Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4mwa_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 1.A ND2 ARG 182.A O no hydrogen 3.334 N/A THR 3.A OG1 ALA 181.A O no hydrogen 2.935 N/A HIS 4.A ND1 THR 6.A OG1 no hydrogen 3.019 N/A ARG 5.A N GLY 216.A O no hydrogen 3.025 N/A ARG 5.A NE GLY 218.A O no hydrogen 2.901 N/A ARG 5.A NH1 LEU 213.A O no hydrogen 3.094 N/A ARG 5.A NH1 ILE 217.A O no hydrogen 3.146 N/A ARG 5.A NH2 ASN 22.A OD1 no hydrogen 2.892 N/A THR 6.A N HIS 4.A ND1 no hydrogen 3.246 N/A THR 6.A OG1 HIS 4.A ND1 no hydrogen 3.019 N/A LYS 7.A N.A HIS 4.A O no hydrogen 2.887 N/A LYS 7.A N.B HIS 4.A O no hydrogen 2.909 N/A LYS 7.A NZ.B THR 6.A OG1 no hydrogen 2.939 N/A THR 8.A OG1 ARG 5.A O no hydrogen 2.736 N/A THR 8.A OG1 ASN 219.A OD1 no hydrogen 2.829 N/A ARG 9.A N ASP 185.A O no hydrogen 2.937 N/A ARG 9.A NH1 ASP 161.A OD1 no hydrogen 3.000 N/A ARG 9.A NH2 ASP 161.A OD1 no hydrogen 3.546 N/A VAL 11.A N ILE 18.A O no hydrogen 2.870 N/A VAL 13.A N LEU 16.A O no hydrogen 2.842 N/A LEU 16.A N VAL 13.A O no hydrogen 2.890 N/A ILE 18.A N VAL 11.A O no hydrogen 2.656 N/A GLY 20.A N THR 8.A OG1 no hydrogen 3.257 N/A ILE 25.A N ASN 219.A O no hydrogen 2.957 N/A ILE 26.A N GLN 52.A OE1 no hydrogen 2.973 N/A GLN 27.A N LEU 221.A O no hydrogen 2.976 N/A SER 28.A N VAL 53.A O no hydrogen 3.133 N/A SER 28.A OG PRO 229.A O no hydrogen 3.221 N/A SER 28.A OG GLU 232.A OE1 no hydrogen 2.984 N/A THR 29.A N ARG 55.A O no hydrogen 3.060 N/A THR 29.A OG1 ARG 55.A O no hydrogen 3.382 N/A THR 30.A N GLU 42.A OE2 no hydrogen 2.611 N/A THR 30.A OG1 GLU 42.A OE1 no hydrogen 2.744 N/A THR 30.A OG1 GLU 42.A OE2 no hydrogen 3.560 N/A THR 31.A OG1 THR 39.A OG1 no hydrogen 2.738 N/A THR 33.A OG1 ALA 57.A O no hydrogen 2.608 N/A ASP 35.A N LYS 32.A O no hydrogen 2.700 N/A THR 39.A N ASP 35.A O no hydrogen 2.855 N/A THR 39.A OG1 THR 31.A OG1 no hydrogen 2.738 N/A THR 39.A OG1 LYS 32.A O no hydrogen 2.643 N/A THR 39.A OG1 ASP 35.A O no hydrogen 2.952 N/A VAL 40.A N VAL 36.A O no hydrogen 2.713 N/A ALA 41.A N GLU 37.A O no hydrogen 2.755 N/A GLU 42.A N ALA 38.A O no hydrogen 3.305 N/A ILE 43.A N.A THR 39.A O no hydrogen 3.011 N/A ILE 43.A N.B THR 39.A O no hydrogen 3.009 N/A LYS 44.A N VAL 40.A O no hydrogen 2.847 N/A LYS 44.A NZ GLN 73.A O no hydrogen 3.293 N/A ARG 45.A N ALA 41.A O no hydrogen 3.239 N/A ARG 45.A NH1 ASP 228.A OD1 no hydrogen 2.926 N/A ARG 45.A NH2 ASP 228.A OD1 no hydrogen 3.520 N/A LEU 46.A N GLU 42.A O no hydrogen 2.924 N/A GLU 47.A N ILE 43.A O.A no hydrogen 2.672 N/A GLU 47.A N ILE 43.A O.B no hydrogen 2.723 N/A GLU 48.A N LYS 44.A O no hydrogen 3.236 N/A ALA 49.A N ARG 45.A O no hydrogen 2.945 N/A GLY 50.A N GLU 47.A O no hydrogen 2.630 N/A CYS 51.A N LEU 46.A O no hydrogen 3.057 N/A CYS 51.A SG VAL 53.A O no hydrogen 3.054 N/A GLN 52.A N ILE 26.A O no hydrogen 2.904 N/A GLN 52.A NE2 SER 247.A O no hydrogen 2.785 N/A VAL 53.A N ILE 26.A O no hydrogen 3.035 N/A VAL 54.A N PRO 77.A O no hydrogen 3.028 N/A ARG 55.A N SER 28.A O no hydrogen 3.087 N/A VAL 56.A N VAL 79.A O no hydrogen 2.863 N/A ALA 63.A N ASP 60.A OD1 no hydrogen 3.288 N/A ALA 64.A N ASP 60.A O no hydrogen 3.178 N/A ASN 65.A N GLU 61.A O no hydrogen 2.934 N/A ALA 66.A N ALA 63.A O no hydrogen 3.231 N/A ILE 70.A N ALA 66.A O no hydrogen 2.931 N/A LYS 71.A N ILE 67.A O no hydrogen 3.139 N/A LYS 71.A NZ GLY 96.A O no hydrogen 2.377 N/A LYS 71.A NZ ASP 98.A OD2 no hydrogen 2.435 N/A LYS 72.A N ALA 68.A O no hydrogen 3.246 N/A GLN 73.A N ILE 70.A O no hydrogen 3.165 N/A ILE 74.A N ILE 70.A O no hydrogen 3.202 N/A ASN 75.A N GLU 47.A OE2 no hydrogen 2.835 N/A LEU 78.A N ASP 98.A OD2 no hydrogen 3.070 N/A VAL 79.A N VAL 54.A O no hydrogen 2.750 N/A ALA 80.A N LYS 99.A O no hydrogen 2.894 N/A ILE 82.A N ARG 101.A O no hydrogen 3.246 N/A LEU 90.A N TYR 86.A O no hydrogen 3.046 N/A LYS 91.A N ARG 87.A O no hydrogen 2.784 N/A ALA 92.A N LEU 88.A O no hydrogen 2.782 N/A ILE 93.A N ALA 89.A O no hydrogen 3.026 N/A GLU 94.A N LEU 90.A O no hydrogen 3.065 N/A GLY 95.A N LYS 91.A O no hydrogen 3.038 N/A GLY 96.A N ILE 93.A O no hydrogen 3.157 N/A ILE 97.A N ALA 92.A O no hydrogen 3.006 N/A ASP 98.A N LEU 78.A O no hydrogen 3.027 N/A VAL 100.A N PRO 118.A O no hydrogen 3.334 N/A ARG 101.A N ALA 80.A O no hydrogen 2.723 N/A ILE 102.A N ARG 120.A O no hydrogen 3.121 N/A ASN 103.A ND2 GLY 122.A O no hydrogen 2.640 N/A VAL 108.A N LYS 104.A O no hydrogen 2.848 N/A ASN 110.A N GLU 106.A O no hydrogen 2.942 N/A ALA 111.A N ALA 107.A O no hydrogen 3.009 N/A ALA 112.A N VAL 108.A O no hydrogen 2.822 N/A LYS 113.A N VAL 109.A O no hydrogen 2.468 N/A GLU 114.A N ASN 110.A O no hydrogen 2.963 N/A ARG 115.A N ALA 111.A O no hydrogen 3.218 N/A GLY 116.A N ALA 112.A O no hydrogen 3.181 N/A GLY 116.A N LYS 113.A O no hydrogen 3.230 N/A ILE 117.A N ALA 112.A O no hydrogen 3.172 N/A ILE 119.A N ASP 161.A O no hydrogen 3.013 N/A ARG 120.A N VAL 100.A O no hydrogen 3.152 N/A ARG 120.A NH1 SER 165.A OG no hydrogen 2.926 N/A ILE 121.A N ILE 163.A O no hydrogen 2.876 N/A GLY 122.A N ASN 103.A OD1 no hydrogen 2.718 N/A VAL 123.A N SER 165.A O no hydrogen 3.134 N/A ALA 125.A N LYS 166.A O no hydrogen 2.714 N/A GLY 126.A N ASN 124.A OD1 no hydrogen 2.443 N/A SER 127.A N ASN 124.A O no hydrogen 3.264 N/A LEU 133.A N GLU 129.A O no hydrogen 3.230 N/A GLU 134.A N ARG 130.A O no hydrogen 2.782 N/A LYS 135.A N HIS 131.A O no hydrogen 2.987 N/A LYS 135.A NZ TYR 136.A OH no hydrogen 3.450 N/A LYS 135.A NZ GLU 145.A OE1 no hydrogen 3.367 N/A LYS 135.A NZ GLU 145.A OE2 no hydrogen 2.819 N/A TYR 136.A N ILE 132.A O no hydrogen 2.914 N/A TYR 136.A OH GLU 145.A OE2 no hydrogen 2.552 N/A GLY 137.A N LEU 133.A O no hydrogen 2.720 N/A THR 140.A OG1 TYR 138.A O no hydrogen 3.297 N/A GLU 145.A N ASP 142.A O no hydrogen 3.152 N/A SER 146.A N GLY 143.A O no hydrogen 2.666 N/A LEU 148.A N VAL 144.A O no hydrogen 2.887 N/A HIS 149.A N GLU 145.A O no hydrogen 3.032 N/A HIS 150.A N SER 146.A O no hydrogen 3.279 N/A HIS 150.A ND1 SER 146.A O no hydrogen 2.570 N/A ILE 151.A N ALA 147.A O no hydrogen 2.950 N/A LYS 152.A N LEU 148.A O no hydrogen 2.862 N/A LEU 154.A N HIS 150.A O no hydrogen 3.461 N/A GLU 155.A N ILE 151.A O no hydrogen 3.008 N/A ASP 156.A N LYS 152.A O no hydrogen 2.932 N/A LEU 157.A N LEU 154.A O no hydrogen 2.777 N/A ASP 158.A N GLU 155.A O no hydrogen 3.135 N/A PHE 159.A N LEU 154.A O no hydrogen 3.230 N/A ILE 163.A N ILE 119.A O no hydrogen 3.280 N/A VAL 164.A N PRO 187.A O no hydrogen 3.050 N/A SER 165.A N ILE 121.A O no hydrogen 3.125 N/A SER 165.A OG ILE 121.A O no hydrogen 3.563 N/A LEU 172.A N ASP 169.A OD1 no hydrogen 3.067 N/A ALA 173.A N ASP 169.A O no hydrogen 2.874 N/A ILE 174.A N.A VAL 170.A O no hydrogen 2.826 N/A ILE 174.A N.B VAL 170.A O no hydrogen 2.828 N/A GLU 175.A N ASN 171.A O no hydrogen 3.124 N/A ALA 176.A N LEU 172.A O no hydrogen 2.947 N/A TYR 177.A N ALA 173.A O no hydrogen 3.188 N/A TYR 177.A OH HIS 189.A O no hydrogen 2.760 N/A GLU 178.A N ILE 174.A O.A no hydrogen 3.062 N/A GLU 178.A N ILE 174.A O.B no hydrogen 3.102 N/A LYS 179.A N GLU 175.A O no hydrogen 2.862 N/A ALA 180.A N ALA 176.A O no hydrogen 2.706 N/A ALA 181.A N TYR 177.A O no hydrogen 2.894 N/A ARG 182.A N GLU 178.A O no hydrogen 3.396 N/A ALA 183.A N LYS 179.A O no hydrogen 3.357 N/A PHE 184.A N ALA 180.A O no hydrogen 3.258 N/A TYR 186.A OH GLU 155.A OE2 no hydrogen 2.442 N/A HIS 189.A N VAL 164.A O no hydrogen 2.641 N/A LEU 190.A N THR 220.A O no hydrogen 2.761 N/A THR 193.A N ALA 167.A O no hydrogen 3.170 N/A ALA 200.A N THR 197.A OG1 no hydrogen 3.014 N/A GLY 201.A N THR 197.A O no hydrogen 2.780 N/A THR 202.A N LEU 198.A O no hydrogen 2.973 N/A THR 202.A N PHE 199.A O no hydrogen 3.085 N/A THR 202.A OG1 LEU 198.A O no hydrogen 2.538 N/A VAL 203.A N PHE 199.A O no hydrogen 3.117 N/A LYS 204.A N ALA 200.A O no hydrogen 2.994 N/A LYS 204.A NZ SER 168.A O no hydrogen 3.001 N/A LYS 204.A NZ THR 193.A O no hydrogen 2.910 N/A LYS 204.A NZ SER 195.A OG no hydrogen 2.705 N/A SER 205.A N GLY 201.A O no hydrogen 3.165 N/A ALA 206.A N THR 202.A O no hydrogen 3.086 N/A ALA 207.A N VAL 203.A O no hydrogen 2.914 N/A GLY 208.A N LYS 204.A O no hydrogen 2.851 N/A LEU 209.A N SER 205.A O no hydrogen 2.844 N/A GLY 210.A N ALA 206.A O no hydrogen 2.817 N/A ALA 211.A N ALA 207.A O no hydrogen 3.248 N/A ILE 212.A N GLY 208.A O no hydrogen 3.032 N/A LEU 213.A N LEU 209.A O no hydrogen 2.706 N/A ASN 214.A N GLY 210.A O no hydrogen 2.803 N/A LYS 215.A N ILE 212.A O no hydrogen 2.972 N/A LYS 215.A NZ GLU 178.A OE2 no hydrogen 2.813 N/A GLY 216.A N LEU 213.A O no hydrogen 2.624 N/A ASN 219.A N LEU 188.A O no hydrogen 2.844 N/A ASN 219.A ND2 ARG 5.A O no hydrogen 3.010 N/A THR 220.A N LEU 188.A O no hydrogen 3.294 N/A THR 220.A OG1 ILE 25.A O no hydrogen 3.239 N/A LEU 221.A N ILE 25.A O no hydrogen 2.938 N/A ARG 222.A N LEU 190.A O no hydrogen 2.870 N/A LEU 225.A N GLU 232.A OE2 no hydrogen 2.945 N/A SER 226.A OG GLU 194.A OE1 no hydrogen 2.244 N/A SER 226.A OG GLU 194.A OE2 no hydrogen 3.086 N/A VAL 230.A N ASP 228.A OD1 no hydrogen 3.241 N/A GLU 231.A N ASP 228.A O no hydrogen 2.902 N/A GLU 232.A N PRO 229.A O no hydrogen 3.083 N/A LYS 234.A N VAL 230.A O no hydrogen 2.949 N/A VAL 235.A N GLU 231.A O no hydrogen 3.142 N/A ALA 236.A N GLU 232.A O no hydrogen 3.149 N/A ARG 237.A N VAL 233.A O no hydrogen 2.991 N/A GLU 238.A N LYS 234.A O no hydrogen 3.431 N/A LEU 239.A N VAL 235.A O no hydrogen 3.102 N/A LEU 240.A N ALA 236.A O no hydrogen 2.935 N/A LYS 241.A N ARG 237.A O no hydrogen 2.593 N/A LYS 241.A NZ GLU 238.A OE2 no hydrogen 3.112 N/A SER 242.A N GLU 238.A O no hydrogen 2.845 N/A SER 242.A OG GLU 238.A O no hydrogen 2.572 N/A PHE 243.A N LEU 239.A O no hydrogen 3.143 N/A GLY 244.A N LYS 241.A O no hydrogen 3.345 N/A LEU 245.A N LEU 240.A O no hydrogen 2.844 N/A