Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4yps_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N GLU 57.A OE2 no hydrogen 3.058 N/A HIS 8.A ND1 VAL 6.A O no hydrogen 2.923 N/A ILE 9.A N VAL 73.A O no hydrogen 2.788 N/A ARG 11.A N GLU 76.A OE2 no hydrogen 2.535 N/A ASP 13.A N LYS 10.A O no hydrogen 3.225 N/A ILE 14.A N ARG 11.A O no hydrogen 2.869 N/A VAL 15.A N GLU 29.A O no hydrogen 3.135 N/A LYS 17.A N LEU 27.A O no hydrogen 2.669 N/A TRP 18.A N LEU 27.A O no hydrogen 3.411 N/A LEU 20.A N VAL 25.A O no hydrogen 2.721 N/A GLY 21.A N VAL 25.A O no hydrogen 3.380 N/A LYS 24.A NZ GLU 19.A OE1 no hydrogen 3.026 N/A VAL 25.A N GLY 21.A O no hydrogen 3.140 N/A PHE 26.A N VAL 41.A O no hydrogen 2.812 N/A LEU 27.A N TRP 18.A O no hydrogen 2.713 N/A ALA 28.A N VAL 39.A O no hydrogen 2.873 N/A GLU 29.A N VAL 15.A O no hydrogen 2.946 N/A CYS 30.A N MET 37.A O no hydrogen 2.501 N/A CYS 30.A SG ASP 13.A O no hydrogen 3.927 N/A HIS 31.A N ASP 13.A O no hydrogen 3.276 N/A VAL 39.A N ALA 28.A O no hydrogen 2.746 N/A ALA 40.A N PHE 84.A O no hydrogen 2.848 N/A VAL 41.A N PHE 26.A O no hydrogen 2.885 N/A LYS 42.A N MET 82.A O no hydrogen 2.798 N/A LEU 44.A N LEU 80.A O no hydrogen 3.222 N/A SER 45.A OG SER 47.A OG no hydrogen 2.997 N/A SER 47.A OG SER 45.A OG no hydrogen 2.997 N/A ALA 48.A N SER 45.A OG no hydrogen 3.259 N/A ARG 49.A N SER 45.A O no hydrogen 3.168 N/A GLN 50.A N GLU 46.A O no hydrogen 2.934 N/A ASP 51.A N SER 47.A O no hydrogen 3.173 N/A PHE 52.A N ALA 48.A O no hydrogen 2.734 N/A GLN 53.A N ARG 49.A O no hydrogen 3.052 N/A ARG 54.A N GLN 50.A O no hydrogen 2.918 N/A GLU 55.A N ASP 51.A O no hydrogen 2.726 N/A ALA 56.A N PHE 52.A O no hydrogen 2.786 N/A GLU 57.A N GLN 53.A O no hydrogen 2.950 N/A LEU 58.A N ARG 54.A O no hydrogen 3.052 N/A LEU 59.A N GLU 55.A O no hydrogen 2.733 N/A THR 60.A N ALA 56.A O no hydrogen 2.930 N/A THR 60.A OG1 ALA 56.A O no hydrogen 2.816 N/A MET 61.A N GLU 57.A O no hydrogen 3.263 N/A MET 61.A N LEU 58.A O no hydrogen 2.947 N/A LEU 62.A N LEU 58.A O no hydrogen 3.012 N/A GLN 63.A N TYR 135.A OH no hydrogen 3.063 N/A HIS 66.A N HIS 64.A ND1 no hydrogen 3.052 N/A HIS 66.A ND1 VAL 159.A O no hydrogen 3.091 N/A ILE 67.A N HIS 64.A O no hydrogen 2.782 N/A VAL 68.A N ILE 161.A O no hydrogen 3.130 N/A ARG 69.A N GLU 85.A OE1 no hydrogen 2.750 N/A PHE 70.A N GLN 63.A OE1 no hydrogen 3.515 N/A PHE 71.A N VAL 83.A O no hydrogen 2.734 N/A VAL 73.A N HIS 7.A O no hydrogen 2.941 N/A CYS 74.A N LEU 81.A O no hydrogen 2.984 N/A CYS 74.A SG ILE 9.A O no hydrogen 3.263 N/A LEU 81.A N CYS 74.A O no hydrogen 3.012 N/A MET 82.A N LYS 42.A O no hydrogen 2.969 N/A VAL 83.A N GLY 72.A O no hydrogen 2.918 N/A PHE 84.A N ALA 40.A O no hydrogen 2.737 N/A GLU 85.A N ARG 69.A O no hydrogen 2.865 N/A ARG 88.A NH1 GLN 155.A OE1 no hydrogen 2.596 N/A ARG 88.A NH2 GLU 110.A OE1 no hydrogen 3.237 N/A HIS 89.A N VAL 153.A O no hydrogen 2.978 N/A HIS 89.A NE2 ASP 111.A OD1 no hydrogen 2.974 N/A HIS 89.A NE2 ASP 111.A OD2 no hydrogen 2.994 N/A GLY 90.A N MET 87.A O no hydrogen 2.986 N/A LEU 92.A N CYS 151.A O no hydrogen 3.013 N/A ASN 93.A ND2 THR 148.A OG1 no hydrogen 3.111 N/A ASN 93.A ND2 GLU 209.A OE2 no hydrogen 3.496 N/A ASN 93.A ND2 GLY 214.A O no hydrogen 3.088 N/A ARG 94.A N ASP 91.A OD1 no hydrogen 2.872 N/A PHE 95.A N ASP 91.A O no hydrogen 2.925 N/A LEU 96.A N LEU 92.A O no hydrogen 2.827 N/A ARG 97.A N ASN 93.A O no hydrogen 3.115 N/A ARG 97.A NE ASN 93.A OD1 no hydrogen 3.293 N/A SER 98.A N ARG 94.A O no hydrogen 3.100 N/A SER 98.A OG PHE 95.A O no hydrogen 2.918 N/A HIS 99.A N PHE 95.A O no hydrogen 3.287 N/A HIS 99.A N LEU 96.A O no hydrogen 3.058 N/A GLY 100.A N ARG 97.A O no hydrogen 3.106 N/A ALA 103.A N GLY 100.A O no hydrogen 3.191 N/A GLY 118.A N GLN 121.A OE1 no hydrogen 2.597 N/A LEU 122.A N GLY 118.A O no hydrogen 2.932 N/A LEU 123.A N LEU 119.A O no hydrogen 2.939 N/A ALA 124.A N GLY 120.A O no hydrogen 3.048 N/A VAL 125.A N GLN 121.A O no hydrogen 3.031 N/A ALA 126.A N LEU 122.A O no hydrogen 3.021 N/A SER 127.A N LEU 123.A O no hydrogen 2.959 N/A GLN 128.A N ALA 124.A O no hydrogen 3.134 N/A GLN 128.A NE2 ALA 124.A O no hydrogen 3.301 N/A GLN 128.A NE2 LEU 157.A O no hydrogen 3.073 N/A VAL 129.A N VAL 125.A O no hydrogen 3.143 N/A ALA 130.A N ALA 126.A O no hydrogen 2.951 N/A ALA 131.A N SER 127.A O no hydrogen 2.944 N/A GLY 132.A N GLN 128.A O no hydrogen 3.145 N/A MET 133.A N VAL 129.A O no hydrogen 3.006 N/A VAL 134.A N ALA 130.A O no hydrogen 2.665 N/A TYR 135.A N ALA 131.A O no hydrogen 3.154 N/A LEU 136.A N GLY 132.A O no hydrogen 3.120 N/A ALA 137.A N MET 133.A O no hydrogen 2.846 N/A GLY 138.A N VAL 134.A O no hydrogen 2.914 N/A LEU 139.A N TYR 135.A O no hydrogen 3.301 N/A LEU 139.A N LEU 136.A O no hydrogen 3.010 N/A HIS 140.A N ALA 137.A O no hydrogen 2.768 N/A PHE 141.A N LEU 136.A O no hydrogen 2.987 N/A HIS 143.A N ASP 199.A OD2 no hydrogen 2.794 N/A ASP 145.A N HIS 143.A ND1 no hydrogen 2.990 N/A THR 148.A N GLU 209.A OE1 no hydrogen 2.920 N/A THR 148.A OG1 GLU 209.A OE2 no hydrogen 2.777 N/A ARG 149.A NE TYR 173.A OH no hydrogen 2.803 N/A ARG 149.A NH2 ASP 145.A OD1 no hydrogen 2.777 N/A ASN 150.A N ALA 147.A O no hydrogen 2.841 N/A ASN 150.A ND2 ASP 145.A O no hydrogen 2.787 N/A CYS 151.A N THR 148.A O no hydrogen 3.018 N/A CYS 151.A SG ALA 147.A O no hydrogen 3.836 N/A LEU 152.A N LYS 160.A O no hydrogen 2.770 N/A VAL 153.A N GLY 90.A O no hydrogen 2.943 N/A GLY 154.A N VAL 158.A O no hydrogen 2.769 N/A GLY 156.A N ASP 111.A OD1 no hydrogen 3.015 N/A LEU 157.A N GLY 154.A O no hydrogen 3.007 N/A VAL 158.A N GLN 155.A O no hydrogen 3.396 N/A VAL 159.A N GLN 128.A OE1 no hydrogen 2.995 N/A LYS 160.A N LEU 152.A O no hydrogen 2.915 N/A LYS 160.A NZ GLU 85.A OE1 no hydrogen 2.861 N/A ILE 161.A N HIS 66.A O no hydrogen 3.031 N/A GLY 162.A N ASN 150.A O no hydrogen 2.806 N/A ASP 167.A N GLU 22.A O no hydrogen 3.214 N/A TYR 169.A N ARG 166.A O no hydrogen 2.810 N/A TYR 169.A OH ASP 91.A OD1 no hydrogen 3.082 N/A TYR 169.A OH ASP 91.A OD2 no hydrogen 3.003 N/A SER 170.A N ASP 167.A O no hydrogen 3.331 N/A SER 170.A OG ASP 167.A O no hydrogen 3.100 N/A ASP 172.A N TYR 169.A O no hydrogen 2.807 N/A TYR 173.A N SER 170.A O no hydrogen 2.967 N/A TYR 173.A OH ASP 145.A OD1 no hydrogen 3.389 N/A TYR 173.A OH ASP 145.A OD2 no hydrogen 2.308 N/A TYR 174.A N LEU 179.A O no hydrogen 2.616 N/A VAL 176.A N THR 177.A O no hydrogen 2.723 N/A LEU 179.A N TYR 174.A O no hydrogen 2.822 N/A ARG 182.A NH1 PRO 217.A O no hydrogen 3.143 N/A ARG 182.A NH1 TRP 218.A O no hydrogen 2.828 N/A ARG 182.A NH1 LEU 221.A O no hydrogen 3.317 N/A ARG 182.A NH2 LEU 221.A O no hydrogen 2.696 N/A ARG 182.A NH2 ASN 223.A OD1 no hydrogen 3.365 N/A TRP 183.A N PRO 180.A O no hydrogen 2.901 N/A TRP 183.A NE1 GLU 209.A OE1 no hydrogen 2.970 N/A MET 184.A N ILE 181.A O no hydrogen 2.921 N/A GLU 187.A N GLU 187.A OE1 no hydrogen 2.845 N/A SER 188.A N PRO 185.A O no hydrogen 2.955 N/A SER 188.A OG LYS 193.A O no hydrogen 2.857 N/A ILE 189.A N PRO 185.A O no hydrogen 3.061 N/A LEU 190.A N PRO 186.A O no hydrogen 2.603 N/A TYR 191.A N GLU 187.A O no hydrogen 3.007 N/A ARG 192.A N SER 188.A O no hydrogen 3.081 N/A LYS 193.A N GLU 187.A O no hydrogen 3.154 N/A THR 195.A N SER 198.A OG no hydrogen 2.530 N/A THR 195.A OG1 GLU 197.A OE1 no hydrogen 3.237 N/A THR 195.A OG1 SER 198.A OG no hydrogen 2.870 N/A THR 196.A OG1 GLU 197.A OE2 no hydrogen 2.920 N/A SER 198.A N THR 195.A O no hydrogen 2.967 N/A SER 198.A N THR 195.A OG1 no hydrogen 3.133 N/A SER 198.A OG GLU 187.A OE2 no hydrogen 3.514 N/A SER 198.A OG THR 195.A O no hydrogen 3.204 N/A SER 198.A OG THR 195.A OG1 no hydrogen 2.870 N/A ASP 199.A N THR 195.A O no hydrogen 3.211 N/A VAL 200.A N THR 196.A O no hydrogen 3.079 N/A TRP 201.A N GLU 197.A O no hydrogen 3.312 N/A SER 202.A N SER 198.A O no hydrogen 3.033 N/A SER 202.A OG TRP 183.A O no hydrogen 2.969 N/A SER 202.A OG SER 198.A O no hydrogen 3.308 N/A PHE 203.A N ASP 199.A O no hydrogen 2.753 N/A GLY 204.A N VAL 200.A O no hydrogen 3.163 N/A VAL 205.A N TRP 201.A O no hydrogen 3.223 N/A VAL 206.A N SER 202.A O no hydrogen 2.871 N/A LEU 207.A N PHE 203.A O no hydrogen 2.886 N/A TRP 208.A N GLY 204.A O no hydrogen 3.202 N/A TRP 208.A NE1 GLU 237.A O no hydrogen 2.799 N/A GLU 209.A N VAL 205.A O no hydrogen 2.860 N/A ILE 210.A N VAL 206.A O no hydrogen 2.874 N/A PHE 211.A N LEU 207.A O no hydrogen 3.057 N/A THR 212.A N GLU 209.A O no hydrogen 3.196 N/A THR 212.A OG1 TRP 208.A O no hydrogen 3.062 N/A THR 212.A OG1 GLU 209.A O no hydrogen 3.138 N/A TYR 213.A N ILE 210.A O no hydrogen 3.188 N/A GLY 214.A N GLU 209.A O no hydrogen 2.771 N/A LYS 215.A N THR 212.A OG1 no hydrogen 3.142 N/A GLN 216.A NE2 THR 171.A O no hydrogen 3.319 N/A GLN 216.A NE2 ASP 172.A OD1 no hydrogen 2.876 N/A LEU 221.A N TRP 218.A O no hydrogen 2.815 N/A SER 222.A N GLU 225.A OE1 no hydrogen 2.563 N/A GLU 225.A N SER 222.A OG no hydrogen 3.053 N/A ALA 226.A N SER 222.A O no hydrogen 2.939 N/A ILE 227.A N ASN 223.A O no hydrogen 3.056 N/A ASP 228.A N THR 224.A O no hydrogen 2.838 N/A CYS 229.A N GLU 225.A O no hydrogen 2.986 N/A CYS 229.A SG GLU 225.A O no hydrogen 3.546 N/A ILE 230.A N ALA 226.A O no hydrogen 2.836 N/A THR 231.A N ILE 227.A O no hydrogen 2.952 N/A THR 231.A OG1 ILE 227.A O no hydrogen 2.870 N/A THR 231.A OG1 ASP 228.A O no hydrogen 3.239 N/A GLN 232.A N ASP 228.A O no hydrogen 2.853 N/A ARG 234.A N CYS 229.A O no hydrogen 2.960 N/A ARG 234.A NH2 GLN 232.A OE1 no hydrogen 2.297 N/A ARG 238.A NH2 CYS 242.A O no hydrogen 2.558 N/A CYS 242.A N PRO 239.A O no hydrogen 2.864 N/A CYS 242.A SG PRO 243.A O no hydrogen 3.459 N/A GLU 245.A N GLU 245.A OE1 no hydrogen 2.767 N/A VAL 246.A N PRO 243.A O no hydrogen 2.912 N/A TYR 247.A N PRO 243.A O no hydrogen 2.945 N/A TYR 247.A OH LEU 236.A O no hydrogen 2.584 N/A ALA 248.A N PRO 244.A O no hydrogen 2.791 N/A ILE 249.A N GLU 245.A O no hydrogen 3.285 N/A MET 250.A N VAL 246.A O no hydrogen 2.910 N/A ARG 251.A N TYR 247.A O no hydrogen 2.859 N/A GLY 252.A N ALA 248.A O no hydrogen 3.046 N/A CYS 253.A N MET 250.A O no hydrogen 2.820 N/A CYS 253.A SG ILE 249.A O no hydrogen 3.455 N/A TRP 254.A N ARG 251.A O no hydrogen 3.086 N/A ARG 256.A NH2 THR 231.A O no hydrogen 2.954 N/A GLN 260.A N GLU 257.A O no hydrogen 3.018 N/A ARG 261.A N PRO 258.A O no hydrogen 3.045 N/A ARG 261.A NE GLN 255.A O no hydrogen 2.680 N/A ARG 261.A NH1 GLU 187.A OE1 no hydrogen 3.521 N/A ARG 261.A NH1 GLU 187.A OE2 no hydrogen 2.809 N/A ARG 261.A NH1 GLU 197.A O no hydrogen 2.971 N/A ARG 261.A NH2 GLU 187.A OE1 no hydrogen 2.762 N/A ARG 261.A NH2 GLN 255.A O no hydrogen 3.131 N/A ARG 261.A NH2 ARG 256.A O no hydrogen 3.197 N/A ASP 266.A N SER 263.A OG no hydrogen 3.035 N/A VAL 267.A N SER 263.A O no hydrogen 2.969 N/A HIS 268.A N ILE 264.A O no hydrogen 2.893 N/A ALA 269.A N LYS 265.A O no hydrogen 3.153 N/A ARG 270.A N ASP 266.A O no hydrogen 3.091 N/A LEU 271.A N VAL 267.A O no hydrogen 3.014 N/A GLN 272.A N HIS 268.A O no hydrogen 2.826 N/A ALA 273.A N ALA 269.A O no hydrogen 3.175 N/A ALA 273.A N ARG 270.A O no hydrogen 3.129 N/A LEU 274.A N ARG 270.A O no hydrogen 2.930 N/A ALA 275.A N LEU 271.A O no hydrogen 2.863 N/A GLN 276.A N GLN 272.A O no hydrogen 3.021 N/A ALA 277.A N LEU 274.A O no hydrogen 3.115 N/A