Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3mpr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 5.A N PHE 269.A O no hydrogen 2.827 N/A THR 5.A OG1 THR 130.A OG1 no hydrogen 2.595 N/A LEU 7.A N LEU 267.A O no hydrogen 2.986 N/A THR 8.A N ASP 44.A OD2 no hydrogen 2.918 N/A VAL 9.A N VAL 265.A O no hydrogen 2.837 N/A ALA 10.A N ILE 45.A O no hydrogen 3.269 N/A SER 11.A N VAL 263.A O no hydrogen 3.028 N/A SER 11.A OG GLY 173.A O no hydrogen 3.423 N/A TYR 12.A N GLY 47.A O no hydrogen 2.902 N/A ASN 13.A ND2 GLU 50.A OE2 no hydrogen 2.911 N/A ASN 13.A ND2 ASP 174.A OD2 no hydrogen 2.862 N/A LEU 14.A N GLN 49.A O no hydrogen 3.125 N/A ARG 15.A N ASN 13.A OD1 no hydrogen 2.847 N/A ARG 15.A NE ASP 21.A OD2 no hydrogen 3.013 N/A ARG 15.A NH1 GLU 50.A OE1 no hydrogen 3.273 N/A ASN 16.A N GLU 50.A OE1 no hydrogen 2.914 N/A ASN 18.A ND2 ASN 16.A O no hydrogen 2.960 N/A ASN 18.A ND2 ASP 21.A OD2 no hydrogen 3.048 N/A ASP 21.A N ASN 18.A OD1 no hydrogen 2.936 N/A SER 22.A N ASN 18.A O no hydrogen 3.344 N/A SER 22.A OG ASN 18.A O no hydrogen 3.268 N/A ALA 23.A N GLY 19.A O no hydrogen 2.983 N/A ARG 24.A N SER 20.A O no hydrogen 3.193 N/A ARG 24.A NH2 ASP 21.A OD1 no hydrogen 2.705 N/A GLY 25.A N SER 22.A O no hydrogen 3.092 N/A ASP 26.A N ASP 21.A O no hydrogen 2.867 N/A TRP 28.A NE1 ASP 58.A OD2 no hydrogen 2.792 N/A GLN 30.A N GLY 27.A O no hydrogen 3.115 N/A GLN 30.A NE2 TYR 244.A OH no hydrogen 2.898 N/A ARG 31.A N GLY 27.A O no hydrogen 3.038 N/A ARG 31.A N TRP 28.A O no hydrogen 3.029 N/A ARG 31.A NE ASP 26.A O no hydrogen 2.922 N/A ARG 31.A NH1 LEU 14.A O no hydrogen 2.887 N/A ARG 31.A NH1 PRO 257.A O no hydrogen 2.833 N/A ARG 31.A NH2 LEU 14.A O no hydrogen 3.156 N/A ARG 31.A NH2 ARG 15.A O no hydrogen 3.110 N/A TYR 32.A N TRP 28.A O no hydrogen 2.933 N/A VAL 34.A N ARG 31.A O no hydrogen 2.988 N/A ILE 35.A N ARG 31.A O no hydrogen 3.141 N/A ALA 36.A N TYR 32.A O no hydrogen 2.874 N/A GLN 37.A N PRO 33.A O no hydrogen 3.067 N/A GLN 39.A N ALA 36.A O no hydrogen 3.066 N/A TYR 40.A N GLN 37.A O no hydrogen 2.768 N/A ASP 42.A N GLN 39.A O no hydrogen 3.205 N/A PHE 43.A N VAL 38.A O no hydrogen 3.150 N/A ASP 44.A N THR 8.A O no hydrogen 2.877 N/A ILE 45.A N THR 8.A O no hydrogen 3.464 N/A PHE 46.A N PHE 85.A O no hydrogen 2.853 N/A GLY 47.A N ALA 10.A O no hydrogen 2.984 N/A THR 48.A N ALA 83.A O no hydrogen 2.860 N/A THR 48.A OG1 ALA 83.A O no hydrogen 2.715 N/A GLN 49.A N TYR 12.A O no hydrogen 3.337 N/A GLN 49.A NE2 ASN 138.A OD1 no hydrogen 2.930 N/A GLU 50.A N HIS 81.A O no hydrogen 3.279 N/A GLN 55.A NE2 GLU 50.A O no hydrogen 3.652 N/A LEU 56.A N PHE 52.A O no hydrogen 3.160 N/A LYS 57.A N LEU 53.A O no hydrogen 3.033 N/A ASP 58.A N HIS 54.A O no hydrogen 3.076 N/A LYS 59.A NZ ASP 66.A OD1 no hydrogen 3.037 N/A GLU 60.A N LYS 57.A O no hydrogen 2.974 N/A ALA 61.A N ASP 58.A O no hydrogen 2.933 N/A LEU 62.A N LYS 59.A O no hydrogen 2.956 N/A TYR 65.A N LEU 62.A O no hydrogen 2.987 N/A TYR 65.A OH PHE 43.A O no hydrogen 2.542 N/A ASP 66.A N TYR 86.A O no hydrogen 3.022 N/A TYR 67.A N ASP 66.A OD1 no hydrogen 2.788 N/A ILE 68.A N ILE 84.A O no hydrogen 2.915 N/A VAL 70.A N ASP 98.A OD2 no hydrogen 3.118 N/A GLY 71.A N LYS 76.A O no hydrogen 2.930 N/A ARG 72.A N GLU 80.A O no hydrogen 2.962 N/A ASP 73.A N LYS 78.A O no hydrogen 3.076 N/A GLY 75.A N GLY 71.A O no hydrogen 2.839 N/A LYS 76.A N ASP 74.A OD1 no hydrogen 2.848 N/A LYS 78.A N ASP 74.A OD1 no hydrogen 3.130 N/A HIS 81.A N CYS 51.A O no hydrogen 2.884 N/A HIS 81.A ND1 CYS 51.A O no hydrogen 2.867 N/A SER 82.A OG ILE 119.A O no hydrogen 2.876 N/A ILE 84.A N ILE 68.A O no hydrogen 2.913 N/A PHE 85.A N PHE 46.A O no hydrogen 2.861 N/A TYR 86.A N ASP 66.A O no hydrogen 3.002 N/A ARG 87.A N ASP 44.A O no hydrogen 2.997 N/A ARG 87.A NH2 ASP 89.A OD2 no hydrogen 2.588 N/A THR 88.A N GLY 64.A O no hydrogen 2.857 N/A THR 88.A OG1 GLY 64.A O no hydrogen 3.296 N/A LYS 90.A N ARG 87.A O no hydrogen 3.074 N/A PHE 91.A N ARG 87.A O no hydrogen 3.299 N/A ASP 92.A N LYS 126.A O no hydrogen 2.912 N/A VAL 94.A N HIS 124.A O no hydrogen 2.824 N/A GLU 95.A N HIS 124.A O no hydrogen 3.447 N/A GLY 97.A N TRP 122.A O no hydrogen 3.057 N/A PHE 99.A N CYS 120.A O no hydrogen 2.870 N/A TRP 100.A N PRO 105.A O no hydrogen 2.749 N/A TRP 100.A NE1 ARG 72.A O no hydrogen 2.835 N/A LEU 101.A N ARG 118.A O no hydrogen 2.870 N/A SER 102.A N TRP 100.A O no hydrogen 3.008 N/A SER 102.A OG SER 109.A OG no hydrogen 2.829 N/A GLU 103.A N GLU 103.A OE1 no hydrogen 2.566 N/A THR 104.A N SER 102.A OG no hydrogen 3.081 N/A THR 104.A OG1 THR 104.A O no hydrogen 2.618 N/A THR 104.A OG1 SER 109.A OG no hydrogen 3.083 N/A VAL 107.A N THR 104.A O no hydrogen 3.194 N/A SER 109.A OG SER 102.A OG no hydrogen 2.829 N/A SER 109.A OG THR 104.A O no hydrogen 3.283 N/A SER 109.A OG THR 104.A OG1 no hydrogen 3.083 N/A SER 109.A OG VAL 107.A O no hydrogen 2.670 N/A TRP 112.A N GLU 103.A OE1 no hydrogen 3.098 N/A TRP 112.A N GLU 103.A OE2 no hydrogen 3.181 N/A ALA 114.A N GLY 111.A O no hydrogen 2.832 N/A VAL 115.A N ASP 141.A OD1 no hydrogen 3.127 N/A VAL 115.A N ASP 141.A OD2 no hydrogen 3.296 N/A LEU 116.A N ASP 141.A OD2 no hydrogen 3.160 N/A ARG 118.A NE ASP 141.A OD2 no hydrogen 2.980 N/A ARG 118.A NH2 ASP 141.A OD2 no hydrogen 2.985 N/A CYS 120.A N PHE 99.A O no hydrogen 2.828 N/A CYS 120.A SG SER 121.A O no hydrogen 4.024 N/A CYS 120.A SG ASN 138.A O no hydrogen 3.566 N/A SER 121.A N ASN 138.A O no hydrogen 2.976 N/A SER 121.A OG ASP 98.A OD2 no hydrogen 2.586 N/A TRP 122.A N GLY 97.A O no hydrogen 2.970 N/A GLY 123.A N PHE 136.A O no hydrogen 3.018 N/A HIS 124.A N GLU 95.A O no hydrogen 2.736 N/A HIS 124.A NE2 GLU 133.A OE1 no hydrogen 2.718 N/A PHE 125.A N PHE 134.A O no hydrogen 2.842 N/A LYS 126.A N ASP 92.A O no hydrogen 2.946 N/A CYS 127.A N PHE 132.A O no hydrogen 2.832 N/A CYS 127.A SG PHE 132.A O no hydrogen 3.502 N/A LYS 128.A N LYS 90.A O no hydrogen 2.844 N/A LYS 128.A NZ THR 88.A O no hydrogen 2.886 N/A THR 130.A N ASP 129.A OD1 no hydrogen 2.674 N/A THR 130.A OG1 THR 5.A OG1 no hydrogen 2.595 N/A GLY 131.A N CYS 127.A O no hydrogen 2.825 N/A PHE 132.A N THR 130.A OG1 no hydrogen 3.195 N/A PHE 134.A N PHE 125.A O no hydrogen 3.052 N/A LEU 135.A N PRO 168.A O no hydrogen 2.871 N/A PHE 136.A N GLY 123.A O no hydrogen 2.899 N/A PHE 137.A N ILE 170.A O no hydrogen 2.731 N/A ASN 138.A N SER 121.A O no hydrogen 2.898 N/A ASN 138.A ND2 THR 48.A O no hydrogen 2.776 N/A ASN 138.A ND2 SER 82.A O no hydrogen 2.880 N/A LEU 139.A N THR 172.A O no hydrogen 3.203 N/A HIS 142.A N HIS 142.A ND1 no hydrogen 2.867 N/A ILE 143.A N ASP 141.A OD1 no hydrogen 3.073 N/A GLY 144.A N ASP 141.A OD1 no hydrogen 2.843 N/A LYS 146.A N ASP 113.A OD2 no hydrogen 3.094 N/A ALA 147.A N ASP 113.A OD1 no hydrogen 2.800 N/A ARG 148.A N GLY 144.A O no hydrogen 2.987 N/A ARG 148.A NH1 ASP 141.A O no hydrogen 3.151 N/A ARG 148.A NH1 HIS 142.A O no hydrogen 3.150 N/A VAL 149.A N LYS 145.A O no hydrogen 3.149 N/A GLU 150.A N LYS 146.A O no hydrogen 2.860 N/A SER 151.A N ALA 147.A O no hydrogen 2.734 N/A SER 151.A OG ALA 147.A O no hydrogen 2.687 N/A ALA 152.A N ARG 148.A O no hydrogen 3.065 N/A PHE 153.A N VAL 149.A O no hydrogen 3.353 N/A LEU 154.A N GLU 150.A O no hydrogen 2.963 N/A VAL 155.A N SER 151.A O no hydrogen 2.884 N/A GLN 156.A N ALA 152.A O no hydrogen 3.169 N/A GLU 157.A N PHE 153.A O no hydrogen 2.930 N/A LYS 158.A N LEU 154.A O no hydrogen 2.931 N/A LYS 158.A NZ GLU 160.A OE2 no hydrogen 2.910 N/A LYS 159.A NZ GLU 157.A OE2 no hydrogen 2.827 N/A GLU 160.A N GLU 157.A O no hydrogen 2.917 N/A LEU 161.A N LYS 158.A O no hydrogen 2.828 N/A GLY 162.A N LYS 159.A O no hydrogen 3.114 N/A ARG 163.A N GLU 160.A O no hydrogen 3.061 N/A ARG 163.A NE GLU 95.A OE1 no hydrogen 3.217 N/A ARG 163.A NH2 GLU 95.A OE2 no hydrogen 2.635 N/A LYS 165.A N GLY 162.A O no hydrogen 3.061 N/A ALA 169.A N SER 229.A OG no hydrogen 2.788 N/A ILE 170.A N LEU 135.A O no hydrogen 2.871 N/A LEU 171.A N PHE 227.A O no hydrogen 2.739 N/A THR 172.A N PHE 137.A O no hydrogen 2.874 N/A THR 172.A OG1 PHE 137.A O no hydrogen 3.480 N/A THR 172.A OG1 ASN 138.A OD1 no hydrogen 2.799 N/A GLY 173.A N SER 11.A OG no hydrogen 3.091 N/A ASP 174.A N LEU 139.A O no hydrogen 3.093 N/A PHE 175.A N ILE 223.A O no hydrogen 2.711 N/A ASN 176.A N ASP 174.A OD1 no hydrogen 2.870 N/A VAL 177.A N PHE 175.A O no hydrogen 2.685 N/A GLN 179.A N GLN 179.A OE1 no hydrogen 2.623 N/A GLN 179.A NE2 GLU 220.A O no hydrogen 2.918 N/A THR 180.A N ASP 178.A OD1 no hydrogen 3.020 N/A THR 180.A OG1 ASP 178.A OD1 no hydrogen 2.792 N/A HIS 181.A N ASP 178.A O no hydrogen 3.147 N/A TYR 184.A N HIS 181.A O no hydrogen 3.054 N/A TYR 184.A OH ASP 195.A OD2 no hydrogen 2.565 N/A ASP 185.A N HIS 181.A O no hydrogen 3.233 N/A ALA 186.A N GLN 182.A O no hydrogen 2.852 N/A PHE 187.A N TYR 184.A O no hydrogen 3.059 N/A VAL 188.A N ASP 185.A O no hydrogen 3.199 N/A SER 189.A N ASP 185.A O no hydrogen 2.918 N/A SER 189.A OG ASP 185.A O no hydrogen 3.322 N/A GLY 191.A N VAL 188.A O no hydrogen 2.992 N/A CYS 194.A N VAL 228.A O no hydrogen 2.790 N/A SER 196.A N ILE 226.A O no hydrogen 3.124 N/A SER 196.A OG.A ILE 226.A O no hydrogen 2.916 N/A SER 196.A OG.B ILE 226.A O no hydrogen 2.705 N/A TYR 197.A N ASP 195.A OD1 no hydrogen 2.942 N/A GLU 198.A N ASP 195.A O no hydrogen 2.911 N/A LYS 199.A N ASP 195.A O no hydrogen 2.941 N/A CYS 200.A N SER 196.A O no hydrogen 3.071 N/A CYS 200.A SG TYR 197.A O no hydrogen 3.429 N/A CYS 200.A SG TYR 202.A O no hydrogen 3.498 N/A ASP 201.A N VAL 234.A O no hydrogen 3.006 N/A TYR 202.A N LYS 235.A O no hydrogen 3.020 N/A ARG 203.A NE TYR 197.A O no hydrogen 3.078 N/A ARG 203.A NH2 TYR 197.A O no hydrogen 2.925 N/A TYR 204.A N TYR 237.A O no hydrogen 2.830 N/A ASN 207.A ND2 SER 217.A O no hydrogen 2.985 N/A GLY 208.A N ASN 207.A OD1 no hydrogen 2.927 N/A THR 209.A OG1 ASP 224.A OD1 no hydrogen 2.697 N/A ASN 211.A N ASP 259.A O no hydrogen 2.859 N/A ASN 211.A ND2 SER 258.A O no hydrogen 3.408 N/A ASN 212.A N ASP 259.A O no hydrogen 3.131 N/A PHE 213.A N ASN 211.A OD1 no hydrogen 2.738 N/A ASP 214.A N ASN 211.A O no hydrogen 2.906 N/A ASN 216.A N ASP 214.A OD1 no hydrogen 2.775 N/A SER 217.A N ASP 214.A O no hydrogen 3.235 N/A SER 217.A OG ASN 211.A O no hydrogen 3.539 N/A SER 217.A OG ASP 214.A O no hydrogen 3.356 N/A THR 219.A N ASN 207.A OD1 no hydrogen 3.355 N/A SER 221.A N THR 219.A OG1 no hydrogen 2.918 N/A SER 221.A OG ASP 178.A OD2 no hydrogen 2.737 N/A ARG 222.A N GLN 179.A OE1 no hydrogen 2.876 N/A ARG 222.A NH2 ASP 195.A OD2 no hydrogen 2.884 N/A ILE 223.A N THR 209.A OG1 no hydrogen 3.015 N/A ASP 224.A N THR 209.A OG1 no hydrogen 3.050 N/A HIS 225.A N GLY 173.A O no hydrogen 3.386 N/A PHE 227.A N LEU 171.A O no hydrogen 2.764 N/A VAL 228.A N CYS 194.A O no hydrogen 2.959 N/A SER 229.A N ALA 169.A O no hydrogen 2.944 N/A SER 229.A OG ALA 169.A O no hydrogen 3.385 N/A PHE 232.A N SER 229.A O no hydrogen 3.059 N/A HIS 233.A N VAL 268.A O no hydrogen 2.888 N/A HIS 233.A NE2 ASP 201.A OD2 no hydrogen 2.580 N/A LYS 235.A N GLU 266.A O no hydrogen 2.912 N/A ARG 236.A N GLU 266.A O no hydrogen 3.412 N/A ARG 236.A NE GLU 266.A OE2 no hydrogen 2.830 N/A ARG 236.A NH2 GLU 266.A OE1 no hydrogen 2.801 N/A ARG 236.A NH2 GLU 266.A OE2 no hydrogen 3.467 N/A TYR 237.A N TYR 202.A O no hydrogen 2.916 N/A GLY 238.A N LYS 264.A O no hydrogen 2.880 N/A VAL 239.A N TYR 204.A O no hydrogen 3.028 N/A LEU 240.A N PRO 262.A O no hydrogen 3.240 N/A TYR 244.A N ARG 255.A O no hydrogen 3.122 N/A ARG 245.A NH1 THR 243.A OG1 no hydrogen 2.935 N/A ARG 245.A NH1 TYR 244.A O no hydrogen 2.975 N/A SER 246.A N GLU 253.A O no hydrogen 3.138 N/A ARG 248.A N ALA 251.A O no hydrogen 2.931 N/A GLU 253.A N SER 246.A O no hydrogen 2.999 N/A ARG 255.A N TYR 244.A O no hydrogen 3.019 N/A ARG 255.A NE SER 246.A OG no hydrogen 2.985 N/A ARG 255.A NH1 ARG 24.A O no hydrogen 2.889 N/A ARG 255.A NH1 ASP 26.A OD1 no hydrogen 3.025 N/A ARG 255.A NH2 ARG 24.A O no hydrogen 3.181 N/A THR 256.A OG1 ASN 211.A OD1 no hydrogen 3.256 N/A THR 256.A OG1 SER 258.A O no hydrogen 2.846 N/A SER 258.A OG ASN 13.A O no hydrogen 2.586 N/A HIS 260.A ND1 ASP 259.A OD1 no hydrogen 3.203 N/A PHE 261.A N THR 209.A O no hydrogen 2.830 N/A VAL 263.A N SER 11.A O no hydrogen 3.009 N/A LYS 264.A N GLY 238.A O no hydrogen 2.848 N/A LYS 264.A NZ HIS 41.A O no hydrogen 2.940 N/A VAL 265.A N VAL 9.A O no hydrogen 2.816 N/A GLU 266.A N ARG 236.A O no hydrogen 2.966 N/A LEU 267.A N LEU 7.A O no hydrogen 2.799 N/A VAL 268.A N HIS 233.A O no hydrogen 2.944 N/A PHE 269.A N THR 5.A O no hydrogen 2.815 N/A HIS 273.A N ASP 270.A OD1 no hydrogen 3.125 N/A