Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2vka_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N THR 9.A O no hydrogen 2.755 N/A CYS 3.A N ARG 7.A O no hydrogen 2.683 N/A CYS 3.A SG ARG 7.A O no hydrogen 3.388 N/A GLY 6.A N CYS 3.A O no hydrogen 2.951 N/A ARG 7.A NE ASP 5.A OD2 no hydrogen 2.474 N/A ARG 7.A NH1 ASP 22.A OD1 no hydrogen 2.938 N/A ARG 7.A NH2 ASP 5.A OD2 no hydrogen 2.888 N/A ARG 7.A NH2 ASP 22.A OD2 no hydrogen 2.806 N/A THR 9.A N ALA 1.A O no hydrogen 2.993 N/A THR 9.A OG1 ASP 280.A OD1 no hydrogen 2.629 N/A ALA 10.A N ASP 280.A OD2 no hydrogen 2.862 N/A ASN 11.A ND2 ASP 277.A O no hydrogen 2.825 N/A CYS 14.A N ASN 11.A O no hydrogen 3.000 N/A CYS 14.A SG ASP 277.A O no hydrogen 3.349 N/A CYS 15.A N ALA 12.A O no hydrogen 3.042 N/A CYS 15.A SG ALA 12.A O no hydrogen 3.506 N/A LEU 17.A N CYS 14.A O no hydrogen 2.981 N/A PHE 18.A N CYS 15.A O no hydrogen 3.177 N/A LEU 21.A N LEU 17.A O no hydrogen 2.752 N/A ASP 22.A N PHE 18.A O no hydrogen 3.010 N/A ASP 23.A N PRO 19.A O no hydrogen 3.042 N/A ILE 24.A N ILE 20.A O no hydrogen 2.918 N/A GLN 25.A N LEU 21.A O no hydrogen 3.012 N/A GLN 25.A NE2 ASN 113.A OD1 no hydrogen 2.928 N/A GLU 26.A N ASP 22.A O no hydrogen 3.072 N/A ASN 27.A N ASP 23.A O no hydrogen 2.719 N/A ASN 27.A ND2 ASP 23.A O no hydrogen 3.395 N/A ASN 27.A ND2 ASP 23.A OD1 no hydrogen 2.763 N/A LEU 28.A N ILE 24.A O no hydrogen 2.817 N/A PHE 29.A N ILE 24.A O no hydrogen 2.755 N/A GLY 31.A N GLN 25.A O no hydrogen 2.857 N/A ALA 32.A N GLN 25.A O no hydrogen 2.817 N/A GLN 33.A N PHE 29.A O no hydrogen 3.066 N/A GLN 33.A NE2 ASP 30.A O no hydrogen 2.881 N/A CYS 34.A SG GLY 191.A O no hydrogen 3.525 N/A GLU 37.A N GLU 37.A OE1 no hydrogen 2.813 N/A HIS 39.A N GLY 35.A O no hydrogen 3.056 N/A GLU 40.A N GLU 36.A O no hydrogen 2.750 N/A SER 41.A N GLU 37.A O no hydrogen 2.959 N/A SER 41.A OG GLU 37.A O no hydrogen 2.879 N/A LEU 42.A N VAL 38.A O no hydrogen 2.923 N/A ARG 43.A N HIS 39.A O no hydrogen 2.961 N/A ARG 43.A NH1 ALA 79.A O no hydrogen 3.134 N/A ARG 43.A NH2 ALA 79.A O no hydrogen 3.275 N/A LEU 44.A N GLU 40.A O no hydrogen 2.915 N/A THR 45.A N SER 41.A O no hydrogen 3.208 N/A THR 45.A OG1 LEU 42.A O no hydrogen 2.651 N/A HIS 47.A N ARG 43.A O no hydrogen 3.040 N/A HIS 47.A ND1 ASN 78.A OD1 no hydrogen 2.743 N/A ASP 48.A N LEU 44.A O no hydrogen 2.883 N/A ALA 49.A N THR 45.A O no hydrogen 2.945 N/A ILE 50.A N PHE 46.A O no hydrogen 2.859 N/A GLY 51.A N ASP 48.A O no hydrogen 3.385 N/A PHE 52.A N ILE 50.A O no hydrogen 2.701 N/A SER 53.A N GLY 57.A O no hydrogen 3.046 N/A SER 53.A OG ASP 154.A OD2 no hydrogen 3.487 N/A LEU 56.A N SER 53.A OG no hydrogen 3.204 N/A GLY 57.A N SER 53.A O no hydrogen 2.730 N/A GLY 60.A N GLY 51.A O no hydrogen 3.098 N/A ALA 61.A N LEU 268.A O no hydrogen 2.785 N/A GLY 63.A N ASP 48.A OD2 no hydrogen 2.863 N/A SER 64.A N ASP 62.A OD1 no hydrogen 3.053 N/A SER 64.A OG ASP 48.A OD1 no hydrogen 3.561 N/A SER 64.A OG ASP 62.A OD1 no hydrogen 3.152 N/A SER 64.A OG GLU 72.A OE1 no hydrogen 3.505 N/A SER 64.A OG GLU 72.A OE2 no hydrogen 2.490 N/A ILE 65.A N ASP 48.A OD1 no hydrogen 3.440 N/A ILE 66.A N GLY 63.A O no hydrogen 3.068 N/A ALA 67.A N GLY 63.A O no hydrogen 2.877 N/A PHE 68.A N SER 64.A O no hydrogen 2.748 N/A ASP 69.A N ILE 66.A O no hydrogen 3.212 N/A ILE 71.A N PHE 68.A O no hydrogen 3.041 N/A GLU 72.A N PHE 68.A O no hydrogen 3.030 N/A THR 73.A N ASP 69.A O no hydrogen 2.932 N/A THR 73.A OG1 ASP 69.A O no hydrogen 2.683 N/A ASN 74.A N ILE 71.A O no hydrogen 2.949 N/A PHE 75.A N GLU 72.A O no hydrogen 3.137 N/A ASN 78.A N PHE 75.A O no hydrogen 2.834 N/A ASN 78.A ND2 GLU 72.A O no hydrogen 2.690 N/A ALA 79.A N PRO 76.A O no hydrogen 3.064 N/A ILE 81.A N ASN 78.A O no hydrogen 2.976 N/A VAL 85.A N ILE 81.A O no hydrogen 3.013 N/A SER 86.A N.A ASP 82.A O no hydrogen 2.841 N/A SER 86.A N.B ASP 82.A O no hydrogen 2.815 N/A SER 86.A OG.A ASP 82.A O no hydrogen 2.967 N/A ALA 87.A N GLU 83.A O no hydrogen 3.011 N/A GLN 88.A N ILE 84.A O no hydrogen 2.922 N/A GLN 88.A NE2 SER 41.A OG no hydrogen 3.088 N/A LYS 89.A N VAL 85.A O no hydrogen 3.051 N/A LYS 89.A NZ ASP 69.A OD2 no hydrogen 2.810 N/A VAL 92.A N GLN 88.A O no hydrogen 3.242 N/A ALA 93.A N LYS 89.A O no hydrogen 2.889 N/A LYS 94.A N PRO 90.A O no hydrogen 2.792 N/A LYS 94.A NZ ASP 23.A OD2 no hydrogen 3.391 N/A HIS 95.A N PHE 91.A O no hydrogen 2.966 N/A HIS 95.A NE2 ASP 23.A OD2 no hydrogen 2.650 N/A SER 98.A OG ARG 126.A O no hydrogen 2.711 N/A ASP 101.A N SER 98.A OG no hydrogen 3.232 N/A PHE 102.A N SER 98.A O no hydrogen 2.873 N/A ILE 103.A N ALA 99.A O no hydrogen 3.001 N/A GLN 104.A N GLY 100.A O no hydrogen 3.493 N/A GLN 104.A NE2 THR 45.A O no hydrogen 3.414 N/A PHE 105.A N ASP 101.A O no hydrogen 2.855 N/A ALA 106.A N PHE 102.A O no hydrogen 2.660 N/A GLY 107.A N ILE 103.A O no hydrogen 2.936 N/A ALA 108.A N GLN 104.A O no hydrogen 2.979 N/A VAL 109.A N PHE 105.A O no hydrogen 2.876 N/A GLY 110.A N ALA 106.A O no hydrogen 2.864 N/A VAL 111.A N GLY 107.A O no hydrogen 3.032 N/A SER 112.A N ALA 108.A O no hydrogen 3.165 N/A SER 112.A OG VAL 109.A O no hydrogen 2.548 N/A ASN 113.A N GLY 110.A O no hydrogen 3.028 N/A ASN 113.A ND2 GLN 25.A OE1 no hydrogen 2.896 N/A ASN 113.A ND2 GLN 33.A O no hydrogen 3.581 N/A CYS 114.A N VAL 111.A O no hydrogen 3.002 N/A CYS 114.A SG GLY 110.A O no hydrogen 3.719 N/A GLY 116.A N PRO 286.A O no hydrogen 2.953 N/A GLY 117.A N CYS 114.A O no hydrogen 2.769 N/A ARG 119.A NH1 ILE 282.A O no hydrogen 3.149 N/A PHE 122.A N SER 279.A OG no hydrogen 2.942 N/A LEU 124.A N ILE 276.A O no hydrogen 2.737 N/A GLY 125.A N ASP 101.A OD1 no hydrogen 3.339 N/A GLY 125.A N ASP 101.A OD2 no hydrogen 2.714 N/A ARG 126.A N ASP 101.A OD1 no hydrogen 2.856 N/A ARG 126.A NE ALA 266.A O no hydrogen 3.264 N/A ARG 126.A NH1 ALA 266.A O no hydrogen 2.768 N/A ARG 126.A NH2 ASP 101.A OD1 no hydrogen 2.930 N/A ARG 126.A NH2 PHE 123.A O no hydrogen 2.764 N/A SER 133.A N GLU 72.A OE2 no hydrogen 2.858 N/A SER 133.A OG PRO 134.A O no hydrogen 2.739 N/A GLU 140.A N ASP 143.A OD2 no hydrogen 2.849 N/A ASP 143.A N GLU 140.A O no hydrogen 3.019 N/A SER 147.A N SER 144.A OG no hydrogen 3.005 N/A ILE 148.A N SER 144.A O no hydrogen 3.012 N/A LEU 149.A N VAL 145.A O no hydrogen 2.785 N/A ALA 150.A N ASP 146.A O no hydrogen 2.956 N/A ARG 151.A N SER 147.A O no hydrogen 2.978 N/A ARG 151.A NH1 ILE 50.A O no hydrogen 2.965 N/A ARG 151.A NH1 LEU 137.A O no hydrogen 2.885 N/A ARG 151.A NH2 PHE 52.A O no hydrogen 2.636 N/A ARG 151.A NH2 ASP 154.A OD2 no hydrogen 2.898 N/A MET 152.A N ILE 148.A O no hydrogen 2.862 N/A GLY 153.A N LEU 149.A O no hydrogen 2.739 N/A ASP 154.A N ALA 150.A O no hydrogen 2.850 N/A ALA 155.A N ARG 151.A O no hydrogen 3.183 N/A GLY 156.A N GLY 153.A O no hydrogen 3.015 N/A PHE 157.A N MET 152.A O no hydrogen 2.917 N/A SER 158.A N GLU 161.A OE1 no hydrogen 2.844 N/A SER 158.A OG GLU 161.A OE1 no hydrogen 3.267 N/A GLU 161.A N SER 158.A OG no hydrogen 3.425 N/A VAL 162.A N SER 158.A O no hydrogen 3.091 N/A VAL 163.A N PRO 159.A O no hydrogen 3.248 N/A TRP 164.A N VAL 160.A O no hydrogen 2.940 N/A TRP 164.A NE1 GLU 243.A OE2 no hydrogen 2.794 N/A LEU 165.A N GLU 161.A O no hydrogen 2.975 N/A LEU 166.A N VAL 162.A O no hydrogen 3.117 N/A ALA 167.A N TRP 164.A O no hydrogen 3.201 N/A SER 168.A N LEU 165.A O no hydrogen 3.087 N/A SER 168.A OG LEU 165.A O no hydrogen 2.878 N/A HIS 169.A N LEU 166.A O no hydrogen 2.943 N/A HIS 169.A ND1 ASP 231.A OD2 no hydrogen 2.962 N/A SER 170.A N ALA 167.A O no hydrogen 2.941 N/A SER 170.A OG ASP 187.A OD2 no hydrogen 3.076 N/A SER 170.A OG VAL 192.A O no hydrogen 3.312 N/A SER 170.A OG ASP 194.A O no hydrogen 2.565 N/A ILE 171.A N SER 168.A O no hydrogen 3.031 N/A ALA 174.A N THR 184.A O no hydrogen 2.975 N/A SER 180.A N ASP 178.A OD1 no hydrogen 3.123 N/A SER 180.A OG ASP 178.A OD1 no hydrogen 2.639 N/A SER 180.A OG ASP 178.A OD2 no hydrogen 3.399 N/A ILE 181.A N ASP 178.A O no hydrogen 3.052 N/A GLY 183.A N ALA 174.A O no hydrogen 2.934 N/A GLY 183.A N ASP 175.A OD1 no hydrogen 2.843 N/A THR 184.A OG1 ILE 181.A O no hydrogen 2.740 N/A PHE 186.A N ALA 172.A O no hydrogen 2.948 N/A SER 188.A N GLU 200.A OE1 no hydrogen 2.865 N/A SER 188.A OG GLU 200.A OE1 no hydrogen 3.485 N/A SER 188.A OG GLU 200.A OE2 no hydrogen 2.584 N/A THR 189.A N ASP 187.A OD1 no hydrogen 2.897 N/A THR 189.A OG1 ASP 187.A OD1 no hydrogen 3.386 N/A THR 189.A OG1 ASP 194.A OD1 no hydrogen 3.003 N/A THR 189.A OG1 ASP 194.A OD2 no hydrogen 2.673 N/A VAL 192.A N THR 189.A O no hydrogen 2.984 N/A PHE 193.A N PRO 115.A O no hydrogen 2.855 N/A ASP 194.A N SER 170.A OG no hydrogen 3.048 N/A GLN 196.A NE2 GLU 200.A OE2 no hydrogen 2.928 N/A GLN 196.A NE2 HIS 293.A O no hydrogen 2.792 N/A ILE 199.A N SER 195.A O no hydrogen 3.203 N/A GLU 200.A N GLN 196.A O no hydrogen 2.870 N/A THR 201.A N PHE 197.A O no hydrogen 3.063 N/A THR 201.A OG1 PHE 197.A O no hydrogen 2.776 N/A GLN 202.A N ILE 199.A O no hydrogen 3.074 N/A GLN 202.A NE2 ALA 235.A O no hydrogen 2.996 N/A GLN 202.A NE2 GLU 304.A O no hydrogen 2.905 N/A LEU 203.A N GLU 200.A O no hydrogen 3.250 N/A LYS 204.A N ASP 302.A O no hydrogen 2.872 N/A LYS 204.A NZ SER 301.A O no hydrogen 3.135 N/A ARG 206.A N SER 220.A O no hydrogen 2.765 N/A ARG 206.A NE PRO 221.A O no hydrogen 3.222 N/A ARG 206.A NH1 PRO 221.A O no hydrogen 2.971 N/A LEU 207.A N SER 220.A O no hydrogen 3.063 N/A THR 211.A N ASP 178.A OD2 no hydrogen 2.831 N/A THR 211.A OG1 ASP 178.A OD1 no hydrogen 3.351 N/A THR 211.A OG1 ASP 178.A OD2 no hydrogen 3.503 N/A ASN 214.A ND2 THR 211.A OG1 no hydrogen 2.837 N/A ASN 214.A ND2 GLU 217.A OE1 no hydrogen 3.074 N/A GLU 217.A N ASN 214.A O no hydrogen 3.280 N/A ALA 218.A N ARG 227.A O no hydrogen 2.801 N/A SER 220.A N LEU 207.A O no hydrogen 2.809 N/A SER 220.A OG LEU 222.A O no hydrogen 2.750 N/A SER 220.A OG GLU 225.A O no hydrogen 2.777 N/A LEU 222.A N SER 220.A OG no hydrogen 3.092 N/A GLU 225.A N LEU 222.A O no hydrogen 3.186 N/A ILE 226.A N PRO 185.A O no hydrogen 2.993 N/A ARG 227.A NH1 LEU 203.A O no hydrogen 2.993 N/A ARG 227.A NH2 GLU 200.A O no hydrogen 2.749 N/A ARG 227.A NH2 LEU 203.A O no hydrogen 2.759 N/A GLN 229.A N GLY 216.A O no hydrogen 2.835 N/A SER 230.A N PRO 141.A O no hydrogen 2.996 N/A HIS 232.A N LEU 228.A O no hydrogen 2.937 N/A HIS 232.A ND1 GLN 229.A OE1 no hydrogen 2.872 N/A LEU 233.A N GLN 229.A O no hydrogen 2.857 N/A LEU 234.A N SER 230.A O no hydrogen 2.916 N/A ALA 235.A N ASP 231.A O no hydrogen 3.004 N/A ARG 236.A N LEU 233.A O no hydrogen 2.968 N/A ARG 236.A NE GLU 304.A OE1 no hydrogen 2.795 N/A ARG 236.A NH1 THR 201.A O no hydrogen 3.091 N/A ARG 236.A NH1 GLU 304.A OE1 no hydrogen 2.747 N/A ARG 236.A NH2 THR 201.A O no hydrogen 2.815 N/A ARG 236.A NH2 HIS 232.A O no hydrogen 3.023 N/A ASP 237.A N LEU 233.A O no hydrogen 2.756 N/A GLN 239.A N ASP 237.A OD1 no hydrogen 2.850 N/A THR 240.A N ASP 237.A O no hydrogen 3.013 N/A THR 240.A OG1 LEU 234.A O no hydrogen 2.648 N/A ALA 241.A N ASP 237.A O no hydrogen 2.772 N/A TRP 244.A N THR 240.A O no hydrogen 2.958 N/A TRP 244.A NE1 THR 201.A OG1 no hydrogen 2.767 N/A GLN 245.A N ALA 241.A O no hydrogen 3.008 N/A GLN 245.A NE2 THR 310.A O no hydrogen 2.938 N/A SER 246.A N CYS 242.A O no hydrogen 3.007 N/A SER 246.A OG GLU 243.A O no hydrogen 2.563 N/A PHE 247.A N TRP 244.A O no hydrogen 3.220 N/A VAL 248.A N GLN 245.A O no hydrogen 2.964 N/A ASN 249.A N SER 195.A OG no hydrogen 3.174 N/A ASN 250.A N PHE 247.A O no hydrogen 2.967 N/A ASN 250.A ND2 SER 246.A O no hydrogen 2.992 N/A GLN 251.A NE2 GLY 116.A O no hydrogen 3.053 N/A GLN 251.A NE2 PHE 193.A O no hydrogen 2.917 N/A LYS 253.A NZ GLU 243.A OE2 no hydrogen 2.823 N/A LYS 253.A NZ SER 246.A OG no hydrogen 2.715 N/A ILE 254.A N ASN 250.A O no hydrogen 3.079 N/A GLN 255.A N GLN 251.A O no hydrogen 2.862 N/A GLN 255.A NE2 GLY 116.A O no hydrogen 2.962 N/A ASN 256.A N PRO 252.A O no hydrogen 3.062 N/A ARG 257.A N.A LYS 253.A O no hydrogen 2.947 N/A ARG 257.A N.B LYS 253.A O no hydrogen 2.953 N/A ARG 257.A NE.B ASN 256.A OD1 no hydrogen 2.685 N/A ARG 257.A NH1.A ASN 256.A OD1 no hydrogen 3.223 N/A ARG 257.A NH2.B ASN 256.A OD1 no hydrogen 2.736 N/A PHE 258.A N ILE 254.A O no hydrogen 2.901 N/A ALA 259.A N GLN 255.A O no hydrogen 3.146 N/A ALA 260.A N ASN 256.A O no hydrogen 3.141 N/A THR 261.A N ARG 257.A O.A no hydrogen 2.886 N/A THR 261.A N ARG 257.A O.B no hydrogen 3.040 N/A THR 261.A OG1 ARG 257.A O.A no hydrogen 2.745 N/A THR 261.A OG1 ARG 257.A O.B no hydrogen 2.623 N/A MET 262.A N PHE 258.A O no hydrogen 2.869 N/A SER 263.A N ALA 259.A O no hydrogen 2.958 N/A LYS 264.A N ALA 260.A O no hydrogen 3.096 N/A LYS 264.A NZ GLY 156.A O no hydrogen 2.739 N/A LYS 264.A NZ GLU 161.A OE1 no hydrogen 3.082 N/A LYS 264.A NZ GLU 161.A OE2 no hydrogen 2.793 N/A MET 265.A N THR 261.A O no hydrogen 2.870 N/A ALA 266.A N MET 262.A O no hydrogen 2.726 N/A LEU 267.A N LYS 264.A O no hydrogen 3.115 N/A LEU 268.A N MET 265.A O no hydrogen 3.190 N/A GLN 270.A N LEU 267.A O no hydrogen 2.806 N/A GLN 270.A NE2 ALA 61.A O no hydrogen 3.005 N/A THR 273.A N ASP 271.A OD1 no hydrogen 3.198 N/A THR 273.A OG1 ASP 271.A OD1 no hydrogen 2.896 N/A THR 273.A OG1 ASP 271.A OD2 no hydrogen 3.219 N/A LYS 274.A N ASP 271.A O no hydrogen 2.889 N/A LEU 275.A N LYS 272.A O no hydrogen 3.135 N/A ILE 276.A N LEU 124.A O no hydrogen 2.831 N/A CYS 278.A N PHE 122.A O no hydrogen 2.738 N/A CYS 278.A SG ILE 276.A O no hydrogen 3.710 N/A SER 279.A N ASP 277.A OD1 no hydrogen 2.942 N/A SER 279.A OG ASP 277.A OD1 no hydrogen 2.573 N/A VAL 281.A N CYS 278.A O no hydrogen 3.109 N/A ILE 282.A N SER 279.A O no hydrogen 3.191 N/A HIS 293.A N GLN 196.A OE1 no hydrogen 3.051 N/A HIS 293.A ND1 ALA 291.A O no hydrogen 2.912 N/A LEU 294.A N THR 316.A O no hydrogen 2.958 N/A PHE 298.A N PRO 295.A O no hydrogen 3.125 N/A SER 299.A N ASP 302.A OD2 no hydrogen 2.761 N/A SER 299.A OG SER 301.A OG no hydrogen 3.280 N/A SER 301.A OG SER 299.A OG no hydrogen 3.280 N/A ASP 302.A N SER 299.A O no hydrogen 2.915 N/A VAL 303.A N LEU 300.A O no hydrogen 2.930 N/A GLU 304.A N GLN 202.A O no hydrogen 2.792 N/A PHE 312.A N GLN 305.A OE1 no hydrogen 2.920 N/A