Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6vpj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A OG SER 2.A OG no hydrogen 2.935 N/A SER 15.A N ASN 13.A OD1 no hydrogen 3.122 N/A SER 16.A OG ASN 13.A O no hydrogen 3.052 N/A ARG 19.A NH1 GLN 47.A OE1 no hydrogen 2.698 N/A ARG 19.A NH2 ASP 25.A OD1 no hydrogen 3.029 N/A ARG 19.A NH2 GLN 47.A OE1 no hydrogen 3.259 N/A GLN 20.A NE2 LYS 18.A O no hydrogen 3.391 N/A ALA 22.A N ASP 25.A OD2 no hydrogen 2.947 N/A ASP 25.A N ALA 22.A O no hydrogen 3.012 N/A PHE 26.A N LEU 23.A O no hydrogen 3.316 N/A GLU 27.A N ARG 44.A O no hydrogen 2.767 N/A GLY 29.A N LEU 42.A O no hydrogen 2.592 N/A LEU 32.A N VAL 40.A O no hydrogen 2.793 N/A GLY 33.A N VAL 40.A O no hydrogen 3.425 N/A LYS 34.A NZ ASN 39.A OD1.A no hydrogen 3.305 N/A LYS 34.A NZ ASN 39.A OD1.B no hydrogen 2.421 N/A GLY 35.A N GLY 38.A O no hydrogen 2.958 N/A ASN 39.A N VAL 56.A O no hydrogen 2.894 N/A ASN 39.A ND2.A VAL 56.A O no hydrogen 3.096 N/A VAL 40.A N GLY 33.A O no hydrogen 3.011 N/A TYR 41.A N LEU 54.A O no hydrogen 2.806 N/A LEU 42.A N ARG 30.A O no hydrogen 2.860 N/A ALA 43.A N LEU 52.A O no hydrogen 2.841 N/A ARG 44.A N GLU 27.A O no hydrogen 2.884 N/A ARG 44.A NH1 LYS 49.A O no hydrogen 3.148 N/A GLU 45.A N PHE 50.A O no hydrogen 2.997 N/A LYS 46.A N ASP 25.A O no hydrogen 2.854 N/A LYS 46.A NZ GLU 24.A O no hydrogen 2.553 N/A GLN 47.A N GLU 45.A OE1 no hydrogen 2.673 N/A SER 48.A N GLU 45.A OE2 no hydrogen 2.877 N/A SER 48.A OG GLU 45.A OE2 no hydrogen 2.821 N/A LYS 49.A N GLU 45.A O no hydrogen 2.787 N/A LEU 52.A N ALA 43.A O no hydrogen 2.811 N/A ALA 53.A N LEU 103.A O no hydrogen 2.979 N/A LEU 54.A N TYR 41.A O no hydrogen 2.799 N/A LYS 55.A N LEU 101.A O no hydrogen 2.915 N/A VAL 56.A N ASN 39.A O no hydrogen 2.713 N/A LEU 57.A N VAL 99.A O no hydrogen 2.803 N/A LYS 59.A N THR 97.A O no hydrogen 2.939 N/A LYS 59.A NZ HIS 94.A ND1 no hydrogen 2.999 N/A LYS 59.A NZ ASP 95.A O no hydrogen 2.674 N/A GLN 61.A NE2 LYS 36.A O no hydrogen 2.741 N/A LEU 62.A N PHE 58.A O no hydrogen 3.045 N/A GLU 63.A N LYS 59.A O no hydrogen 2.996 N/A LYS 64.A N ALA 60.A O no hydrogen 2.925 N/A ALA 65.A N GLN 61.A O no hydrogen 3.223 N/A GLY 66.A N GLU 63.A O no hydrogen 3.165 N/A VAL 67.A N LEU 62.A O no hydrogen 3.195 N/A GLN 70.A NE2 GLN 70.A O no hydrogen 3.531 N/A GLN 70.A NE2 GLU 74.A OE2 no hydrogen 2.684 N/A LEU 71.A N VAL 67.A O no hydrogen 3.013 N/A ARG 72.A N GLU 68.A O no hydrogen 2.937 N/A ARG 72.A NE GLU 76.A OE2 no hydrogen 2.925 N/A ARG 73.A N HIS 69.A O no hydrogen 3.073 N/A ARG 73.A NH1.B GLU 76.A OE1 no hydrogen 2.925 N/A GLU 74.A N GLN 70.A O no hydrogen 2.937 N/A VAL 75.A N LEU 71.A O no hydrogen 2.937 N/A GLU 76.A N ARG 72.A O no hydrogen 2.976 N/A ILE 77.A N ARG 73.A O no hydrogen 2.915 N/A GLN 78.A N GLU 74.A O no hydrogen 2.842 N/A SER 79.A N VAL 75.A O no hydrogen 3.140 N/A SER 79.A OG VAL 75.A O no hydrogen 2.847 N/A SER 79.A OG GLU 76.A O no hydrogen 3.393 N/A SER 79.A OG HIS 80.A ND1 no hydrogen 3.131 N/A HIS 80.A N ILE 77.A O no hydrogen 3.159 N/A HIS 80.A ND1 SER 79.A OG no hydrogen 3.131 N/A LEU 81.A N GLN 78.A O no hydrogen 3.079 N/A ARG 82.A N TYR 139.A OH no hydrogen 2.880 N/A ASN 85.A N HIS 83.A ND1 no hydrogen 2.992 N/A ASN 85.A ND2 LEU 163.A O no hydrogen 2.958 N/A ILE 86.A N HIS 83.A O no hydrogen 3.097 N/A LEU 87.A N ILE 165.A O no hydrogen 2.866 N/A ARG 88.A N GLU 104.A OE2 no hydrogen 2.915 N/A TYR 90.A N ILE 102.A O no hydrogen 2.855 N/A PHE 93.A N TYR 100.A O no hydrogen 3.079 N/A ASP 95.A N ARG 98.A O no hydrogen 3.031 N/A ARG 98.A N ASP 95.A OD1 no hydrogen 2.778 N/A VAL 99.A N LEU 57.A O no hydrogen 2.666 N/A TYR 100.A N PHE 93.A O no hydrogen 2.756 N/A TYR 100.A OH ASP 95.A OD2 no hydrogen 2.943 N/A LEU 101.A N LYS 55.A O no hydrogen 2.820 N/A ILE 102.A N GLY 91.A O no hydrogen 2.955 N/A LEU 103.A N ALA 53.A O no hydrogen 2.794 N/A GLU 104.A N ARG 88.A O no hydrogen 2.817 N/A LEU 108.A N LEU 157.A O no hydrogen 3.192 N/A VAL 111.A N LEU 155.A O no hydrogen 2.920 N/A TYR 112.A N PRO 152.A O no hydrogen 3.133 N/A ARG 113.A N THR 110.A OG1 no hydrogen 3.016 N/A GLU 114.A N THR 110.A O no hydrogen 3.179 N/A LEU 115.A N VAL 111.A O no hydrogen 2.758 N/A GLN 116.A N TYR 112.A O no hydrogen 3.064 N/A LYS 117.A N ARG 113.A O no hydrogen 3.150 N/A LEU 118.A N GLU 114.A O no hydrogen 3.044 N/A PHE 121.A N PHE 212.A O no hydrogen 2.855 N/A GLN 124.A NE2 ASN 276.A OD1 no hydrogen 2.869 N/A ARG 125.A N ASP 122.A OD1 no hydrogen 2.900 N/A ARG 125.A NH1 TYR 129.A OH no hydrogen 3.377 N/A THR 126.A N ASP 122.A O no hydrogen 3.004 N/A THR 126.A OG1 ASP 122.A O no hydrogen 2.829 N/A ALA 127.A N GLU 123.A O no hydrogen 2.901 N/A THR 128.A N GLN 124.A O no hydrogen 3.110 N/A THR 128.A OG1 GLN 124.A O no hydrogen 2.794 N/A THR 128.A OG1 SER 278.A OG no hydrogen 3.426 N/A TYR 129.A N ARG 125.A O no hydrogen 3.080 N/A TYR 129.A OH GLU 114.A OE1 no hydrogen 2.827 N/A ILE 130.A N THR 126.A O no hydrogen 2.954 N/A THR 131.A N ALA 127.A O no hydrogen 3.107 N/A THR 131.A OG1 ALA 127.A O no hydrogen 3.194 N/A THR 131.A OG1 SER 277.A OG no hydrogen 3.072 N/A GLU 132.A N THR 128.A O no hydrogen 3.113 N/A LEU 133.A N TYR 129.A O no hydrogen 2.851 N/A ALA 134.A N ILE 130.A O no hydrogen 2.777 N/A ASN 135.A N THR 131.A O no hydrogen 3.077 N/A ALA 136.A N GLU 132.A O no hydrogen 2.985 N/A LEU 137.A N LEU 133.A O no hydrogen 2.748 N/A SER 138.A N ALA 134.A O no hydrogen 3.001 N/A SER 138.A OG ALA 134.A O no hydrogen 3.046 N/A TYR 139.A N ASN 135.A O no hydrogen 3.162 N/A VAL 140.A N ALA 136.A O no hydrogen 2.870 N/A HIS 141.A N LEU 137.A O no hydrogen 2.932 N/A HIS 141.A ND1.B GLU 198.A OE2.B no hydrogen 2.356 N/A HIS 141.A NE2.A ASP 201.A OD2 no hydrogen 2.643 N/A HIS 141.A NE2.B ASP 201.A OD2 no hydrogen 2.585 N/A SER 142.A N SER 138.A O no hydrogen 3.074 N/A SER 142.A OG SER 138.A O no hydrogen 3.502 N/A SER 142.A OG TYR 139.A O no hydrogen 2.836 N/A LYS 143.A N TYR 139.A O no hydrogen 3.129 N/A ARG 144.A N HIS 141.A O no hydrogen 3.049 N/A ARG 144.A NH1 HIS 141.A O no hydrogen 2.800 N/A VAL 145.A N VAL 140.A O no hydrogen 3.078 N/A HIS 147.A ND1 VAL 145.A O no hydrogen 3.257 N/A HIS 147.A NE2 ASP 201.A OD1 no hydrogen 2.975 N/A ARG 148.A NH2 ASP 167.A OD1 no hydrogen 2.927 N/A ARG 148.A NH2 PHE 168.A O no hydrogen 2.881 N/A LYS 151.A N ASN 154.A OD1 no hydrogen 3.137 N/A LYS 151.A NZ ASP 149.A O no hydrogen 3.395 N/A LYS 151.A NZ ASN 154.A OD1 no hydrogen 3.345 N/A ASN 154.A N LYS 151.A O no hydrogen 2.951 N/A LEU 155.A N PRO 152.A O no hydrogen 3.306 N/A LEU 156.A N LYS 164.A O no hydrogen 2.726 N/A GLY 158.A N GLU 162.A O no hydrogen 2.800 N/A GLY 161.A N GLY 158.A O no hydrogen 3.031 N/A GLU 162.A N GLU 162.A OE2 no hydrogen 2.590 N/A LEU 163.A N GLU 132.A OE2 no hydrogen 2.934 N/A LYS 164.A N LEU 156.A O no hydrogen 2.746 N/A LYS 164.A NZ PRO 84.A O no hydrogen 2.663 N/A LYS 164.A NZ GLU 104.A OE1 no hydrogen 2.763 N/A ILE 165.A N ASN 85.A O no hydrogen 2.828 N/A ALA 166.A N ASN 154.A O no hydrogen 2.791 N/A ALA 174.A N SER 171.A O no hydrogen 3.188 N/A THR 178.A OG1 ALA 174.A O no hydrogen 3.052 N/A GLY 181.A N THR 178.A O no hydrogen 3.485 N/A THR 182.A OG1 ASP 184.A OD2 no hydrogen 2.900 N/A LEU 186.A N LEU 183.A O no hydrogen 2.962 N/A GLU 189.A N GLU 189.A OE2 no hydrogen 2.712 N/A MET 190.A N PRO 187.A O no hydrogen 3.239 N/A ILE 191.A N PRO 188.A O no hydrogen 2.991 N/A GLU 192.A N PRO 188.A O no hydrogen 2.696 N/A ARG 194.A N.B ILE 191.A O no hydrogen 2.583 N/A ARG 194.A NH1.B ASP 149.A OD1 no hydrogen 2.975 N/A ARG 194.A NH2.B ASP 149.A OD1 no hydrogen 2.939 N/A HIS 196.A N.B GLU 192.A O no hydrogen 2.803 N/A HIS 196.A ND1.A ASP 197.A OD2.A no hydrogen 2.696 N/A LYS 199.A N ASP 197.A OD1.A no hydrogen 2.923 N/A LYS 199.A NZ ARG 261.A O no hydrogen 2.812 N/A LEU 202.A N GLU 198.A O.A no hydrogen 2.905 N/A LEU 202.A N GLU 198.A O.B no hydrogen 3.019 N/A TRP 203.A N LYS 199.A O no hydrogen 3.105 N/A SER 204.A N VAL 200.A O no hydrogen 3.044 N/A SER 204.A OG VAL 200.A O no hydrogen 3.410 N/A LEU 205.A N ASP 201.A O no hydrogen 2.788 N/A GLY 206.A N LEU 202.A O no hydrogen 3.012 N/A VAL 207.A N TRP 203.A O no hydrogen 3.026 N/A LEU 208.A N SER 204.A O no hydrogen 3.041 N/A VAL 209.A N LEU 205.A O no hydrogen 2.860 N/A TYR 210.A N GLY 206.A O no hydrogen 3.103 N/A TYR 210.A OH THR 237.A O no hydrogen 2.683 N/A GLU 211.A N VAL 207.A O no hydrogen 2.910 N/A PHE 212.A N LEU 208.A O no hydrogen 2.862 N/A LEU 213.A N VAL 209.A O no hydrogen 3.049 N/A VAL 214.A N TYR 210.A O no hydrogen 2.784 N/A GLY 215.A N GLU 211.A O no hydrogen 2.740 N/A GLN 225.A N GLN 225.A OE1 no hydrogen 2.701 N/A GLU 226.A N THR 223.A OG1 no hydrogen 3.084 N/A THR 227.A N THR 223.A O no hydrogen 3.218 N/A THR 227.A OG1 THR 223.A O no hydrogen 3.007 N/A TYR 228.A N TYR 224.A O no hydrogen 3.022 N/A TYR 228.A OH.B TYR 224.A OH.A no hydrogen 1.520 N/A LYS 229.A N GLN 225.A O no hydrogen 3.083 N/A ARG 230.A N GLU 226.A O no hydrogen 2.908 N/A ARG 230.A NE.B GLU 235.A OE2 no hydrogen 3.058 N/A ILE 231.A N THR 227.A O no hydrogen 3.004 N/A SER 232.A N TYR 228.A O no hydrogen 3.067 N/A SER 232.A OG TYR 228.A O no hydrogen 3.008 N/A SER 232.A OG LYS 229.A O no hydrogen 3.041 N/A ARG 233.A N LYS 229.A O no hydrogen 2.988 N/A ARG 233.A NH1 GLU 235.A OE1 no hydrogen 2.516 N/A VAL 234.A N ILE 231.A O no hydrogen 2.993 N/A GLU 235.A N ARG 230.A O no hydrogen 2.784 N/A VAL 242.A N PRO 239.A O no hydrogen 3.383 N/A THR 243.A OG1 GLU 123.A OE1 no hydrogen 2.702 N/A GLU 244.A N GLU 244.A OE1 no hydrogen 2.500 N/A ARG 247.A N THR 243.A O no hydrogen 2.871 N/A ARG 247.A NH1 PRO 239.A O no hydrogen 3.251 N/A ARG 247.A NH1 VAL 242.A O no hydrogen 2.614 N/A ASP 248.A N GLU 244.A O no hydrogen 2.851 N/A LEU 249.A N GLY 245.A O no hydrogen 3.144 N/A ILE 250.A N ALA 246.A O no hydrogen 2.961 N/A SER 251.A N ARG 247.A O no hydrogen 2.931 N/A SER 251.A OG ARG 247.A O no hydrogen 2.957 N/A ARG 252.A N ASP 248.A O no hydrogen 3.166 N/A ARG 252.A NH1 ASP 248.A OD2 no hydrogen 3.182 N/A LEU 253.A N LEU 249.A O no hydrogen 2.984 N/A LEU 254.A N ILE 250.A O no hydrogen 2.863 N/A ASN 257.A ND2 GLN 260.A OE1 no hydrogen 3.095 N/A SER 259.A N ASN 257.A OD1 no hydrogen 3.162 N/A SER 259.A OG ASN 257.A OD1 no hydrogen 2.603 N/A GLN 260.A N ASN 257.A O no hydrogen 3.029 N/A ARG 261.A N PRO 258.A O no hydrogen 3.159 N/A ARG 261.A NE LYS 255.A O no hydrogen 2.786 N/A ARG 261.A NH1 LYS 199.A O no hydrogen 2.807 N/A ARG 261.A NH2 LYS 255.A O no hydrogen 3.049 N/A ARG 261.A NH2 HIS 256.A O no hydrogen 3.424 N/A MET 263.A N GLU 266.A OE1 no hydrogen 2.979 N/A LEU 264.A N GLU 198.A OE1.A no hydrogen 3.104 N/A VAL 267.A N MET 263.A O no hydrogen 2.917 N/A LEU 268.A N LEU 264.A O no hydrogen 3.101 N/A GLU 269.A N ARG 265.A O no hydrogen 3.142 N/A GLU 269.A N GLU 266.A O no hydrogen 3.224 N/A HIS 270.A N VAL 267.A O no hydrogen 3.111 N/A HIS 270.A NE2 ASP 248.A OD2 no hydrogen 2.560 N/A TRP 272.A N HIS 270.A ND1 no hydrogen 3.045 N/A TRP 272.A NE1 GLU 123.A OE1 no hydrogen 2.581 N/A THR 274.A N HIS 270.A O no hydrogen 2.950 N/A THR 274.A OG1 HIS 270.A O no hydrogen 3.313 N/A THR 274.A OG1 PRO 271.A O no hydrogen 3.232 N/A ALA 275.A N PRO 271.A O no hydrogen 3.070 N/A ASN 276.A N TRP 272.A O no hydrogen 3.332 N/A ASN 276.A N ILE 273.A O no hydrogen 3.251 N/A ASN 276.A ND2 TRP 272.A O no hydrogen 2.829 N/A SER 277.A N ILE 273.A O no hydrogen 2.827 N/A SER 277.A OG THR 131.A OG1 no hydrogen 3.072 N/A SER 277.A OG LYS 279.A OXT no hydrogen 3.292 N/A SER 278.A N THR 128.A OG1 no hydrogen 3.068 N/A SER 278.A OG THR 128.A OG1 no hydrogen 3.426 N/A LYS 279.A N SER 277.A OG no hydrogen 3.081 N/A