Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7wt5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N HIS 4.A NE2 no hydrogen 3.195 N/A GLY 2.A N GLU 265.A OE1 no hydrogen 2.656 N/A HIS 4.A N VAL 104.A O no hydrogen 2.811 N/A HIS 4.A ND1 ASP 30.A OD2 no hydrogen 2.643 N/A HIS 4.A NE2 GLN 181.A OE1 no hydrogen 3.053 N/A SER 5.A N ASP 30.A OD1 no hydrogen 2.789 N/A MET 6.A N CYS 102.A O no hydrogen 2.948 N/A ARG 7.A N TYR 28.A O no hydrogen 2.877 N/A ARG 7.A NH2 ASP 103.A OD1 no hydrogen 2.793 N/A TYR 8.A N PHE 100.A O no hydrogen 2.961 N/A PHE 9.A N VAL 26.A O no hydrogen 2.778 N/A TYR 10.A N MET 98.A O no hydrogen 2.773 N/A THR 11.A N ILE 24.A O no hydrogen 2.814 N/A SER 12.A N LEU 96.A O no hydrogen 2.860 N/A VAL 13.A N ARG 22.A O no hydrogen 2.924 N/A SER 14.A N HIS 94.A O no hydrogen 2.934 N/A SER 14.A OG HIS 94.A O no hydrogen 3.485 N/A ARG 15.A NE GLU 20.A O no hydrogen 3.478 N/A ARG 15.A NH1 ASP 40.A OD1 no hydrogen 3.569 N/A ARG 15.A NH2 ASP 40.A OD1 no hydrogen 2.803 N/A ARG 18.A N ARG 15.A O no hydrogen 2.851 N/A ARG 22.A N VAL 13.A O no hydrogen 3.011 N/A ARG 22.A NE ASP 38.A OD1 no hydrogen 2.904 N/A ARG 22.A NH2 ASP 38.A OD2 no hydrogen 2.850 N/A PHE 23.A N SER 39.A OG no hydrogen 2.816 N/A ILE 24.A N THR 11.A O no hydrogen 2.885 N/A ALA 25.A N PHE 37.A O no hydrogen 2.827 N/A VAL 26.A N PHE 9.A O no hydrogen 2.903 N/A GLY 27.A N VAL 35.A O no hydrogen 3.147 N/A TYR 28.A N ARG 7.A O no hydrogen 2.686 N/A VAL 29.A N THR 32.A O no hydrogen 2.931 N/A ASP 30.A N SER 5.A O no hydrogen 2.804 N/A THR 32.A N VAL 29.A O no hydrogen 2.838 N/A THR 32.A OG1 TYR 210.A OH no hydrogen 2.786 N/A GLN 33.A NE2 VAL 35.A O no hydrogen 3.021 N/A PHE 34.A N GLY 27.A O no hydrogen 2.835 N/A ARG 36.A N GLU 47.A O no hydrogen 3.000 N/A ARG 36.A NE GLU 47.A OE1.A no hydrogen 2.986 N/A ARG 36.A NH2 GLU 47.A OE1.A no hydrogen 3.536 N/A PHE 37.A N ALA 25.A O no hydrogen 2.797 N/A SER 39.A N PHE 23.A O no hydrogen 2.835 N/A SER 39.A OG PHE 23.A O no hydrogen 3.425 N/A ASP 40.A N ASP 38.A OD1 no hydrogen 2.838 N/A ALA 41.A N ASP 38.A O no hydrogen 2.850 N/A SER 43.A OG GLU 47.A OE1.B no hydrogen 3.081 N/A SER 43.A OG GLU 47.A OE2.A no hydrogen 2.833 N/A GLN 44.A NE2 SER 39.A O no hydrogen 2.928 N/A GLN 44.A NE2 ALA 41.A O no hydrogen 2.684 N/A ARG 45.A N SER 43.A OG no hydrogen 3.076 N/A ARG 45.A NH1 ASP 62.A OD1 no hydrogen 2.966 N/A ARG 45.A NH2 ASP 62.A OD1 no hydrogen 3.025 N/A MET 46.A N THR 65.A OG1 no hydrogen 3.025 N/A GLU 47.A N ARG 36.A O no hydrogen 2.862 N/A ARG 49.A N PHE 34.A O no hydrogen 2.749 N/A ILE 53.A N ALA 50.A O no hydrogen 3.276 N/A GLU 54.A N PRO 51.A O no hydrogen 3.100 N/A GLN 55.A N TRP 52.A O no hydrogen 3.351 N/A GLU 56.A N.A ILE 53.A O no hydrogen 3.220 N/A GLU 56.A N.B ILE 53.A O no hydrogen 3.160 N/A GLU 59.A N GLU 59.A OE1 no hydrogen 2.778 N/A TYR 60.A N GLY 57.A O.B no hydrogen 3.110 N/A TYR 60.A OH TYR 172.A OH no hydrogen 2.655 N/A TRP 61.A N GLY 57.A O.A no hydrogen 3.457 N/A ASP 62.A N PRO 58.A O no hydrogen 3.047 N/A GLU 63.A N GLU 59.A O no hydrogen 2.858 N/A GLU 64.A N TYR 60.A O no hydrogen 2.760 N/A THR 65.A N TRP 61.A O no hydrogen 2.960 N/A THR 65.A OG1 TRP 61.A O no hydrogen 2.713 N/A GLY 66.A N ASP 62.A O no hydrogen 2.927 N/A LYS 67.A N GLU 63.A O no hydrogen 2.994 N/A LYS 67.A NZ GLU 64.A OE2 no hydrogen 2.886 N/A VAL 68.A N GLU 64.A O no hydrogen 3.052 N/A LYS 69.A N THR 65.A O no hydrogen 3.085 N/A ALA 70.A N GLY 66.A O no hydrogen 3.028 N/A HIS 71.A N LYS 67.A O no hydrogen 2.834 N/A HIS 71.A NE2 ASP 75.A OD2 no hydrogen 2.796 N/A SER 72.A N VAL 68.A O no hydrogen 2.867 N/A SER 72.A OG LYS 69.A O no hydrogen 2.880 N/A GLN 73.A N LYS 69.A O no hydrogen 3.083 N/A GLN 73.A NE2.A GLU 77.A OE2 no hydrogen 3.386 N/A THR 74.A N ALA 70.A O no hydrogen 3.021 N/A THR 74.A OG1 ALA 70.A O no hydrogen 3.322 N/A ASP 75.A N HIS 71.A O no hydrogen 2.953 N/A ARG 76.A N SER 72.A O no hydrogen 2.936 N/A ARG 76.A NH1.B GLU 20.A OE2 no hydrogen 3.175 N/A ARG 76.A NH2.B GLN 73.A OE1.B no hydrogen 2.608 N/A GLU 77.A N GLN 73.A O no hydrogen 3.009 N/A ASN 78.A N THR 74.A O no hydrogen 2.781 N/A ASN 78.A ND2 ASP 75.A OD1 no hydrogen 3.289 N/A LEU 79.A N ASP 75.A O no hydrogen 2.908 N/A ARG 80.A N.A ARG 76.A O no hydrogen 3.442 N/A ARG 80.A N.B ARG 76.A O no hydrogen 3.445 N/A ARG 80.A N.B GLU 77.A O no hydrogen 3.028 N/A ARG 80.A NH1.B GLU 90.A OE2 no hydrogen 2.695 N/A ILE 81.A N GLU 77.A O no hydrogen 2.975 N/A ALA 82.A N ASN 78.A O no hydrogen 3.009 N/A LEU 83.A N LEU 79.A O no hydrogen 3.136 N/A ARG 84.A N ARG 80.A O.A no hydrogen 3.252 N/A ARG 84.A N ARG 80.A O.B no hydrogen 3.212 N/A TYR 85.A N ILE 81.A O no hydrogen 2.881 N/A TYR 86.A N ALA 82.A O no hydrogen 2.897 N/A TYR 86.A OH ASP 138.A OD1 no hydrogen 3.345 N/A TYR 86.A OH ASP 138.A OD2 no hydrogen 2.617 N/A ASN 87.A N ARG 84.A O no hydrogen 3.122 N/A GLN 88.A N LEU 83.A O no hydrogen 2.921 N/A ALA 91.A N SER 89.A OG no hydrogen 3.103 N/A SER 93.A OG SER 14.A O no hydrogen 3.534 N/A HIS 94.A N SER 14.A OG no hydrogen 2.762 N/A HIS 94.A ND1 ASP 120.A OD2 no hydrogen 2.697 N/A THR 95.A N ASP 120.A OD1 no hydrogen 2.857 N/A LEU 96.A N SER 12.A O no hydrogen 2.792 N/A GLN 97.A N ALA 118.A O no hydrogen 2.844 N/A MET 98.A N TYR 10.A O no hydrogen 2.937 N/A MET 99.A N GLN 116.A O no hydrogen 2.855 N/A PHE 100.A N TYR 8.A O no hydrogen 3.226 N/A GLY 101.A N TYR 114.A O no hydrogen 3.106 N/A CYS 102.A N MET 6.A O no hydrogen 3.068 N/A ASP 103.A N ARG 112.A O.A no hydrogen 2.809 N/A ASP 103.A N ARG 112.A O.B no hydrogen 2.864 N/A ASP 103.A N ARG 112.A O.C no hydrogen 2.813 N/A VAL 104.A N HIS 4.A O no hydrogen 2.875 N/A GLY 105.A N ARG 109.A O no hydrogen 2.774 N/A SER 106.A N GLY 2.A O no hydrogen 2.726 N/A SER 106.A OG GLY 2.A O no hydrogen 3.302 N/A GLY 108.A N GLY 105.A O no hydrogen 2.840 N/A ARG 109.A N ASP 107.A OD1 no hydrogen 2.924 N/A LEU 111.A N ASP 103.A O no hydrogen 2.788 N/A ARG 112.A N.A ASP 103.A O no hydrogen 3.401 N/A ARG 112.A N.B ASP 103.A O no hydrogen 3.416 N/A ARG 112.A N.C ASP 103.A O no hydrogen 3.410 N/A ARG 112.A NE.B GLY 113.A O no hydrogen 3.217 N/A ARG 112.A NE.C ASP 103.A OD2 no hydrogen 2.369 N/A TYR 114.A N GLY 101.A O no hydrogen 2.768 N/A GLN 116.A N MET 99.A O no hydrogen 2.839 N/A TYR 117.A N ILE 125.A O no hydrogen 2.745 N/A TYR 117.A OH ASP 75.A OD1 no hydrogen 2.700 N/A ALA 118.A N GLN 97.A O no hydrogen 2.827 N/A TYR 119.A N LYS 122.A O no hydrogen 2.858 N/A TYR 119.A OH GLN 88.A OE1 no hydrogen 2.660 N/A ASP 120.A N THR 95.A O no hydrogen 2.783 N/A LYS 122.A N TYR 119.A O no hydrogen 3.052 N/A TYR 124.A N TYR 117.A O no hydrogen 2.829 N/A TYR 124.A OH THR 144.A OG1 no hydrogen 2.824 N/A ILE 125.A N TYR 117.A O no hydrogen 3.332 N/A ALA 126.A N THR 135.A O no hydrogen 2.932 N/A LEU 127.A N HIS 115.A O no hydrogen 2.921 N/A LYS 128.A N SER 133.A O no hydrogen 2.906 N/A LYS 128.A NZ THR 135.A OG1 no hydrogen 2.622 N/A LEU 131.A N LYS 128.A O no hydrogen 2.922 N/A ARG 132.A N ASP 130.A OD1 no hydrogen 3.086 N/A THR 135.A N ALA 126.A O no hydrogen 2.737 N/A ALA 137.A N TYR 124.A O no hydrogen 3.099 N/A ALA 141.A N ASP 138.A OD1 no hydrogen 2.914 N/A GLN 142.A N ASP 138.A O no hydrogen 3.283 N/A GLN 142.A N MET 139.A O no hydrogen 3.149 N/A ILE 143.A N ALA 140.A O no hydrogen 3.028 N/A THR 144.A OG1 TYR 124.A OH no hydrogen 2.824 N/A LYS 145.A N ALA 141.A O no hydrogen 2.842 N/A LYS 145.A NZ TRP 134.A O no hydrogen 2.924 N/A ARG 146.A N GLN 142.A O no hydrogen 2.988 N/A LYS 147.A N ILE 143.A O no hydrogen 3.109 N/A TRP 148.A N THR 144.A O no hydrogen 2.825 N/A GLU 149.A N LYS 145.A O no hydrogen 2.795 N/A ALA 150.A N ARG 146.A O no hydrogen 3.077 N/A ALA 151.A N LYS 147.A O no hydrogen 3.257 N/A HIS 152.A N GLU 149.A O no hydrogen 3.190 N/A HIS 152.A ND1 GLU 155.A OE2 no hydrogen 2.728 N/A VAL 153.A N TRP 148.A O no hydrogen 3.031 N/A GLN 156.A N HIS 152.A O no hydrogen 3.298 N/A GLN 156.A NE2 ALA 151.A O no hydrogen 3.067 N/A GLN 156.A NE2 HIS 152.A O no hydrogen 3.630 N/A GLN 157.A N VAL 153.A O no hydrogen 2.945 N/A ARG 158.A N ALA 154.A O no hydrogen 2.808 N/A ARG 158.A NE GLU 162.A OE2 no hydrogen 2.711 N/A ARG 158.A NH2 GLU 162.A OE2 no hydrogen 3.547 N/A ALA 159.A N GLU 155.A O no hydrogen 3.072 N/A TYR 160.A N GLN 156.A O no hydrogen 3.044 N/A LEU 161.A N GLN 157.A O no hydrogen 2.794 N/A GLU 162.A N ARG 158.A O no hydrogen 2.903 N/A GLY 163.A N TYR 160.A O no hydrogen 3.172 N/A CYS 165.A N TYR 160.A O no hydrogen 2.960 N/A ASP 167.A N GLY 163.A O no hydrogen 2.869 N/A GLY 168.A N THR 164.A O no hydrogen 2.768 N/A LEU 169.A N CYS 165.A O no hydrogen 3.000 N/A ARG 170.A N VAL 166.A O no hydrogen 3.034 N/A ARG 170.A NE GLY 108.A O no hydrogen 3.145 N/A ARG 170.A NH2 GLY 108.A O no hydrogen 2.662 N/A ARG 171.A N ASP 167.A O no hydrogen 3.086 N/A ARG 171.A NE.A GLU 56.A OE1.A no hydrogen 2.667 N/A ARG 171.A NE.A GLU 56.A OE1.B no hydrogen 2.481 N/A ARG 171.A NE.A GLU 56.A OE2.A no hydrogen 2.917 N/A ARG 171.A NH1.C GLU 56.A OE1.A no hydrogen 2.494 N/A ARG 171.A NH1.C GLU 56.A OE1.B no hydrogen 2.718 N/A ARG 171.A NH2.A GLU 56.A OE1.A no hydrogen 2.841 N/A ARG 171.A NH2.A GLU 56.A OE1.B no hydrogen 2.965 N/A ARG 171.A NH2.A GLU 56.A OE2.B no hydrogen 3.103 N/A TYR 172.A N GLY 168.A O no hydrogen 2.893 N/A LEU 173.A N LEU 169.A O no hydrogen 2.897 N/A GLU 174.A N ARG 170.A O no hydrogen 3.008 N/A ASN 175.A N ARG 171.A O no hydrogen 2.997 N/A ASN 175.A ND2 GLU 56.A OE2.A no hydrogen 3.378 N/A GLY 176.A N TYR 172.A O no hydrogen 2.774 N/A LYS 177.A N GLU 174.A O no hydrogen 3.233 N/A THR 179.A N GLY 176.A O no hydrogen 3.054 N/A THR 179.A OG1 GLY 176.A O no hydrogen 3.274 N/A LEU 180.A N GLY 176.A O no hydrogen 2.732 N/A GLN 181.A N LYS 177.A O no hydrogen 3.273 N/A ARG 182.A N THR 179.A O no hydrogen 3.432 N/A ARG 182.A NE.A ASP 184.A OD2 no hydrogen 3.103 N/A ARG 182.A NE.B THR 179.A O no hydrogen 2.969 N/A ARG 182.A NH1.A THR 179.A O no hydrogen 2.632 N/A ARG 182.A NH1.B GLY 240.A O no hydrogen 3.043 N/A ARG 182.A NH2.B ASP 184.A OD2 no hydrogen 3.189 N/A ARG 182.A NH2.B GLY 240.A O no hydrogen 3.417 N/A THR 183.A OG1 THR 183.A O no hydrogen 2.563 N/A LYS 187.A N LEU 207.A O no hydrogen 2.747 N/A HIS 189.A N TRP 205.A O no hydrogen 3.270 N/A THR 191.A N ARG 203.A O no hydrogen 2.855 N/A THR 191.A OG1 HIS 193.A NE2 no hydrogen 2.746 N/A HIS 192.A NE2 GLU 255.A OE2 no hydrogen 2.990 N/A HIS 193.A N THR 201.A O no hydrogen 2.751 N/A HIS 193.A NE2 THR 191.A OG1 no hydrogen 2.746 N/A ILE 195.A N GLU 199.A O no hydrogen 2.935 N/A SER 196.A N GLU 199.A O no hydrogen 3.148 N/A HIS 198.A N SER 196.A OG no hydrogen 3.060 N/A GLU 199.A N SER 196.A OG no hydrogen 3.149 N/A ALA 200.A N VAL 250.A O no hydrogen 3.021 N/A THR 201.A N HIS 193.A O no hydrogen 2.631 N/A LEU 202.A N VAL 248.A O no hydrogen 2.853 N/A ARG 203.A N THR 191.A O no hydrogen 2.902 N/A CYS 204.A N ALA 246.A O no hydrogen 2.691 N/A TRP 205.A N HIS 189.A O no hydrogen 2.754 N/A ALA 206.A N LYS 244.A O no hydrogen 2.819 N/A LEU 207.A N LYS 187.A O no hydrogen 2.909 N/A PHE 209.A N PHE 242.A O no hydrogen 3.308 N/A TYR 210.A N ASP 184.A O no hydrogen 3.037 N/A TYR 210.A OH THR 32.A OG1 no hydrogen 2.786 N/A ALA 212.A N ASP 31.A OD2 no hydrogen 2.798 N/A THR 215.A N GLN 263.A O no hydrogen 2.995 N/A THR 217.A N HIS 261.A O no hydrogen 3.039 N/A TRP 218.A NE1 ALA 246.A O no hydrogen 2.995 N/A GLN 219.A N THR 259.A O no hydrogen 2.857 N/A ARG 220.A N GLU 223.A O no hydrogen 2.891 N/A ASP 221.A N ARG 257.A O no hydrogen 2.919 N/A GLU 223.A N ARG 220.A O no hydrogen 3.007 N/A GLN 225.A N TRP 218.A O no hydrogen 3.125 N/A ASP 228.A N GLN 225.A O no hydrogen 3.090 N/A THR 229.A OG1 GLN 225.A O no hydrogen 2.398 N/A GLU 230.A N ALA 247.A O no hydrogen 2.821 N/A VAL 232.A N TRP 245.A O no hydrogen 3.410 N/A ARG 235.A N GLN 243.A O no hydrogen 2.918 N/A ARG 235.A NE GLN 243.A OE1 no hydrogen 2.943 N/A ARG 235.A NH2 GLN 243.A OE1 no hydrogen 3.123 N/A ALA 237.A N THR 241.A O no hydrogen 2.884 N/A THR 241.A N ASP 239.A OD1 no hydrogen 3.134 N/A THR 241.A OG1 ASP 239.A OD1 no hydrogen 2.728 N/A PHE 242.A N PHE 209.A O no hydrogen 2.794 N/A GLN 243.A N ARG 235.A O no hydrogen 2.823 N/A LYS 244.A N ALA 206.A O no hydrogen 2.986 N/A LYS 244.A NZ VAL 232.A O no hydrogen 2.842 N/A LYS 244.A NZ THR 234.A OG1 no hydrogen 3.056 N/A ALA 246.A N CYS 204.A O no hydrogen 2.923 N/A ALA 247.A N GLU 230.A O no hydrogen 2.829 N/A VAL 248.A N LEU 202.A O no hydrogen 2.876 N/A VAL 250.A N ALA 200.A O no hydrogen 2.881 N/A SER 252.A N HIS 198.A O no hydrogen 2.821 N/A SER 252.A OG ASP 197.A O no hydrogen 2.860 N/A GLU 254.A N PRO 251.A O no hydrogen 3.060 N/A GLU 255.A N GLU 255.A OE1 no hydrogen 2.779 N/A GLN 256.A NE2 TRP 275.A O no hydrogen 3.136 N/A ARG 257.A N GLU 254.A O no hydrogen 3.025 N/A ARG 257.A NE ASP 221.A OD1 no hydrogen 3.403 N/A ARG 257.A NE ASP 221.A OD2 no hydrogen 3.181 N/A ARG 257.A NH1 GLU 254.A OE1 no hydrogen 2.606 N/A ARG 257.A NH2 ASP 221.A OD2 no hydrogen 2.681 N/A TYR 258.A N GLU 255.A O no hydrogen 3.080 N/A THR 259.A N GLN 219.A O no hydrogen 3.001 N/A THR 259.A OG1 HIS 261.A NE2 no hydrogen 2.612 N/A CYS 260.A N LEU 273.A O no hydrogen 2.872 N/A HIS 261.A N THR 217.A O no hydrogen 2.773 N/A HIS 261.A NE2 THR 259.A OG1 no hydrogen 2.612 N/A VAL 262.A N LEU 271.A O no hydrogen 2.965 N/A GLN 263.A N THR 215.A O no hydrogen 2.935 N/A HIS 264.A NE2 PRO 211.A O no hydrogen 2.935 N/A GLY 266.A N HIS 264.A ND1 no hydrogen 2.961 N/A LEU 267.A N HIS 264.A O no hydrogen 2.830 N/A LEU 271.A N VAL 262.A O no hydrogen 2.964 N/A LEU 273.A N CYS 260.A O no hydrogen 2.757 N/A ARG 274.A NH1.B GLN 256.A O no hydrogen 3.130 N/A ARG 274.A NH2.B GLN 256.A O no hydrogen 2.902 N/A