Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4e2j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A OG1 SER 5.A OG no hydrogen 3.351 N/A SER 5.A N THR 2.A OG1 no hydrogen 3.300 N/A SER 5.A OG THR 2.A O no hydrogen 3.020 N/A SER 5.A OG THR 2.A OG1 no hydrogen 3.351 N/A LEU 6.A N THR 2.A O no hydrogen 3.325 N/A LEU 7.A N LEU 3.A O no hydrogen 3.056 N/A GLU 8.A N ILE 4.A O no hydrogen 3.038 N/A VAL 9.A N SER 5.A O no hydrogen 3.144 N/A ILE 10.A N LEU 6.A O no hydrogen 2.967 N/A SER 17.A N ASP 97.A OD1 no hydrogen 3.025 N/A SER 17.A OG ASP 97.A OD1 no hydrogen 2.817 N/A GLY 18.A N ASP 97.A OD2 no hydrogen 2.777 N/A TYR 19.A N SER 17.A OG no hydrogen 3.179 N/A THR 22.A N ASP 20.A OD1 no hydrogen 3.238 N/A THR 22.A OG1 ASP 20.A OD1 no hydrogen 2.707 N/A THR 22.A OG1 ASP 20.A OD2 no hydrogen 3.420 N/A LEU 23.A N ASP 20.A O no hydrogen 3.198 N/A ARG 29.A NH1 PRO 24.A O no hydrogen 2.777 N/A LEU 30.A N THR 26.A O no hydrogen 3.274 N/A MET 31.A N SER 27.A O no hydrogen 3.024 N/A SER 32.A N THR 28.A O no hydrogen 3.003 N/A SER 32.A OG THR 28.A O no hydrogen 3.028 N/A THR 33.A N ARG 29.A O no hydrogen 2.917 N/A THR 33.A OG1 ARG 29.A O no hydrogen 2.628 N/A LEU 34.A N LEU 30.A O no hydrogen 2.852 N/A ASN 35.A N MET 31.A O no hydrogen 2.933 N/A ASN 35.A ND2 GLU 218.A O no hydrogen 3.031 N/A ARG 36.A N SER 32.A O no hydrogen 2.998 N/A LEU 37.A N THR 33.A O no hydrogen 3.021 N/A GLY 38.A N LEU 34.A O no hydrogen 2.845 N/A GLY 39.A N ASN 35.A O no hydrogen 2.863 N/A ARG 40.A N ARG 36.A O no hydrogen 3.370 N/A ARG 40.A NH1 TYR 16.A O no hydrogen 2.817 N/A ARG 40.A NH2 TYR 16.A O no hydrogen 2.983 N/A GLN 41.A N LEU 37.A O no hydrogen 2.956 N/A VAL 42.A N GLY 38.A O no hydrogen 2.907 N/A VAL 43.A N GLY 39.A O no hydrogen 3.187 N/A SER 44.A N ARG 40.A O no hydrogen 3.091 N/A SER 44.A OG ARG 40.A O no hydrogen 3.259 N/A ALA 45.A N GLN 41.A O no hydrogen 2.901 N/A VAL 46.A N VAL 42.A O no hydrogen 3.015 N/A VAL 46.A N VAL 43.A O no hydrogen 3.211 N/A LYS 47.A N VAL 43.A O no hydrogen 3.274 N/A TRP 48.A N SER 44.A O no hydrogen 2.788 N/A ALA 49.A N ALA 45.A O no hydrogen 2.868 N/A LYS 50.A N VAL 46.A O no hydrogen 3.036 N/A ALA 51.A N TRP 48.A O no hydrogen 3.036 N/A LEU 52.A N ALA 49.A O no hydrogen 3.044 N/A PHE 55.A N LEU 52.A O no hydrogen 3.080 N/A ASN 57.A N GLY 54.A O no hydrogen 2.898 N/A LEU 58.A N PHE 55.A O no hydrogen 3.270 N/A HIS 59.A N SER 153.A OG no hydrogen 3.104 N/A ASP 61.A N HIS 59.A ND1 no hydrogen 3.300 N/A GLN 63.A N HIS 59.A O no hydrogen 3.021 N/A GLN 63.A NE2 LEU 58.A O no hydrogen 2.797 N/A MET 64.A N LEU 60.A O no hydrogen 3.077 N/A THR 65.A N ASP 61.A O no hydrogen 2.978 N/A THR 65.A OG1 ASP 61.A O no hydrogen 2.728 N/A LEU 66.A N ASP 62.A O no hydrogen 2.975 N/A LEU 67.A N GLN 63.A O no hydrogen 3.381 N/A GLN 68.A N MET 64.A O no hydrogen 2.840 N/A TYR 69.A N THR 65.A O no hydrogen 2.815 N/A SER 70.A N LEU 66.A O no hydrogen 3.095 N/A SER 70.A OG LEU 66.A O no hydrogen 2.719 N/A TRP 71.A N LEU 67.A O no hydrogen 3.147 N/A TRP 71.A NE1 GLN 230.A OE1 no hydrogen 3.143 N/A LEU 74.A N SER 70.A O no hydrogen 3.018 N/A MET 75.A N TRP 71.A O no hydrogen 3.097 N/A ALA 76.A N MET 72.A O no hydrogen 2.888 N/A PHE 77.A N SER 73.A O no hydrogen 2.934 N/A SER 78.A N LEU 74.A O no hydrogen 2.971 N/A SER 78.A OG LEU 74.A O no hydrogen 3.136 N/A SER 78.A OG TYR 134.A OH no hydrogen 3.040 N/A LEU 79.A N MET 75.A O no hydrogen 2.918 N/A GLY 80.A N ALA 76.A O no hydrogen 2.831 N/A TRP 81.A N PHE 77.A O no hydrogen 2.892 N/A ARG 82.A N SER 78.A O no hydrogen 2.841 N/A ARG 82.A NE CYS 93.A O no hydrogen 3.076 N/A SER 83.A N LEU 79.A O no hydrogen 2.997 N/A SER 83.A OG LEU 79.A O no hydrogen 2.800 N/A SER 83.A OG MET 91.A O no hydrogen 3.369 N/A TYR 84.A N GLY 80.A O no hydrogen 3.092 N/A TYR 84.A OH GLN 128.A OE1 no hydrogen 3.330 N/A LYS 85.A N TRP 81.A O no hydrogen 3.007 N/A GLN 86.A N ARG 82.A O no hydrogen 2.808 N/A SER 87.A N SER 83.A O no hydrogen 3.214 N/A SER 87.A OG SER 83.A O no hydrogen 3.119 N/A SER 87.A OG MET 91.A O no hydrogen 3.247 N/A ASN 88.A N TYR 84.A O no hydrogen 2.953 N/A GLY 89.A N SER 83.A O no hydrogen 2.893 N/A ASN 90.A N SER 87.A O no hydrogen 3.129 N/A ASN 90.A ND2 SER 87.A O no hydrogen 3.158 N/A MET 91.A N SER 87.A OG no hydrogen 3.020 N/A LEU 92.A N ILE 100.A O no hydrogen 3.386 N/A CYS 93.A N SER 83.A OG no hydrogen 3.022 N/A CYS 93.A SG SER 87.A OG no hydrogen 3.563 N/A CYS 93.A SG MET 91.A O no hydrogen 3.570 N/A ALA 95.A N LEU 98.A O no hydrogen 3.335 N/A LEU 98.A N ALA 95.A O no hydrogen 2.901 N/A ILE 100.A N LEU 92.A O no hydrogen 2.961 N/A GLU 102.A N GLU 102.A OE1 no hydrogen 2.571 N/A ARG 104.A NH2 VAL 99.A O no hydrogen 2.751 N/A MET 105.A N ASN 101.A O no hydrogen 3.124 N/A MET 105.A N GLU 102.A O no hydrogen 3.290 N/A GLN 106.A N GLU 103.A O no hydrogen 3.309 N/A GLN 106.A NE2 GLU 102.A O no hydrogen 3.356 N/A MET 110.A N LEU 107.A O no hydrogen 3.048 N/A TYR 111.A N LEU 107.A O no hydrogen 2.886 N/A GLN 113.A N GLN 113.A OE1 no hydrogen 2.668 N/A CYS 114.A N MET 110.A O no hydrogen 3.122 N/A CYS 114.A SG MET 110.A O no hydrogen 3.233 N/A GLN 115.A N TYR 111.A O no hydrogen 2.997 N/A GLN 116.A N ASP 112.A O no hydrogen 3.156 N/A GLN 116.A NE2 ASP 112.A O no hydrogen 3.619 N/A GLN 116.A NE2 ASP 112.A OD2 no hydrogen 2.919 N/A MET 117.A N GLN 113.A O no hydrogen 3.111 N/A LEU 118.A N CYS 114.A O no hydrogen 2.880 N/A LYS 119.A N GLN 115.A O no hydrogen 3.218 N/A SER 121.A OG LEU 118.A O no hydrogen 2.813 N/A SER 122.A N LEU 118.A O no hydrogen 2.903 N/A SER 122.A OG LEU 118.A O no hydrogen 3.496 N/A SER 122.A OG LYS 119.A O no hydrogen 2.688 N/A GLU 123.A N LYS 119.A O no hydrogen 3.251 N/A GLU 123.A N ILE 120.A O no hydrogen 3.120 N/A VAL 125.A N SER 121.A O no hydrogen 3.103 N/A ARG 126.A N SER 122.A O no hydrogen 2.853 N/A ARG 126.A NE GLU 123.A OE1 no hydrogen 2.948 N/A ARG 126.A NH2 GLU 123.A OE1 no hydrogen 3.471 N/A ARG 126.A NH2 GLU 123.A OE2 no hydrogen 2.803 N/A LEU 127.A N GLU 123.A O no hydrogen 3.051 N/A GLN 128.A N VAL 125.A O no hydrogen 3.371 N/A GLN 128.A NE2 VAL 125.A O no hydrogen 2.644 N/A VAL 129.A N PHE 124.A O no hydrogen 3.322 N/A SER 130.A N GLU 133.A OE1 no hydrogen 2.818 N/A GLU 133.A N SER 130.A OG no hydrogen 3.324 N/A TYR 134.A N SER 130.A O no hydrogen 2.943 N/A TYR 134.A OH SER 78.A OG no hydrogen 3.040 N/A LEU 135.A N TYR 131.A O no hydrogen 3.010 N/A CYS 136.A N ASP 132.A O no hydrogen 3.114 N/A CYS 136.A SG ASP 132.A O no hydrogen 3.317 N/A MET 137.A N GLU 133.A O no hydrogen 2.974 N/A LYS 138.A N TYR 134.A O no hydrogen 2.943 N/A LYS 138.A NZ GLU 11.A OE1 no hydrogen 2.809 N/A LYS 138.A NZ GLU 11.A OE2 no hydrogen 3.442 N/A VAL 139.A N LEU 135.A O no hydrogen 3.263 N/A LEU 140.A N CYS 136.A O no hydrogen 3.163 N/A LEU 141.A N MET 137.A O no hydrogen 2.855 N/A LEU 142.A N LYS 138.A O no hydrogen 3.264 N/A LEU 143.A N LEU 140.A O no hydrogen 2.976 N/A SER 144.A N LEU 141.A O no hydrogen 3.241 N/A SER 144.A OG LEU 140.A O no hydrogen 2.507 N/A VAL 146.A N LYS 240.A O no hydrogen 2.882 N/A LYS 148.A N SER 238.A O no hydrogen 3.088 N/A LYS 148.A NZ GLY 237.A O no hydrogen 2.873 N/A GLY 150.A N PRO 147.A O no hydrogen 3.267 N/A LYS 152.A N ASP 62.A OD1 no hydrogen 2.987 N/A LYS 152.A NZ ASP 61.A OD2 no hydrogen 3.025 N/A SER 153.A N ASP 62.A OD2 no hydrogen 2.723 N/A SER 153.A OG ASP 62.A OD2 no hydrogen 2.673 N/A GLN 154.A NE2 ASP 158.A OD1 no hydrogen 3.061 N/A PHE 157.A N SER 153.A O no hydrogen 3.170 N/A ASP 158.A N GLN 154.A O no hydrogen 2.835 N/A GLU 159.A N ALA 155.A O no hydrogen 3.082 N/A ILE 160.A N VAL 156.A O no hydrogen 2.923 N/A ARG 161.A N PHE 157.A O no hydrogen 3.113 N/A ARG 161.A NH1 LEU 143.A O no hydrogen 2.819 N/A MET 162.A N ASP 158.A O no hydrogen 3.179 N/A THR 163.A N GLU 159.A O no hydrogen 2.963 N/A THR 163.A OG1 GLU 159.A O no hydrogen 2.984 N/A TYR 164.A N ILE 160.A O no hydrogen 3.028 N/A TYR 164.A OH PRO 53.A O no hydrogen 2.779 N/A ILE 165.A N ARG 161.A O no hydrogen 2.825 N/A LYS 166.A N MET 162.A O no hydrogen 3.246 N/A GLU 167.A N THR 163.A O no hydrogen 3.166 N/A LEU 168.A N TYR 164.A O no hydrogen 3.061 N/A GLY 169.A N ILE 165.A O no hydrogen 3.209 N/A LYS 170.A N LYS 166.A O no hydrogen 3.051 N/A LYS 170.A NZ GLU 167.A OE2 no hydrogen 2.880 N/A ALA 171.A N GLU 167.A O no hydrogen 2.950 N/A ILE 172.A N LEU 168.A O no hydrogen 2.971 N/A VAL 173.A N GLY 169.A O no hydrogen 3.013 N/A LYS 174.A N LYS 170.A O no hydrogen 2.774 N/A LYS 174.A NZ ASP 132.A OD2 no hydrogen 3.127 N/A ARG 175.A N ALA 171.A O no hydrogen 3.174 N/A ARG 175.A NH2 GLN 128.A O no hydrogen 3.499 N/A GLU 176.A N ILE 172.A O no hydrogen 3.023 N/A GLY 177.A N VAL 173.A O no hydrogen 2.703 N/A SER 180.A OG GLN 181.A OE1 no hydrogen 3.428 N/A GLN 181.A N SER 179.A OG no hydrogen 3.116 N/A GLN 181.A NE2 GLN 184.A OE1 no hydrogen 2.714 N/A GLN 184.A N GLN 181.A O no hydrogen 3.164 N/A ARG 185.A NE GLU 133.A OE2 no hydrogen 2.805 N/A ARG 185.A NH1 LEU 127.A O no hydrogen 2.789 N/A ARG 185.A NH2 LEU 127.A O no hydrogen 2.997 N/A ARG 185.A NH2 GLU 133.A OE1 no hydrogen 2.708 N/A ARG 185.A NH2 GLU 133.A OE2 no hydrogen 3.225 N/A PHE 186.A N ASN 182.A O no hydrogen 2.950 N/A TYR 187.A N TRP 183.A O no hydrogen 3.063 N/A GLN 188.A N GLN 184.A O no hydrogen 2.999 N/A LEU 189.A N ARG 185.A O no hydrogen 2.981 N/A THR 190.A N PHE 186.A O no hydrogen 2.959 N/A THR 190.A OG1 PHE 186.A O no hydrogen 2.966 N/A THR 190.A OG1 TYR 187.A O no hydrogen 2.898 N/A THR 190.A OG1 HIS 245.A NE2 no hydrogen 2.866 N/A LYS 191.A N TYR 187.A O no hydrogen 3.016 N/A LEU 192.A N GLN 188.A O no hydrogen 3.161 N/A LEU 193.A N LEU 189.A O no hydrogen 3.026 N/A ASP 194.A N THR 190.A O no hydrogen 3.016 N/A SER 195.A N LYS 191.A O no hydrogen 3.092 N/A SER 195.A OG LYS 191.A O no hydrogen 3.407 N/A SER 195.A OG LEU 192.A O no hydrogen 2.932 N/A MET 196.A N LEU 193.A O no hydrogen 3.109 N/A HIS 197.A N ASP 194.A O no hydrogen 3.387 N/A HIS 197.A NE2 LEU 242.A O no hydrogen 3.103 N/A MET 199.A N SER 195.A O no hydrogen 3.027 N/A VAL 200.A N MET 196.A O no hydrogen 3.020 N/A GLY 201.A N HIS 197.A O no hydrogen 2.890 N/A LEU 203.A N VAL 200.A O no hydrogen 2.872 N/A LEU 204.A N VAL 200.A O no hydrogen 3.001 N/A GLN 205.A N GLY 201.A O no hydrogen 3.064 N/A PHE 206.A N GLY 202.A O no hydrogen 3.299 N/A CYS 207.A N LEU 203.A O no hydrogen 2.981 N/A PHE 208.A N LEU 204.A O no hydrogen 2.726 N/A TYR 209.A N GLN 205.A O no hydrogen 2.997 N/A THR 210.A N PHE 206.A O no hydrogen 2.968 N/A THR 210.A OG1 PHE 206.A O no hydrogen 2.727 N/A PHE 211.A N CYS 207.A O no hydrogen 2.976 N/A VAL 212.A N PHE 208.A O no hydrogen 2.983 N/A ASN 213.A N TYR 209.A O no hydrogen 2.943 N/A ASN 213.A ND2 TYR 209.A O no hydrogen 3.603 N/A GLU 218.A N SER 32.A OG no hydrogen 3.072 N/A ALA 224.A N PRO 220.A O no hydrogen 2.926 N/A GLU 225.A N GLU 221.A O no hydrogen 2.884 N/A ILE 226.A N MET 222.A O no hydrogen 3.462 N/A ILE 227.A N LEU 223.A O no hydrogen 2.843 N/A SER 228.A N ALA 224.A O no hydrogen 3.058 N/A SER 228.A OG ALA 224.A O no hydrogen 3.051 N/A SER 228.A OG GLU 225.A O no hydrogen 3.555 N/A ASN 229.A N GLU 225.A O no hydrogen 3.359 N/A GLN 230.A N ILE 226.A O no hydrogen 2.747 N/A LEU 231.A N ILE 227.A O no hydrogen 2.704 N/A PHE 234.A N GLN 230.A O no hydrogen 3.399 N/A LYS 235.A N LEU 231.A O no hydrogen 3.348 N/A ALA 236.A N PRO 232.A O no hydrogen 3.051 N/A GLY 237.A N PHE 234.A O no hydrogen 3.064 N/A SER 238.A N LYS 233.A O no hydrogen 2.932 N/A LYS 240.A N VAL 146.A O no hydrogen 2.585 N/A LEU 242.A N SER 144.A O no hydrogen 2.704 N/A PHE 244.A N ASP 194.A OD1 no hydrogen 2.784 N/A HIS 245.A N ASP 194.A OD2 no hydrogen 2.954 N/A HIS 245.A NE2 THR 190.A OG1 no hydrogen 2.866 N/A