Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8xpz_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N GLU 28.A OE2 no hydrogen 2.899 N/A LEU 5.A N TYR 30.A OH no hydrogen 3.466 N/A ASN 8.A N VAL 17.A O no hydrogen 3.027 N/A ASN 8.A ND2 VAL 17.A O no hydrogen 3.551 N/A TYR 9.A N PRO 6.A O no hydrogen 3.060 N/A VAL 11.A N TRP 15.A O no hydrogen 2.736 N/A ARG 14.A N VAL 11.A O no hydrogen 3.145 N/A ARG 14.A NE ASP 34.A OD1 no hydrogen 3.175 N/A ARG 14.A NE ASP 34.A OD2 no hydrogen 3.117 N/A ARG 14.A NH2 ASP 34.A OD2 no hydrogen 2.984 N/A TRP 15.A N VAL 11.A O no hydrogen 3.097 N/A TRP 15.A NE1 ASP 34.A OD2 no hydrogen 3.181 N/A LYS 16.A N MET 33.A O no hydrogen 2.892 N/A LYS 16.A NZ ASN 8.A O no hydrogen 3.276 N/A VAL 17.A N TYR 9.A O no hydrogen 2.846 N/A LEU 18.A N GLU 31.A O no hydrogen 2.803 N/A LYS 19.A N GLU 31.A O no hydrogen 3.385 N/A LYS 20.A NZ GLU 28.A OE1 no hydrogen 3.228 N/A ILE 21.A N ILE 29.A O no hydrogen 3.080 N/A GLY 22.A N ILE 29.A O no hydrogen 3.198 N/A GLU 28.A N VAL 45.A O no hydrogen 2.947 N/A ILE 29.A N GLY 22.A O no hydrogen 3.468 N/A TYR 30.A N LEU 43.A O no hydrogen 2.669 N/A TYR 30.A OH LEU 5.A O no hydrogen 3.280 N/A TYR 30.A OH GLU 28.A OE2 no hydrogen 2.641 N/A GLU 31.A N LYS 19.A O no hydrogen 2.967 N/A ALA 32.A N VAL 41.A O no hydrogen 2.910 N/A MET 33.A N LYS 16.A O no hydrogen 2.863 N/A ASP 34.A N GLU 39.A O no hydrogen 3.007 N/A LEU 35.A N ARG 14.A O no hydrogen 2.659 N/A THR 37.A N ASP 34.A OD1 no hydrogen 2.818 N/A ARG 38.A N ASP 34.A O no hydrogen 2.598 N/A ARG 38.A NH1 LEU 35.A O no hydrogen 2.875 N/A ASN 40.A ND2 GLU 31.A OE2 no hydrogen 2.830 N/A VAL 41.A N ALA 32.A O no hydrogen 2.698 N/A ALA 42.A N MET 88.A O no hydrogen 3.059 N/A LEU 43.A N TYR 30.A O no hydrogen 2.766 N/A LYS 44.A N VAL 86.A O no hydrogen 2.911 N/A VAL 45.A N GLU 28.A O no hydrogen 2.839 N/A GLU 46.A N ASN 84.A O no hydrogen 2.764 N/A ALA 48.A N LYS 82.A O no hydrogen 3.134 N/A GLN 50.A N SER 47.A O no hydrogen 3.147 N/A GLN 50.A NE2 LYS 52.A O no hydrogen 2.879 N/A GLN 53.A NE2 GLN 50.A O no hydrogen 3.618 N/A VAL 54.A N GLU 46.A OE1 no hydrogen 2.904 N/A LEU 55.A N GLU 46.A OE1 no hydrogen 3.488 N/A MET 57.A N VAL 54.A O no hydrogen 3.045 N/A GLU 58.A N VAL 54.A O no hydrogen 3.146 N/A VAL 59.A N LEU 55.A O no hydrogen 3.185 N/A ALA 60.A N LYS 56.A O no hydrogen 3.144 N/A VAL 61.A N MET 57.A O no hydrogen 2.603 N/A LEU 62.A N GLU 58.A O no hydrogen 2.773 N/A LYS 63.A N VAL 59.A O no hydrogen 2.617 N/A LYS 63.A N ALA 60.A O no hydrogen 3.197 N/A LYS 64.A N ALA 60.A O no hydrogen 3.037 N/A LEU 65.A N VAL 61.A O no hydrogen 3.153 N/A GLN 66.A N LYS 63.A O no hydrogen 3.323 N/A GLN 66.A NE2 LEU 62.A O no hydrogen 2.944 N/A GLN 66.A NE2 CYS 72.A O no hydrogen 2.873 N/A LYS 68.A N LEU 65.A O no hydrogen 3.181 N/A HIS 70.A NE2 GLU 121.A OE1 no hydrogen 2.918 N/A CYS 72.A SG GLN 89.A O no hydrogen 3.651 N/A ARG 73.A N GLN 89.A OE1 no hydrogen 3.032 N/A PHE 74.A N GLN 66.A OE1 no hydrogen 2.963 N/A ILE 75.A N VAL 87.A O no hydrogen 2.960 N/A GLY 76.A N VAL 87.A O no hydrogen 3.230 N/A GLY 78.A N TYR 85.A O no hydrogen 3.150 N/A ASN 80.A N PHE 83.A O no hydrogen 3.134 N/A LYS 82.A N ASN 80.A OD1 no hydrogen 3.038 N/A PHE 83.A N ASN 80.A OD1 no hydrogen 3.273 N/A ASN 84.A N GLU 46.A O no hydrogen 2.726 N/A ASN 84.A ND2 GLN 53.A OE1 no hydrogen 3.520 N/A TYR 85.A N GLY 78.A O no hydrogen 2.961 N/A VAL 86.A N LYS 44.A O no hydrogen 2.826 N/A VAL 87.A N GLY 76.A O no hydrogen 2.778 N/A MET 88.A N ALA 42.A O no hydrogen 2.802 N/A GLN 89.A N ARG 73.A O no hydrogen 2.924 N/A GLY 92.A N MET 143.A O no hydrogen 2.695 N/A LEU 95.A N PHE 141.A O no hydrogen 2.872 N/A ASP 97.A N ASN 94.A OD1 no hydrogen 3.202 N/A LEU 98.A N ASN 94.A O no hydrogen 3.100 N/A ARG 99.A N LEU 95.A O no hydrogen 2.781 N/A ARG 99.A NH1 GLY 105.A O no hydrogen 3.067 N/A ARG 100.A N ALA 96.A O no hydrogen 3.132 N/A ARG 100.A NH2 ASP 97.A OD1 no hydrogen 2.625 N/A SER 101.A N ASP 97.A O no hydrogen 2.986 N/A SER 101.A OG ASP 97.A O no hydrogen 3.209 N/A GLN 102.A NE2 LEU 98.A O no hydrogen 2.968 N/A PHE 107.A N PHE 213.A O no hydrogen 2.660 N/A THR 108.A N ASP 290.A OD2 no hydrogen 2.861 N/A THR 108.A OG1 ASP 290.A OD1 no hydrogen 2.859 N/A THR 108.A OG1 ASP 290.A OD2 no hydrogen 3.434 N/A SER 110.A OG GLU 287.A OE1 no hydrogen 2.867 N/A THR 111.A OG1 ASP 290.A OD1 no hydrogen 3.054 N/A THR 112.A N THR 108.A O no hydrogen 2.974 N/A THR 112.A OG1 PHE 107.A O no hydrogen 3.210 N/A THR 112.A OG1 THR 108.A O no hydrogen 3.310 N/A LEU 113.A N LEU 109.A O no hydrogen 2.885 N/A ARG 114.A N SER 110.A O no hydrogen 3.335 N/A ARG 114.A NE SER 110.A O no hydrogen 2.847 N/A ARG 114.A NH2 SER 110.A OG no hydrogen 2.587 N/A ARG 114.A NH2 ALA 288.A O no hydrogen 2.862 N/A LEU 115.A N THR 111.A O no hydrogen 2.880 N/A GLY 116.A N THR 112.A O no hydrogen 3.033 N/A LYS 117.A N LEU 113.A O no hydrogen 3.092 N/A GLN 118.A N ARG 114.A O no hydrogen 3.316 N/A GLN 118.A NE2 ARG 151.A O no hydrogen 3.092 N/A ILE 119.A N LEU 115.A O no hydrogen 2.888 N/A LEU 120.A N GLY 116.A O no hydrogen 2.907 N/A GLU 121.A N LYS 117.A O no hydrogen 3.034 N/A SER 122.A N GLN 118.A O no hydrogen 3.163 N/A SER 122.A OG ILE 119.A O no hydrogen 2.954 N/A ILE 123.A N ILE 119.A O no hydrogen 2.930 N/A GLU 124.A N LEU 120.A O no hydrogen 2.899 N/A ALA 125.A N GLU 121.A O no hydrogen 2.800 N/A ILE 126.A N SER 122.A O no hydrogen 3.004 N/A HIS 127.A N ILE 123.A O no hydrogen 3.177 N/A HIS 127.A ND1 TYR 267.A OH no hydrogen 2.605 N/A HIS 127.A NE2 ASP 202.A OD2 no hydrogen 2.663 N/A SER 128.A N GLU 124.A O no hydrogen 2.779 N/A SER 128.A OG ALA 125.A O no hydrogen 2.501 N/A GLY 130.A N HIS 127.A O no hydrogen 2.857 N/A PHE 131.A N ILE 126.A O no hydrogen 3.112 N/A LEU 132.A N ARG 162.A O no hydrogen 2.705 N/A HIS 133.A N ASP 202.A OD2 no hydrogen 3.232 N/A ARG 134.A N ASP 202.A OD1 no hydrogen 3.048 N/A ARG 134.A NE LEU 160.A O no hydrogen 2.797 N/A ARG 134.A NH2 LEU 160.A O no hydrogen 3.035 N/A ASP 135.A N HIS 133.A ND1 no hydrogen 3.209 N/A LYS 137.A NZ THR 183.A OG1 no hydrogen 2.573 N/A ASN 140.A N LYS 137.A O no hydrogen 2.871 N/A ASN 140.A ND2 ASP 135.A O no hydrogen 2.637 N/A ASN 140.A ND2 ASP 135.A OD2 no hydrogen 3.078 N/A PHE 141.A N PRO 138.A O no hydrogen 2.966 N/A ALA 142.A N TYR 154.A O no hydrogen 2.994 N/A MET 143.A N ARG 93.A O no hydrogen 3.110 N/A GLY 144.A N LYS 152.A O no hydrogen 3.045 N/A LEU 146.A N THR 149.A OG1 no hydrogen 3.021 N/A THR 149.A N LEU 146.A O no hydrogen 2.943 N/A THR 149.A OG1 LEU 146.A O no hydrogen 3.351 N/A TYR 150.A N LEU 146.A O no hydrogen 2.817 N/A ARG 151.A NH1 GLU 287.A O no hydrogen 3.476 N/A ARG 151.A NH2 GLU 287.A O no hydrogen 3.300 N/A LYS 152.A N THR 149.A O no hydrogen 2.796 N/A CYS 153.A N GLN 118.A OE1 no hydrogen 3.019 N/A TYR 154.A N ALA 142.A O no hydrogen 2.609 N/A MET 155.A N HIS 70.A O no hydrogen 2.808 N/A LEU 156.A N ASN 140.A O no hydrogen 3.034 N/A PHE 158.A N GLU 58.A OE1 no hydrogen 3.386 N/A GLY 159.A N ASP 157.A OD1 no hydrogen 2.912 N/A ALA 161.A N PHE 158.A O no hydrogen 3.332 N/A ARG 162.A N LEU 132.A O no hydrogen 2.978 N/A GLN 163.A NE2 THR 165.A O no hydrogen 3.313 N/A TYR 164.A N GLY 130.A O no hydrogen 2.819 N/A TYR 164.A OH HIS 127.A O no hydrogen 2.582 N/A THR 165.A OG1 GLY 130.A O no hydrogen 3.551 N/A THR 168.A OG1 ASN 166.A OD1 no hydrogen 2.817 N/A THR 168.A OG1 ASP 170.A OD1 no hydrogen 2.804 N/A GLY 169.A N ASN 166.A O no hydrogen 3.055 N/A ASP 170.A N ASN 166.A OD1 no hydrogen 2.748 N/A ASP 170.A N THR 168.A OG1 no hydrogen 3.374 N/A ARG 172.A N TYR 164.A O no hydrogen 2.754 N/A ARG 172.A NH1 GLN 163.A O no hydrogen 2.667 N/A ARG 175.A N GLU 196.A OE1 no hydrogen 2.934 N/A ARG 175.A NE GLU 196.A OE1 no hydrogen 2.695 N/A ARG 175.A NH2 GLU 196.A OE1 no hydrogen 3.515 N/A ARG 175.A NH2 GLU 196.A OE2 no hydrogen 2.755 N/A ALA 178.A N ASN 194.A O no hydrogen 3.130 N/A PHE 180.A N ASN 194.A OD1 no hydrogen 3.052 N/A ARG 185.A NH1 TYR 186.A OH no hydrogen 3.403 N/A ARG 185.A NH1 GLU 212.A OE1 no hydrogen 3.457 N/A TYR 186.A OH GLU 212.A OE1 no hydrogen 2.264 N/A ALA 187.A N VAL 184.A O no hydrogen 3.192 N/A SER 188.A OG ASP 201.A OD1 no hydrogen 2.741 N/A ASN 190.A ND2 ASP 201.A OD1 no hydrogen 2.872 N/A ALA 191.A N SER 188.A OG no hydrogen 3.314 N/A HIS 192.A N SER 188.A O no hydrogen 3.081 N/A HIS 192.A NE2 VAL 184.A O no hydrogen 3.212 N/A LYS 193.A N VAL 189.A O no hydrogen 2.798 N/A LYS 193.A N ASN 190.A O no hydrogen 3.100 N/A LYS 193.A NZ GLU 234.A OE2 no hydrogen 2.922 N/A ASN 194.A N ALA 191.A O no hydrogen 2.930 N/A ARG 195.A N ASN 190.A O no hydrogen 3.012 N/A GLY 198.A N ASP 201.A OD2 no hydrogen 2.588 N/A ASP 202.A N ARG 199.A O no hydrogen 3.088 N/A LEU 203.A N ARG 199.A O no hydrogen 3.354 N/A TRP 204.A N HIS 200.A O no hydrogen 2.725 N/A SER 205.A N ASP 201.A O no hydrogen 3.191 N/A SER 205.A OG TYR 186.A O no hydrogen 2.951 N/A SER 205.A OG ASP 201.A O no hydrogen 2.922 N/A LEU 206.A N ASP 202.A O no hydrogen 2.992 N/A PHE 207.A N LEU 203.A O no hydrogen 2.742 N/A TYR 208.A N TRP 204.A O no hydrogen 2.998 N/A TYR 208.A OH HIS 238.A NE2 no hydrogen 2.977 N/A MET 209.A N SER 205.A O no hydrogen 2.979 N/A LEU 210.A N LEU 206.A O no hydrogen 3.150 N/A VAL 211.A N PHE 207.A O no hydrogen 3.211 N/A GLU 212.A N TYR 208.A O no hydrogen 3.244 N/A PHE 213.A N MET 209.A O no hydrogen 2.872 N/A ALA 214.A N LEU 210.A O no hydrogen 3.148 N/A VAL 215.A N VAL 211.A O no hydrogen 2.742 N/A GLY 216.A N GLU 212.A O no hydrogen 2.977 N/A TRP 220.A NE1 ARG 185.A O no hydrogen 2.931 N/A ARG 221.A N LEU 218.A O no hydrogen 3.006 N/A ILE 223.A N TRP 220.A O no hydrogen 3.205 N/A LYS 226.A NZ PHE 180.A O no hydrogen 3.000 N/A GLN 228.A N ASP 225.A OD1 no hydrogen 3.157 N/A VAL 229.A N ASP 225.A O no hydrogen 3.236 N/A GLY 230.A N LYS 226.A O no hydrogen 3.346 N/A MET 231.A N GLU 227.A O no hydrogen 3.210 N/A MET 231.A N GLN 228.A O no hydrogen 3.249 N/A ILE 232.A N GLN 228.A O no hydrogen 3.101 N/A LYS 233.A N VAL 229.A O no hydrogen 3.023 N/A LYS 233.A NZ VAL 184.A O no hydrogen 2.429 N/A LYS 233.A NZ ARG 185.A O no hydrogen 3.198 N/A LYS 233.A NZ ALA 187.A O no hydrogen 2.588 N/A LYS 233.A NZ HIS 192.A NE2 no hydrogen 3.019 N/A GLU 234.A N GLY 230.A O no hydrogen 2.828 N/A LYS 235.A N ILE 232.A O no hydrogen 3.350 N/A TYR 236.A N ILE 232.A O no hydrogen 2.947 N/A HIS 238.A ND1 TYR 236.A O no hydrogen 3.135 N/A HIS 238.A NE2 TYR 208.A OH no hydrogen 2.977 N/A ARG 239.A NH1 HIS 250.A ND1 no hydrogen 2.917 N/A ARG 239.A NH2 ASP 254.A OD1 no hydrogen 2.908 N/A MET 240.A N GLU 237.A O no hydrogen 2.770 N/A LEU 242.A N ARG 239.A O no hydrogen 2.835 N/A LYS 243.A N MET 240.A O no hydrogen 2.868 N/A MET 245.A N LEU 242.A O no hydrogen 2.989 N/A PHE 249.A N PRO 246.A O no hydrogen 3.063 N/A HIS 250.A N SER 247.A O no hydrogen 3.102 N/A LEU 251.A N GLU 248.A O no hydrogen 2.957 N/A LEU 253.A N PHE 249.A O no hydrogen 3.011 N/A ASP 254.A N HIS 250.A O no hydrogen 3.051 N/A HIS 255.A N LEU 251.A O no hydrogen 3.158 N/A ILE 256.A N PHE 252.A O no hydrogen 3.204 N/A ALA 257.A N LEU 253.A O no hydrogen 3.038 N/A SER 258.A N ASP 254.A O no hydrogen 3.259 N/A SER 258.A N HIS 255.A O no hydrogen 2.984 N/A SER 258.A OG HIS 255.A O no hydrogen 2.681 N/A LEU 259.A N ILE 256.A O no hydrogen 3.247 N/A TYR 261.A OH ARG 172.A O no hydrogen 2.660 N/A THR 263.A N ASP 260.A OD2 no hydrogen 3.361 N/A THR 263.A OG1 ASP 260.A OD2 no hydrogen 2.434 N/A ASP 266.A N HIS 255.A NE2 no hydrogen 3.066 N/A TYR 267.A OH HIS 127.A ND1 no hydrogen 2.605 N/A GLN 268.A NE2 SER 272.A OG no hydrogen 3.015 N/A LEU 269.A N ASP 266.A OD1 no hydrogen 2.568 N/A MET 271.A N TYR 267.A O no hydrogen 3.046 N/A SER 272.A N GLN 268.A O no hydrogen 2.838 N/A SER 272.A OG GLN 268.A O no hydrogen 3.192 N/A VAL 273.A N LEU 269.A O no hydrogen 3.192 N/A PHE 274.A N MET 271.A O no hydrogen 3.201 N/A GLU 275.A N MET 271.A O no hydrogen 3.100 N/A ASN 276.A N SER 272.A O no hydrogen 2.669 N/A ASN 276.A ND2 GLU 248.A OE1 no hydrogen 3.452 N/A SER 277.A N VAL 273.A O no hydrogen 3.247 N/A SER 277.A OG VAL 273.A O no hydrogen 2.488 N/A MET 278.A N PHE 274.A O no hydrogen 3.009 N/A LYS 279.A N GLU 275.A O no hydrogen 2.845 N/A GLU 280.A N ASN 276.A O no hydrogen 3.016 N/A ARG 281.A N MET 278.A O no hydrogen 3.263 N/A ARG 281.A NH1 SER 277.A O no hydrogen 2.917 N/A ARG 281.A NH1 GLU 280.A OE1 no hydrogen 3.393 N/A GLY 282.A N LYS 279.A O no hydrogen 3.279 N/A ILE 283.A N MET 278.A O no hydrogen 2.945 N/A GLU 287.A N ALA 284.A O no hydrogen 2.957 N/A PHE 289.A N GLU 292.A OE1 no hydrogen 3.021 N/A ASP 290.A N THR 111.A OG1 no hydrogen 3.391 N/A GLU 292.A N PHE 289.A O no hydrogen 2.716 N/A