hydrogen 2.894 N/A ASN 116.A N TRP 112.A O no hydrogen 2.975 N/A ASN 116.A ND2 GLN 84.A OE1 no hydrogen 2.778 N/A LEU 117.A N TYR 113.A O no hydrogen 3.218 N/A ASN 118.A N TYR 114.A O no hydrogen 2.906 N/A LYS 119.A N GLU 115.A O no hydrogen 2.859 N/A HIS 120.A N ASN 116.A O no hydrogen 3.187 N/A HIS 120.A N LEU 117.A O no hydrogen 3.008 N/A HIS 120.A ND1 ASN 116.A O no hydrogen 2.813 N/A LEU 121.A N ASN 118.A O no hydrogen 3.185 N/A VAL 126.A N ARG 122.A O no hydrogen 2.944 N/A LYS 127.A N GLN 123.A O no hydrogen 2.995 N/A SER 128.A N ASP 124.A O no hydrogen 3.099 N/A TYR 129.A N GLU 125.A O no hydrogen 2.970 N/A TYR 129.A OH ASP 73.A OD2 no hydrogen 2.638 N/A TYR 129.A OH GLN 74.A OE1 no hydrogen 2.607 N/A LEU 130.A N VAL 126.A O no hydrogen 2.881 N/A ASP 131.A N LYS 127.A O no hydrogen 3.019 N/A LEU 132.A N SER 128.A O no hydrogen 2.956 N/A ILE 133.A N TYR 129.A O no hydrogen 2.918 N/A GLU 134.A N ASP 131.A O no hydrogen 3.306 N/A TYR 135.A N LEU 130.A O no hydrogen 3.001 N/A ASN 137.A N LYS 153.A O no hydrogen 2.879 N/A ASN 137.A ND2 SER 151.A O no hydrogen 2.892 N/A GLU 138.A N TYR 135.A O no hydrogen 2.940 N/A GLU 139.A N ASN 137.A OD1 no hydrogen 3.044 N/A SER 141.A OG GLU 139.A OE1 no hydrogen 3.307 N/A GLY 142.A N SER 151.A OG no hydrogen 2.834 N/A ASN 145.A ND2 GLU 115.A OE2 no hydrogen 3.172 N/A TYR 146.A OH TYR 63.A OH no hydrogen 2.947 N/A TYR 146.A OH ASN 118.A OD1 no hydrogen 2.686 N/A ASN 148.A N ASN 145.A O no hydrogen 3.121 N/A ASN 148.A ND2 ASN 60.A OD1 no hydrogen 3.349 N/A GLU 149.A N SER 58.A OG no hydrogen 2.879 N/A GLU 149.A N ASN 60.A OD1 no hydrogen 3.285 N/A SER 151.A OG GLU 139.A O no hydrogen 2.650 N/A LEU 152.A N TYR 146.A O no hydrogen 3.235 N/A LYS 153.A N ASN 137.A OD1 no hydrogen 2.930 N/A LYS 153.A NZ ASP 10.A OD1 no hydrogen 3.130 N/A ILE 154.A N TYR 57.A O no hydrogen 2.798 N/A SER 155.A N GLU 158.A OE1 no hydrogen 3.123 N/A SER 155.A OG GLU 158.A OE1 no hydrogen 2.870 N/A ILE 157.A N SER 53.A O no hydrogen 3.106 N/A GLU 158.A N SER 155.A OG no hydrogen 3.390 N/A GLN 159.A N SER 155.A O no hydrogen 2.909 N/A GLN 159.A NE2 THR 62.A OG1 no hydrogen 2.900 N/A VAL 160.A N ALA 156.A O no hydrogen 3.081 N/A ASN 161.A N ILE 157.A O no hydrogen 2.895 N/A LEU 162.A N GLU 158.A O no hydrogen 2.858 N/A LEU 163.A N GLN 159.A O no hydrogen 3.293 N/A LYS 164.A N VAL 160.A O no hydrogen 3.056 N/A LYS 164.A NZ TYR 45.A OH no hydrogen 3.304 N/A ASN 165.A N ASN 161.A O no hydrogen 2.874 N/A MET 166.A N LEU 162.A O no hydrogen 2.907 N/A LYS 167.A N LEU 163.A O no hydrogen 2.917 N/A LYS 167.A NZ GLU 182.A OE2 no hydrogen 2.753 N/A LYS 167.A NZ GLU 218.A OE1 no hydrogen 3.196 N/A GLN 168.A N LYS 164.A O no hydrogen 2.835 N/A GLN 168.A NE2 GLU 40.A OE2 no hydrogen 2.829 N/A HIS 169.A N MET 166.A O no hydrogen 3.224 N/A ASN 170.A N ASN 165.A O no hydrogen 2.856 N/A ASN 170.A ND2 ASN 165.A OD1 no hydrogen 3.420 N/A ASN 170.A ND2 GLN 168.A OE1 no hydrogen 3.660 N/A ILE 178.A N ASP 174.A O no hydrogen 3.073 N/A GLU 179.A N ASN 175.A O no hydrogen 2.927 N/A LYS 180.A N LYS 176.A O no hydrogen 3.078 N/A LYS 180.A NZ LEU 79.A O no hydrogen 2.376 N/A VAL 181.A N ALA 177.A O no hydrogen 2.910 N/A GLU 182.A N ILE 178.A O no hydrogen 2.773 N/A ASN 183.A N GLU 179.A O no hydrogen 2.978 N/A SER 184.A N LYS 180.A O no hydrogen 3.062 N/A SER 184.A OG VAL 181.A O no hydrogen 2.634 N/A MET 185.A N GLU 182.A O no hydrogen 3.123 N/A THR 186.A N ASN 183.A O no hydrogen 3.157 N/A THR 186.A OG1 GLU 182.A O no hydrogen 2.813 N/A LEU 187.A N TYR 195.A O no hydrogen 2.691 N/A LYS 188.A N TYR 195.A O no hydrogen 3.168 N/A LYS 190.A N TYR 193.A O no hydrogen 2.860 N/A LYS 190.A NZ TYR 193.A OH no hydrogen 2.591 N/A LYS 194.A N GLU 218.A O no hydrogen 2.797 N/A LYS 194.A NZ GLN 189.A OE1 no hydrogen 2.863 N/A TYR 195.A N LYS 188.A O no hydrogen 2.803 N/A TYR 195.A OH GLU 246.A OE2 no hydrogen 2.465 N/A VAL 196.A N TYR 216.A O no hydrogen 2.973 N/A GLY 197.A N MET 185.A O no hydrogen 2.853 N/A LYS 198.A N VAL 214.A O no hydrogen 2.770 N/A LYS 198.A NZ SER 109.A OG no hydrogen 2.712 N/A LYS 198.A NZ THR 199.A O no hydrogen 2.841 N/A GLY 200.A N TRP 212.A O no hydrogen 3.024 N/A GLY 202.A N ASN 210.A O no hydrogen 2.765 N/A VAL 204.A N LYS 207.A O no hydrogen 2.880 N/A LYS 207.A N VAL 204.A O no hydrogen 3.055 N/A GLU 208.A N ASP 234.A OD1 no hydrogen 3.378 N/A ALA 209.A N GLY 202.A O no hydrogen 3.039 N/A ASN 210.A ND2 SER 58.A O no hydrogen 3.004 N/A ASN 210.A ND2 GLU 149.A OE2 no hydrogen 2.844 N/A GLY 211.A N LEU 230.A O no hydrogen 2.939 N/A TRP 212.A N GLY 200.A O no hydrogen 2.958 N/A TRP 212.A NE1 SER 58.A O no hydrogen 2.794 N/A PHE 213.A N THR 228.A O no hydrogen 3.001 N/A VAL 214.A N LYS 198.A O no hydrogen 3.159 N/A GLY 215.A N PHE 226.A O no hydrogen 3.011 N/A TYR 216.A N VAL 196.A O no hydrogen 2.992 N/A TYR 216.A OH GLU 182.A OE2 no hydrogen 2.747 N/A VAL 217.A N TYR 224.A O no hydrogen 2.771 N/A GLU 218.A N LYS 194.A O no hydrogen 2.828 N/A THR 219.A N ASN 222.A O no hydrogen 2.823 N/A THR 219.A OG1 ASP 221.A OD1 no hydrogen 3.282 N/A THR 219.A OG1 ASN 222.A O no hydrogen 3.242 N/A ASP 221.A N THR 219.A OG1 no hydrogen 3.312 N/A ASN 222.A ND2 ASN 39.A OD1 no hydrogen 2.716 N/A ASN 222.A ND2 TYR 224.A OH no hydrogen 3.080 N/A THR 223.A N ASN 222.A OD1 no hydrogen 2.881 N/A THR 223.A OG1 GLU 40.A OE1 no hydrogen 3.477 N/A TYR 224.A N VAL 217.A O no hydrogen 2.874 N/A TYR 225.A N TYR 38.A O no hydrogen 2.964 N/A TYR 225.A OH GLU 40.A OE2 no hydrogen 2.474 N/A PHE 226.A N GLY 215.A O no hydrogen 2.849 N/A ALA 227.A N VAL 36.A O no hydrogen 2.920 N/A THR 228.A N PHE 213.A O no hydrogen 2.818 N/A THR 228.A OG1 SER 245.A OG no hydrogen 2.535 N/A HIS 229.A N SER 34.A O no hydrogen 2.951 N/A HIS 229.A NE2 ASN 210.A OD1 no hydrogen 2.582 N/A LEU 230.A N GLY 211.A O no hydrogen 2.859 N/A LYS 231.A N ASP 32.A O no hydrogen 2.878 N/A ASN 235.A N ASP 234.A OD1 no hydrogen 2.599 N/A ALA 236.A N GLU 208.A O no hydrogen 2.985 N/A ASN 237.A ND2 GLU 208.A OE1 no hydrogen 3.082 N/A GLY 238.A N THR 201.A OG1 no hydrogen 2.729 N/A LYS 240.A N ASN 237.A OD1 no hydrogen 2.707 N/A ALA 241.A N ASN 237.A O no hydrogen 3.044 N/A GLN 242.A N GLY 238.A O no hydrogen 2.834 N/A GLN 242.A NE2 GLU 246.A OE2 no hydrogen 2.718 N/A GLN 243.A N GLU 239.A O no hydrogen 2.889 N/A ILE 244.A N LYS 240.A O no hydrogen 2.990 N/A SER 245.A N ALA 241.A O no hydrogen 2.940 N/A SER 245.A OG THR 228.A OG1 no hydrogen 2.535 N/A SER 245.A OG ALA 241.A O no hydrogen 2.747 N/A GLU 246.A N GLN 242.A O no hydrogen 2.837 N/A ARG 247.A N GLN 243.A O no hydrogen 3.042 N/A ILE 248.A N ILE 244.A O no hydrogen 3.015 N/A LEU 249.A N SER 245.A O no hydrogen 2.784 N/A LYS 250.A N GLU 246.A O no hydrogen 2.891 N/A GLU 251.A N ARG 247.A O no hydrogen 2.970 N/A MET 252.A N ILE 248.A O no hydrogen 3.009 N/A GLU 253.A N LYS 250.A O no hydrogen 2.819 N/A LEU 254.A N LEU 249.A O no hydrogen 2.885 N/A