Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kj4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 1.A SG CYS 5.A O no hydrogen 3.746 N/A CYS 1.A SG VAL 6.A O no hydrogen 3.962 N/A CYS 5.A SG GLY 3.A O no hydrogen 3.989 N/A VAL 6.A N SER 16.A O no hydrogen 2.888 N/A CYS 7.A SG VAL 6.A O no hydrogen 3.439 N/A CYS 7.A SG THR 14.A O no hydrogen 3.954 N/A TYR 8.A N THR 14.A O no hydrogen 3.377 N/A VAL 13.A N GLN 34.A OE1 no hydrogen 2.969 N/A THR 14.A OG1 LYS 12.A O no hydrogen 2.708 N/A THR 15.A N ARG 35.A O no hydrogen 2.927 N/A SER 16.A N VAL 6.A O no hydrogen 3.050 N/A CYS 17.A N PHE 37.A O no hydrogen 2.905 N/A GLN 19.A N HIS 39.A O no hydrogen 3.115 N/A GLN 19.A NE2 HIS 39.A O no hydrogen 3.404 N/A GLN 20.A N ASN 41.A OD1 no hydrogen 2.799 N/A GLY 21.A N ASN 41.A OD1 no hydrogen 3.086 N/A LEU 22.A N ASN 41.A OD1 no hydrogen 3.112 N/A SER 33.A N PRO 30.A O no hydrogen 3.096 N/A SER 33.A OG THR 15.A OG1 no hydrogen 2.710 N/A SER 33.A OG PRO 30.A O no hydrogen 3.022 N/A GLN 34.A N VAL 13.A O no hydrogen 2.807 N/A ARG 35.A NE THR 14.A OG1 no hydrogen 2.910 N/A ARG 35.A NH2 THR 14.A OG1 no hydrogen 2.879 N/A ILE 36.A N ILE 59.A O no hydrogen 2.992 N/A PHE 37.A N THR 15.A O no hydrogen 2.744 N/A LEU 38.A N TRP 61.A O no hydrogen 2.898 N/A HIS 39.A N HIS 39.A ND1 no hydrogen 2.815 N/A GLY 40.A N HIS 63.A O no hydrogen 3.010 N/A ASN 41.A ND2 CYS 17.A O no hydrogen 2.692 N/A ASN 41.A ND2 LEU 38.A O no hydrogen 3.091 N/A ARG 42.A N LEU 22.A O no hydrogen 2.918 N/A ALA 49.A N ALA 73.A O no hydrogen 3.124 N/A SER 50.A OG PRO 47.A O no hydrogen 2.728 N/A CYS 54.A N PHE 51.A O no hydrogen 3.134 N/A CYS 54.A SG PRO 30.A O no hydrogen 3.593 N/A CYS 54.A SG PHE 51.A O no hydrogen 3.807 N/A ARG 55.A N SER 53.A O no hydrogen 2.751 N/A LEU 57.A N CYS 54.A O no hydrogen 3.028 N/A THR 58.A N GLN 34.A O no hydrogen 3.167 N/A THR 58.A OG1 GLN 34.A O no hydrogen 3.479 N/A LEU 60.A N GLN 83.A O no hydrogen 2.967 N/A TRP 61.A N ILE 36.A O no hydrogen 2.970 N/A LEU 62.A N ASP 85.A O no hydrogen 2.830 N/A HIS 63.A N HIS 63.A ND1 no hydrogen 2.807 N/A SER 64.A N SER 87.A O no hydrogen 2.749 N/A ASN 65.A N ASN 89.A OD1 no hydrogen 2.967 N/A ASN 65.A ND2 LEU 62.A O no hydrogen 2.788 N/A ALA 66.A N ILE 43.A O no hydrogen 3.140 N/A ALA 68.A N SER 44.A O no hydrogen 3.276 N/A ASP 71.A N VAL 46.A O no hydrogen 3.185 N/A ALA 73.A N ASP 71.A OD1 no hydrogen 3.267 N/A ALA 74.A N ASP 71.A O no hydrogen 3.022 N/A THR 76.A N ALA 73.A O no hydrogen 3.499 N/A LEU 81.A N LEU 78.A O no hydrogen 3.240 N/A GLU 82.A N THR 58.A O no hydrogen 2.645 N/A GLN 83.A N THR 58.A O no hydrogen 2.726 N/A LEU 84.A N THR 108.A O no hydrogen 3.139 N/A ASP 85.A N LEU 60.A O no hydrogen 3.240 N/A LEU 86.A N HIS 110.A O no hydrogen 3.048 N/A SER 87.A OG ASP 85.A OD1 no hydrogen 2.476 N/A SER 87.A OG ASP 112.A OD2 no hydrogen 3.171 N/A ASN 89.A ND2 LEU 62.A O no hydrogen 3.181 N/A ASN 89.A ND2 LEU 86.A O no hydrogen 2.931 N/A LEU 92.A N ASN 89.A O no hydrogen 2.944 N/A ARG 93.A N CYS 114.A O no hydrogen 3.196 N/A VAL 94.A N LEU 92.A O no hydrogen 3.059 N/A THR 98.A N ASP 96.A OD1 no hydrogen 2.837 N/A THR 98.A OG1 ASP 96.A OD1 no hydrogen 2.885 N/A THR 99.A N ASP 96.A O no hydrogen 2.736 N/A THR 99.A OG1 ASP 96.A O no hydrogen 2.562 N/A ARG 101.A N THR 98.A O no hydrogen 3.085 N/A ARG 101.A NH2 PRO 97.A O no hydrogen 2.708 N/A LEU 103.A N PHE 100.A O no hydrogen 3.138 N/A LEU 106.A N LEU 103.A O no hydrogen 3.118 N/A HIS 107.A N GLU 82.A O no hydrogen 2.840 N/A THR 108.A N GLU 82.A O no hydrogen 3.071 N/A LEU 109.A N TYR 132.A O no hydrogen 3.158 N/A HIS 110.A N LEU 84.A O no hydrogen 2.894 N/A HIS 110.A ND1 ASP 112.A OD2 no hydrogen 2.773 N/A LEU 111.A N TYR 134.A O no hydrogen 2.764 N/A ARG 113.A N GLN 136.A O no hydrogen 2.612 N/A CYS 114.A N ASN 138.A OD1 no hydrogen 3.164 N/A CYS 114.A SG LEU 86.A O no hydrogen 3.148 N/A CYS 114.A SG LEU 111.A O no hydrogen 3.561 N/A CYS 114.A SG ASP 112.A O no hydrogen 3.551 N/A LEU 116.A N ASN 138.A OD1 no hydrogen 3.377 N/A GLN 117.A N ARG 93.A O no hydrogen 3.123 N/A LEU 130.A N LEU 127.A O no hydrogen 3.034 N/A GLN 131.A N HIS 107.A O no hydrogen 2.957 N/A LEU 133.A N HIS 156.A O no hydrogen 3.069 N/A TYR 134.A N LEU 109.A O no hydrogen 3.250 N/A LEU 135.A N PHE 158.A O no hydrogen 2.725 N/A GLN 136.A N GLN 136.A OE1 no hydrogen 2.500 N/A ASP 137.A N HIS 160.A O no hydrogen 2.937 N/A ASN 138.A N ASN 162.A OD1 no hydrogen 3.111 N/A ASN 138.A ND2 LEU 111.A O no hydrogen 3.384 N/A ASN 146.A N HIS 170.A O no hydrogen 2.872 N/A THR 147.A OG1 PRO 144.A O no hydrogen 2.618 N/A THR 147.A OG1 ASP 145.A O no hydrogen 3.565 N/A ARG 149.A N ASN 146.A O no hydrogen 2.880 N/A ARG 149.A NH1 ASN 146.A OD1 no hydrogen 3.292 N/A LEU 151.A N PHE 148.A O no hydrogen 2.978 N/A LEU 154.A N LEU 151.A O no hydrogen 3.361 N/A THR 155.A N GLN 131.A O no hydrogen 2.989 N/A THR 155.A OG1 GLN 131.A O no hydrogen 3.405 N/A THR 155.A OG1 HIS 156.A ND1 no hydrogen 3.390 N/A HIS 156.A N GLN 131.A O no hydrogen 3.127 N/A LEU 157.A N ARG 180.A O no hydrogen 3.026 N/A PHE 158.A N LEU 133.A O no hydrogen 2.732 N/A LEU 159.A N LEU 182.A O no hydrogen 2.853 N/A GLY 161.A N HIS 184.A O no hydrogen 3.176 N/A ASN 162.A N GLN 185.A O no hydrogen 3.195 N/A ASN 162.A ND2 LEU 135.A O no hydrogen 3.293 N/A ASN 162.A ND2 LEU 159.A O no hydrogen 2.533 N/A ARG 163.A N LEU 140.A O no hydrogen 3.060 N/A ILE 164.A N ASN 186.A OD1 no hydrogen 3.158 N/A VAL 167.A N ARG 190.A O no hydrogen 3.069 N/A ALA 171.A N PRO 168.A O no hydrogen 3.034 N/A ARG 173.A N HIS 170.A O no hydrogen 3.468 N/A GLY 174.A N ASP 198.A OD2 no hydrogen 3.370 N/A LEU 175.A N PHE 172.A O no hydrogen 3.475 N/A HIS 176.A N GLY 174.A O no hydrogen 2.639 N/A SER 177.A OG GLY 152.A O no hydrogen 2.727 N/A LEU 178.A N LEU 175.A O no hydrogen 3.393 N/A ASP 179.A N THR 155.A O no hydrogen 2.536 N/A ARG 180.A N THR 155.A O no hydrogen 3.078 N/A LEU 181.A N THR 204.A O no hydrogen 2.851 N/A LEU 182.A N LEU 157.A O no hydrogen 3.264 N/A LEU 183.A N TYR 206.A O no hydrogen 3.093 N/A GLN 185.A N PHE 208.A O no hydrogen 3.065 N/A ASN 186.A N ALA 209.A O no hydrogen 3.230 N/A ASN 186.A ND2 LEU 159.A O no hydrogen 3.462 N/A ASN 186.A ND2 HIS 184.A O no hydrogen 2.923 N/A ALA 189.A N PRO 165.A O no hydrogen 2.717 N/A HIS 192.A N VAL 167.A O no hydrogen 2.892 N/A HIS 194.A NE2 GLU 218.A OE2 no hydrogen 2.766 N/A ARG 197.A NH2 ASP 198.A OD2 no hydrogen 2.157 N/A LEU 199.A N PHE 196.A O no hydrogen 2.929 N/A LEU 199.A N ARG 197.A O no hydrogen 2.525 N/A MET 203.A N ASP 179.A O no hydrogen 2.969 N/A THR 204.A N ASP 179.A O no hydrogen 3.127 N/A LEU 205.A N TYR 228.A O no hydrogen 3.132 N/A TYR 206.A N LEU 181.A O no hydrogen 3.456 N/A LEU 207.A N ARG 230.A O no hydrogen 2.899 N/A ALA 209.A N ASN 232.A O no hydrogen 3.442 N/A ASN 210.A ND2 LEU 183.A O no hydrogen 3.397 N/A ASN 210.A ND2 LEU 207.A O no hydrogen 2.763 N/A ASN 211.A N VAL 188.A O no hydrogen 2.666 N/A VAL 219.A N PRO 216.A O no hydrogen 2.991 N/A LEU 223.A N LEU 220.A O no hydrogen 3.106 N/A ARG 224.A N PRO 222.A O no hydrogen 2.814 N/A SER 225.A OG GLY 200.A O no hydrogen 2.685 N/A SER 225.A OG LEU 202.A O no hydrogen 3.561 N/A LEU 226.A N LEU 223.A O no hydrogen 3.414 N/A GLN 227.A N MET 203.A O no hydrogen 2.855 N/A TYR 228.A N MET 203.A O no hydrogen 3.006 N/A LEU 229.A N SER 255.A O no hydrogen 3.099 N/A ARG 230.A N LEU 205.A O no hydrogen 3.090 N/A ASN 234.A ND2 LEU 231.A O no hydrogen 2.807 N/A TRP 236.A N ASN 234.A O no hydrogen 2.500 N/A TRP 236.A NE1 LEU 231.A O no hydrogen 2.572 N/A VAL 237.A N SER 213.A O no hydrogen 2.810 N/A CYS 238.A N LEU 263.A O no hydrogen 2.761 N/A ASP 239.A N VAL 237.A O no hydrogen 3.148 N/A ARG 241.A NE ASP 239.A OD1 no hydrogen 2.755 N/A ARG 241.A NH2 ASP 239.A OD1 no hydrogen 3.509 N/A ARG 241.A NH2 ASP 239.A OD2 no hydrogen 3.351 N/A ALA 242.A N ASP 239.A O no hydrogen 2.680 N/A ARG 243.A N CYS 240.A O no hydrogen 3.353 N/A TRP 246.A N ALA 242.A O no hydrogen 2.457 N/A ALA 247.A N ARG 243.A O no hydrogen 2.832 N/A TRP 248.A N PRO 244.A O no hydrogen 3.388 N/A LEU 249.A N LEU 245.A O no hydrogen 3.322 N/A GLN 250.A N TRP 246.A O no hydrogen 3.350 N/A GLN 250.A NE2 TRP 246.A O no hydrogen 2.956 N/A LYS 251.A N ALA 247.A O no hydrogen 3.465 N/A PHE 252.A N TRP 248.A O no hydrogen 3.035 N/A SER 255.A N GLN 227.A O no hydrogen 2.791 N/A SER 256.A OG SER 257.A O no hydrogen 2.985 N/A SER 257.A OG ASN 232.A OD1 no hydrogen 2.870 N/A SER 257.A OG GLU 258.A O no hydrogen 3.385 N/A VAL 259.A N ASP 271.A OD1 no hydrogen 2.729 N/A CYS 261.A SG ARG 270.A O no hydrogen 3.244 N/A LEU 267.A N PRO 264.A O no hydrogen 2.529 N/A LEU 272.A N VAL 259.A O no hydrogen 2.777 N/A LYS 273.A N ASP 271.A OD1 no hydrogen 3.324 N/A LYS 273.A NZ SER 256.A OG no hydrogen 3.070 N/A ARG 274.A NH2 ASP 271.A OD2 no hydrogen 2.788 N/A LEU 275.A N LEU 272.A O no hydrogen 2.587 N/A ALA 276.A N ASP 279.A OD2 no hydrogen 2.864 N/A LEU 280.A N ALA 277.A O no hydrogen 3.291 N/A