Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2cgw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 1.A N TRP 4.A O no hydrogen 2.786 N/A GLU 2.A N TRP 4.A O no hydrogen 2.692 N/A ASP 5.A N VAL 22.A O no hydrogen 3.171 N/A VAL 7.A N LEU 20.A O no hydrogen 2.869 N/A LEU 10.A N VAL 18.A O no hydrogen 2.991 N/A GLY 11.A N VAL 18.A O no hydrogen 3.342 N/A GLY 13.A N GLY 16.A O no hydrogen 2.845 N/A GLU 17.A N ILE 34.A O no hydrogen 3.313 N/A VAL 18.A N GLY 11.A O no hydrogen 2.799 N/A GLN 19.A N VAL 32.A O no hydrogen 2.772 N/A GLN 19.A NE2 GLU 17.A OE1 no hydrogen 2.839 N/A LEU 20.A N GLN 8.A O no hydrogen 3.094 N/A ALA 21.A N VAL 30.A O no hydrogen 2.676 N/A VAL 22.A N ASP 5.A O no hydrogen 2.992 N/A ASN 23.A N GLU 28.A O no hydrogen 2.871 N/A VAL 25.A N ASN 23.A OD1 no hydrogen 3.160 N/A GLU 28.A N THR 26.A OG1 no hydrogen 3.364 N/A VAL 30.A N ALA 21.A O no hydrogen 2.776 N/A ALA 31.A N LEU 75.A O no hydrogen 2.872 N/A VAL 32.A N GLN 19.A O no hydrogen 2.810 N/A LYS 33.A N LEU 73.A O no hydrogen 2.993 N/A LYS 33.A NZ GLU 46.A OE1 no hydrogen 3.066 N/A LYS 33.A NZ GLU 46.A OE2 no hydrogen 2.721 N/A LYS 33.A NZ ASP 139.A OD2 no hydrogen 3.564 N/A ILE 34.A N GLU 17.A O no hydrogen 2.761 N/A VAL 35.A N GLN 71.A O no hydrogen 3.144 N/A MET 37.A N ASN 69.A O no hydrogen 3.366 N/A ARG 39.A N ASP 36.A OD1 no hydrogen 3.082 N/A LYS 45.A NZ THR 144.A OG1 no hydrogen 2.856 N/A GLU 46.A N ASN 42.A O no hydrogen 2.960 N/A ILE 47.A N ILE 43.A O no hydrogen 2.983 N/A CYS 48.A N LYS 44.A O no hydrogen 3.151 N/A ILE 49.A N LYS 45.A O no hydrogen 2.884 N/A ASN 50.A N GLU 46.A O no hydrogen 2.909 N/A ASN 50.A ND2 GLU 46.A O no hydrogen 3.043 N/A LYS 51.A N ILE 47.A O no hydrogen 2.870 N/A LYS 51.A NZ HIS 64.A NE2 no hydrogen 3.117 N/A MET 52.A N ILE 49.A O no hydrogen 3.070 N/A LEU 53.A N ASN 50.A O no hydrogen 3.063 N/A ASN 54.A N TYR 111.A OH no hydrogen 2.900 N/A GLU 56.A N GLU 56.A OE2 no hydrogen 2.835 N/A ASN 57.A N HIS 55.A ND1 no hydrogen 2.958 N/A ASN 57.A ND2 LEU 135.A O no hydrogen 2.953 N/A VAL 58.A N HIS 55.A O no hydrogen 3.196 N/A VAL 59.A N ILE 137.A O no hydrogen 3.037 N/A LYS 60.A N GLU 76.A OE2 no hydrogen 2.745 N/A LYS 60.A NZ ASN 54.A OD1 no hydrogen 3.540 N/A TYR 62.A N PHE 74.A O no hydrogen 2.686 N/A ARG 65.A N TYR 72.A O no hydrogen 3.429 N/A ARG 65.A NH1 HIS 64.A O no hydrogen 3.090 N/A GLN 71.A N VAL 35.A O no hydrogen 2.909 N/A TYR 72.A N ARG 65.A O no hydrogen 3.130 N/A LEU 73.A N LYS 33.A O no hydrogen 3.040 N/A PHE 74.A N GLY 63.A O no hydrogen 2.759 N/A LEU 75.A N ALA 31.A O no hydrogen 2.721 N/A GLU 76.A N LYS 60.A O no hydrogen 2.810 N/A CYS 78.A SG GLU 76.A O no hydrogen 3.952 N/A GLY 80.A N LEU 129.A O no hydrogen 2.731 N/A GLY 81.A N CYS 78.A O no hydrogen 3.367 N/A LEU 83.A N LEU 127.A O no hydrogen 2.765 N/A PHE 84.A N PRO 124.A O no hydrogen 3.301 N/A ASP 85.A N GLU 82.A O no hydrogen 2.940 N/A ARG 86.A N LEU 83.A O no hydrogen 2.923 N/A ARG 86.A NH1 GLY 80.A O no hydrogen 3.306 N/A ARG 86.A NH2 ASP 133.A OD1 no hydrogen 2.574 N/A ILE 87.A N PHE 84.A O no hydrogen 3.356 N/A GLU 88.A N GLY 92.A O no hydrogen 2.953 N/A ASP 90.A N GLY 195.A O no hydrogen 2.957 N/A ILE 91.A N GLU 88.A O no hydrogen 2.832 N/A GLY 92.A N GLU 88.A O no hydrogen 2.908 N/A ALA 98.A N PRO 94.A O no hydrogen 3.130 N/A GLN 99.A N GLU 95.A O no hydrogen 2.865 N/A ARG 100.A N PRO 96.A O no hydrogen 3.231 N/A ARG 100.A NH2 ASP 133.A O no hydrogen 2.585 N/A PHE 101.A N ASP 97.A O no hydrogen 3.129 N/A PHE 102.A N ALA 98.A O no hydrogen 2.866 N/A HIS 103.A N GLN 99.A O no hydrogen 2.821 N/A HIS 103.A NE2 TYR 256.A O no hydrogen 2.763 N/A GLN 104.A N ARG 100.A O no hydrogen 3.068 N/A LEU 105.A N PHE 101.A O no hydrogen 2.842 N/A MET 106.A N PHE 102.A O no hydrogen 2.938 N/A ALA 107.A N HIS 103.A O no hydrogen 2.883 N/A GLY 108.A N GLN 104.A O no hydrogen 3.025 N/A VAL 109.A N LEU 105.A O no hydrogen 2.867 N/A VAL 110.A N MET 106.A O no hydrogen 2.781 N/A TYR 111.A N ALA 107.A O no hydrogen 3.170 N/A LEU 112.A N GLY 108.A O no hydrogen 3.081 N/A HIS 113.A N VAL 109.A O no hydrogen 2.909 N/A HIS 113.A NE2 ASP 181.A OD2 no hydrogen 2.876 N/A GLY 114.A N VAL 110.A O no hydrogen 2.857 N/A ILE 115.A N TYR 111.A O no hydrogen 3.162 N/A ILE 115.A N LEU 112.A O no hydrogen 3.026 N/A GLY 116.A N HIS 113.A O no hydrogen 3.158 N/A ILE 117.A N LEU 112.A O no hydrogen 2.930 N/A THR 118.A N THR 144.A O no hydrogen 2.928 N/A THR 118.A OG1 ASP 181.A OD1 no hydrogen 3.286 N/A THR 118.A OG1 ASP 181.A OD2 no hydrogen 2.825 N/A HIS 119.A NE2 SER 138.A O no hydrogen 2.829 N/A ARG 120.A N ASP 181.A OD1 no hydrogen 3.231 N/A ARG 120.A NE LEU 142.A O no hydrogen 2.972 N/A ARG 120.A NH2 LEU 142.A O no hydrogen 3.085 N/A ASP 121.A N HIS 119.A ND1 no hydrogen 3.061 N/A LYS 123.A NZ THR 161.A OG1 no hydrogen 3.098 N/A GLU 125.A N GLU 125.A OE1 no hydrogen 2.530 N/A ASN 126.A N LYS 123.A O no hydrogen 2.915 N/A ASN 126.A ND2 ASP 121.A O no hydrogen 2.967 N/A LEU 127.A N PRO 124.A O no hydrogen 3.253 N/A LEU 128.A N LYS 136.A O no hydrogen 2.941 N/A LEU 129.A N GLY 81.A O no hydrogen 2.654 N/A ASP 130.A N ASN 134.A O no hydrogen 2.978 N/A ARG 132.A N ASP 130.A OD2 no hydrogen 2.804 N/A ASP 133.A N ASP 130.A O no hydrogen 3.190 N/A ASN 134.A N ASP 130.A OD2 no hydrogen 2.862 N/A LEU 135.A N GLN 104.A OE1 no hydrogen 2.720 N/A LYS 136.A N LEU 128.A O no hydrogen 2.704 N/A LYS 136.A NZ GLU 56.A O no hydrogen 3.134 N/A LYS 136.A NZ GLU 76.A OE1 no hydrogen 2.668 N/A LYS 136.A NZ GLU 76.A OE2 no hydrogen 3.499 N/A ILE 137.A N ASN 57.A O no hydrogen 2.692 N/A SER 138.A N ASN 126.A O no hydrogen 2.971 N/A GLY 141.A N ASP 139.A OD2 no hydrogen 2.954 N/A ALA 143.A N PHE 140.A O no hydrogen 3.035 N/A THR 144.A N THR 118.A O no hydrogen 2.924 N/A PHE 146.A N GLY 116.A O no hydrogen 2.933 N/A ARG 147.A NH1 HIS 113.A O no hydrogen 2.938 N/A ARG 147.A NH2 HIS 113.A O no hydrogen 3.425 N/A TYR 148.A N ARG 151.A O no hydrogen 3.080 N/A ASN 150.A ND2 ASN 150.A O no hydrogen 3.006 N/A ARG 151.A N TYR 148.A O no hydrogen 3.002 N/A ARG 153.A N PHE 146.A O no hydrogen 2.763 N/A LEU 155.A N PHE 175.A O no hydrogen 2.901 N/A THR 161.A OG1 ASP 121.A OD2 no hydrogen 2.838 N/A TYR 164.A N THR 161.A O no hydrogen 2.816 N/A VAL 165.A N LEU 162.A O no hydrogen 3.379 N/A GLU 168.A N GLU 168.A OE2 no hydrogen 2.781 N/A LEU 169.A N ALA 166.A O no hydrogen 3.167 N/A LEU 170.A N PRO 167.A O no hydrogen 2.869 N/A LYS 171.A N PRO 167.A O no hydrogen 3.198 N/A LYS 171.A N GLU 168.A O no hydrogen 3.127 N/A LYS 171.A NZ ASP 204.A OD2 no hydrogen 3.495 N/A LYS 171.A NZ GLU 239.A OE2 no hydrogen 2.710 N/A ARG 172.A N GLU 168.A O no hydrogen 2.803 N/A PHE 175.A N LEU 155.A O no hydrogen 3.029 N/A HIS 176.A ND1 GLU 152.A OE1 no hydrogen 2.682 N/A VAL 180.A N ALA 177.A O no hydrogen 3.223 N/A ASP 181.A N ALA 177.A O no hydrogen 3.413 N/A VAL 182.A N GLU 178.A O no hydrogen 3.141 N/A TRP 183.A N PRO 179.A O no hydrogen 3.089 N/A SER 184.A N VAL 180.A O no hydrogen 3.155 N/A SER 184.A OG ASP 181.A O no hydrogen 3.058 N/A CYS 185.A N ASP 181.A O no hydrogen 2.944 N/A CYS 185.A SG ASP 181.A O no hydrogen 3.168 N/A GLY 186.A N VAL 182.A O no hydrogen 2.963 N/A ILE 187.A N TRP 183.A O no hydrogen 3.011 N/A VAL 188.A N SER 184.A O no hydrogen 2.957 N/A LEU 189.A N CYS 185.A O no hydrogen 3.071 N/A THR 190.A N GLY 186.A O no hydrogen 3.037 N/A THR 190.A OG1 GLY 186.A O no hydrogen 2.892 N/A ALA 191.A N ILE 187.A O no hydrogen 2.963 N/A MET 192.A N VAL 188.A O no hydrogen 2.843 N/A LEU 193.A N LEU 189.A O no hydrogen 2.985 N/A LEU 193.A N THR 190.A O no hydrogen 3.121 N/A GLY 195.A N ALA 191.A O no hydrogen 2.943 N/A GLN 201.A NE2 SER 203.A OG no hydrogen 2.596 N/A SER 203.A N GLN 201.A O no hydrogen 2.882 N/A CYS 206.A N SER 203.A O no hydrogen 2.691 N/A CYS 206.A SG GLN 201.A O no hydrogen 3.522 N/A CYS 206.A SG GLU 208.A OE1 no hydrogen 3.796 N/A GLU 208.A N GLU 208.A OE1 no hydrogen 2.668 N/A SER 210.A N CYS 206.A O no hydrogen 2.858 N/A SER 210.A OG CYS 206.A O no hydrogen 3.266 N/A ASP 211.A N GLN 207.A O no hydrogen 2.764 N/A TRP 212.A N GLU 208.A O no hydrogen 3.207 N/A TRP 212.A NE1 LEU 237.A O no hydrogen 3.092 N/A LYS 213.A N TYR 209.A O no hydrogen 3.240 N/A LYS 213.A NZ ASP 204.A OD2 no hydrogen 2.590 N/A LYS 213.A NZ GLU 239.A OE2 no hydrogen 3.317 N/A GLU 214.A N SER 210.A O no hydrogen 3.115 N/A LYS 215.A N TRP 212.A O no hydrogen 2.773 N/A LYS 216.A N ASP 211.A O no hydrogen 3.127 N/A LYS 216.A NZ ASP 211.A OD2 no hydrogen 3.183 N/A THR 217.A N LYS 215.A O no hydrogen 2.871 N/A LEU 219.A N LYS 216.A O no hydrogen 3.231 N/A LYS 223.A N LEU 219.A O no hydrogen 2.970 N/A LYS 224.A N PRO 221.A O no hydrogen 3.173 N/A LYS 224.A NZ ASP 90.A O no hydrogen 3.073 N/A LYS 224.A NZ ASP 90.A OD2 no hydrogen 3.227 N/A LYS 224.A NZ ALA 194.A O no hydrogen 2.959 N/A LYS 224.A NZ GLU 196.A OE2 no hydrogen 2.759 N/A ILE 225.A N TRP 222.A O no hydrogen 2.897 N/A LEU 230.A N ASP 226.A O no hydrogen 3.067 N/A ALA 231.A N SER 227.A O no hydrogen 2.924 N/A LEU 232.A N ALA 228.A O no hydrogen 3.357 N/A LEU 233.A N PRO 229.A O no hydrogen 2.847 N/A HIS 234.A N LEU 230.A O no hydrogen 2.746 N/A LYS 235.A N LEU 232.A O no hydrogen 2.761 N/A LYS 235.A NZ ASP 253.A OD2 no hydrogen 2.663 N/A ILE 236.A N LEU 232.A O no hydrogen 2.985 N/A LEU 237.A N LEU 233.A O no hydrogen 2.842 N/A VAL 238.A N ILE 236.A O no hydrogen 2.882 N/A SER 242.A N ASN 240.A OD1 no hydrogen 2.934 N/A SER 242.A OG ASN 240.A OD1 no hydrogen 3.365 N/A ALA 243.A N ASN 240.A O no hydrogen 2.964 N/A ARG 244.A N ASN 240.A O no hydrogen 3.193 N/A ARG 244.A NE VAL 238.A O no hydrogen 2.938 N/A ARG 244.A NH1 GLU 168.A OE1 no hydrogen 3.472 N/A ARG 244.A NH1 GLU 168.A OE2 no hydrogen 2.703 N/A ARG 244.A NH1 VAL 238.A O no hydrogen 2.987 N/A ARG 244.A NH1 GLU 239.A O no hydrogen 3.106 N/A ARG 244.A NH2 GLU 168.A OE1 no hydrogen 2.680 N/A ARG 244.A NH2 GLU 168.A OE2 no hydrogen 3.453 N/A ARG 244.A NH2 PRO 179.A O no hydrogen 2.826 N/A ILE 245.A N LYS 235.A O no hydrogen 3.339 N/A ILE 250.A N THR 246.A O no hydrogen 2.909 N/A LYS 251.A N ILE 247.A O no hydrogen 2.928 N/A LYS 252.A N ASP 249.A O no hydrogen 3.006 N/A LYS 252.A NZ ASP 249.A OD2 no hydrogen 2.724 N/A ASP 253.A N ILE 250.A O no hydrogen 2.960 N/A TRP 255.A NE1 GLU 95.A OE1 no hydrogen 3.048 N/A TYR 256.A N ASP 253.A OD1 no hydrogen 2.957 N/A ASN 257.A N ASP 253.A O no hydrogen 3.207 N/A ASN 257.A N ARG 254.A O no hydrogen 3.218 N/A ASN 257.A ND2 LYS 251.A O no hydrogen 2.750 N/A ASN 257.A ND2 ASP 253.A O no hydrogen 2.967 N/A LYS 258.A N TRP 255.A O no hydrogen 3.009 N/A LYS 261.A NZ ASP 97.A OD1 no hydrogen 3.343 N/A