Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1n46_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 5.A N GLU 8.A OE1 no hydrogen 3.319 N/A GLU 8.A N THR 5.A OG1 no hydrogen 3.232 N/A TRP 9.A N THR 5.A O no hydrogen 2.941 N/A GLU 10.A N ASP 6.A O no hydrogen 3.099 N/A LEU 11.A N GLU 7.A O no hydrogen 3.040 N/A ILE 12.A N GLU 8.A O no hydrogen 2.845 N/A LYS 13.A N TRP 9.A O no hydrogen 2.952 N/A THR 14.A N GLU 10.A O no hydrogen 3.031 N/A THR 14.A OG1 GLU 10.A O no hydrogen 3.213 N/A VAL 15.A N LEU 11.A O no hydrogen 2.855 N/A THR 16.A N ILE 12.A O no hydrogen 2.917 N/A THR 16.A OG1 ILE 12.A O no hydrogen 2.813 N/A THR 16.A OG1 THR 155.A OG1 no hydrogen 2.693 N/A GLU 17.A N LYS 13.A O no hydrogen 2.962 N/A ALA 18.A N THR 14.A O no hydrogen 3.070 N/A HIS 19.A N VAL 15.A O no hydrogen 2.994 N/A VAL 20.A N THR 16.A O no hydrogen 2.889 N/A ALA 21.A N GLU 17.A O no hydrogen 2.869 N/A THR 22.A N HIS 19.A O no hydrogen 3.048 N/A THR 22.A OG1 ALA 18.A O no hydrogen 2.898 N/A THR 22.A OG1 HIS 19.A O no hydrogen 3.266 N/A ASN 23.A N VAL 20.A O no hydrogen 3.283 N/A ARG 30.A NH1 ASP 109.A OD2 no hydrogen 3.170 N/A LYS 31.A N GLU 120.A O no hydrogen 3.092 N/A LEU 33.A N ALA 122.A O no hydrogen 3.041 N/A ILE 37.A N PRO 34.A O no hydrogen 2.945 N/A GLY 48.A N ASN 130.A OD1 no hydrogen 3.006 N/A VAL 51.A N GLU 232.A OE1 no hydrogen 2.916 N/A ASP 52.A N ASN 130.A O no hydrogen 2.895 N/A ALA 55.A N ASP 52.A OD1 no hydrogen 2.912 N/A PHE 56.A N ASP 52.A O no hydrogen 2.875 N/A SER 57.A N LEU 53.A O no hydrogen 2.911 N/A SER 57.A OG GLU 54.A O no hydrogen 3.034 N/A HIS 58.A N GLU 54.A O no hydrogen 3.170 N/A HIS 58.A ND1 GLU 54.A O no hydrogen 3.015 N/A PHE 59.A N ALA 55.A O no hydrogen 3.052 N/A THR 60.A N PHE 56.A O no hydrogen 2.887 N/A THR 60.A OG1 PHE 56.A O no hydrogen 3.499 N/A THR 60.A OG1 SER 57.A O no hydrogen 3.120 N/A THR 60.A OG1 LEU 237.A O no hydrogen 3.017 N/A LYS 61.A N SER 57.A O no hydrogen 3.192 N/A ILE 62.A N PHE 59.A O no hydrogen 3.086 N/A ILE 63.A N THR 60.A O no hydrogen 3.495 N/A ALA 66.A N ILE 62.A O no hydrogen 3.183 N/A ILE 67.A N ILE 63.A O no hydrogen 3.014 N/A THR 68.A N THR 64.A O no hydrogen 3.064 N/A ARG 69.A N PRO 65.A O no hydrogen 3.159 N/A ARG 69.A NH2 ASN 118.A O no hydrogen 3.117 N/A VAL 71.A N ILE 67.A O no hydrogen 2.949 N/A ASP 72.A N THR 68.A O no hydrogen 2.676 N/A PHE 73.A N ARG 69.A O no hydrogen 3.024 N/A ALA 74.A N VAL 70.A O no hydrogen 3.220 N/A LYS 75.A N VAL 71.A O no hydrogen 3.176 N/A LYS 76.A N ASP 72.A O no hydrogen 3.190 N/A LEU 77.A N ALA 74.A O no hydrogen 3.001 N/A CYS 81.A N LEU 77.A O no hydrogen 3.177 N/A CYS 81.A SG LYS 75.A O no hydrogen 2.954 N/A CYS 81.A SG LEU 77.A O no hydrogen 3.379 N/A GLU 82.A N MET 79.A O no hydrogen 3.147 N/A LEU 83.A N PHE 80.A O no hydrogen 3.064 N/A ASP 87.A N PRO 84.A O no hydrogen 3.070 N/A GLN 88.A N PRO 84.A O no hydrogen 3.040 N/A GLN 88.A NE2 PHE 80.A O no hydrogen 2.693 N/A ILE 89.A N CYS 85.A O no hydrogen 2.990 N/A ILE 90.A N GLU 86.A O no hydrogen 3.238 N/A LEU 91.A N ASP 87.A O no hydrogen 2.924 N/A LEU 92.A N GLN 88.A O no hydrogen 3.006 N/A LYS 93.A N ILE 89.A O no hydrogen 2.910 N/A LYS 93.A NZ GLU 247.A O no hydrogen 2.545 N/A GLY 94.A N ILE 90.A O no hydrogen 2.961 N/A CYS 95.A N LEU 91.A O no hydrogen 3.044 N/A CYS 95.A SG LEU 91.A O no hydrogen 3.359 N/A CYS 96.A N LEU 92.A O no hydrogen 3.028 N/A ILE 99.A N CYS 95.A O no hydrogen 2.918 N/A MET 100.A N CYS 96.A O no hydrogen 2.949 N/A SER 101.A N MET 97.A O no hydrogen 2.944 N/A SER 101.A OG MET 97.A O no hydrogen 2.693 N/A LEU 102.A N GLU 98.A O no hydrogen 3.179 N/A ARG 103.A N ILE 99.A O no hydrogen 2.990 N/A ARG 103.A NE GLN 161.A OE1 no hydrogen 2.873 N/A ARG 103.A NH1 THR 22.A O no hydrogen 2.553 N/A ARG 103.A NH2 HIS 19.A ND1 no hydrogen 3.103 N/A ARG 103.A NH2 THR 22.A O no hydrogen 3.334 N/A ARG 103.A NH2 THR 22.A OG1 no hydrogen 3.033 N/A ALA 104.A N MET 100.A O no hydrogen 3.081 N/A ALA 105.A N SER 101.A O no hydrogen 2.899 N/A VAL 106.A N LEU 102.A O no hydrogen 2.906 N/A ARG 107.A N ARG 103.A O no hydrogen 3.134 N/A ARG 107.A N ALA 104.A O no hydrogen 2.939 N/A ARG 107.A NH1 THR 116.A O no hydrogen 3.033 N/A ARG 107.A NH2 ASN 23.A OD1 no hydrogen 2.719 N/A TYR 108.A N ALA 105.A O no hydrogen 2.990 N/A TYR 108.A OH GLU 113.A OE1 no hydrogen 3.126 N/A ASP 109.A N THR 114.A O no hydrogen 2.895 N/A GLU 111.A N ASP 109.A OD1 no hydrogen 3.271 N/A SER 112.A N ASP 109.A OD2 no hydrogen 3.293 N/A SER 112.A OG ASP 109.A OD2 no hydrogen 2.532 N/A SER 112.A OG THR 114.A OG1 no hydrogen 2.535 N/A THR 114.A N ASP 109.A O no hydrogen 3.300 N/A THR 114.A OG1 SER 112.A OG no hydrogen 2.535 N/A LEU 115.A N VAL 123.A O no hydrogen 2.982 N/A LEU 117.A N MET 121.A O no hydrogen 2.725 N/A GLU 120.A N LEU 117.A O no hydrogen 3.141 N/A MET 121.A N LEU 117.A O no hydrogen 3.072 N/A ALA 122.A N LYS 31.A O no hydrogen 3.057 N/A VAL 123.A N LEU 115.A O no hydrogen 2.770 N/A THR 124.A N GLN 127.A OE1 no hydrogen 3.033 N/A THR 124.A OG1 GLN 127.A OE1 no hydrogen 3.463 N/A ARG 125.A NE ASP 138.A OD1 no hydrogen 3.101 N/A ARG 125.A NH1 ASP 142.A OD1 no hydrogen 3.040 N/A ARG 125.A NH2 ASP 138.A OD1 no hydrogen 3.131 N/A ARG 125.A NH2 ASP 142.A OD1 no hydrogen 2.699 N/A ARG 125.A NH2 ASP 142.A OD2 no hydrogen 3.328 N/A GLN 127.A N THR 124.A OG1 no hydrogen 3.214 N/A GLN 127.A NE2 LEU 33.A O no hydrogen 3.236 N/A LEU 128.A N THR 124.A O no hydrogen 3.014 N/A LYS 129.A N ARG 125.A O no hydrogen 3.087 N/A LYS 129.A NZ ASP 138.A OD1 no hydrogen 2.997 N/A LYS 129.A NZ ASP 138.A OD2 no hydrogen 2.899 N/A ASN 130.A N GLY 126.A O no hydrogen 2.729 N/A ASN 130.A ND2 GLY 38.A O no hydrogen 3.155 N/A ASN 130.A ND2 GLU 47.A OE2 no hydrogen 3.329 N/A GLY 131.A N GLN 127.A O no hydrogen 2.941 N/A GLY 132.A N LYS 129.A O no hydrogen 3.348 N/A LEU 133.A N LEU 128.A O no hydrogen 3.132 N/A GLY 134.A N LYS 129.A O no hydrogen 2.945 N/A VAL 136.A N LEU 133.A O no hydrogen 3.157 N/A SER 137.A N GLY 134.A O no hydrogen 2.983 N/A SER 137.A OG ARG 125.A O no hydrogen 2.726 N/A ALA 139.A N VAL 135.A O no hydrogen 3.117 N/A ILE 140.A N VAL 136.A O no hydrogen 3.040 N/A PHE 141.A N SER 137.A O no hydrogen 2.958 N/A ASP 142.A N ASP 138.A O no hydrogen 2.796 N/A LEU 143.A N ALA 139.A O no hydrogen 2.873 N/A GLY 144.A N ILE 140.A O no hydrogen 2.793 N/A MET 145.A N PHE 141.A O no hydrogen 2.725 N/A SER 146.A N ASP 142.A O no hydrogen 2.969 N/A SER 146.A OG LEU 143.A O no hydrogen 3.176 N/A LEU 147.A N LEU 143.A O no hydrogen 2.926 N/A LEU 147.A N GLY 144.A O no hydrogen 3.308 N/A SER 148.A OG GLY 144.A O no hydrogen 3.472 N/A SER 148.A OG MET 145.A O no hydrogen 3.272 N/A SER 149.A OG SER 146.A O no hydrogen 3.277 N/A PHE 150.A N LEU 147.A O no hydrogen 2.793 N/A ASN 151.A N SER 148.A O no hydrogen 3.229 N/A ASP 153.A N GLU 156.A OE1 no hydrogen 2.837 N/A THR 155.A OG1 THR 16.A OG1 no hydrogen 2.693 N/A GLU 156.A N ASP 153.A OD1 no hydrogen 3.013 N/A VAL 157.A N ASP 153.A O no hydrogen 2.980 N/A ALA 158.A N ASP 154.A O no hydrogen 2.879 N/A LEU 159.A N THR 155.A O no hydrogen 2.903 N/A LEU 160.A N GLU 156.A O no hydrogen 3.024 N/A GLN 161.A N VAL 157.A O no hydrogen 3.043 N/A GLN 161.A NE2 HIS 19.A ND1 no hydrogen 2.998 N/A ALA 162.A N ALA 158.A O no hydrogen 2.954 N/A VAL 163.A N LEU 159.A O no hydrogen 2.937 N/A LEU 164.A N LEU 160.A O no hydrogen 2.950 N/A LEU 165.A N GLN 161.A O no hydrogen 2.740 N/A MET 166.A N ALA 162.A O no hydrogen 2.910 N/A SER 167.A OG LEU 164.A O no hydrogen 2.762 N/A ARG 170.A NH1 GLU 98.A OE2 no hydrogen 2.816 N/A ARG 170.A NH2 GLU 98.A OE1 no hydrogen 2.640 N/A ARG 170.A NH2 GLU 98.A OE2 no hydrogen 3.224 N/A ALA 174.A N ASP 87.A OD1 no hydrogen 2.735 N/A CYS 175.A N ASP 87.A OD2 no hydrogen 2.779 N/A VAL 176.A N ALA 174.A O no hydrogen 3.045 N/A ARG 178.A NE TYR 182.A OH no hydrogen 2.862 N/A ARG 178.A NH2 GLU 82.A OE1 no hydrogen 3.251 N/A ARG 178.A NH2 TYR 182.A OH no hydrogen 3.532 N/A ILE 179.A N CYS 175.A O no hydrogen 3.024 N/A GLU 180.A N VAL 176.A O no hydrogen 3.050 N/A LYS 181.A N GLU 177.A O no hydrogen 3.168 N/A TYR 182.A N ARG 178.A O no hydrogen 3.106 N/A TYR 182.A OH GLU 82.A OE1 no hydrogen 2.394 N/A GLN 183.A N ILE 179.A O no hydrogen 3.014 N/A GLN 183.A NE2 VAL 163.A O no hydrogen 2.713 N/A ASP 184.A N GLU 180.A O no hydrogen 2.886 N/A SER 185.A N LYS 181.A O no hydrogen 2.937 N/A SER 185.A OG LYS 181.A O no hydrogen 2.818 N/A PHE 186.A N TYR 182.A O no hydrogen 2.856 N/A LEU 187.A N GLN 183.A O no hydrogen 2.743 N/A LEU 188.A N ASP 184.A O no hydrogen 2.817 N/A ALA 189.A N SER 185.A O no hydrogen 3.063 N/A PHE 190.A N PHE 186.A O no hydrogen 2.998 N/A GLU 191.A N LEU 187.A O no hydrogen 2.927 N/A HIS 192.A N LEU 188.A O no hydrogen 3.053 N/A HIS 192.A ND1 GLU 8.A OE1 no hydrogen 2.559 N/A TYR 193.A N ALA 189.A O no hydrogen 2.908 N/A TYR 193.A OH ASP 153.A OD2 no hydrogen 2.664 N/A ILE 194.A N PHE 190.A O no hydrogen 2.878 N/A ASN 195.A N GLU 191.A O no hydrogen 2.858 N/A ASN 195.A ND2 PRO 2.A O no hydrogen 2.744 N/A TYR 196.A N HIS 192.A O no hydrogen 3.071 N/A ARG 197.A N TYR 193.A O no hydrogen 2.849 N/A ARG 197.A NE GLU 156.A OE2 no hydrogen 2.654 N/A ARG 197.A NH2 GLU 156.A OE1 no hydrogen 3.002 N/A LYS 198.A N ILE 194.A O no hydrogen 3.253 N/A HIS 199.A NE2 GLU 156.A OE2 no hydrogen 2.717 N/A LYS 207.A N HIS 203.A O no hydrogen 3.001 N/A LYS 207.A NZ THR 202.A O no hydrogen 2.901 N/A LYS 207.A NZ THR 202.A OG1 no hydrogen 3.352 N/A LEU 208.A N PHE 204.A O no hydrogen 2.847 N/A LEU 209.A N TRP 205.A O no hydrogen 2.760 N/A MET 210.A N PRO 206.A O no hydrogen 3.125 N/A LYS 211.A N LEU 208.A O no hydrogen 2.980 N/A LYS 211.A NZ SER 146.A OG no hydrogen 2.967 N/A VAL 212.A N LEU 209.A O no hydrogen 2.882 N/A ASP 214.A N MET 210.A O no hydrogen 3.122 N/A LEU 215.A N LYS 211.A O no hydrogen 2.928 N/A ARG 216.A N VAL 212.A O no hydrogen 2.937 N/A ARG 216.A NH2 ASP 169.A OD1 no hydrogen 3.368 N/A ARG 216.A NH2 ASP 169.A OD2 no hydrogen 2.579 N/A MET 217.A N THR 213.A O no hydrogen 3.165 N/A ILE 218.A N ASP 214.A O no hydrogen 2.952 N/A GLY 219.A N LEU 215.A O no hydrogen 2.921 N/A ALA 220.A N ARG 216.A O no hydrogen 3.016 N/A CYS 221.A N MET 217.A O no hydrogen 2.865 N/A HIS 222.A N ILE 218.A O no hydrogen 2.917 N/A ALA 223.A N GLY 219.A O no hydrogen 3.121 N/A ARG 225.A N CYS 221.A O no hydrogen 3.126 N/A ARG 225.A NE GLY 132.A O no hydrogen 2.982 N/A ARG 225.A NH2 GLY 132.A O no hydrogen 2.990 N/A PHE 226.A N HIS 222.A O no hydrogen 2.837 N/A LEU 227.A N SER 224.A O no hydrogen 3.036 N/A HIS 228.A N SER 224.A O no hydrogen 3.324 N/A MET 229.A N ARG 225.A O no hydrogen 2.865 N/A LYS 230.A N PHE 226.A O no hydrogen 2.828 N/A LYS 230.A NZ GLU 247.A OE2 no hydrogen 2.892 N/A VAL 231.A N LEU 227.A O no hydrogen 3.260 N/A GLU 232.A N HIS 228.A O no hydrogen 3.078 N/A CYS 233.A N MET 229.A O no hydrogen 2.933 N/A LEU 237.A N PRO 234.A O no hydrogen 2.939 N/A PHE 238.A N THR 235.A O no hydrogen 3.040 N/A LEU 243.A N PRO 239.A O no hydrogen 3.120 N/A GLU 244.A N PRO 240.A O no hydrogen 2.889 N/A VAL 245.A N LEU 241.A O no hydrogen 3.131 N/A PHE 246.A N PHE 242.A O no hydrogen 3.158 N/A GLU 247.A N LEU 243.A O no hydrogen 2.992 N/A