Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3vje_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A N ASP 5.A OD2 no hydrogen 3.088 N/A ASP 5.A N THR 2.A OG1 no hydrogen 3.199 N/A MET 6.A N THR 2.A O no hydrogen 3.322 N/A ASN 7.A N MET 3.A O no hydrogen 3.022 N/A PHE 8.A N MET 4.A O no hydrogen 3.021 N/A LYS 9.A N ASP 5.A O no hydrogen 2.782 N/A TYR 10.A N MET 6.A O no hydrogen 3.008 N/A TYR 10.A OH ASP 83.A OD2 no hydrogen 2.739 N/A CYS 11.A N ASN 7.A O no hydrogen 3.095 N/A CYS 11.A SG ASN 7.A O no hydrogen 3.491 N/A HIS 12.A N PHE 8.A O no hydrogen 2.814 N/A LYS 13.A N LYS 9.A O no hydrogen 2.914 N/A ILE 14.A N TYR 10.A O no hydrogen 3.144 N/A MET 15.A N CYS 11.A O no hydrogen 3.107 N/A LYS 16.A N HIS 12.A O no hydrogen 2.790 N/A LYS 17.A N LYS 13.A O no hydrogen 3.059 N/A SER 19.A N MET 15.A O no hydrogen 2.789 N/A SER 23.A N SER 19.A OG no hydrogen 2.911 N/A SER 23.A OG ASP 27.A OD2 no hydrogen 3.442 N/A PHE 26.A N PHE 22.A O no hydrogen 3.054 N/A ASP 27.A N SER 23.A O no hydrogen 3.273 N/A LEU 28.A N ALA 25.A O no hydrogen 2.947 N/A LEU 29.A N PHE 26.A O no hydrogen 3.138 N/A ARG 34.A N PRO 30.A O no hydrogen 2.904 N/A LYS 35.A N GLU 31.A O no hydrogen 2.966 N/A ALA 36.A N ASP 32.A O no hydrogen 3.255 N/A VAL 37.A N GLN 33.A O no hydrogen 2.935 N/A TRP 38.A N ARG 34.A O no hydrogen 2.916 N/A TRP 38.A NE1 ASP 27.A OD1 no hydrogen 2.815 N/A ALA 39.A N LYS 35.A O no hydrogen 3.210 N/A ILE 40.A N ALA 36.A O no hydrogen 2.987 N/A TYR 41.A N VAL 37.A O no hydrogen 2.768 N/A ALA 42.A N TRP 38.A O no hydrogen 2.824 N/A VAL 43.A N ALA 39.A O no hydrogen 2.975 N/A CYS 44.A N ILE 40.A O no hydrogen 2.930 N/A CYS 44.A SG ILE 40.A O no hydrogen 3.320 N/A ARG 45.A N TYR 41.A O no hydrogen 2.868 N/A ARG 45.A NH2 TYR 41.A OH no hydrogen 3.214 N/A LYS 46.A N ALA 42.A O no hydrogen 3.019 N/A ILE 47.A N VAL 43.A O no hydrogen 2.990 N/A ASP 48.A N CYS 44.A O no hydrogen 2.960 N/A ASP 49.A N ARG 45.A O no hydrogen 2.768 N/A SER 50.A N LYS 46.A O no hydrogen 2.939 N/A SER 50.A OG ILE 47.A O no hydrogen 2.826 N/A ASP 52.A N ASP 48.A O no hydrogen 3.407 N/A VAL 53.A N ASP 49.A O no hydrogen 2.769 N/A TYR 54.A N ASP 49.A O no hydrogen 3.265 N/A ASP 56.A N SER 50.A O no hydrogen 3.133 N/A ASN 61.A N ILE 57.A O no hydrogen 2.751 N/A GLN 62.A N GLN 58.A O no hydrogen 2.787 N/A ILE 63.A N PHE 59.A O no hydrogen 2.956 N/A LYS 64.A N LEU 60.A O no hydrogen 3.012 N/A GLU 65.A N ASN 61.A O no hydrogen 2.979 N/A ASP 66.A N GLN 62.A O no hydrogen 2.910 N/A ILE 67.A N ILE 63.A O no hydrogen 3.037 N/A GLN 68.A N LYS 64.A O no hydrogen 2.918 N/A SER 69.A N GLU 65.A O no hydrogen 2.847 N/A SER 69.A OG GLU 65.A O no hydrogen 3.162 N/A ILE 70.A N ASP 66.A O no hydrogen 3.128 N/A GLU 71.A N ILE 67.A O no hydrogen 2.971 N/A LYS 72.A N GLN 68.A O no hydrogen 3.030 N/A LYS 72.A NZ TYR 73.A OH no hydrogen 3.472 N/A TYR 73.A N SER 69.A O no hydrogen 2.966 N/A GLU 76.A N TYR 73.A O no hydrogen 3.356 N/A HIS 78.A NE2 TYR 73.A O no hydrogen 2.791 N/A GLN 81.A N ASP 66.A OD1 no hydrogen 2.774 N/A SER 82.A N ASP 66.A OD2 no hydrogen 2.682 N/A SER 82.A OG ASP 66.A OD2 no hydrogen 2.588 N/A ASP 83.A N SER 82.A OG no hydrogen 2.722 N/A ARG 84.A NE TYR 77.A OH no hydrogen 3.395 N/A ARG 84.A NH2 TYR 77.A OH no hydrogen 2.704 N/A ILE 86.A N ASP 83.A OD1 no hydrogen 3.179 N/A MET 87.A N ASP 83.A O no hydrogen 3.042 N/A MET 88.A N ARG 84.A O no hydrogen 2.889 N/A ALA 89.A N ARG 85.A O no hydrogen 3.230 N/A LEU 90.A N ILE 86.A O no hydrogen 2.918 N/A GLN 91.A N MET 87.A O no hydrogen 2.878 N/A GLN 91.A NE2 PRO 74.A O no hydrogen 2.937 N/A GLN 91.A NE2 GLU 76.A O no hydrogen 2.828 N/A HIS 92.A N MET 88.A O no hydrogen 3.012 N/A VAL 93.A N ALA 89.A O no hydrogen 2.969 N/A ALA 94.A N LEU 90.A O no hydrogen 2.881 N/A GLN 95.A N GLN 91.A O no hydrogen 3.004 N/A GLN 95.A NE2 PRO 74.A O no hydrogen 2.724 N/A HIS 96.A N VAL 93.A O no hydrogen 2.817 N/A HIS 96.A ND1 HIS 92.A O no hydrogen 2.684 N/A LYS 97.A N VAL 93.A O no hydrogen 2.789 N/A ASN 98.A ND2 GLU 149.A OE1 no hydrogen 3.350 N/A GLN 102.A NE2 ASN 106.A OD1 no hydrogen 2.769 N/A SER 103.A N ALA 100.A O no hydrogen 2.966 N/A SER 103.A OG GLU 139.A OE1 no hydrogen 2.781 N/A TYR 105.A N PHE 101.A O no hydrogen 3.027 N/A TYR 105.A OH GLU 71.A OE1 no hydrogen 2.736 N/A ASN 106.A N GLN 102.A O no hydrogen 2.893 N/A ASN 106.A ND2 TYR 131.A OH no hydrogen 3.158 N/A LEU 107.A N SER 103.A O no hydrogen 2.962 N/A ILE 108.A N PHE 104.A O no hydrogen 2.914 N/A ASP 109.A N TYR 105.A O no hydrogen 2.996 N/A THR 110.A N ASN 106.A O no hydrogen 3.012 N/A THR 110.A OG1 ASN 106.A O no hydrogen 2.787 N/A VAL 111.A N LEU 107.A O no hydrogen 2.908 N/A TYR 112.A N ILE 108.A O no hydrogen 2.877 N/A TYR 112.A OH ASN 61.A OD1 no hydrogen 2.313 N/A LYS 113.A N ASP 109.A O no hydrogen 2.945 N/A ASP 114.A N THR 110.A O no hydrogen 2.959 N/A GLN 115.A N TYR 112.A O no hydrogen 2.984 N/A THR 118.A OG1 MET 119.A O no hydrogen 3.076 N/A GLU 121.A N GLU 125.A OE2 no hydrogen 3.109 N/A ALA 124.A N THR 122.A OG1 no hydrogen 3.119 N/A GLU 125.A N THR 122.A O no hydrogen 3.160 N/A LEU 126.A N THR 122.A O no hydrogen 3.168 N/A PHE 127.A N ASP 123.A O no hydrogen 2.725 N/A GLY 128.A N ALA 124.A O no hydrogen 2.846 N/A TYR 129.A N GLU 125.A O no hydrogen 2.958 N/A CYS 130.A N LEU 126.A O no hydrogen 2.862 N/A CYS 130.A SG LEU 126.A O no hydrogen 3.532 N/A TYR 131.A N PHE 127.A O no hydrogen 2.828 N/A TYR 131.A OH GLU 139.A OE1 no hydrogen 2.647 N/A GLY 132.A N GLY 128.A O no hydrogen 2.983 N/A VAL 133.A N TYR 129.A O no hydrogen 2.978 N/A ALA 134.A N CYS 130.A O no hydrogen 3.095 N/A ALA 134.A N TYR 131.A O no hydrogen 3.344 N/A GLY 135.A N CYS 130.A O no hydrogen 3.132 N/A THR 136.A N TYR 131.A O no hydrogen 2.992 N/A THR 136.A OG1 GLY 132.A O no hydrogen 2.776 N/A GLY 138.A N ALA 134.A O no hydrogen 3.027 N/A GLU 139.A N GLY 135.A O no hydrogen 2.955 N/A VAL 140.A N THR 136.A O no hydrogen 2.945 N/A LEU 141.A N VAL 137.A O no hydrogen 2.895 N/A THR 142.A N GLU 139.A O no hydrogen 3.217 N/A THR 142.A OG1 GLY 138.A O no hydrogen 2.917 N/A THR 142.A OG1 GLU 139.A O no hydrogen 3.466 N/A ILE 144.A N LEU 141.A O no hydrogen 2.958 N/A LEU 145.A N LEU 141.A O no hydrogen 2.953 N/A LEU 145.A N THR 142.A O no hydrogen 3.160 N/A SER 146.A OG HIS 148.A O no hydrogen 3.407 N/A SER 146.A OG VAL 232.A O no hydrogen 2.586 N/A HIS 148.A N SER 146.A OG no hydrogen 3.175 N/A THR 150.A OG1 THR 153.A OG1 no hydrogen 2.989 N/A THR 153.A N THR 150.A O no hydrogen 2.877 N/A THR 153.A OG1 HIS 148.A O no hydrogen 3.235 N/A THR 153.A OG1 THR 150.A OG1 no hydrogen 2.989 N/A TYR 154.A N THR 150.A O no hydrogen 3.254 N/A ASP 155.A N HIS 151.A O no hydrogen 2.953 N/A VAL 156.A N GLN 152.A O no hydrogen 3.025 N/A ALA 157.A N THR 153.A O no hydrogen 2.957 N/A ARG 158.A N TYR 154.A O no hydrogen 2.824 N/A ARG 158.A NH1 GLU 162.A OE2 no hydrogen 2.799 N/A ARG 158.A NH2 ASP 155.A OD1 no hydrogen 2.822 N/A ARG 159.A N ASP 155.A O no hydrogen 3.081 N/A ARG 159.A NH1 GLN 229.A OE1 no hydrogen 3.304 N/A ARG 159.A NH2 ASP 155.A OD2 no hydrogen 2.674 N/A LEU 160.A N VAL 156.A O no hydrogen 2.898 N/A GLY 161.A N ALA 157.A O no hydrogen 3.055 N/A GLU 162.A N ARG 158.A O no hydrogen 2.950 N/A SER 163.A N ARG 159.A O no hydrogen 2.971 N/A SER 163.A OG ARG 159.A O no hydrogen 2.814 N/A LEU 164.A N LEU 160.A O no hydrogen 2.932 N/A GLN 165.A N GLY 161.A O no hydrogen 2.882 N/A LEU 166.A N GLU 162.A O no hydrogen 3.015 N/A ILE 167.A N SER 163.A O no hydrogen 2.988 N/A ASN 168.A N LEU 164.A O no hydrogen 3.032 N/A ILE 169.A N GLN 165.A O no hydrogen 3.013 N/A LEU 170.A N LEU 166.A O no hydrogen 2.982 N/A ARG 171.A N ILE 167.A O no hydrogen 2.934 N/A ARG 171.A NE ASP 172.A OD2 no hydrogen 3.005 N/A ARG 171.A NH1 ASP 172.A OD1 no hydrogen 3.289 N/A ASP 172.A N ASN 168.A O no hydrogen 3.054 N/A ASP 172.A N ILE 169.A O no hydrogen 3.263 N/A ASP 176.A N ASP 172.A O no hydrogen 2.718 N/A PHE 177.A N VAL 173.A O no hydrogen 2.837 N/A GLU 178.A N GLY 174.A O no hydrogen 3.077 N/A ASN 179.A N ASP 176.A O no hydrogen 3.017 N/A GLU 180.A N PHE 177.A O no hydrogen 2.986 N/A ARG 181.A N ASP 176.A O no hydrogen 2.792 N/A SER 185.A N TYR 215.A OH no hydrogen 3.178 N/A SER 185.A OG ASP 123.A OD1 no hydrogen 2.770 N/A SER 185.A OG TYR 215.A OH no hydrogen 3.429 N/A LYS 186.A N PHE 120.A O no hydrogen 2.744 N/A GLN 187.A N GLU 121.A O no hydrogen 2.881 N/A ARG 188.A N SER 185.A OG no hydrogen 3.082 N/A ARG 188.A NE ASP 123.A OD2 no hydrogen 2.903 N/A ARG 188.A NH1 GLN 191.A OE1 no hydrogen 2.785 N/A ARG 188.A NH2 ASP 123.A OD2 no hydrogen 2.943 N/A LEU 189.A N SER 185.A O no hydrogen 2.819 N/A LYS 190.A N LYS 186.A O no hydrogen 2.998 N/A GLN 191.A N GLN 187.A O no hydrogen 3.066 N/A TYR 192.A N ARG 188.A O no hydrogen 3.096 N/A GLU 193.A N LYS 190.A O no hydrogen 3.381 N/A VAL 194.A N LEU 189.A O no hydrogen 2.905 N/A GLU 198.A N ASP 195.A OD2 no hydrogen 2.967 N/A VAL 199.A N ASP 195.A O no hydrogen 2.939 N/A TYR 200.A N ILE 196.A O no hydrogen 2.704 N/A TYR 200.A OH GLU 178.A OE2 no hydrogen 2.678 N/A GLN 201.A N ALA 197.A O no hydrogen 2.962 N/A GLN 201.A NE2 ASN 202.A OD1 no hydrogen 3.041 N/A ASN 202.A N GLU 198.A O no hydrogen 2.795 N/A ASN 202.A ND2 GLU 198.A OE2 no hydrogen 2.592 N/A GLY 203.A N VAL 199.A O no hydrogen 2.903 N/A TYR 208.A N ASN 205.A OD1 no hydrogen 3.006 N/A ILE 209.A N ASN 205.A O no hydrogen 3.011 N/A ASP 210.A N ASN 206.A O no hydrogen 3.016 N/A LEU 211.A N HIS 207.A O no hydrogen 3.082 N/A TRP 212.A N TYR 208.A O no hydrogen 2.809 N/A TRP 212.A NE1 LEU 170.A O no hydrogen 2.906 N/A GLU 213.A N ILE 209.A O no hydrogen 2.864 N/A TYR 214.A N ASP 210.A O no hydrogen 2.881 N/A TYR 215.A N LEU 211.A O no hydrogen 3.358 N/A TYR 215.A OH ASP 123.A OD1 no hydrogen 2.545 N/A ALA 216.A N TRP 212.A O no hydrogen 2.985 N/A ALA 217.A N GLU 213.A O no hydrogen 2.944 N/A ALA 219.A N TYR 215.A O no hydrogen 3.077 N/A GLU 220.A N ALA 216.A O no hydrogen 2.900 N/A LYS 221.A N ALA 217.A O no hydrogen 3.111 N/A ASP 222.A N ILE 218.A O no hydrogen 3.105 N/A PHE 223.A N ALA 219.A O no hydrogen 3.031 N/A ARG 224.A N GLU 220.A O no hydrogen 3.063 N/A ASP 225.A N LYS 221.A O no hydrogen 3.176 N/A VAL 226.A N ASP 222.A O no hydrogen 3.006 N/A MET 227.A N PHE 223.A O no hydrogen 2.802 N/A ASP 228.A N ARG 224.A O no hydrogen 2.833 N/A GLN 229.A N ASP 225.A O no hydrogen 3.262 N/A GLN 229.A N VAL 226.A O no hydrogen 2.968 N/A GLN 229.A NE2 GLN 152.A OE1 no hydrogen 2.539 N/A ILE 230.A N MET 227.A O no hydrogen 3.158 N/A VAL 232.A N GLN 229.A O no hydrogen 3.234 N/A PHE 233.A N ILE 230.A O no hydrogen 3.116 N/A SER 234.A N LEU 145.A O no hydrogen 2.997 N/A SER 234.A OG LEU 145.A O no hydrogen 3.332 N/A ALA 237.A N SER 234.A OG no hydrogen 3.191 N/A GLN 238.A N SER 234.A O no hydrogen 2.958 N/A ILE 241.A N ALA 237.A O no hydrogen 2.813 N/A GLU 242.A N GLN 238.A O no hydrogen 2.890 N/A LEU 243.A N PRO 239.A O no hydrogen 2.991 N/A ALA 244.A N ILE 240.A O no hydrogen 3.136 N/A ALA 245.A N ILE 241.A O no hydrogen 3.134 N/A ARG 246.A N GLU 242.A O no hydrogen 2.925 N/A ARG 246.A NH1 ARG 246.A O no hydrogen 3.180 N/A ARG 246.A NH1 GLU 250.A OE1 no hydrogen 3.142 N/A ARG 246.A NH2 GLU 250.A OE1 no hydrogen 3.389 N/A ILE 247.A N LEU 243.A O no hydrogen 2.768 N/A ALA 248.A N ALA 244.A O no hydrogen 2.989 N/A ILE 249.A N ALA 245.A O no hydrogen 3.179 N/A GLU 250.A N ARG 246.A O no hydrogen 2.985 N/A ILE 251.A N ILE 247.A O no hydrogen 2.807 N/A LEU 252.A N ALA 248.A O no hydrogen 3.252 N/A ASP 253.A N ILE 249.A O no hydrogen 3.107 N/A GLU 254.A N GLU 250.A O no hydrogen 2.965 N/A VAL 255.A N ILE 251.A O no hydrogen 2.983 N/A ARG 256.A N LEU 252.A O no hydrogen 3.088 N/A ARG 256.A NE GLU 213.A OE1 no hydrogen 3.194 N/A ARG 256.A NE GLU 213.A OE2 no hydrogen 2.605 N/A ARG 256.A NH1 GLU 220.A OE2 no hydrogen 3.091 N/A ARG 256.A NH1 ASP 253.A OD1 no hydrogen 2.980 N/A ARG 256.A NH2 GLU 213.A OE1 no hydrogen 2.882 N/A ARG 256.A NH2 GLU 220.A OE2 no hydrogen 2.927 N/A GLN 257.A N ASP 253.A O no hydrogen 2.700 N/A ALA 258.A N GLU 254.A O no hydrogen 2.810 N/A ASN 259.A N ARG 256.A O no hydrogen 2.985 N/A TYR 260.A N VAL 255.A O no hydrogen 2.808 N/A TYR 260.A OH GLU 213.A OE2 no hydrogen 2.362 N/A THR 261.A N ALA 258.A O no hydrogen 3.263 N/A HIS 263.A N THR 261.A OG1 no hydrogen 3.013 N/A HIS 263.A NE2 TYR 200.A O no hydrogen 2.984 N/A ARG 265.A NH1 GLU 175.A OE1 no hydrogen 3.282 N/A ARG 271.A NH1 ARG 271.A O no hydrogen 2.816 N/A LYS 272.A NZ GLU 250.A OE2 no hydrogen 2.852 N/A LYS 273.A N GLU 269.A O no hydrogen 2.961 N/A LYS 273.A NZ VAL 268.A O no hydrogen 3.539 N/A ALA 274.A N LYS 270.A O no hydrogen 3.003 N/A LYS 275.A N ARG 271.A O no hydrogen 3.111 N/A LEU 276.A N LYS 272.A O no hydrogen 2.869 N/A PHE 277.A N LYS 273.A O no hydrogen 2.868 N/A HIS 278.A N ALA 274.A O no hydrogen 2.913 N/A GLU 279.A N LYS 275.A O no hydrogen 3.138 N/A ILE 280.A N LEU 276.A O no hydrogen 2.993 N/A ASN 281.A N PHE 277.A O no hydrogen 2.930 N/A SER 282.A OG GLU 279.A O no hydrogen 2.962 N/A LYS 283.A N ILE 280.A O no hydrogen 3.222 N/A LYS 283.A NZ GLU 242.A OE2 no hydrogen 2.690 N/A TYR 284.A N ASN 281.A O no hydrogen 3.268 N/A TYR 284.A OH GLU 242.A OE1 no hydrogen 2.662 N/A