Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kbt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A NE2 ASP 8.A OD1 no hydrogen 3.225 N/A TYR 5.A N GLU 1.A O no hydrogen 3.035 N/A TYR 6.A N ALA 2.A O no hydrogen 3.012 N/A ASP 8.A N GLN 4.A O no hydrogen 3.175 N/A ALA 9.A N TYR 5.A O no hydrogen 2.882 N/A ASP 10.A N TYR 6.A O no hydrogen 2.878 N/A GLU 11.A N LEU 7.A O no hydrogen 2.814 N/A ALA 12.A N ASP 8.A O no hydrogen 2.950 N/A GLU 13.A N ALA 9.A O no hydrogen 2.901 N/A ALA 14.A N ASP 10.A O no hydrogen 3.018 N/A TRP 15.A N GLU 11.A O no hydrogen 3.030 N/A ILE 16.A N ALA 12.A O no hydrogen 2.926 N/A GLY 17.A N GLU 13.A O no hydrogen 2.915 N/A GLU 18.A N ALA 14.A O no hydrogen 2.945 N/A GLN 19.A N TRP 15.A O no hydrogen 2.954 N/A GLU 20.A N ILE 16.A O no hydrogen 2.893 N/A LEU 21.A N GLY 17.A O no hydrogen 2.866 N/A TYR 22.A N GLU 18.A O no hydrogen 2.801 N/A VAL 23.A N GLU 18.A O no hydrogen 3.041 N/A ILE 24.A N GLN 19.A O no hydrogen 2.986 N/A SER 25.A OG GLU 27.A OE1 no hydrogen 3.519 N/A GLU 27.A N SER 25.A OG no hydrogen 3.144 N/A GLU 33.A N GLU 33.A OE1 no hydrogen 2.527 N/A GLY 34.A N ASP 31.A OD1 no hydrogen 2.569 N/A ALA 35.A N ASP 31.A O no hydrogen 2.819 N/A ILE 36.A N GLU 32.A O no hydrogen 2.815 N/A VAL 37.A N GLU 33.A O no hydrogen 2.997 N/A MET 38.A N GLY 34.A O no hydrogen 2.935 N/A LEU 39.A N ALA 35.A O no hydrogen 2.855 N/A LYS 40.A N ILE 36.A O no hydrogen 2.824 N/A ARG 41.A N VAL 37.A O no hydrogen 2.838 N/A HIS 42.A N MET 38.A O no hydrogen 2.756 N/A HIS 42.A NE2 ALA 95.A O no hydrogen 2.867 N/A LEU 43.A N LEU 39.A O no hydrogen 2.839 N/A ARG 44.A N LYS 40.A O no hydrogen 3.475 N/A GLN 45.A N ARG 41.A O no hydrogen 3.213 N/A GLN 46.A N HIS 42.A O no hydrogen 2.778 N/A GLN 46.A NE2 GLU 96.A OE1 no hydrogen 3.285 N/A ARG 47.A N LEU 43.A O no hydrogen 2.877 N/A ALA 48.A N ARG 44.A O no hydrogen 3.056 N/A VAL 49.A N GLN 45.A O no hydrogen 3.147 N/A GLU 50.A N GLN 46.A O no hydrogen 3.055 N/A ASP 51.A N ARG 47.A O no hydrogen 2.925 N/A TYR 52.A N ALA 48.A O no hydrogen 2.979 N/A TYR 52.A N VAL 49.A O no hydrogen 3.164 N/A GLY 53.A N GLU 50.A O no hydrogen 2.974 N/A ARG 54.A NE ASP 51.A OD1 no hydrogen 3.295 N/A ARG 54.A NH2 ASP 51.A OD1 no hydrogen 2.802 N/A ASN 55.A ND2 TYR 52.A O no hydrogen 3.650 N/A ILE 56.A N TYR 52.A O no hydrogen 3.310 N/A LYS 57.A N GLY 53.A O no hydrogen 2.926 N/A GLN 58.A N ARG 54.A O no hydrogen 3.033 N/A LEU 59.A N ASN 55.A O no hydrogen 3.122 N/A ALA 60.A N ILE 56.A O no hydrogen 2.956 N/A SER 61.A N LYS 57.A O no hydrogen 2.887 N/A ARG 62.A N GLN 58.A O no hydrogen 3.058 N/A ARG 62.A NH1 ASP 8.A OD2 no hydrogen 2.710 N/A ARG 62.A NH2 ASP 8.A OD2 no hydrogen 2.775 N/A ALA 63.A N LEU 59.A O no hydrogen 2.836 N/A GLN 64.A N ALA 60.A O no hydrogen 2.681 N/A GLY 65.A N SER 61.A O no hydrogen 2.986 N/A LEU 66.A N ARG 62.A O no hydrogen 2.900 N/A LEU 67.A N ALA 63.A O no hydrogen 2.885 N/A SER 68.A N GLN 64.A O no hydrogen 2.865 N/A SER 68.A OG GLN 64.A O no hydrogen 3.455 N/A ALA 69.A N GLY 65.A O no hydrogen 3.059 N/A GLY 70.A N LEU 67.A O no hydrogen 2.814 N/A HIS 71.A N LEU 66.A O no hydrogen 3.245 N/A GLU 73.A N HIS 71.A ND1 no hydrogen 2.982 N/A GLY 74.A N HIS 71.A O no hydrogen 3.138 N/A ILE 77.A N GLU 73.A O no hydrogen 2.890 N/A ILE 78.A N GLY 74.A O no hydrogen 3.062 N/A ARG 79.A N GLU 75.A O no hydrogen 3.207 N/A LEU 80.A N GLN 76.A O no hydrogen 3.140 N/A GLN 81.A N ILE 77.A O no hydrogen 3.170 N/A GLY 82.A N ILE 78.A O no hydrogen 3.111 N/A GLN 83.A N ARG 79.A O no hydrogen 2.883 N/A VAL 84.A N LEU 80.A O no hydrogen 2.799 N/A ASP 85.A N GLN 81.A O no hydrogen 2.799 N/A LYS 86.A N GLY 82.A O no hydrogen 2.890 N/A HIS 87.A N GLN 83.A O no hydrogen 2.943 N/A HIS 87.A ND1 GLU 13.A OE1 no hydrogen 2.807 N/A HIS 87.A ND1 GLU 13.A OE2 no hydrogen 2.862 N/A TYR 88.A N VAL 84.A O no hydrogen 2.797 N/A TYR 88.A OH VAL 49.A O no hydrogen 2.666 N/A ALA 89.A N ASP 85.A O no hydrogen 2.970 N/A GLY 90.A N LYS 86.A O no hydrogen 2.882 N/A LEU 91.A N HIS 87.A O no hydrogen 3.111 N/A LYS 92.A N TYR 88.A O no hydrogen 3.015 N/A ASP 93.A N ALA 89.A O no hydrogen 3.141 N/A VAL 94.A N GLY 90.A O no hydrogen 3.120 N/A ALA 95.A N LEU 91.A O no hydrogen 2.960 N/A GLU 96.A N LYS 92.A O no hydrogen 2.952 N/A GLU 97.A N ASP 93.A O no hydrogen 2.724 N/A ARG 98.A N VAL 94.A O no hydrogen 3.048 N/A ARG 98.A NH1 GLU 27.A O no hydrogen 2.677 N/A ARG 98.A NH2 GLU 27.A O no hydrogen 3.503 N/A LYS 99.A N ALA 95.A O no hydrogen 2.911 N/A ARG 100.A N GLU 96.A O no hydrogen 2.835 N/A ARG 100.A NE GLU 97.A OE2 no hydrogen 2.697 N/A ARG 100.A NH2 GLU 97.A OE2 no hydrogen 2.504 N/A LYS 101.A N GLU 97.A O no hydrogen 2.777 N/A LEU 102.A N ARG 98.A O no hydrogen 2.902 N/A GLU 103.A N LYS 99.A O no hydrogen 2.985 N/A ASN 104.A N ARG 100.A O no hydrogen 3.030 N/A MET 105.A N LYS 101.A O no hydrogen 2.929 N/A TYR 106.A N LEU 102.A O no hydrogen 2.806 N/A HIS 107.A N GLU 103.A O no hydrogen 2.981 N/A LEU 108.A N ASN 104.A O no hydrogen 3.066 N/A PHE 109.A N MET 105.A O no hydrogen 3.194 N/A GLN 110.A N TYR 106.A O no hydrogen 3.197 N/A LEU 111.A N HIS 107.A O no hydrogen 2.988 N/A LYS 112.A N LEU 108.A O no hydrogen 2.839 N/A ARG 113.A N PHE 109.A O no hydrogen 3.053 N/A ARG 113.A NE GLU 32.A OE1 no hydrogen 2.998 N/A ARG 113.A NH1 GLU 32.A OE1 no hydrogen 2.905 N/A ARG 113.A NH1 GLU 32.A OE2 no hydrogen 2.900 N/A GLU 114.A N GLN 110.A O no hydrogen 2.866 N/A THR 115.A N LEU 111.A O no hydrogen 2.756 N/A THR 115.A OG1 LEU 111.A O no hydrogen 3.185 N/A ASP 116.A N LYS 112.A O no hydrogen 2.987 N/A ASP 117.A N ARG 113.A O no hydrogen 3.095 N/A LEU 118.A N GLU 114.A O no hydrogen 3.286 N/A GLU 119.A N THR 115.A O no hydrogen 2.768 N/A GLN 120.A N ASP 116.A O no hydrogen 2.986 N/A TRP 121.A N ASP 117.A O no hydrogen 3.013 N/A ILE 122.A N LEU 118.A O no hydrogen 2.929 N/A SER 123.A N GLU 119.A O no hydrogen 2.854 N/A GLU 124.A N GLN 120.A O no hydrogen 2.936 N/A LYS 125.A N TRP 121.A O no hydrogen 2.991 N/A GLU 126.A N ILE 122.A O no hydrogen 2.948 N/A LEU 127.A N SER 123.A O no hydrogen 3.426 N/A VAL 128.A N GLU 124.A O no hydrogen 3.475 N/A ALA 129.A N LYS 125.A O no hydrogen 3.074 N/A SER 130.A N GLU 126.A O no hydrogen 2.951 N/A SER 130.A N LEU 127.A O no hydrogen 3.026 N/A SER 130.A OG LEU 127.A O no hydrogen 3.156 N/A SER 131.A N VAL 128.A O no hydrogen 3.357 N/A HIS 140.A N ASP 137.A OD1 no hydrogen 2.495 N/A HIS 140.A ND1 ASP 137.A OD1 no hydrogen 3.107 N/A HIS 140.A ND1 ASP 137.A OD2 no hydrogen 3.061 N/A VAL 141.A N ASP 137.A O no hydrogen 3.188 N/A THR 142.A N PHE 138.A O no hydrogen 2.879 N/A THR 142.A OG1 PHE 138.A O no hydrogen 2.567 N/A LEU 143.A N ASP 139.A O no hydrogen 2.986 N/A LEU 144.A N HIS 140.A O no hydrogen 2.912 N/A ARG 145.A N VAL 141.A O no hydrogen 2.765 N/A ARG 145.A NH2 ASP 146.A OD1 no hydrogen 3.160 N/A ASP 146.A N THR 142.A O no hydrogen 2.861 N/A LYS 147.A N LEU 143.A O no hydrogen 2.731 N/A PHE 148.A N LEU 144.A O no hydrogen 2.776 N/A ARG 149.A N ARG 145.A O no hydrogen 3.046 N/A ASP 150.A N ASP 146.A O no hydrogen 3.237 N/A PHE 151.A N LYS 147.A O no hydrogen 3.029 N/A ALA 152.A N PHE 148.A O no hydrogen 2.789 N/A ARG 153.A N ARG 149.A O no hydrogen 3.012 N/A GLU 154.A N ASP 150.A O no hydrogen 2.906 N/A THR 155.A N PHE 151.A O no hydrogen 2.955 N/A THR 155.A OG1 PHE 151.A O no hydrogen 2.627 N/A GLY 156.A N ALA 152.A O no hydrogen 3.001 N/A ALA 157.A N ARG 153.A O no hydrogen 2.988 N/A ILE 158.A N GLU 154.A O no hydrogen 2.981 N/A GLY 159.A N THR 155.A O no hydrogen 2.830 N/A GLN 160.A N GLY 156.A O no hydrogen 3.071 N/A GLN 160.A NE2 GLN 160.A O no hydrogen 3.678 N/A GLN 160.A NE2 ASP 164.A OD1 no hydrogen 3.051 N/A GLU 161.A N ALA 157.A O no hydrogen 3.427 N/A ARG 162.A N ILE 158.A O no hydrogen 3.212 N/A VAL 163.A N GLY 159.A O no hydrogen 2.726 N/A ASP 164.A N GLN 160.A O no hydrogen 2.745 N/A ASN 165.A N GLU 161.A O no hydrogen 2.824 N/A VAL 166.A N ARG 162.A O no hydrogen 3.056 N/A ASN 167.A N VAL 163.A O no hydrogen 2.945 N/A ASN 167.A ND2 VAL 163.A O no hydrogen 2.721 N/A ASN 167.A ND2 ASN 192.A OD1 no hydrogen 3.232 N/A ALA 168.A N ASP 164.A O no hydrogen 2.769 N/A PHE 169.A N ASN 165.A O no hydrogen 3.064 N/A ILE 170.A N VAL 166.A O no hydrogen 2.853 N/A GLU 171.A N ASN 167.A O no hydrogen 2.853 N/A ARG 172.A N ALA 168.A O no hydrogen 2.929 N/A LEU 173.A N PHE 169.A O no hydrogen 3.127 N/A ILE 174.A N ILE 170.A O no hydrogen 3.166 N/A ASP 175.A N GLU 171.A O no hydrogen 2.816 N/A ALA 176.A N ARG 172.A O no hydrogen 2.962 N/A GLY 177.A N ILE 174.A O no hydrogen 3.045 N/A HIS 178.A NE2 ASN 104.A O no hydrogen 3.253 N/A SER 179.A N ASN 104.A OD1 no hydrogen 3.394 N/A SER 179.A OG GLU 180.A OE2 no hydrogen 3.079 N/A GLU 180.A N HIS 178.A ND1 no hydrogen 2.744 N/A ILE 184.A N GLU 180.A O no hydrogen 2.875 N/A ALA 185.A N ALA 181.A O no hydrogen 3.042 N/A GLU 186.A N ALA 182.A O no hydrogen 3.435 N/A TRP 187.A N THR 183.A O no hydrogen 3.148 N/A LYS 188.A N ILE 184.A O no hydrogen 2.941 N/A LYS 188.A NZ GLU 171.A OE2 no hydrogen 3.057 N/A ASP 189.A N ALA 185.A O no hydrogen 2.905 N/A GLY 190.A N GLU 186.A O no hydrogen 2.882 N/A LEU 191.A N TRP 187.A O no hydrogen 2.887 N/A ASN 192.A N LYS 188.A O no hydrogen 2.775 N/A ASN 192.A ND2 ASN 167.A OD1 no hydrogen 2.840 N/A ASN 192.A ND2 LYS 188.A O no hydrogen 2.923 N/A GLU 193.A N ASP 189.A O no hydrogen 3.050 N/A MET 194.A N GLY 190.A O no hydrogen 3.089 N/A TRP 195.A N LEU 191.A O no hydrogen 3.019 N/A TRP 195.A NE1 GLN 160.A OE1 no hydrogen 2.802 N/A ALA 196.A N ASN 192.A O no hydrogen 3.077 N/A ASP 197.A N GLU 193.A O no hydrogen 2.965 N/A LEU 198.A N MET 194.A O no hydrogen 2.786 N/A LEU 199.A N TRP 195.A O no hydrogen 2.911 N/A GLU 200.A N ALA 196.A O no hydrogen 2.876 N/A LEU 201.A N ASP 197.A O no hydrogen 2.730 N/A ILE 202.A N LEU 198.A O no hydrogen 2.804 N/A ASP 203.A N LEU 199.A O no hydrogen 3.181 N/A THR 204.A N GLU 200.A O no hydrogen 2.921 N/A THR 204.A OG1 LEU 201.A O no hydrogen 3.275 N/A ARG 205.A N LEU 201.A O no hydrogen 3.067 N/A ARG 205.A NH1 GLU 133.A O no hydrogen 3.239 N/A ARG 205.A NH2 GLU 133.A O no hydrogen 2.987 N/A MET 206.A N ILE 202.A O no hydrogen 3.076 N/A GLN 207.A N ASP 203.A O no hydrogen 2.945 N/A LEU 208.A N THR 204.A O no hydrogen 2.760 N/A LEU 209.A N ARG 205.A O no hydrogen 2.933 N/A ALA 210.A N MET 206.A O no hydrogen 2.873 N/A ALA 211.A N GLN 207.A O no hydrogen 3.068 N/A SER 212.A N LEU 208.A O no hydrogen 2.937 N/A SER 212.A OG MET 134.A O no hydrogen 3.426 N/A TYR 213.A N LEU 209.A O no hydrogen 2.901 N/A ASP 214.A N ALA 210.A O no hydrogen 2.923 N/A LEU 215.A N ALA 211.A O no hydrogen 3.108 N/A HIS 216.A N SER 212.A O no hydrogen 3.108 N/A ARG 217.A N TYR 213.A O no hydrogen 2.757 N/A TYR 218.A N ASP 214.A O no hydrogen 2.976 N/A TYR 218.A OH ILE 269.A O no hydrogen 2.706 N/A PHE 219.A N LEU 215.A O no hydrogen 3.314 N/A TYR 220.A N HIS 216.A O no hydrogen 2.904 N/A THR 221.A N ARG 217.A O no hydrogen 3.006 N/A THR 221.A OG1 ARG 217.A O no hydrogen 3.065 N/A GLY 222.A N TYR 218.A O no hydrogen 2.870 N/A ALA 223.A N PHE 219.A O no hydrogen 3.133 N/A GLU 224.A N TYR 220.A O no hydrogen 3.076 N/A ILE 225.A N THR 221.A O no hydrogen 2.930 N/A LEU 226.A N GLY 222.A O no hydrogen 2.964 N/A GLY 227.A N ALA 223.A O no hydrogen 3.215 N/A LEU 228.A N GLU 224.A O no hydrogen 2.932 N/A ILE 229.A N ILE 225.A O no hydrogen 2.727 N/A ASP 230.A N LEU 226.A O no hydrogen 2.878 N/A GLU 231.A N GLY 227.A O no hydrogen 2.848 N/A LYS 232.A N LEU 228.A O no hydrogen 3.238 N/A LYS 232.A NZ GLU 235.A OE1 no hydrogen 3.348 N/A LYS 232.A NZ GLU 235.A OE2 no hydrogen 3.193 N/A HIS 233.A N ILE 229.A O no hydrogen 2.820 N/A ARG 234.A N ASP 230.A O no hydrogen 3.004 N/A GLU 235.A N GLU 231.A O no hydrogen 3.131 N/A VAL 240.A N PHE 236.A O no hydrogen 3.472 N/A LEU 242.A N ARG 238.A O no hydrogen 3.054 N/A LEU 243.A N ASP 239.A O no hydrogen 2.774 N/A GLY 244.A N VAL 240.A O no hydrogen 2.770 N/A VAL 245.A N HIS 241.A O no hydrogen 2.959 N/A GLN 246.A N LEU 242.A O no hydrogen 3.068 N/A VAL 247.A N LEU 243.A O no hydrogen 2.973 N/A GLN 248.A N GLY 244.A O no hydrogen 3.066 N/A GLN 249.A N VAL 245.A O no hydrogen 3.008 N/A PHE 250.A N GLN 246.A O no hydrogen 3.139 N/A GLN 251.A N VAL 247.A O no hydrogen 2.902 N/A ASP 252.A N GLN 248.A O no hydrogen 3.131 N/A VAL 253.A N GLN 249.A O no hydrogen 2.970 N/A ALA 254.A N PHE 250.A O no hydrogen 3.031 N/A THR 255.A N GLN 251.A O no hydrogen 3.392 N/A THR 255.A OG1 GLN 251.A O no hydrogen 3.414 N/A ARG 256.A N ASP 252.A O no hydrogen 3.162 N/A ARG 256.A NH1 ASP 214.A OD2 no hydrogen 3.004 N/A ARG 256.A NH2 ASP 214.A OD2 no hydrogen 3.292 N/A LEU 257.A N VAL 253.A O no hydrogen 3.017 N/A GLN 258.A N ALA 254.A O no hydrogen 3.121 N/A GLN 258.A N THR 255.A O no hydrogen 3.143 N/A THR 259.A OG1 ARG 256.A O no hydrogen 2.820 N/A ALA 260.A N LEU 257.A O no hydrogen 3.252 N/A TYR 261.A N GLN 258.A O no hydrogen 3.202 N/A GLU 267.A N GLY 263.A O no hydrogen 3.190 N/A ALA 268.A N GLU 264.A O no hydrogen 3.019 N/A ILE 269.A N LYS 265.A O no hydrogen 3.255 N/A GLN 270.A N ALA 266.A O no hydrogen 3.118 N/A ASN 271.A N GLU 267.A O no hydrogen 2.636 N/A LYS 272.A N ALA 268.A O no hydrogen 3.041 N/A GLU 273.A N ILE 269.A O no hydrogen 3.102 N/A GLN 274.A N GLN 270.A O no hydrogen 2.821 N/A GLU 275.A N ASN 271.A O no hydrogen 2.834 N/A VAL 276.A N LYS 272.A O no hydrogen 3.129 N/A SER 277.A N GLU 273.A O no hydrogen 2.910 N/A SER 277.A OG GLU 273.A O no hydrogen 3.060 N/A SER 277.A OG GLU 273.A OE2 no hydrogen 2.878 N/A ALA 278.A N GLN 274.A O no hydrogen 2.734 N/A ALA 279.A N GLU 275.A O no hydrogen 2.987 N/A TRP 280.A N VAL 276.A O no hydrogen 2.891 N/A GLN 281.A N SER 277.A O no hydrogen 2.851 N/A ALA 282.A N ALA 278.A O no hydrogen 3.094 N/A LEU 283.A N ALA 279.A O no hydrogen 3.316 N/A LEU 284.A N TRP 280.A O no hydrogen 3.097 N/A