Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ngg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 3.A N PHE 71.A O no hydrogen 3.033 N/A TYR 4.A N THR 41.A O no hydrogen 2.841 N/A LEU 5.A N ALA 68.A O no hydrogen 2.823 N/A TYR 6.A N ILE 39.A O no hydrogen 2.781 N/A VAL 7.A N GLU 65.A O no hydrogen 2.735 N/A ILE 8.A N PHE 37.A O no hydrogen 3.089 N/A GLY 9.A N SER 63.A O no hydrogen 2.668 N/A VAL 11.A N THR 61.A O no hydrogen 3.083 N/A LEU 12.A N GLU 31.A OE1 no hydrogen 2.977 N/A THR 13.A N GLU 59.A O no hydrogen 2.857 N/A THR 13.A OG1 GLU 59.A O no hydrogen 3.267 N/A THR 13.A OG1 GLU 59.A OE2 no hydrogen 3.499 N/A THR 13.A OG1 THR 61.A OG1 no hydrogen 2.635 N/A THR 14.A N GLU 59.A O no hydrogen 3.094 N/A THR 14.A OG1 GLU 59.A OE2 no hydrogen 3.197 N/A LEU 16.A N SER 57.A O no hydrogen 2.968 N/A GLU 19.A N GLU 19.A OE1 no hydrogen 2.664 N/A LEU 20.A N PRO 17.A O no hydrogen 2.890 N/A ASN 21.A N ASP 18.A O no hydrogen 3.387 N/A ASN 21.A ND2 ARG 25.A O no hydrogen 2.541 N/A ARG 24.A N ASN 21.A O no hydrogen 2.827 N/A ARG 24.A NH1 ASP 18.A O no hydrogen 2.697 N/A ARG 24.A NH2 ASP 18.A O no hydrogen 2.975 N/A ARG 25.A N ASN 21.A OD1 no hydrogen 2.881 N/A ARG 25.A NE ASP 211.A OD2 no hydrogen 2.638 N/A ARG 25.A NH2 ASP 211.A OD1 no hydrogen 3.391 N/A TYR 28.A N SER 57.A OG no hydrogen 2.677 N/A GLU 31.A N GLU 31.A OE1 no hydrogen 2.926 N/A ASP 32.A N PRO 29.A O no hydrogen 3.225 N/A THR 33.A N PRO 30.A O no hydrogen 3.218 N/A THR 33.A OG1 PRO 30.A O no hydrogen 3.415 N/A THR 34.A OG1 ASN 103.A OD1 no hydrogen 2.672 N/A ARG 35.A NE ASP 113.A OD2 no hydrogen 2.973 N/A CYS 36.A N LEU 102.A O no hydrogen 2.990 N/A CYS 36.A SG THR 34.A O no hydrogen 3.710 N/A GLY 38.A N LEU 100.A O no hydrogen 2.726 N/A ILE 39.A N TYR 6.A O no hydrogen 2.838 N/A LEU 40.A N CYS 98.A O no hydrogen 2.759 N/A THR 41.A N TYR 4.A O no hydrogen 2.989 N/A THR 41.A OG1 LYS 43.A O no hydrogen 2.456 N/A LYS 43.A NZ TYR 97.A OH no hydrogen 2.786 N/A ILE 45.A N TYR 6.A OH no hydrogen 2.900 N/A PHE 51.A N ILE 62.A O no hydrogen 3.071 N/A VAL 53.A N VAL 60.A O no hydrogen 2.979 N/A TYR 54.A N LEU 219.A O no hydrogen 2.735 N/A THR 55.A N GLY 58.A O no hydrogen 2.996 N/A THR 55.A OG1 GLY 58.A O no hydrogen 3.021 N/A ARG 56.A NH1 HIS 212.A O no hydrogen 3.248 N/A ARG 56.A NH2 HIS 212.A O no hydrogen 2.760 N/A SER 57.A N THR 55.A OG1 no hydrogen 3.162 N/A SER 57.A OG TYR 28.A O no hydrogen 3.505 N/A GLY 58.A N THR 55.A O no hydrogen 2.983 N/A GLU 59.A N THR 14.A O no hydrogen 2.720 N/A VAL 60.A N VAL 53.A O no hydrogen 2.973 N/A THR 61.A N VAL 11.A O no hydrogen 2.655 N/A THR 61.A OG1 THR 13.A OG1 no hydrogen 2.635 N/A ILE 62.A N PHE 51.A O no hydrogen 2.694 N/A SER 63.A N GLY 9.A O no hydrogen 2.935 N/A GLU 65.A N VAL 7.A O no hydrogen 3.129 N/A ALA 67.A N LEU 5.A O no hydrogen 2.843 N/A ALA 68.A N LEU 5.A O no hydrogen 3.443 N/A GLY 70.A N CYS 3.A O no hydrogen 3.093 N/A MET 77.A N SER 74.A OG no hydrogen 3.054 N/A LEU 78.A N SER 74.A O no hydrogen 3.078 N/A GLU 79.A N LEU 75.A O no hydrogen 2.892 N/A LEU 80.A N GLN 76.A O no hydrogen 2.970 N/A ILE 81.A N MET 77.A O no hydrogen 2.881 N/A THR 82.A N LEU 78.A O no hydrogen 2.839 N/A THR 82.A OG1 LEU 78.A O no hydrogen 2.896 N/A ARG 83.A N GLU 79.A O no hydrogen 2.979 N/A ARG 83.A NE GLU 121.A OE2 no hydrogen 2.619 N/A ARG 83.A NH2 GLU 121.A OE1 no hydrogen 3.504 N/A ARG 83.A NH2 GLU 121.A OE2 no hydrogen 3.125 N/A LEU 84.A N LEU 80.A O no hydrogen 3.153 N/A LEU 84.A N ILE 81.A O no hydrogen 3.127 N/A HIS 85.A N ILE 81.A O no hydrogen 2.999 N/A GLN 86.A N THR 82.A O no hydrogen 3.274 N/A TYR 87.A N ARG 83.A O no hydrogen 2.908 N/A TYR 87.A OH GLU 124.A OE1 no hydrogen 3.327 N/A ILE 88.A N LEU 84.A O no hydrogen 2.916 N/A PHE 89.A N HIS 85.A O no hydrogen 3.136 N/A SER 90.A N GLN 86.A O no hydrogen 2.751 N/A HIS 91.A N TYR 87.A O no hydrogen 2.765 N/A ILE 92.A N TYR 87.A O no hydrogen 3.101 N/A LEU 93.A N ILE 88.A O no hydrogen 2.996 N/A ARG 94.A NH1 PRO 162.A O no hydrogen 3.497 N/A ARG 94.A NH2 PRO 162.A O no hydrogen 2.603 N/A LEU 95.A N PHE 89.A O no hydrogen 2.726 N/A CYS 98.A N LEU 40.A O no hydrogen 3.095 N/A VAL 99.A N HIS 85.A ND1 no hydrogen 3.004 N/A LEU 100.A N GLY 38.A O no hydrogen 3.064 N/A LEU 102.A N CYS 36.A O no hydrogen 2.799 N/A ASN 103.A N ASP 111.A O no hydrogen 2.946 N/A ASN 103.A ND2 ASP 113.A OD2 no hydrogen 3.238 N/A VAL 104.A N ASN 103.A OD1 no hydrogen 2.834 N/A VAL 105.A N THR 109.A O no hydrogen 3.071 N/A ASP 111.A N ASN 103.A O no hydrogen 2.821 N/A ASP 113.A N PRO 101.A O no hydrogen 2.840 N/A PHE 114.A N ILE 112.A O no hydrogen 2.964 N/A LYS 115.A NZ ASP 119.A OD2 no hydrogen 3.108 N/A PHE 116.A N ASP 113.A OD1 no hydrogen 3.018 N/A MET 117.A N ASP 113.A O no hydrogen 3.398 N/A GLU 118.A N PHE 114.A O no hydrogen 2.957 N/A ASP 119.A N LYS 115.A O no hydrogen 2.827 N/A ILE 120.A N PHE 116.A O no hydrogen 2.892 N/A GLU 121.A N MET 117.A O no hydrogen 3.174 N/A LYS 122.A N GLU 118.A O no hydrogen 2.854 N/A SER 123.A N ASP 119.A O no hydrogen 2.849 N/A GLU 124.A N ILE 120.A O no hydrogen 2.825 N/A ALA 125.A N GLU 121.A O no hydrogen 2.664 N/A ARG 126.A N SER 123.A O no hydrogen 3.017 N/A ILE 127.A N LYS 122.A O no hydrogen 2.676 N/A LYS 133.A N SER 131.A OG no hydrogen 2.888 N/A THR 135.A N THR 138.A O no hydrogen 3.276 N/A THR 135.A OG1 GLU 137.A OE1 no hydrogen 3.025 N/A THR 135.A OG1 THR 138.A OG1 no hydrogen 3.383 N/A GLU 137.A N THR 135.A OG1 no hydrogen 3.209 N/A THR 138.A N THR 135.A OG1 no hydrogen 3.054 N/A THR 138.A OG1 LYS 133.A O no hydrogen 3.398 N/A THR 138.A OG1 THR 135.A OG1 no hydrogen 3.383 N/A THR 138.A OG1 THR 138.A O no hydrogen 2.407 N/A PHE 140.A N THR 201.A OG1 no hydrogen 2.980 N/A ASP 146.A N LYS 143.A O no hydrogen 2.989 N/A TYR 147.A N LEU 144.A O no hydrogen 2.956 N/A ILE 152.A N PHE 165.A O no hydrogen 2.709 N/A ILE 153.A N ALA 243.A O no hydrogen 2.997 N/A ARG 155.A N LEU 241.A O no hydrogen 3.312 N/A ARG 157.A NH1 ASN 158.A OD1 no hydrogen 3.074 N/A ARG 157.A NH1 HIS 163.A ND1 no hydrogen 3.392 N/A GLN 161.A N ASP 160.A OD1 no hydrogen 3.172 N/A ARG 164.A NH1 ILE 92.A O no hydrogen 3.373 N/A ARG 164.A NH2 ILE 92.A O no hydrogen 3.472 N/A PHE 165.A N ILE 152.A O no hydrogen 2.827 N/A TYR 166.A N ASP 211.A O no hydrogen 2.830 N/A VAL 167.A N ALA 150.A O no hydrogen 3.371 N/A ALA 168.A N ASP 209.A O no hydrogen 2.718 N/A ASP 169.A N ASP 209.A O no hydrogen 3.135 N/A TYR 171.A N LEU 207.A O no hydrogen 2.831 N/A LEU 174.A N TYR 171.A O no hydrogen 3.086 N/A THR 175.A N SER 178.A OG no hydrogen 2.856 N/A THR 175.A OG1 LEU 203.A O no hydrogen 3.449 N/A LEU 177.A N THR 175.A OG1 no hydrogen 3.048 N/A SER 178.A N THR 175.A O no hydrogen 2.731 N/A SER 178.A OG THR 175.A O no hydrogen 2.971 N/A PHE 180.A N GLU 186.A O no hydrogen 3.162 N/A GLU 184.A N GLU 184.A OE1 no hydrogen 2.436 N/A TYR 185.A N SER 182.A O no hydrogen 3.212 N/A GLU 186.A N GLU 190.A OE1 no hydrogen 2.503 N/A ALA 189.A N PRO 176.A O no hydrogen 3.032 N/A GLU 190.A N THR 187.A OG1 no hydrogen 3.022 N/A TYR 191.A N THR 187.A O no hydrogen 2.980 N/A TYR 192.A N PHE 188.A O no hydrogen 3.029 N/A LYS 193.A N ALA 189.A O no hydrogen 3.078 N/A LYS 193.A NZ ASN 197.A OD1 no hydrogen 2.677 N/A LYS 193.A NZ ASP 199.A OD1 no hydrogen 3.224 N/A THR 194.A N GLU 190.A O no hydrogen 2.785 N/A THR 194.A OG1 GLU 190.A O no hydrogen 2.922 N/A LYS 195.A N TYR 191.A O no hydrogen 2.578 N/A TYR 196.A N TYR 192.A O no hydrogen 2.968 N/A ASN 197.A N LYS 193.A O no hydrogen 2.822 N/A LEU 198.A N TYR 192.A O no hydrogen 2.992 N/A THR 201.A N GLU 240.A OE1 no hydrogen 3.231 N/A THR 201.A N GLU 240.A OE2 no hydrogen 2.986 N/A THR 201.A OG1 GLU 240.A OE2 no hydrogen 2.989 N/A ASN 202.A N GLU 240.A OE1 no hydrogen 3.345 N/A ASN 202.A ND2 PHE 140.A O no hydrogen 2.999 N/A ASN 204.A N ASN 202.A OD1 no hydrogen 3.042 N/A GLN 205.A NE2 ASN 202.A O no hydrogen 2.530 N/A GLN 205.A NE2 GLU 240.A OE1 no hydrogen 3.024 N/A LEU 208.A N LEU 237.A O no hydrogen 2.864 N/A ASP 209.A N ASP 169.A O no hydrogen 2.726 N/A ASP 211.A N TYR 166.A O no hydrogen 3.043 N/A HIS 212.A N ASN 233.A OD1 no hydrogen 3.368 N/A HIS 212.A ND1 ASN 233.A OD1 no hydrogen 3.136 N/A THR 213.A N ARG 164.A O no hydrogen 3.066 N/A THR 213.A OG1 ARG 164.A O no hydrogen 3.431 N/A ARG 216.A NH2 THR 221.A O no hydrogen 3.522 N/A LEU 219.A N SER 260.A OG no hydrogen 2.829 N/A LEU 220.A N ASN 218.A OD1 no hydrogen 3.075 N/A TRP 228.A N ARG 224.A O no hydrogen 3.127 N/A GLU 229.A N LYS 225.A O no hydrogen 3.243 N/A SER 230.A N ALA 226.A O no hydrogen 3.352 N/A LEU 231.A N LYS 227.A O no hydrogen 3.121 N/A GLN 232.A N TRP 228.A O no hydrogen 2.745 N/A ASN 233.A ND2 ASP 211.A OD1 no hydrogen 2.716 N/A LYS 234.A N LEU 231.A O no hydrogen 2.827 N/A GLN 235.A NE2 GLN 232.A O no hydrogen 3.020 N/A LEU 237.A N LEU 208.A O no hydrogen 2.987 N/A GLU 240.A N GLN 205.A OE1 no hydrogen 3.222 N/A LEU 241.A N VAL 238.A O no hydrogen 2.925 N/A CYS 242.A N PRO 239.A O no hydrogen 2.891 N/A CYS 242.A SG VAL 238.A O no hydrogen 3.501 N/A ALA 243.A N ILE 153.A O no hydrogen 2.982 N/A HIS 245.A N VAL 151.A O no hydrogen 2.978 N/A ILE 247.A N HIS 245.A ND1 no hydrogen 2.945 N/A ALA 249.A N ASP 149.A O no hydrogen 2.712 N/A SER 250.A N ASP 149.A OD1 no hydrogen 2.547 N/A SER 250.A OG ASP 149.A OD2 no hydrogen 2.873 N/A LEU 251.A N PRO 248.A O no hydrogen 3.255 N/A TRP 252.A N PRO 248.A O no hydrogen 3.023 N/A ARG 253.A N ALA 249.A O no hydrogen 2.932 N/A LYS 254.A NZ PRO 30.A O no hydrogen 3.018 N/A LYS 254.A NZ THR 33.A O no hydrogen 2.904 N/A LYS 254.A NZ THR 33.A OG1 no hydrogen 3.073 N/A LYS 254.A NZ ARG 35.A O no hydrogen 2.761 N/A ALA 255.A N LEU 251.A O no hydrogen 2.890 N/A VAL 256.A N TRP 252.A O no hydrogen 3.220 N/A CYS 257.A N LYS 254.A O no hydrogen 3.070 N/A CYS 257.A SG ARG 253.A O no hydrogen 3.722 N/A LEU 258.A N ALA 255.A O no hydrogen 2.944 N/A SER 260.A OG LEU 217.A O no hydrogen 3.155 N/A ILE 261.A N CYS 257.A O no hydrogen 3.107 N/A LEU 262.A N LEU 258.A O no hydrogen 2.802 N/A TYR 263.A N PRO 259.A O no hydrogen 2.861 N/A ARG 264.A N SER 260.A O no hydrogen 2.895 N/A LEU 265.A N ILE 261.A O no hydrogen 3.038 N/A HIS 266.A N LEU 262.A O no hydrogen 2.997 N/A CYS 267.A N ARG 264.A O no hydrogen 2.875 N/A CYS 267.A SG LEU 265.A O no hydrogen 3.742 N/A