Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4r1y_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N LEU 1.A O no hydrogen 2.812 N/A HIS 7.A N ALA 4.A O no hydrogen 3.222 N/A VAL 8.A N VAL 5.A O no hydrogen 2.634 N/A ILE 10.A N ILE 70.A O no hydrogen 2.868 N/A SER 14.A N GLY 11.A O no hydrogen 3.008 N/A ILE 16.A N THR 35.A O no hydrogen 2.927 N/A HIS 18.A N HIS 33.A O no hydrogen 2.908 N/A GLU 21.A N HIS 18.A O no hydrogen 2.955 N/A ILE 23.A N VAL 31.A O no hydrogen 2.848 N/A GLY 26.A N GLY 29.A O no hydrogen 2.854 N/A HIS 27.A N MET 150.A O no hydrogen 3.203 N/A PHE 28.A N ASP 149.A OD1 no hydrogen 2.932 N/A PHE 28.A N ASP 149.A OD2 no hydrogen 3.212 N/A GLY 29.A N GLY 26.A O no hydrogen 3.326 N/A VAL 31.A N GLY 24.A O no hydrogen 2.976 N/A TYR 32.A N VAL 42.A O no hydrogen 2.741 N/A HIS 33.A N GLU 21.A O no hydrogen 3.050 N/A GLY 34.A N CYS 40.A O no hydrogen 2.908 N/A THR 35.A N ILE 16.A O no hydrogen 2.684 N/A LEU 36.A N ILE 38.A O no hydrogen 2.863 N/A LEU 37.A N SER 14.A O no hydrogen 2.601 N/A CYS 40.A N GLY 34.A O no hydrogen 3.122 N/A ALA 41.A N LEU 78.A O no hydrogen 2.857 N/A VAL 42.A N TYR 32.A O no hydrogen 2.735 N/A LYS 43.A N VAL 76.A O no hydrogen 2.736 N/A LYS 43.A NZ SER 44.A O no hydrogen 3.509 N/A LYS 43.A NZ ASP 149.A OD1 no hydrogen 2.791 N/A SER 44.A N CYS 30.A O no hydrogen 2.820 N/A ASN 46.A ND2 PHE 28.A O no hydrogen 3.052 N/A ASN 46.A ND2 SER 44.A OG no hydrogen 3.240 N/A THR 51.A N SER 47.A O no hydrogen 2.955 N/A GLU 52.A N GLN 48.A O no hydrogen 3.139 N/A GLY 53.A N LEU 50.A O no hydrogen 3.193 N/A MET 56.A N GLY 53.A O no hydrogen 3.275 N/A LYS 57.A N ILE 54.A O no hydrogen 3.145 N/A ASP 58.A N ILE 55.A O no hydrogen 3.011 N/A PHE 59.A N MET 56.A O no hydrogen 3.138 N/A SER 60.A N TYR 115.A OH no hydrogen 3.011 N/A ASN 63.A N HIS 61.A ND1 no hydrogen 3.068 N/A ASN 63.A ND2 VAL 139.A O no hydrogen 3.010 N/A VAL 64.A N HIS 61.A O no hydrogen 3.075 N/A LEU 65.A N VAL 141.A O no hydrogen 2.849 N/A LEU 68.A N VAL 77.A O no hydrogen 2.866 N/A GLY 69.A N VAL 77.A O no hydrogen 3.181 N/A ILE 70.A N VAL 8.A O no hydrogen 3.113 N/A CYS 71.A N LEU 75.A O no hydrogen 2.816 N/A CYS 71.A SG ILE 10.A O no hydrogen 3.551 N/A LEU 75.A N CYS 71.A O no hydrogen 2.805 N/A VAL 76.A N LYS 43.A O no hydrogen 2.902 N/A VAL 77.A N GLY 69.A O no hydrogen 2.817 N/A LEU 78.A N ALA 41.A O no hydrogen 2.797 N/A HIS 83.A N LEU 133.A O no hydrogen 3.013 N/A GLY 84.A N MET 81.A O no hydrogen 3.039 N/A LEU 86.A N CYS 131.A O no hydrogen 2.665 N/A ARG 87.A N ALA 128.A O no hydrogen 3.286 N/A ARG 87.A NE GLY 199.A O no hydrogen 3.313 N/A ARG 87.A NH2 GLY 199.A O no hydrogen 2.961 N/A ASN 88.A N ASP 85.A OD2 no hydrogen 2.833 N/A ASN 88.A ND2 ASP 85.A OD1 no hydrogen 2.604 N/A PHE 89.A N ASP 85.A O no hydrogen 3.057 N/A ILE 90.A N LEU 86.A O no hydrogen 3.125 N/A ARG 91.A N ARG 87.A O no hydrogen 3.164 N/A ARG 91.A NH1 GLY 199.A O no hydrogen 2.974 N/A ASN 92.A N PHE 89.A O no hydrogen 3.430 N/A HIS 95.A N ASN 92.A O no hydrogen 3.246 N/A THR 98.A N ASP 101.A OD2 no hydrogen 3.105 N/A LYS 100.A NZ PHE 260.A O no hydrogen 3.299 N/A LYS 100.A NZ PHE 263.A O no hydrogen 2.484 N/A ASP 101.A N THR 98.A OG1 no hydrogen 2.985 N/A LEU 102.A N THR 98.A O no hydrogen 3.107 N/A ILE 103.A N VAL 99.A O no hydrogen 2.986 N/A GLY 104.A N LYS 100.A O no hydrogen 2.869 N/A PHE 105.A N ASP 101.A O no hydrogen 2.895 N/A GLY 106.A N LEU 102.A O no hydrogen 3.264 N/A LEU 107.A N ILE 103.A O no hydrogen 2.778 N/A GLN 108.A N GLY 104.A O no hydrogen 2.966 N/A GLN 108.A NE2 GLY 104.A O no hydrogen 3.566 N/A VAL 109.A N PHE 105.A O no hydrogen 3.011 N/A ALA 110.A N GLY 106.A O no hydrogen 2.872 N/A LYS 111.A N LEU 107.A O no hydrogen 3.035 N/A GLY 112.A N GLN 108.A O no hydrogen 3.082 N/A MET 113.A N VAL 109.A O no hydrogen 2.886 N/A LYS 114.A N ALA 110.A O no hydrogen 2.813 N/A TYR 115.A N LYS 111.A O no hydrogen 3.061 N/A LEU 116.A N GLY 112.A O no hydrogen 3.062 N/A ALA 117.A N MET 113.A O no hydrogen 2.747 N/A SER 118.A N LYS 114.A O no hydrogen 2.996 N/A SER 118.A OG TYR 115.A O no hydrogen 2.640 N/A LYS 119.A N TYR 115.A O no hydrogen 3.131 N/A LYS 119.A N LEU 116.A O no hydrogen 3.077 N/A LYS 120.A N ALA 117.A O no hydrogen 2.947 N/A PHE 121.A N LEU 116.A O no hydrogen 3.020 N/A HIS 123.A N ASP 184.A OD2 no hydrogen 2.935 N/A HIS 123.A NE2 ALA 142.A O no hydrogen 2.716 N/A ARG 124.A N ASP 184.A OD1 no hydrogen 3.010 N/A ARG 124.A NH2 GLU 52.A OE2 no hydrogen 3.448 N/A ASP 125.A N HIS 123.A ND1 no hydrogen 3.072 N/A ALA 128.A N GLU 194.A OE1 no hydrogen 2.952 N/A ARG 129.A NE TYR 156.A OH no hydrogen 3.078 N/A ARG 129.A NH2 ASP 125.A OD1 no hydrogen 3.104 N/A ARG 129.A NH2 TYR 156.A OH no hydrogen 3.495 N/A ASN 130.A N ALA 127.A O no hydrogen 2.879 N/A ASN 130.A ND2 ASP 125.A O no hydrogen 2.661 N/A ASN 130.A ND2 TYR 156.A OH no hydrogen 3.495 N/A CYS 131.A N ALA 128.A O no hydrogen 3.264 N/A CYS 131.A SG ALA 127.A O no hydrogen 3.718 N/A MET 132.A N LYS 140.A O no hydrogen 2.979 N/A LEU 133.A N GLY 84.A O no hydrogen 2.778 N/A ASP 134.A N THR 138.A O no hydrogen 3.172 N/A GLU 135.A N GLU 135.A OE2 no hydrogen 2.985 N/A LYS 136.A N ASP 134.A OD1 no hydrogen 2.891 N/A PHE 137.A N ASP 134.A O no hydrogen 2.969 N/A THR 138.A N ASP 134.A OD1 no hydrogen 3.023 N/A VAL 139.A N GLN 108.A OE1 no hydrogen 3.005 N/A LYS 140.A N MET 132.A O no hydrogen 2.823 N/A LYS 140.A NZ PRO 62.A O no hydrogen 2.661 N/A VAL 141.A N ASN 63.A O no hydrogen 2.878 N/A ALA 142.A N ASN 130.A O no hydrogen 2.989 N/A ALA 147.A N PHE 144.A O no hydrogen 3.148 N/A ARG 148.A N GLY 145.A O no hydrogen 3.098 N/A ASP 149.A N ASP 143.A OD1 no hydrogen 2.910 N/A MET 150.A N ASP 149.A OD2 no hydrogen 2.663 N/A TYR 151.A OH ALA 147.A O no hydrogen 2.617 N/A GLU 154.A N ASP 152.A OD1 no hydrogen 3.413 N/A TYR 155.A N ASP 152.A O no hydrogen 3.437 N/A TYR 156.A N LYS 153.A O no hydrogen 3.399 N/A TYR 156.A OH ASP 125.A OD1 no hydrogen 3.332 N/A TYR 156.A OH ASP 125.A OD2 no hydrogen 2.379 N/A SER 157.A N LEU 164.A O no hydrogen 2.943 N/A SER 157.A OG THR 208.A OG1 no hydrogen 3.011 N/A HIS 159.A N ALA 162.A O no hydrogen 3.203 N/A THR 160.A OG1 HIS 159.A O no hydrogen 3.036 N/A THR 160.A OG1 GLN 177.A OE1 no hydrogen 2.547 N/A LEU 164.A N SER 157.A O no hydrogen 2.695 N/A VAL 166.A N LEU 164.A O no hydrogen 2.918 N/A LYS 167.A NZ TYR 203.A O no hydrogen 2.982 N/A LYS 167.A NZ VAL 206.A O no hydrogen 3.054 N/A TRP 168.A N PRO 165.A O no hydrogen 2.942 N/A TRP 168.A NE1 GLU 194.A OE1 no hydrogen 2.962 N/A MET 169.A N VAL 166.A O no hydrogen 3.258 N/A GLU 172.A N GLU 172.A OE1 no hydrogen 2.762 N/A SER 173.A OG LYS 178.A O no hydrogen 2.873 N/A LEU 174.A N ALA 170.A O no hydrogen 3.081 N/A GLN 175.A N LEU 171.A O no hydrogen 3.211 N/A GLN 175.A NE2 LEU 171.A O no hydrogen 3.523 N/A THR 176.A N GLU 172.A O no hydrogen 2.757 N/A THR 176.A OG1 GLU 172.A O no hydrogen 2.636 N/A GLN 177.A N SER 173.A O no hydrogen 2.676 N/A LYS 178.A N THR 176.A OG1 no hydrogen 3.244 N/A LYS 178.A NZ THR 176.A O no hydrogen 3.355 N/A THR 180.A N SER 183.A OG no hydrogen 2.693 N/A LYS 182.A NZ ARG 246.A O no hydrogen 3.057 N/A SER 183.A N THR 180.A O no hydrogen 2.892 N/A SER 183.A N THR 180.A OG1 no hydrogen 3.124 N/A SER 183.A OG THR 180.A O no hydrogen 2.783 N/A ASP 184.A N THR 180.A O no hydrogen 3.057 N/A VAL 185.A N THR 181.A O no hydrogen 3.064 N/A TRP 186.A N LYS 182.A O no hydrogen 3.371 N/A SER 187.A N SER 183.A O no hydrogen 3.157 N/A SER 187.A OG TRP 168.A O no hydrogen 2.676 N/A SER 187.A OG SER 183.A O no hydrogen 3.492 N/A PHE 188.A N ASP 184.A O no hydrogen 2.790 N/A GLY 189.A N VAL 185.A O no hydrogen 3.120 N/A VAL 190.A N TRP 186.A O no hydrogen 3.246 N/A LEU 191.A N SER 187.A O no hydrogen 2.853 N/A LEU 192.A N PHE 188.A O no hydrogen 2.929 N/A TRP 193.A N GLY 189.A O no hydrogen 3.175 N/A TRP 193.A NE1 LEU 222.A O no hydrogen 2.819 N/A GLU 194.A N VAL 190.A O no hydrogen 2.869 N/A LEU 195.A N LEU 191.A O no hydrogen 2.894 N/A MET 196.A N LEU 192.A O no hydrogen 2.977 N/A THR 197.A N TRP 193.A O no hydrogen 3.124 N/A THR 197.A OG1 TRP 193.A O no hydrogen 2.976 N/A THR 197.A OG1 GLU 194.A O no hydrogen 3.118 N/A ARG 198.A N LEU 195.A O no hydrogen 3.081 N/A ARG 198.A NE ILE 90.A O no hydrogen 2.817 N/A ARG 198.A NH2 ILE 90.A O no hydrogen 3.050 N/A ARG 198.A NH2 HIS 95.A O no hydrogen 2.877 N/A GLY 199.A N GLU 194.A O no hydrogen 2.753 N/A ALA 200.A N THR 197.A OG1 no hydrogen 3.219 N/A VAL 206.A N TYR 203.A O no hydrogen 3.040 N/A THR 208.A OG1 SER 157.A OG no hydrogen 3.011 N/A ASP 210.A N ASN 207.A O no hydrogen 2.720 N/A ILE 211.A N THR 208.A O no hydrogen 3.309 N/A TYR 214.A N ASP 210.A O no hydrogen 3.326 N/A LEU 215.A N ILE 211.A O no hydrogen 3.003 N/A LEU 216.A N THR 212.A O no hydrogen 3.033 N/A GLN 217.A N VAL 213.A O no hydrogen 3.012 N/A GLN 217.A N TYR 214.A O no hydrogen 3.304 N/A GLY 218.A N LEU 215.A O no hydrogen 3.213 N/A ARG 219.A NE GLN 217.A OE1 no hydrogen 3.289 N/A ARG 220.A NE TRP 239.A O no hydrogen 3.294 N/A ARG 220.A NH1 LEU 215.A O no hydrogen 3.320 N/A ARG 220.A NH1 ARG 219.A O no hydrogen 2.866 N/A ARG 220.A NH2 TRP 239.A O no hydrogen 3.025 N/A GLN 223.A NE2 CYS 227.A O no hydrogen 2.823 N/A GLN 223.A NE2 ASP 229.A OD1 no hydrogen 2.850 N/A CYS 227.A N PRO 224.A O no hydrogen 3.023 N/A CYS 227.A SG PRO 228.A O no hydrogen 3.471 N/A LEU 231.A N PRO 228.A O no hydrogen 2.966 N/A TYR 232.A N PRO 228.A O no hydrogen 3.099 N/A TYR 232.A OH LEU 221.A O no hydrogen 2.705 N/A GLU 233.A N ASP 229.A O no hydrogen 2.936 N/A VAL 234.A N PRO 230.A O no hydrogen 3.152 N/A MET 235.A N LEU 231.A O no hydrogen 2.982 N/A LEU 236.A N TYR 232.A O no hydrogen 2.915 N/A LYS 237.A N GLU 233.A O no hydrogen 3.021 N/A CYS 238.A N VAL 234.A O no hydrogen 2.988 N/A CYS 238.A SG VAL 185.A O no hydrogen 3.673 N/A CYS 238.A SG VAL 234.A O no hydrogen 3.488 N/A TRP 239.A N MET 235.A O no hydrogen 3.214 N/A TRP 239.A N LEU 236.A O no hydrogen 3.093 N/A TRP 239.A NE1 TRP 186.A O no hydrogen 3.094 N/A HIS 240.A N LYS 237.A O no hydrogen 3.039 N/A LYS 242.A N HIS 240.A ND1 no hydrogen 2.997 N/A MET 245.A N LYS 242.A O no hydrogen 2.945 N/A ARG 246.A N ALA 243.A O no hydrogen 3.021 N/A ARG 246.A NE HIS 240.A O no hydrogen 2.926 N/A ARG 246.A NH1 GLU 172.A OE2 no hydrogen 2.804 N/A ARG 246.A NH1 LYS 182.A O no hydrogen 2.995 N/A ARG 246.A NH2 GLU 172.A OE1 no hydrogen 2.922 N/A ARG 246.A NH2 GLU 172.A OE2 no hydrogen 3.534 N/A ARG 246.A NH2 HIS 240.A O no hydrogen 2.963 N/A GLU 251.A N SER 248.A OG no hydrogen 3.047 N/A LEU 252.A N SER 248.A O no hydrogen 3.007 N/A VAL 253.A N PHE 249.A O no hydrogen 2.870 N/A SER 254.A N SER 250.A O no hydrogen 3.281 N/A ARG 255.A N GLU 251.A O no hydrogen 2.992 N/A ARG 255.A NE GLU 251.A OE2 no hydrogen 2.967 N/A ILE 256.A N LEU 252.A O no hydrogen 2.864 N/A SER 257.A N VAL 253.A O no hydrogen 2.898 N/A SER 257.A OG VAL 253.A O no hydrogen 2.720 N/A ALA 258.A N SER 254.A O no hydrogen 3.218 N/A ILE 259.A N ARG 255.A O no hydrogen 3.163 N/A PHE 260.A N ILE 256.A O no hydrogen 2.811 N/A SER 261.A N SER 257.A O no hydrogen 2.974 N/A SER 261.A OG ALA 258.A O no hydrogen 2.614 N/A THR 262.A N ILE 259.A O no hydrogen 3.096 N/A THR 262.A OG1 ILE 259.A O no hydrogen 2.800 N/A PHE 263.A N PHE 260.A O no hydrogen 3.238 N/A