Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5iya_M.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 7.A N LEU 4.A O no hydrogen 3.029 N/A CYS 9.A SG THR 8.A O no hydrogen 3.277 N/A HIS 12.A ND1 ASN 11.A OD1 no hydrogen 2.393 N/A HIS 12.A NE2 GLU 30.A OE2 no hydrogen 2.518 N/A ALA 15.A N GLU 30.A OE2 no hydrogen 3.229 N/A ILE 16.A N ASP 14.A OD1 no hydrogen 2.806 N/A ASP 20.A N ASP 25.A O no hydrogen 2.825 N/A TYR 21.A N GLU 19.A O no hydrogen 3.156 N/A ALA 23.A N ASP 20.A OD2 no hydrogen 2.852 N/A GLY 24.A N ASP 20.A O no hydrogen 2.617 N/A ASP 25.A N ASP 20.A O no hydrogen 2.954 N/A ILE 27.A N VAL 18.A O no hydrogen 3.099 N/A CYS 28.A SG HIS 12.A NE2 no hydrogen 3.694 N/A CYS 28.A SG ASP 14.A OD1 no hydrogen 3.127 N/A CYS 28.A SG ILE 16.A O no hydrogen 3.994 N/A CYS 28.A SG GLU 30.A OE1 no hydrogen 3.225 N/A CYS 28.A SG GLU 30.A OE2 no hydrogen 3.124 N/A GLU 30.A N GLU 30.A OE1 no hydrogen 2.620 N/A CYS 31.A SG CYS 28.A O no hydrogen 3.832 N/A GLY 32.A N CYS 28.A O no hydrogen 3.108 N/A ARG 38.A NH1 ASP 25.A O no hydrogen 2.600 N/A GLY 43.A N ASP 41.A OD1 no hydrogen 2.929 N/A GLU 45.A N ASP 41.A O no hydrogen 2.509 N/A ARG 47.A NH1 SER 44.A O no hydrogen 3.204 N/A THR 48.A N GLU 45.A O no hydrogen 3.313 N/A THR 48.A OG1 GLU 45.A O no hydrogen 3.232 N/A THR 48.A OG1 GLU 45.A OE1 no hydrogen 2.841 N/A SER 52.A OG SER 52.A O no hydrogen 2.323 N/A SER 52.A OG ASP 55.A OD2 no hydrogen 3.251 N/A SER 53.A OG THR 50.A O no hydrogen 3.472 N/A SER 54.A OG ASP 55.A OD1 no hydrogen 3.354 N/A ARG 56.A N SER 53.A O no hydrogen 3.167 N/A ARG 56.A NE SER 52.A O no hydrogen 3.320 N/A ARG 56.A NH1 SER 52.A O no hydrogen 3.140 N/A MET 59.A N ASP 55.A O no hydrogen 2.500 N/A ASN 60.A N ARG 56.A O no hydrogen 2.936 N/A ALA 61.A N ALA 57.A O no hydrogen 2.882 N/A PHE 62.A N MET 58.A O no hydrogen 3.072 N/A LYS 63.A N MET 59.A O no hydrogen 3.418 N/A LYS 63.A NZ GLU 64.A OE1 no hydrogen 2.743 N/A LYS 63.A NZ GLU 64.A OE2 no hydrogen 3.128 N/A GLU 64.A N ASN 60.A O no hydrogen 2.820 N/A ILE 65.A N ALA 61.A O no hydrogen 2.457 N/A THR 66.A N PHE 62.A O no hydrogen 2.795 N/A THR 66.A OG1 PHE 62.A O no hydrogen 2.606 N/A THR 67.A N LYS 63.A O no hydrogen 2.650 N/A THR 67.A OG1 LYS 63.A O no hydrogen 2.544 N/A MET 68.A N ILE 65.A O no hydrogen 3.023 N/A ALA 69.A N ILE 65.A O no hydrogen 2.701 N/A ASP 70.A N THR 66.A O no hydrogen 2.688 N/A ILE 72.A N ALA 69.A O no hydrogen 3.476 N/A ASN 73.A N ASP 70.A O no hydrogen 3.332 N/A LEU 74.A N ALA 69.A O no hydrogen 3.351 N/A ARG 76.A NE ASP 80.A OD1 no hydrogen 2.583 N/A ARG 76.A NH2 ASP 80.A OD1 no hydrogen 3.017 N/A VAL 79.A N PRO 75.A O no hydrogen 3.501 N/A ASP 80.A N ARG 76.A O no hydrogen 2.683 N/A ARG 81.A N ASN 77.A O no hydrogen 3.212 N/A ARG 81.A NE GLN 114.A OE1 no hydrogen 3.004 N/A ARG 81.A NH2 GLN 114.A OE1 no hydrogen 3.072 N/A THR 82.A N ILE 78.A O no hydrogen 2.990 N/A THR 82.A OG1 ILE 78.A O no hydrogen 2.664 N/A ASN 83.A N VAL 79.A O no hydrogen 2.667 N/A ASN 83.A ND2 VAL 79.A O no hydrogen 2.471 N/A ASN 84.A N ASP 80.A O no hydrogen 2.812 N/A ASN 84.A ND2 ASP 80.A O no hydrogen 2.599 N/A LEU 85.A N ARG 81.A O no hydrogen 2.505 N/A PHE 86.A N THR 82.A O no hydrogen 2.916 N/A LYS 87.A N ASN 83.A O no hydrogen 3.060 N/A LYS 87.A NZ GLU 91.A OE1 no hydrogen 3.205 N/A GLN 88.A N ASN 84.A O no hydrogen 2.947 N/A VAL 89.A N LEU 85.A O no hydrogen 2.804 N/A TYR 90.A N PHE 86.A O no hydrogen 2.481 N/A GLU 91.A N LYS 87.A O no hydrogen 2.816 N/A GLN 92.A N GLN 88.A O no hydrogen 3.103 N/A LYS 93.A N VAL 89.A O no hydrogen 3.403 N/A LYS 96.A N LYS 93.A O no hydrogen 3.014 N/A ALA 102.A N ALA 99.A O no hydrogen 3.249 N/A ILE 103.A N ALA 99.A O no hydrogen 3.343 N/A ALA 104.A N ASN 100.A O no hydrogen 2.832 N/A SER 105.A N ASP 101.A O no hydrogen 3.031 N/A SER 105.A OG ASP 101.A O no hydrogen 2.717 N/A SER 105.A OG SER 128.A OG no hydrogen 3.069 N/A ALA 106.A N ALA 102.A O no hydrogen 2.745 N/A CYS 107.A N ILE 103.A O no hydrogen 2.720 N/A CYS 107.A SG ILE 103.A O no hydrogen 3.137 N/A LEU 108.A N ALA 104.A O no hydrogen 2.916 N/A TYR 109.A N SER 105.A O no hydrogen 3.035 N/A ILE 110.A N ALA 106.A O no hydrogen 3.043 N/A ALA 111.A N CYS 107.A O no hydrogen 2.952 N/A CYS 112.A N LEU 108.A O no hydrogen 3.288 N/A CYS 112.A SG LEU 108.A O no hydrogen 3.342 N/A ARG 113.A N TYR 109.A O no hydrogen 3.292 N/A ARG 113.A NH2 TYR 109.A OH no hydrogen 2.396 N/A GLN 114.A N ILE 110.A O no hydrogen 2.612 N/A GLU 115.A N ALA 111.A O no hydrogen 2.625 N/A GLY 116.A N ARG 113.A O no hydrogen 2.909 N/A VAL 117.A N CYS 112.A O no hydrogen 2.495 N/A ARG 119.A NH1 PRO 118.A O no hydrogen 3.306 N/A THR 120.A N GLU 123.A OE1 no hydrogen 2.771 N/A THR 120.A OG1 GLU 123.A OE1 no hydrogen 2.684 N/A LYS 122.A NZ GLY 223.A O no hydrogen 3.002 N/A GLU 123.A N THR 120.A OG1 no hydrogen 3.008 N/A ILE 124.A N THR 120.A O no hydrogen 2.676 N/A CYS 125.A N PHE 121.A O no hydrogen 2.382 N/A CYS 125.A SG PHE 121.A O no hydrogen 3.141 N/A CYS 125.A SG ILE 130.A O no hydrogen 3.642 N/A ALA 126.A N LYS 122.A O no hydrogen 3.096 N/A SER 128.A N CYS 125.A O no hydrogen 2.929 N/A SER 128.A OG SER 105.A OG no hydrogen 3.069 N/A GLU 134.A N SER 131.A OG no hydrogen 3.149 N/A ILE 135.A N SER 131.A O no hydrogen 2.927 N/A GLY 136.A N LYS 132.A O no hydrogen 2.823 N/A ARG 137.A N LYS 133.A O no hydrogen 2.849 N/A ARG 137.A NH1 GLU 134.A OE1 no hydrogen 3.348 N/A CYS 138.A N GLU 134.A O no hydrogen 2.800 N/A CYS 138.A SG GLU 134.A O no hydrogen 3.181 N/A CYS 138.A SG GLU 134.A OE2 no hydrogen 3.275 N/A PHE 139.A N ILE 135.A O no hydrogen 2.712 N/A LYS 140.A N GLY 136.A O no hydrogen 3.013 N/A LEU 141.A N ARG 137.A O no hydrogen 3.141 N/A ILE 142.A N CYS 138.A O no hydrogen 2.815 N/A LEU 143.A N PHE 139.A O no hydrogen 2.918 N/A LYS 144.A N LYS 140.A O no hydrogen 2.920 N/A ALA 145.A N LEU 141.A O no hydrogen 2.484 N/A LEU 146.A N ILE 142.A O no hydrogen 2.604 N/A THR 148.A OG1 LEU 146.A O no hydrogen 3.180 N/A LEU 152.A N ASP 151.A OD1 no hydrogen 2.563 N/A PHE 158.A N THR 155.A O no hydrogen 3.018 N/A MET 159.A N THR 155.A O no hydrogen 3.289 N/A ARG 161.A NH1 ASP 157.A O no hydrogen 2.943 N/A ARG 161.A NH2 ASP 157.A O no hydrogen 2.620 N/A PHE 162.A N PHE 158.A O no hydrogen 3.304 N/A CYS 163.A N MET 159.A O no hydrogen 3.229 N/A CYS 163.A SG MET 159.A O no hydrogen 3.111 N/A SER 164.A N SER 160.A O no hydrogen 2.878 N/A SER 164.A OG SER 160.A O no hydrogen 2.229 N/A ASN 165.A N ARG 161.A O no hydrogen 2.550 N/A LEU 166.A N PHE 162.A O no hydrogen 2.833 N/A CYS 167.A N SER 164.A O no hydrogen 2.605 N/A CYS 167.A SG SER 164.A O no hydrogen 3.517 N/A LEU 168.A N CYS 163.A O no hydrogen 2.595 N/A GLN 171.A NE2 ASP 247.A O no hydrogen 2.664 N/A GLN 173.A N PRO 169.A O no hydrogen 3.033 N/A MET 174.A N LYS 170.A O no hydrogen 2.475 N/A ALA 175.A N GLN 171.A O no hydrogen 2.928 N/A ALA 176.A N VAL 172.A O no hydrogen 2.784 N/A THR 177.A N GLN 173.A O no hydrogen 3.145 N/A THR 177.A OG1 GLN 173.A O no hydrogen 2.843 N/A HIS 178.A N MET 174.A O no hydrogen 3.069 N/A ILE 179.A N ALA 175.A O no hydrogen 2.901 N/A ALA 180.A N ALA 176.A O no hydrogen 2.655 N/A ARG 181.A N THR 177.A O no hydrogen 2.661 N/A ARG 181.A NH2 HIS 178.A ND1 no hydrogen 3.029 N/A LYS 182.A N HIS 178.A O no hydrogen 2.540 N/A LYS 182.A NZ ASP 242.A O no hydrogen 2.424 N/A LYS 182.A NZ ASP 242.A OD1 no hydrogen 2.871 N/A ALA 183.A N ILE 179.A O no hydrogen 2.967 N/A VAL 184.A N ALA 180.A O no hydrogen 2.928 N/A GLU 185.A N ARG 181.A O no hydrogen 3.073 N/A LEU 186.A N LYS 182.A O no hydrogen 3.023 N/A ASP 187.A N VAL 184.A O no hydrogen 2.972 N/A LEU 188.A N ALA 183.A O no hydrogen 2.839 N/A GLY 191.A N VAL 189.A O no hydrogen 2.672 N/A VAL 197.A N SER 193.A O no hydrogen 2.791 N/A ALA 198.A N PRO 194.A O no hydrogen 2.556 N/A ALA 199.A N ILE 195.A O no hydrogen 2.817 N/A ALA 200.A N SER 196.A O no hydrogen 3.241 N/A ALA 201.A N VAL 197.A O no hydrogen 3.079 N/A ILE 202.A N ALA 198.A O no hydrogen 2.695 N/A TYR 203.A N ALA 199.A O no hydrogen 2.603 N/A MET 204.A N ALA 200.A O no hydrogen 2.597 N/A ALA 205.A N ALA 201.A O no hydrogen 2.633 N/A SER 206.A N ILE 202.A O no hydrogen 2.579 N/A SER 206.A OG ILE 202.A O no hydrogen 2.915 N/A SER 206.A OG TYR 203.A O no hydrogen 2.559 N/A GLN 207.A N TYR 203.A O no hydrogen 2.610 N/A GLN 207.A NE2 ARG 213.A O no hydrogen 3.607 N/A ALA 208.A N ALA 205.A O no hydrogen 2.758 N/A SER 209.A N SER 206.A O no hydrogen 3.136 N/A SER 209.A OG ALA 205.A O no hydrogen 3.470 N/A LYS 212.A NZ GLN 207.A O no hydrogen 3.429 N/A LYS 212.A NZ SER 209.A O no hydrogen 2.897 N/A LYS 212.A NZ THR 252.A OG1 no hydrogen 2.561 N/A ARG 213.A NH1 LYS 212.A O no hydrogen 2.374 N/A THR 214.A N GLU 217.A OE1 no hydrogen 3.186 N/A ILE 218.A N THR 214.A O no hydrogen 3.133 N/A GLY 219.A N GLN 215.A O no hydrogen 2.449 N/A ASP 220.A N LYS 216.A O no hydrogen 2.625 N/A ILE 221.A N GLU 217.A O no hydrogen 2.936 N/A ALA 222.A N ILE 218.A O no hydrogen 2.778 N/A GLY 223.A N GLY 219.A O no hydrogen 2.579 N/A ILE 229.A N ALA 225.A O no hydrogen 3.170 N/A ARG 230.A N ASP 226.A O no hydrogen 3.090 N/A ARG 230.A NH2 ASP 226.A OD2 no hydrogen 3.481 N/A GLN 231.A N VAL 227.A O no hydrogen 2.604 N/A SER 232.A N THR 228.A O no hydrogen 2.843 N/A SER 232.A OG THR 228.A O no hydrogen 2.586 N/A TYR 233.A N ILE 229.A O no hydrogen 2.535 N/A TYR 233.A OH PRO 258.A O no hydrogen 2.168 N/A ARG 234.A N ARG 230.A O no hydrogen 3.083 N/A ARG 234.A NH2 GLN 231.A OE1 no hydrogen 2.832 N/A LEU 235.A N GLN 231.A O no hydrogen 3.040 N/A LEU 235.A N SER 232.A O no hydrogen 3.166 N/A ILE 236.A N SER 232.A O no hydrogen 3.070 N/A ILE 236.A N TYR 233.A O no hydrogen 3.132 N/A TYR 237.A N TYR 233.A O no hydrogen 2.687 N/A TYR 237.A OH LEU 257.A O no hydrogen 3.270 N/A ARG 239.A N ILE 236.A O no hydrogen 2.998 N/A ALA 240.A N TYR 237.A O no hydrogen 3.044 N/A LEU 243.A N ARG 239.A O no hydrogen 2.856 N/A ASP 251.A N ALA 208.A O no hydrogen 3.066 N/A THR 252.A OG1 ASP 251.A OD2 no hydrogen 3.479 N/A LYS 256.A N PRO 253.A O no hydrogen 2.681 N/A LYS 256.A NZ ASP 255.A OD1 no hydrogen 3.447 N/A LEU 257.A N VAL 254.A O no hydrogen 3.117 N/A GLN 259.A NE2 TYR 237.A OH no hydrogen 3.006 N/A