Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4kyo_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A N SER 66.A OG no hydrogen 2.655 N/A GLN 1.A NE2 GLU 35.A OE2 no hydrogen 3.034 N/A ASN 6.A ND2 LEU 32.A O no hydrogen 3.002 N/A LEU 8.A N ASN 6.A OD1 no hydrogen 3.183 N/A ARG 9.A N ASN 6.A O no hydrogen 3.037 N/A ARG 9.A NH1 ARG 9.A O no hydrogen 3.337 N/A HIS 11.A N LEU 8.A O no hydrogen 3.075 N/A GLU 16.A N GLU 16.A OE1 no hydrogen 2.716 N/A GLU 17.A N GLN 13.A O no hydrogen 3.011 N/A GLY 18.A N PRO 14.A O no hydrogen 2.747 N/A LEU 19.A N PHE 15.A O no hydrogen 2.878 N/A ARG 20.A N GLU 16.A O no hydrogen 3.259 N/A ARG 20.A NH2 GLU 17.A OE1 no hydrogen 2.365 N/A ARG 21.A N GLU 17.A O no hydrogen 3.041 N/A LEU 22.A N GLY 18.A O no hydrogen 3.022 N/A GLN 23.A N LEU 19.A O no hydrogen 3.131 N/A GLU 24.A N ARG 20.A O no hydrogen 2.916 N/A GLY 25.A N LEU 22.A O no hydrogen 2.961 N/A ASP 26.A N ARG 21.A O no hydrogen 2.922 N/A ASN 29.A N ASP 26.A OD1 no hydrogen 3.455 N/A ASN 29.A ND2 ASP 26.A OD2 no hydrogen 2.899 N/A ALA 30.A N ASP 26.A O no hydrogen 3.233 N/A VAL 31.A N LEU 27.A O no hydrogen 2.839 N/A LEU 32.A N PRO 28.A O no hydrogen 3.184 N/A LEU 33.A N ASN 29.A O no hydrogen 3.163 N/A PHE 34.A N ALA 30.A O no hydrogen 2.849 N/A GLU 35.A N VAL 31.A O no hydrogen 2.841 N/A ALA 36.A N LEU 32.A O no hydrogen 2.882 N/A ALA 37.A N LEU 33.A O no hydrogen 2.969 N/A VAL 38.A N PHE 34.A O no hydrogen 3.143 N/A GLN 39.A N GLU 35.A O no hydrogen 3.091 N/A GLN 39.A NE2 GLU 35.A O no hydrogen 3.303 N/A GLN 40.A N ALA 36.A O no hydrogen 2.881 N/A ASP 41.A N ALA 37.A O no hydrogen 2.856 N/A HIS 44.A N ASP 41.A O no hydrogen 2.896 N/A GLU 46.A N GLU 46.A OE1 no hydrogen 2.600 N/A TRP 48.A N HIS 44.A O no hydrogen 3.138 N/A TRP 48.A NE1 PRO 42.A O no hydrogen 3.050 N/A GLN 49.A N MET 45.A O no hydrogen 3.010 N/A TYR 50.A N GLU 46.A O no hydrogen 3.098 N/A LEU 51.A N ALA 47.A O no hydrogen 2.964 N/A GLY 52.A N TRP 48.A O no hydrogen 2.959 N/A THR 53.A N GLN 49.A O no hydrogen 3.053 N/A THR 53.A OG1 GLN 49.A O no hydrogen 3.449 N/A THR 53.A OG1 TYR 50.A O no hydrogen 3.538 N/A THR 54.A N TYR 50.A O no hydrogen 2.977 N/A THR 54.A OG1 TYR 50.A O no hydrogen 2.650 N/A GLN 55.A N LEU 51.A O no hydrogen 3.034 N/A ALA 56.A N GLY 52.A O no hydrogen 3.116 N/A GLU 57.A N THR 53.A O no hydrogen 3.155 N/A ASN 58.A N THR 54.A O no hydrogen 2.782 N/A ASN 58.A ND2 GLN 55.A OE1 no hydrogen 3.179 N/A GLU 59.A N ALA 56.A O no hydrogen 3.086 N/A GLN 60.A N GLN 55.A O no hydrogen 2.860 N/A GLN 60.A NE2 MET 246.A O no hydrogen 3.655 N/A ALA 64.A N GLN 60.A O no hydrogen 2.933 N/A ILE 65.A N GLU 61.A O no hydrogen 2.923 N/A SER 66.A N LEU 62.A O no hydrogen 3.137 N/A ALA 67.A N LEU 63.A O no hydrogen 2.968 N/A LEU 68.A N ALA 64.A O no hydrogen 2.926 N/A ARG 69.A N ILE 65.A O no hydrogen 2.825 N/A ARG 70.A N SER 66.A O no hydrogen 3.130 N/A ARG 70.A NH1 GLU 73.A OE1 no hydrogen 3.133 N/A ARG 70.A NH2 PRO 42.A O no hydrogen 3.277 N/A CYS 71.A N ALA 67.A O no hydrogen 2.831 N/A CYS 71.A SG MET 45.A O no hydrogen 3.787 N/A LEU 72.A N LEU 68.A O no hydrogen 2.924 N/A GLU 73.A N ARG 69.A O no hydrogen 3.155 N/A GLU 73.A N ARG 70.A O no hydrogen 3.220 N/A LEU 74.A N ARG 70.A O no hydrogen 3.398 N/A LYS 75.A N CYS 71.A O no hydrogen 2.985 N/A LYS 75.A NZ ASP 77.A OD2 no hydrogen 3.338 N/A ASN 78.A N LYS 75.A O no hydrogen 3.144 N/A ASN 78.A ND2 GLN 49.A OE1 no hydrogen 2.822 N/A ALA 81.A N ASN 78.A OD1 no hydrogen 2.960 N/A LEU 82.A N ASN 78.A O no hydrogen 2.952 N/A MET 83.A N GLN 79.A O no hydrogen 3.022 N/A ALA 84.A N THR 80.A O no hydrogen 2.883 N/A LEU 85.A N ALA 81.A O no hydrogen 2.820 N/A ALA 86.A N LEU 82.A O no hydrogen 2.952 N/A VAL 87.A N MET 83.A O no hydrogen 3.124 N/A SER 88.A N ALA 84.A O no hydrogen 3.054 N/A SER 88.A OG GLU 61.A OE2 no hydrogen 2.790 N/A PHE 89.A N LEU 85.A O no hydrogen 2.871 N/A THR 90.A N ALA 86.A O no hydrogen 2.956 N/A THR 90.A OG1 ALA 86.A O no hydrogen 2.579 N/A ASN 91.A N VAL 87.A O no hydrogen 2.928 N/A ASN 91.A ND2 GLU 61.A OE1 no hydrogen 3.034 N/A GLU 92.A N SER 88.A O no hydrogen 3.042 N/A SER 93.A N THR 90.A O no hydrogen 3.352 N/A LEU 94.A N PHE 89.A O no hydrogen 2.983 N/A GLN 97.A N GLN 97.A OE1 no hydrogen 2.519 N/A ALA 98.A N LEU 94.A O no hydrogen 3.005 N/A CYS 99.A N GLN 95.A O no hydrogen 3.107 N/A GLU 100.A N ARG 96.A O no hydrogen 3.103 N/A THR 101.A N GLN 97.A O no hydrogen 3.202 N/A THR 101.A OG1 GLN 97.A O no hydrogen 3.336 N/A LEU 102.A N ALA 98.A O no hydrogen 3.070 N/A ARG 103.A N CYS 99.A O no hydrogen 3.148 N/A ASP 104.A N GLU 100.A O no hydrogen 2.972 N/A TRP 105.A N THR 101.A O no hydrogen 2.885 N/A LEU 106.A N LEU 102.A O no hydrogen 3.209 N/A ARG 107.A N ARG 103.A O no hydrogen 3.141 N/A TYR 108.A N ASP 104.A O no hydrogen 3.060 N/A THR 109.A N LEU 106.A O no hydrogen 3.364 N/A THR 109.A OG1 GLN 79.A OE1 no hydrogen 3.374 N/A THR 109.A OG1 TRP 105.A O no hydrogen 2.781 N/A TYR 112.A N THR 109.A O no hydrogen 3.033 N/A TYR 112.A OH ASP 139.A OD2 no hydrogen 2.568 N/A LEU 115.A N TYR 112.A O no hydrogen 3.132 N/A GLU 122.A N SER 118.A O no hydrogen 3.168 N/A VAL 123.A N LEU 119.A O no hydrogen 3.194 N/A LYS 124.A N PHE 120.A O no hydrogen 2.922 N/A GLU 125.A N LEU 121.A O no hydrogen 3.020 N/A LEU 126.A N GLU 122.A O no hydrogen 3.119 N/A PHE 127.A N VAL 123.A O no hydrogen 3.134 N/A LEU 128.A N LYS 124.A O no hydrogen 3.033 N/A ALA 129.A N GLU 125.A O no hydrogen 2.874 N/A ALA 130.A N LEU 126.A O no hydrogen 3.031 N/A VAL 131.A N PHE 127.A O no hydrogen 3.069 N/A ARG 132.A N LEU 128.A O no hydrogen 3.343 N/A LEU 133.A N ALA 129.A O no hydrogen 2.849 N/A THR 136.A N ASP 134.A OD1 no hydrogen 3.346 N/A THR 136.A OG1 ASP 134.A OD1 no hydrogen 2.826 N/A ASP 141.A N ASP 139.A OD1 no hydrogen 3.115 N/A VAL 142.A N ASP 139.A OD1 no hydrogen 3.469 N/A GLN 143.A N ASP 139.A O no hydrogen 3.062 N/A CYS 144.A N PRO 140.A O no hydrogen 3.046 N/A GLY 145.A N ASP 141.A O no hydrogen 3.031 N/A LEU 146.A N VAL 142.A O no hydrogen 2.927 N/A GLY 147.A N GLN 143.A O no hydrogen 2.891 N/A VAL 148.A N CYS 144.A O no hydrogen 3.022 N/A LEU 149.A N GLY 145.A O no hydrogen 3.034 N/A PHE 150.A N LEU 146.A O no hydrogen 3.010 N/A ASN 151.A N GLY 147.A O no hydrogen 3.176 N/A ASN 151.A ND2 GLY 147.A O no hydrogen 2.863 N/A ASN 151.A ND2 THR 183.A OG1 no hydrogen 3.020 N/A LEU 152.A N VAL 148.A O no hydrogen 3.113 N/A SER 153.A N LEU 149.A O no hydrogen 3.354 N/A SER 153.A OG GLU 155.A OE1 no hydrogen 2.896 N/A GLY 154.A N ASN 151.A O no hydrogen 3.290 N/A GLU 155.A N PHE 150.A O no hydrogen 2.778 N/A LYS 158.A N GLU 155.A O no hydrogen 3.244 N/A ALA 159.A N GLU 155.A O no hydrogen 3.071 N/A VAL 160.A N TYR 156.A O no hydrogen 2.850 N/A ASP 161.A N ASP 157.A O no hydrogen 3.417 N/A CYS 162.A N LYS 158.A O no hydrogen 3.223 N/A CYS 162.A SG GLN 143.A OE1 no hydrogen 3.643 N/A CYS 162.A SG LYS 158.A O no hydrogen 3.427 N/A PHE 163.A N ALA 159.A O no hydrogen 3.103 N/A THR 164.A N VAL 160.A O no hydrogen 2.957 N/A THR 164.A OG1 VAL 160.A O no hydrogen 3.020 N/A ALA 165.A N ASP 161.A O no hydrogen 2.917 N/A ALA 166.A N CYS 162.A O no hydrogen 2.980 N/A LEU 167.A N PHE 163.A O no hydrogen 2.872 N/A SER 168.A N THR 164.A O no hydrogen 3.086 N/A SER 168.A N ALA 165.A O no hydrogen 3.212 N/A SER 168.A OG ALA 165.A O no hydrogen 2.674 N/A VAL 169.A N ALA 166.A O no hydrogen 3.107 N/A ARG 170.A N ALA 166.A O no hydrogen 2.965 N/A ARG 170.A NE ASP 173.A OD2 no hydrogen 3.519 N/A ARG 170.A NH1 ASP 141.A OD1 no hydrogen 2.938 N/A ARG 170.A NH1 ASP 141.A OD2 no hydrogen 3.386 N/A ARG 170.A NH2 ASP 141.A OD1 no hydrogen 3.000 N/A ARG 170.A NH2 ASP 173.A OD2 no hydrogen 3.555 N/A ASP 173.A N ARG 170.A O no hydrogen 3.390 N/A LEU 175.A N ASP 173.A OD1 no hydrogen 3.170 N/A TRP 177.A N ASP 173.A O no hydrogen 3.286 N/A TRP 177.A NE1 PRO 171.A O no hydrogen 3.027 N/A ASN 178.A N TYR 174.A O no hydrogen 3.043 N/A LYS 179.A N LEU 175.A O no hydrogen 3.113 N/A LEU 180.A N LEU 176.A O no hydrogen 2.927 N/A GLY 181.A N TRP 177.A O no hydrogen 2.997 N/A ALA 182.A N ASN 178.A O no hydrogen 2.682 N/A THR 183.A N LYS 179.A O no hydrogen 2.895 N/A THR 183.A OG1 LYS 179.A O no hydrogen 2.736 N/A LEU 184.A N LEU 180.A O no hydrogen 2.922 N/A ALA 185.A N GLY 181.A O no hydrogen 2.936 N/A ASN 186.A N ALA 182.A O no hydrogen 3.064 N/A GLY 187.A N THR 183.A O no hydrogen 2.964 N/A ASN 188.A N ALA 185.A O no hydrogen 3.254 N/A GLN 189.A N LEU 184.A O no hydrogen 2.798 N/A GLN 189.A NE2 GLU 192.A OE1 no hydrogen 3.238 N/A ALA 193.A N GLN 189.A O no hydrogen 3.058 N/A VAL 194.A N SER 190.A O no hydrogen 3.098 N/A ALA 195.A N GLU 191.A O no hydrogen 3.344 N/A ALA 196.A N GLU 192.A O no hydrogen 3.363 N/A TYR 197.A N ALA 193.A O no hydrogen 2.996 N/A ARG 198.A N VAL 194.A O no hydrogen 2.877 N/A ARG 198.A NH2 GLU 226.A OE1.B no hydrogen 3.055 N/A ARG 199.A N ALA 195.A O no hydrogen 3.266 N/A ALA 200.A N ALA 196.A O no hydrogen 2.991 N/A LEU 201.A N TYR 197.A O no hydrogen 2.794 N/A GLU 202.A N ARG 198.A O no hydrogen 2.886 N/A LEU 203.A N ARG 199.A O no hydrogen 3.053 N/A GLN 204.A N ALA 200.A O no hydrogen 2.986 N/A GLY 206.A N GLN 204.A OE1 no hydrogen 3.359 N/A TYR 207.A N GLN 204.A O no hydrogen 3.014 N/A ARG 209.A N GLU 57.A O no hydrogen 2.893 N/A ARG 209.A NE GLU 59.A OE1 no hydrogen 2.876 N/A ARG 209.A NH1 GLU 61.A OE2 no hydrogen 3.188 N/A ARG 209.A NH2 GLU 59.A OE2 no hydrogen 2.948 N/A ARG 209.A NH2 GLU 61.A OE1 no hydrogen 2.873 N/A SER 210.A OG ASN 178.A OD1 no hydrogen 2.894 N/A ARG 211.A N TYR 207.A O no hydrogen 3.226 N/A ARG 211.A NH1 GLU 233.A OE1 no hydrogen 2.706 N/A ARG 211.A NH2 PRO 205.A O no hydrogen 2.996 N/A TYR 212.A N ILE 208.A O no hydrogen 2.941 N/A TYR 212.A OH THR 253.A OG1 no hydrogen 3.122 N/A ASN 213.A N ARG 209.A O no hydrogen 2.908 N/A ASN 213.A ND2 ASN 178.A OD1 no hydrogen 3.041 N/A LEU 214.A N SER 210.A O no hydrogen 2.913 N/A GLY 215.A N ARG 211.A O no hydrogen 2.952 N/A ILE 216.A N TYR 212.A O no hydrogen 3.077 N/A SER 217.A N ASN 213.A O no hydrogen 3.077 N/A CYS 218.A N LEU 214.A O no hydrogen 2.984 N/A CYS 218.A SG LEU 214.A O no hydrogen 3.392 N/A ILE 219.A N GLY 215.A O no hydrogen 2.901 N/A ASN 220.A N ILE 216.A O no hydrogen 2.991 N/A ASN 220.A ND2 SER 190.A OG no hydrogen 3.167 N/A LEU 221.A N SER 217.A O no hydrogen 3.034 N/A GLY 222.A N ILE 219.A O no hydrogen 2.886 N/A ALA 223.A N CYS 218.A O no hydrogen 2.856 N/A ARG 225.A NH2 GLN 263.A OE1 no hydrogen 2.961 N/A ALA 227.A N ALA 223.A O no hydrogen 3.007 N/A VAL 228.A N HIS 224.A O no hydrogen 3.071 N/A GLU 229.A N ARG 225.A O no hydrogen 3.010 N/A HIS 230.A N GLU 226.A O no hydrogen 2.993 N/A HIS 230.A ND1 GLU 233.A OE1 no hydrogen 2.839 N/A HIS 230.A NE2 GLU 226.A OE1.B no hydrogen 2.831 N/A PHE 231.A N ALA 227.A O no hydrogen 3.014 N/A LEU 232.A N VAL 228.A O no hydrogen 2.978 N/A GLU 233.A N GLU 229.A O no hydrogen 2.830 N/A ALA 234.A N HIS 230.A O no hydrogen 2.930 N/A LEU 235.A N PHE 231.A O no hydrogen 2.859 N/A ASN 236.A N LEU 232.A O no hydrogen 2.788 N/A ASN 236.A ND2 GLN 286.A O no hydrogen 3.082 N/A MET 237.A N GLU 233.A O no hydrogen 3.123 N/A GLN 238.A N ALA 234.A O no hydrogen 3.145 N/A GLN 238.A NE2 ASN 58.A OD1 no hydrogen 3.066 N/A GLN 238.A NE2 SER 247.A OG no hydrogen 2.917 N/A ARG 239.A N LEU 235.A O no hydrogen 3.029 N/A ARG 239.A NH1 SER 276.A OG no hydrogen 3.112 N/A ARG 239.A NH2 ASN 236.A OD1 no hydrogen 3.473 N/A GLY 244.A N ARG 239.A O no hydrogen 3.010 N/A SER 247.A N GLN 238.A OE1 no hydrogen 2.824 N/A SER 247.A OG ASN 58.A O no hydrogen 3.195 N/A SER 247.A OG GLU 59.A O no hydrogen 2.503 N/A ASN 249.A ND2 GLU 59.A OE2 no hydrogen 2.961 N/A TRP 251.A N SER 247.A O no hydrogen 3.302 N/A SER 252.A N GLU 248.A O no hydrogen 3.033 N/A THR 253.A N ASN 249.A O no hydrogen 3.037 N/A THR 253.A OG1 TYR 212.A OH no hydrogen 3.122 N/A THR 253.A OG1 ASN 249.A O no hydrogen 2.914 N/A LEU 254.A N ILE 250.A O no hydrogen 3.006 N/A ARG 255.A N TRP 251.A O no hydrogen 3.303 N/A ARG 255.A NE ASP 271.A OD1 no hydrogen 2.799 N/A ARG 255.A NH1 ARG 255.A O no hydrogen 2.958 N/A ARG 255.A NH1 SER 259.A OG no hydrogen 2.695 N/A LEU 256.A N SER 252.A O no hydrogen 3.281 N/A ALA 257.A N THR 253.A O no hydrogen 2.902 N/A LEU 258.A N LEU 254.A O no hydrogen 2.771 N/A SER 259.A N ARG 255.A O no hydrogen 3.222 N/A MET 260.A N LEU 256.A O no hydrogen 3.119 N/A LEU 261.A N ALA 257.A O no hydrogen 3.028 N/A LEU 261.A N LEU 258.A O no hydrogen 3.156 N/A GLY 262.A N LEU 258.A O no hydrogen 2.893 N/A ALA 266.A N GLN 263.A O no hydrogen 2.860 N/A TYR 267.A N SER 264.A O no hydrogen 3.034 N/A ALA 270.A N ALA 266.A O no hydrogen 2.951 N/A ASP 271.A N TYR 267.A O no hydrogen 2.942 N/A ALA 272.A N GLY 268.A O no hydrogen 3.151 N/A ARG 273.A N ALA 270.A O no hydrogen 2.969 N/A ARG 273.A NH1 ALA 270.A O no hydrogen 3.448 N/A ARG 273.A NH2 GLU 248.A OE2 no hydrogen 2.958 N/A ASP 274.A N ALA 269.A O no hydrogen 3.093 N/A SER 276.A OG GLN 286.A OE1 no hydrogen 3.450 N/A THR 277.A OG1 ASP 274.A OD1 no hydrogen 3.086 N/A THR 277.A OG1 ASP 274.A OD2 no hydrogen 2.503 N/A LEU 279.A N LEU 275.A O no hydrogen 2.974 N/A THR 280.A N SER 276.A O no hydrogen 3.469 N/A THR 280.A OG1 SER 276.A O no hydrogen 2.848 N/A MET 281.A N THR 277.A O no hydrogen 3.054 N/A PHE 282.A N LEU 278.A O no hydrogen 3.037 N/A GLY 283.A N THR 280.A O no hydrogen 2.959 N/A LEU 284.A N LEU 279.A O no hydrogen 3.138 N/A GLN 286.A NE2 SER 276.A O no hydrogen 2.926 N/A