Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6w33_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A NE2 GLN 3.A O no hydrogen 3.679 N/A THR 5.A N LYS 1.A O no hydrogen 2.479 N/A HIS 6.A N ASN 2.A O no hydrogen 3.306 N/A LYS 7.A N GLN 3.A O no hydrogen 3.193 N/A GLU 8.A N ALA 4.A O no hydrogen 3.396 N/A PHE 9.A N THR 5.A O no hydrogen 2.978 N/A SER 10.A N HIS 6.A O no hydrogen 2.772 N/A GLN 11.A N LYS 7.A O no hydrogen 2.845 N/A LEU 12.A N GLU 8.A O no hydrogen 3.059 N/A GLU 13.A N PHE 9.A O no hydrogen 3.230 N/A LYS 14.A N SER 10.A O no hydrogen 3.423 N/A LYS 15.A N GLN 11.A O no hydrogen 3.015 N/A PHE 16.A N LEU 12.A O no hydrogen 2.967 N/A ASP 17.A N LYS 14.A O no hydrogen 3.436 N/A ALA 18.A N GLU 13.A O no hydrogen 3.084 N/A ARG 19.A N SER 236.A O no hydrogen 2.962 N/A ARG 19.A NH1 GLU 39.A OE1 no hydrogen 2.954 N/A ARG 19.A NH1 ARG 40.A O no hydrogen 3.144 N/A ARG 19.A NH2 ARG 40.A O no hydrogen 3.025 N/A ARG 19.A NH2 SER 236.A OG no hydrogen 3.142 N/A LEU 20.A N GLU 13.A OE2 no hydrogen 2.792 N/A GLY 21.A N LEU 234.A O no hydrogen 2.835 N/A VAL 22.A N TYR 35.A O no hydrogen 2.880 N/A TYR 23.A N ALA 232.A O no hydrogen 2.898 N/A ALA 24.A N ILE 33.A O.A no hydrogen 2.835 N/A ALA 24.A N ILE 33.A O.B no hydrogen 2.848 N/A ILE 25.A N ILE 230.A O no hydrogen 2.854 N/A ASP 26.A N GLN 31.A O no hydrogen 2.974 N/A THR 27.A N PRO 228.A O no hydrogen 3.022 N/A THR 27.A OG1 PRO 228.A O no hydrogen 2.449 N/A GLY 28.A N ASP 26.A OD1 no hydrogen 2.893 N/A THR 29.A N ASP 26.A O no hydrogen 3.241 N/A ASN 30.A N ASP 26.A O no hydrogen 2.658 N/A GLN 31.A N THR 29.A OG1 no hydrogen 3.149 N/A GLN 31.A NE2 ALA 259.A O no hydrogen 3.079 N/A ILE 33.A N.A ALA 24.A O no hydrogen 2.866 N/A ILE 33.A N.B ALA 24.A O no hydrogen 2.899 N/A TYR 35.A N VAL 22.A O no hydrogen 2.993 N/A TYR 35.A OH GLU 13.A OE1 no hydrogen 2.570 N/A ARG 36.A NE GLU 13.A OE2 no hydrogen 2.976 N/A ARG 36.A NH1 GLU 39.A OE2 no hydrogen 3.018 N/A ARG 36.A NH2 GLU 13.A OE1 no hydrogen 3.206 N/A GLU 39.A N ARG 36.A O no hydrogen 3.240 N/A ARG 40.A NH1 ILE 131.A O no hydrogen 3.099 N/A ARG 40.A NH1 THR 152.A OG1 no hydrogen 2.927 N/A ARG 40.A NH2 ILE 131.A O no hydrogen 2.938 N/A PHE 41.A N SER 153.A O no hydrogen 2.970 N/A PHE 43.A N ASP 151.A O no hydrogen 3.164 N/A THR 45.A OG1 PHE 43.A O no hydrogen 2.874 N/A TYR 46.A N ALA 44.A O no hydrogen 3.340 N/A LYS 47.A NZ SER 102.A O no hydrogen 2.810 N/A LYS 47.A NZ SER 102.A OG no hydrogen 3.119 N/A LYS 47.A NZ ASN 104.A OD1 no hydrogen 2.734 N/A ALA 48.A N THR 45.A O no hydrogen 3.365 N/A ALA 50.A N TYR 46.A O no hydrogen 2.696 N/A ALA 51.A N LYS 47.A O no hydrogen 2.947 N/A GLY 52.A N ALA 48.A O no hydrogen 3.116 N/A VAL 53.A N LEU 49.A O no hydrogen 2.900 N/A LEU 54.A N ALA 50.A O no hydrogen 2.774 N/A LEU 55.A N ALA 51.A O no hydrogen 2.896 N/A GLN 56.A N GLY 52.A O no hydrogen 2.922 N/A GLN 56.A NE2 ALA 170.A O no hydrogen 2.769 N/A GLN 57.A N VAL 53.A O no hydrogen 3.090 N/A GLN 57.A N LEU 54.A O no hydrogen 3.091 N/A ASN 58.A ND2 LEU 54.A O no hydrogen 3.008 N/A SER 62.A N SER 59.A OG no hydrogen 2.878 N/A SER 62.A OG SER 59.A O no hydrogen 2.912 N/A LEU 63.A N ILE 60.A O no hydrogen 3.025 N/A ASN 64.A N ASP 61.A O no hydrogen 3.094 N/A GLU 65.A N SER 62.A O no hydrogen 3.018 N/A ILE 67.A N MET 89.A O no hydrogen 2.793 N/A TYR 69.A OH THR 81.A O no hydrogen 2.693 N/A THR 70.A N ASP 73.A OD2 no hydrogen 3.024 N/A ASP 73.A N THR 70.A O no hydrogen 3.102 N/A ASP 73.A N THR 70.A OG1 no hydrogen 3.278 N/A LEU 74.A N LYS 71.A O no hydrogen 3.000 N/A VAL 75.A N THR 105.A OG1 no hydrogen 3.111 N/A TYR 77.A OH SER 101.A O no hydrogen 3.278 N/A SER 78.A OG VAL 75.A O no hydrogen 2.786 N/A SER 78.A OG THR 105.A OG1 no hydrogen 2.498 N/A VAL 80.A N ASP 103.A OD1 no hydrogen 2.887 N/A THR 81.A N ASP 103.A OD1 no hydrogen 2.917 N/A THR 81.A OG1 ASP 103.A OD1 no hydrogen 3.068 N/A THR 81.A OG1 ASP 103.A OD2 no hydrogen 2.826 N/A GLU 82.A N SER 78.A O no hydrogen 3.035 N/A LYS 83.A N VAL 80.A O no hydrogen 3.089 N/A HIS 84.A N THR 81.A O no hydrogen 3.220 N/A THR 87.A OG1 GLY 88.A O no hydrogen 3.005 N/A GLY 88.A N HIS 84.A O no hydrogen 2.840 N/A MET 89.A N ILE 67.A O no hydrogen 3.044 N/A LYS 90.A N GLU 93.A OE1 no hydrogen 2.815 N/A LYS 90.A NZ ASN 64.A OD1 no hydrogen 3.469 N/A LEU 91.A N GLU 65.A O no hydrogen 2.754 N/A GLY 92.A N LEU 63.A O no hydrogen 2.722 N/A ILE 94.A N LYS 90.A O no hydrogen 3.005 N/A ALA 95.A N LEU 91.A O no hydrogen 3.114 N/A GLU 96.A N GLY 92.A O no hydrogen 2.930 N/A ALA 97.A N GLU 93.A O no hydrogen 2.810 N/A ALA 98.A N ILE 94.A O no hydrogen 2.921 N/A VAL 99.A N ALA 95.A O no hydrogen 3.003 N/A ARG 100.A N GLU 96.A O no hydrogen 2.772 N/A ARG 100.A NE GLU 96.A OE2 no hydrogen 2.906 N/A ARG 100.A NH1 LYS 184.A O no hydrogen 2.760 N/A ARG 100.A NH1 ASN 186.A OD1 no hydrogen 2.960 N/A ARG 100.A NH2 GLU 181.A O no hydrogen 2.917 N/A SER 101.A N ALA 97.A O no hydrogen 3.053 N/A ASP 103.A N ALA 97.A O no hydrogen 3.290 N/A ASN 104.A N TYR 77.A O no hydrogen 3.043 N/A ASN 104.A ND2 ASP 76.A O no hydrogen 3.086 N/A THR 105.A N SER 78.A OG no hydrogen 3.089 N/A THR 105.A OG1 SER 78.A OG no hydrogen 2.498 N/A ALA 106.A N ASP 103.A OD2 no hydrogen 2.808 N/A GLY 107.A N ASP 103.A O no hydrogen 2.980 N/A ASN 108.A N ASN 104.A O no hydrogen 2.938 N/A ASN 108.A ND2 GLU 138.A O no hydrogen 3.036 N/A ILE 109.A N THR 105.A O no hydrogen 2.883 N/A LEU 110.A N ALA 106.A O no hydrogen 2.938 N/A PHE 111.A N GLY 107.A O no hydrogen 2.955 N/A ASN 112.A N ASN 108.A O no hydrogen 2.928 N/A LYS 113.A N ILE 109.A O no hydrogen 2.776 N/A ILE 114.A N LEU 110.A O no hydrogen 3.073 N/A ILE 114.A N PHE 111.A O no hydrogen 3.019 N/A GLY 115.A N ASN 112.A O no hydrogen 3.186 N/A GLY 116.A N PHE 111.A O no hydrogen 2.684 N/A LYS 118.A NZ SER 134.A O no hydrogen 2.681 N/A GLY 119.A N GLY 115.A O no hydrogen 2.895 N/A TYR 120.A N GLY 116.A O no hydrogen 2.861 N/A GLU 121.A N PRO 117.A O no hydrogen 2.904 N/A LYS 122.A N LYS 118.A O no hydrogen 2.958 N/A ALA 123.A N GLY 119.A O no hydrogen 2.986 N/A LEU 124.A N TYR 120.A O no hydrogen 3.139 N/A ARG 125.A N GLU 121.A O no hydrogen 2.880 N/A ARG 125.A NH1 ASP 129.A O no hydrogen 2.790 N/A ARG 125.A NH1 THR 132.A O no hydrogen 2.908 N/A ARG 125.A NH2 THR 132.A O no hydrogen 3.000 N/A HIS 126.A N LYS 122.A O no hydrogen 3.004 N/A MET 127.A N ALA 123.A O no hydrogen 3.278 N/A GLY 128.A N ARG 125.A O no hydrogen 2.808 N/A ASP 129.A N LEU 124.A O no hydrogen 2.868 N/A ILE 131.A N ASP 129.A OD1 no hydrogen 2.932 N/A THR 132.A N ASP 129.A OD1 no hydrogen 3.186 N/A THR 132.A OG1 ASP 129.A OD2 no hydrogen 2.464 N/A THR 132.A OG1 SER 153.A OG no hydrogen 2.668 N/A MET 133.A N THR 152.A O no hydrogen 2.973 N/A SER 134.A N GLU 121.A OE2 no hydrogen 2.978 N/A SER 134.A OG PRO 117.A O no hydrogen 3.468 N/A ASP 135.A N ASP 151.A OD1 no hydrogen 2.878 N/A ARG 136.A N ASP 151.A OD1 no hydrogen 2.990 N/A ARG 136.A NE ASP 151.A OD2 no hydrogen 2.791 N/A ARG 136.A NH1 GLU 143.A OE1 no hydrogen 2.774 N/A ARG 136.A NH2 ASP 151.A OD2 no hydrogen 3.166 N/A GLU 138.A N ASN 108.A OD1 no hydrogen 2.883 N/A LEU 141.A N PHE 137.A O no hydrogen 3.014 N/A ASN 142.A N THR 139.A O no hydrogen 3.054 N/A ASN 142.A ND2 GLU 138.A OE1 no hydrogen 2.699 N/A ASN 142.A ND2 THR 139.A O no hydrogen 3.022 N/A GLU 143.A N GLU 140.A O no hydrogen 3.188 N/A ASP 148.A N ILE 145.A O no hydrogen 2.960 N/A ARG 150.A N ASP 148.A OD1 no hydrogen 3.065 N/A ARG 150.A NE ASP 148.A OD1 no hydrogen 3.141 N/A ARG 150.A NE ASP 148.A OD2 no hydrogen 3.304 N/A ARG 150.A NH2 ASP 148.A OD2 no hydrogen 2.807 N/A ASP 151.A N ASP 135.A OD2 no hydrogen 3.431 N/A THR 152.A N MET 133.A O no hydrogen 3.164 N/A THR 152.A OG1 ILE 149.A O no hydrogen 2.686 N/A SER 153.A N PHE 41.A O no hydrogen 3.033 N/A SER 153.A OG THR 132.A OG1 no hydrogen 2.668 N/A LYS 156.A N SER 37.A O no hydrogen 3.238 N/A ALA 157.A N THR 154.A OG1 no hydrogen 3.039 N/A ILE 158.A N THR 154.A O no hydrogen 2.886 N/A ALA 159.A N ALA 155.A O no hydrogen 2.886 N/A THR 160.A N LYS 156.A O no hydrogen 2.955 N/A THR 160.A OG1 LYS 156.A O no hydrogen 2.701 N/A ASN 161.A N ALA 157.A O no hydrogen 3.065 N/A ASN 161.A ND2 ASP 129.A OD2 no hydrogen 2.712 N/A LEU 162.A N ILE 158.A O no hydrogen 2.910 N/A LYS 163.A N ALA 159.A O no hydrogen 2.774 N/A ALA 164.A N THR 160.A O no hydrogen 3.039 N/A PHE 165.A N ASN 161.A O no hydrogen 3.135 N/A THR 166.A N LEU 162.A O no hydrogen 2.922 N/A THR 166.A OG1 LEU 162.A O no hydrogen 2.812 N/A VAL 167.A N LYS 163.A O no hydrogen 2.978 N/A GLY 168.A N LYS 163.A O no hydrogen 2.881 N/A ALA 170.A N ALA 164.A O no hydrogen 3.156 N/A GLU 174.A N GLU 174.A OE1 no hydrogen 2.708 N/A LYS 175.A NZ LEU 55.A O no hydrogen 2.775 N/A LYS 175.A NZ ASN 58.A O no hydrogen 2.907 N/A ARG 176.A N PRO 172.A O no hydrogen 2.901 N/A ARG 176.A NH2 LEU 171.A O no hydrogen 2.895 N/A LYS 177.A N ALA 173.A O no hydrogen 2.861 N/A ILE 178.A N GLU 174.A O no hydrogen 3.072 N/A LEU 179.A N LYS 175.A O no hydrogen 2.885 N/A THR 180.A N ARG 176.A O no hydrogen 3.084 N/A THR 180.A OG1 ARG 176.A O no hydrogen 3.269 N/A THR 180.A OG1 LYS 177.A O no hydrogen 3.077 N/A GLU 181.A N LYS 177.A O no hydrogen 3.062 N/A TRP 182.A N ILE 178.A O no hydrogen 3.113 N/A MET 183.A N LEU 179.A O no hydrogen 3.042 N/A LYS 184.A N GLU 181.A O no hydrogen 3.154 N/A LYS 184.A NZ GLU 181.A OE2 no hydrogen 3.113 N/A ASN 186.A ND2 TRP 182.A O no hydrogen 2.699 N/A THR 188.A OG1 ARG 100.A O no hydrogen 3.429 N/A GLY 189.A N ASN 186.A O no hydrogen 3.054 N/A ASP 190.A N ALA 187.A O no hydrogen 2.991 N/A LEU 192.A N GLY 189.A O no hydrogen 3.204 N/A ILE 193.A N ASP 217.A OD2 no hydrogen 3.013 N/A ARG 194.A NH1 ASN 186.A O no hydrogen 2.899 N/A ARG 194.A NH1 ASP 190.A OD1 no hydrogen 2.643 N/A ARG 194.A NH2 VAL 203.A O no hydrogen 2.838 N/A ALA 195.A N LEU 192.A O no hydrogen 3.010 N/A GLY 196.A N ILE 193.A O no hydrogen 3.020 N/A TRP 201.A N PRO 198.A O no hydrogen 3.044 N/A VAL 202.A N TRP 222.A O no hydrogen 2.983 N/A GLY 204.A N ILE 220.A O no hydrogen 2.928 N/A ASP 205.A N MET 183.A O no hydrogen 2.972 N/A LYS 206.A N ILE 218.A O no hydrogen 2.780 N/A LYS 206.A NZ SER 102.A OG no hydrogen 3.024 N/A LYS 206.A NZ SER 207.A O no hydrogen 2.918 N/A SER 207.A OG THR 188.A O no hydrogen 3.550 N/A GLY 208.A N ASN 216.A O no hydrogen 2.826 N/A GLY 210.A N THR 214.A O no hydrogen 2.854 N/A SER 211.A N ASN 142.A O no hydrogen 2.906 N/A SER 211.A OG LYS 240.A O no hydrogen 3.168 N/A TYR 212.A N LYS 240.A O no hydrogen 2.932 N/A THR 214.A N GLY 210.A O no hydrogen 3.202 N/A THR 214.A N SER 211.A O no hydrogen 3.127 N/A THR 214.A OG1 SER 211.A O no hydrogen 2.690 N/A ARG 215.A N SER 235.A O no hydrogen 2.942 N/A ARG 215.A NE ASN 246.A OD1 no hydrogen 2.975 N/A ARG 215.A NH1 GLY 208.A O no hydrogen 3.031 N/A ARG 215.A NH2 ASN 246.A OD1 no hydrogen 2.992 N/A ASN 216.A N GLY 208.A O no hydrogen 2.900 N/A ASN 216.A ND2 ALA 42.A O no hydrogen 2.972 N/A ASN 216.A ND2 PHE 43.A O no hydrogen 3.016 N/A ASP 217.A N ILE 233.A O no hydrogen 2.913 N/A ILE 218.A N LYS 206.A O no hydrogen 3.100 N/A ALA 219.A N ILE 231.A O no hydrogen 2.783 N/A ILE 220.A N GLY 204.A O no hydrogen 2.886 N/A VAL 221.A N ILE 229.A O no hydrogen 2.897 N/A TRP 222.A N VAL 202.A O no hydrogen 2.746 N/A ARG 226.A NH1 ASP 26.A OD2 no hydrogen 3.436 N/A ILE 229.A N VAL 221.A O no hydrogen 2.923 N/A ILE 230.A N ILE 25.A O no hydrogen 2.896 N/A ILE 231.A N ALA 219.A O no hydrogen 2.851 N/A ALA 232.A N TYR 23.A O no hydrogen 2.759 N/A ILE 233.A N ASP 217.A O no hydrogen 2.920 N/A LEU 234.A N GLY 21.A O no hydrogen 2.743 N/A SER 235.A N ASN 216.A OD1 no hydrogen 3.167 N/A SER 235.A OG ARG 215.A O no hydrogen 2.685 N/A SER 236.A N ARG 19.A O no hydrogen 3.102 N/A LYS 237.A N TYR 212.A O no hydrogen 2.830 N/A LYS 237.A NZ THR 243.A O no hydrogen 3.031 N/A ALA 242.A N GLU 239.A O no hydrogen 2.976 N/A GLN 247.A N ASP 245.A OD1 no hydrogen 3.096 N/A GLN 247.A NE2 GLU 251.A OE2 no hydrogen 3.486 N/A LEU 248.A N ASP 245.A O no hydrogen 3.061 N/A ILE 249.A N ASN 246.A O no hydrogen 2.928 N/A ALA 250.A N ASN 246.A O no hydrogen 3.320 N/A GLU 251.A N GLN 247.A O no hydrogen 2.874 N/A ALA 252.A N LEU 248.A O no hydrogen 3.072 N/A THR 253.A N ILE 249.A O no hydrogen 3.030 N/A THR 253.A OG1 ILE 249.A O no hydrogen 2.956 N/A GLU 254.A N ALA 250.A O no hydrogen 3.087 N/A VAL 255.A N GLU 251.A O no hydrogen 3.165 N/A ILE 256.A N ALA 252.A O no hydrogen 3.141 N/A VAL 257.A N THR 253.A O no hydrogen 2.902 N/A LYS 258.A N GLU 254.A O no hydrogen 3.107 N/A ALA 259.A N VAL 255.A O no hydrogen 3.119 N/A LEU 260.A N ILE 256.A O no hydrogen 3.001 N/A LEU 260.A N VAL 257.A O no hydrogen 3.376 N/A