Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4d58_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 3.A N ASP 1.A OD1 no hydrogen 2.947 N/A ILE 4.A N VAL 76.A O no hydrogen 2.839 N/A ARG 6.A NH1 PRO 81.A O no hydrogen 2.757 N/A ARG 6.A NH2 GLU 79.A O no hydrogen 2.931 N/A ARG 6.A NH2 PRO 81.A O no hydrogen 2.981 N/A GLU 7.A N GLU 7.A OE1 no hydrogen 2.844 N/A ARG 8.A N GLN 5.A O no hydrogen 2.979 N/A ILE 9.A N ARG 6.A O no hydrogen 2.982 N/A GLU 10.A N ILE 27.A O no hydrogen 2.751 N/A GLY 12.A N GLN 25.A O no hydrogen 2.804 N/A CYS 14.A SG GLY 16.A O no hydrogen 3.469 N/A CYS 14.A SG VAL 23.A O no hydrogen 3.661 N/A ILE 15.A N VAL 23.A O no hydrogen 2.716 N/A GLY 16.A N VAL 23.A O no hydrogen 3.113 N/A VAL 23.A N GLY 16.A O no hydrogen 2.810 N/A HIS 24.A N ILE 40.A O no hydrogen 2.895 N/A HIS 24.A ND1 GLY 12.A O no hydrogen 2.953 N/A GLN 25.A N ARG 13.A O no hydrogen 2.865 N/A GLY 26.A N VAL 38.A O no hydrogen 2.902 N/A ILE 27.A N GLU 10.A O no hydrogen 2.917 N/A TYR 28.A N MET 36.A O no hydrogen 2.835 N/A MET 29.A N ARG 8.A O no hydrogen 2.777 N/A SER 30.A N ASN 33.A O no hydrogen 2.922 N/A SER 30.A OG ASN 33.A O no hydrogen 2.678 N/A ASN 33.A N SER 30.A O no hydrogen 3.145 N/A ALA 35.A N ASN 33.A OD1 no hydrogen 2.962 N/A MET 36.A N TYR 28.A O no hydrogen 2.908 N/A VAL 38.A N GLY 26.A O no hydrogen 3.056 N/A ALA 39.A N MET 86.A O no hydrogen 2.827 N/A ILE 40.A N HIS 24.A O no hydrogen 2.731 N/A LYS 41.A N ILE 84.A O no hydrogen 2.783 N/A LYS 41.A NZ GLU 58.A OE1 no hydrogen 2.717 N/A LYS 41.A NZ ASP 151.A OD2 no hydrogen 3.253 N/A THR 42.A N ASP 22.A O no hydrogen 3.100 N/A THR 42.A OG1 ASP 22.A O no hydrogen 2.648 N/A CYS 43.A SG LYS 44.A O no hydrogen 3.730 N/A LYS 44.A N PHE 20.A O no hydrogen 2.948 N/A SER 48.A N ASN 45.A O no hydrogen 2.905 N/A ARG 52.A N SER 48.A O no hydrogen 2.951 N/A GLU 53.A N ASP 49.A O no hydrogen 3.089 N/A LYS 54.A N SER 50.A O no hydrogen 3.447 N/A LYS 54.A NZ SER 50.A O no hydrogen 3.500 N/A PHE 55.A N VAL 51.A O no hydrogen 3.003 N/A LEU 56.A N ARG 52.A O no hydrogen 2.850 N/A GLN 57.A N GLU 53.A O no hydrogen 2.989 N/A GLN 57.A NE2 THR 61.A OG1 no hydrogen 3.361 N/A GLU 58.A N PHE 55.A O no hydrogen 3.214 N/A ALA 59.A N LEU 56.A O no hydrogen 3.052 N/A LEU 60.A N LEU 56.A O no hydrogen 3.327 N/A THR 61.A N GLN 57.A O no hydrogen 2.932 N/A THR 61.A OG1 GLN 57.A O no hydrogen 3.123 N/A MET 62.A N GLU 58.A O no hydrogen 2.832 N/A ARG 63.A N ALA 59.A O no hydrogen 3.026 N/A GLN 64.A N THR 61.A O no hydrogen 3.118 N/A PHE 65.A N MET 62.A O no hydrogen 3.178 N/A ASP 66.A N TYR 123.A OH no hydrogen 2.988 N/A HIS 69.A N HIS 67.A ND1 no hydrogen 3.016 N/A HIS 69.A ND1 VAL 147.A O no hydrogen 2.933 N/A ILE 70.A N HIS 67.A O no hydrogen 3.271 N/A VAL 71.A N LEU 149.A O no hydrogen 3.046 N/A LYS 72.A N GLU 87.A OE1 no hydrogen 3.005 N/A LYS 72.A NZ HIS 67.A O no hydrogen 3.398 N/A ILE 74.A N ILE 85.A O no hydrogen 2.845 N/A GLY 75.A N ILE 85.A O no hydrogen 2.948 N/A VAL 76.A N TYR 2.A O no hydrogen 2.783 N/A ILE 77.A N TRP 83.A O no hydrogen 2.869 N/A THR 78.A N GLU 3.A OE2 no hydrogen 3.017 N/A THR 78.A OG1 GLU 3.A OE1 no hydrogen 2.583 N/A THR 78.A OG1 GLU 3.A OE2 no hydrogen 3.161 N/A ASN 80.A ND2 CYS 46.A O no hydrogen 3.281 N/A TRP 83.A N ILE 77.A O no hydrogen 3.061 N/A ILE 84.A N LYS 41.A O no hydrogen 2.995 N/A ILE 85.A N GLY 75.A O no hydrogen 2.685 N/A MET 86.A N ALA 39.A O no hydrogen 2.837 N/A GLU 87.A N LYS 72.A O no hydrogen 3.023 N/A LEU 91.A N VAL 141.A O no hydrogen 2.935 N/A GLY 92.A N CYS 89.A O no hydrogen 3.055 N/A LEU 94.A N VAL 139.A O no hydrogen 2.858 N/A ARG 95.A NE GLY 188.A O no hydrogen 3.144 N/A ARG 95.A NH2 GLY 188.A O no hydrogen 2.713 N/A PHE 97.A N GLU 93.A O no hydrogen 3.199 N/A LEU 98.A N LEU 94.A O no hydrogen 2.858 N/A GLN 99.A N ARG 95.A O no hydrogen 3.022 N/A VAL 100.A N SER 96.A O no hydrogen 2.871 N/A ARG 101.A N PHE 97.A O no hydrogen 3.002 N/A SER 104.A N ARG 101.A O no hydrogen 2.966 N/A LEU 105.A N ARG 101.A O no hydrogen 2.941 N/A SER 109.A N ASP 106.A O no hydrogen 3.092 N/A SER 109.A N ASP 106.A OD1 no hydrogen 3.361 N/A SER 109.A OG ASP 106.A OD1 no hydrogen 2.889 N/A LEU 110.A N ASP 106.A O no hydrogen 3.417 N/A ILE 111.A N LEU 107.A O no hydrogen 3.000 N/A LEU 112.A N ALA 108.A O no hydrogen 2.912 N/A TYR 113.A N SER 109.A O no hydrogen 3.018 N/A TYR 113.A OH THR 144.A O no hydrogen 2.560 N/A ALA 114.A N LEU 110.A O no hydrogen 3.150 N/A TYR 115.A N ILE 111.A O no hydrogen 2.930 N/A GLN 116.A N LEU 112.A O no hydrogen 2.760 N/A GLN 116.A NE2 ASP 145.A O no hydrogen 2.796 N/A LEU 117.A N TYR 113.A O no hydrogen 3.032 N/A SER 118.A N ALA 114.A O no hydrogen 2.931 N/A SER 118.A OG TYR 115.A O no hydrogen 2.686 N/A THR 119.A N TYR 115.A O no hydrogen 2.966 N/A THR 119.A OG1 TYR 115.A O no hydrogen 3.441 N/A ALA 120.A N GLN 116.A O no hydrogen 3.201 N/A LEU 121.A N LEU 117.A O no hydrogen 2.902 N/A ALA 122.A N SER 118.A O no hydrogen 2.804 N/A TYR 123.A N THR 119.A O no hydrogen 3.187 N/A LEU 124.A N ALA 120.A O no hydrogen 2.949 N/A GLU 125.A N LEU 121.A O no hydrogen 2.810 N/A SER 126.A N ALA 122.A O no hydrogen 2.853 N/A SER 126.A OG TYR 123.A O no hydrogen 2.538 N/A LYS 127.A N TYR 123.A O no hydrogen 3.249 N/A LYS 127.A N LEU 124.A O no hydrogen 3.051 N/A ARG 128.A N GLU 125.A O no hydrogen 2.953 N/A PHE 129.A N LEU 124.A O no hydrogen 2.984 N/A HIS 131.A N ASP 173.A OD2 no hydrogen 2.789 N/A ARG 132.A N ASP 173.A OD1 no hydrogen 2.871 N/A ALA 136.A N GLU 183.A OE1 no hydrogen 2.887 N/A ARG 137.A NH2 ASP 133.A OD1 no hydrogen 2.693 N/A ASN 138.A N ALA 135.A O no hydrogen 3.052 N/A ASN 138.A ND2 ASP 133.A O no hydrogen 2.683 N/A VAL 139.A N ALA 136.A O no hydrogen 3.103 N/A LEU 140.A N LYS 148.A O no hydrogen 2.845 N/A VAL 141.A N GLY 92.A O no hydrogen 2.754 N/A SER 142.A N CYS 146.A O no hydrogen 2.825 N/A ALA 143.A N CYS 146.A O no hydrogen 3.088 N/A CYS 146.A N ALA 143.A O no hydrogen 2.900 N/A CYS 146.A SG HIS 69.A ND1 no hydrogen 3.865 N/A CYS 146.A SG VAL 147.A O no hydrogen 4.027 N/A VAL 147.A N GLN 116.A OE1 no hydrogen 2.952 N/A LYS 148.A N LEU 140.A O no hydrogen 2.830 N/A LYS 148.A NZ GLU 87.A OE1 no hydrogen 3.559 N/A LYS 148.A NZ GLU 87.A OE2 no hydrogen 2.622 N/A LEU 149.A N HIS 69.A O no hydrogen 2.821 N/A GLY 150.A N ASN 138.A O no hydrogen 2.804 N/A ILE 155.A N LEU 153.A O no hydrogen 2.810 N/A LYS 156.A NZ PHE 192.A O no hydrogen 2.617 N/A LYS 156.A NZ VAL 195.A O no hydrogen 2.549 N/A TRP 157.A N PRO 154.A O no hydrogen 2.911 N/A TRP 157.A NE1 GLU 183.A OE1 no hydrogen 2.779 N/A MET 158.A N ILE 155.A O no hydrogen 3.120 N/A GLU 161.A N GLU 161.A OE1 no hydrogen 2.818 N/A SER 162.A N ALA 159.A O no hydrogen 3.025 N/A SER 162.A OG ARG 167.A O no hydrogen 2.689 N/A ILE 163.A N ALA 159.A O no hydrogen 3.251 N/A ASN 164.A N PRO 160.A O no hydrogen 2.925 N/A ASN 164.A ND2 GLU 205.A OE2 no hydrogen 3.227 N/A PHE 165.A N GLU 161.A O no hydrogen 3.037 N/A ARG 167.A N GLU 161.A O no hydrogen 3.373 N/A THR 169.A N SER 172.A OG no hydrogen 2.787 N/A SER 172.A N THR 169.A OG1 no hydrogen 3.123 N/A SER 172.A OG THR 169.A O no hydrogen 2.911 N/A ASP 173.A N THR 169.A O no hydrogen 3.023 N/A VAL 174.A N SER 170.A O no hydrogen 3.139 N/A TRP 175.A N ALA 171.A O no hydrogen 3.254 N/A MET 176.A N SER 172.A O no hydrogen 3.063 N/A PHE 177.A N ASP 173.A O no hydrogen 2.817 N/A GLY 178.A N VAL 174.A O no hydrogen 2.893 N/A VAL 179.A N TRP 175.A O no hydrogen 3.212 N/A CYS 180.A N MET 176.A O no hydrogen 2.941 N/A MET 181.A N PHE 177.A O no hydrogen 2.894 N/A TRP 182.A N GLY 178.A O no hydrogen 3.102 N/A TRP 182.A NE1 PRO 211.A O no hydrogen 2.790 N/A GLU 183.A N VAL 179.A O no hydrogen 2.908 N/A ILE 184.A N CYS 180.A O no hydrogen 3.002 N/A LEU 185.A N MET 181.A O no hydrogen 3.028 N/A MET 186.A N TRP 182.A O no hydrogen 2.895 N/A HIS 187.A N ILE 184.A O no hydrogen 2.923 N/A GLY 188.A N GLU 183.A O no hydrogen 2.868 N/A VAL 195.A N PHE 192.A O no hydrogen 3.223 N/A ASP 199.A N LYS 196.A O no hydrogen 3.066 N/A VAL 200.A N ASN 197.A O no hydrogen 3.147 N/A ARG 203.A N ASP 199.A O no hydrogen 3.449 N/A ILE 204.A N VAL 200.A O no hydrogen 3.117 N/A GLU 205.A N ILE 201.A O no hydrogen 2.887 N/A ASN 206.A N GLY 202.A O no hydrogen 2.969 N/A GLY 207.A N ILE 204.A O no hydrogen 2.812 N/A GLU 208.A N ARG 203.A O no hydrogen 2.908 N/A ARG 209.A NE TRP 228.A O no hydrogen 3.019 N/A ARG 209.A NH1 ILE 204.A O no hydrogen 3.063 N/A ARG 209.A NH1 GLU 208.A O no hydrogen 2.943 N/A ARG 209.A NH2 TRP 228.A O no hydrogen 3.079 N/A CYS 216.A N PRO 213.A O no hydrogen 3.258 N/A CYS 216.A SG PRO 217.A O no hydrogen 3.620 N/A LEU 220.A N PRO 217.A O no hydrogen 2.894 N/A TYR 221.A N PRO 217.A O no hydrogen 3.183 N/A TYR 221.A OH LEU 210.A O no hydrogen 2.490 N/A SER 222.A N PRO 218.A O no hydrogen 3.031 N/A LEU 223.A N THR 219.A O no hydrogen 3.155 N/A MET 224.A N LEU 220.A O no hydrogen 2.964 N/A THR 225.A N TYR 221.A O no hydrogen 2.829 N/A THR 225.A OG1 TYR 221.A O no hydrogen 3.310 N/A THR 225.A OG1 SER 222.A O no hydrogen 2.600 N/A LYS 226.A N SER 222.A O no hydrogen 3.068 N/A CYS 227.A N LEU 223.A O no hydrogen 3.162 N/A CYS 227.A SG LEU 223.A O no hydrogen 3.444 N/A TRP 228.A N MET 224.A O no hydrogen 3.182 N/A TRP 228.A N THR 225.A O no hydrogen 3.098 N/A ALA 229.A N LYS 226.A O no hydrogen 3.425 N/A TYR 230.A OH GLU 205.A OE2 no hydrogen 2.627 N/A SER 233.A N ASP 231.A OD1 no hydrogen 2.930 N/A SER 233.A OG ASP 231.A OD1 no hydrogen 2.880 N/A SER 233.A OG ASP 231.A OD2 no hydrogen 3.076 N/A ARG 234.A N ASP 231.A O no hydrogen 2.916 N/A ARG 235.A N PRO 232.A O no hydrogen 3.109 N/A ARG 235.A NE ALA 229.A O no hydrogen 2.776 N/A ARG 235.A NH1 GLU 161.A OE2 no hydrogen 2.739 N/A ARG 235.A NH1 ALA 171.A O no hydrogen 2.976 N/A ARG 235.A NH2 GLU 161.A OE1 no hydrogen 2.832 N/A ARG 235.A NH2 GLU 161.A OE2 no hydrogen 3.549 N/A ARG 235.A NH2 ALA 229.A O no hydrogen 3.265 N/A ARG 237.A NH1 GLU 125.A OE2 no hydrogen 3.438 N/A PHE 238.A N GLU 125.A OE2 no hydrogen 3.493 N/A LEU 241.A N ARG 237.A O no hydrogen 3.212 N/A LYS 242.A N PHE 238.A O no hydrogen 2.812 N/A ALA 243.A N THR 239.A O no hydrogen 3.101 N/A GLN 244.A N GLU 240.A O no hydrogen 2.876 N/A LEU 245.A N LEU 241.A O no hydrogen 2.789 N/A SER 246.A N LYS 242.A O no hydrogen 2.987 N/A THR 247.A N ALA 243.A O no hydrogen 3.195 N/A THR 247.A OG1 ALA 243.A O no hydrogen 3.309 N/A ILE 248.A N GLN 244.A O no hydrogen 2.913 N/A LEU 249.A N LEU 245.A O no hydrogen 2.856 N/A GLU 250.A N SER 246.A O no hydrogen 3.064 N/A GLU 251.A N THR 247.A O no hydrogen 3.039 N/A GLU 252.A N ILE 248.A O no hydrogen 2.996 N/A LYS 253.A N LEU 249.A O no hydrogen 2.860 N/A LYS 253.A NZ GLU 250.A OE2 no hydrogen 3.154 N/A LEU 254.A N GLU 250.A O no hydrogen 2.806 N/A GLN 255.A N GLU 251.A O no hydrogen 3.358 N/A