Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6upx_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 6.A N SER 22.A O no hydrogen 2.726 N/A GLN 6.A NE2 GLU 2.A O no hydrogen 2.964 N/A GLN 6.A NE2 GLY 4.A O no hydrogen 2.705 N/A LYS 8.A N ILE 20.A O no hydrogen 3.082 N/A ARG 10.A NH1 ASN 205.A OD1 no hydrogen 2.747 N/A ARG 10.A NH2 ASN 205.A OD1 no hydrogen 2.757 N/A GLU 11.A N ASP 18.A O no hydrogen 2.955 N/A SER 13.A N ASN 16.A O no hydrogen 2.780 N/A SER 13.A OG ASP 15.A OD2 no hydrogen 2.350 N/A SER 13.A OG ASN 16.A O no hydrogen 3.174 N/A ASP 15.A N SER 13.A OG no hydrogen 3.119 N/A ASN 16.A N SER 13.A OG no hydrogen 2.873 N/A VAL 17.A N VAL 231.A O no hydrogen 2.930 N/A ASP 18.A N GLU 11.A O no hydrogen 2.861 N/A PHE 19.A N MET 229.A O no hydrogen 2.928 N/A ILE 20.A N LYS 8.A O no hydrogen 2.785 N/A LEU 21.A N PHE 227.A O no hydrogen 2.871 N/A SER 22.A N GLN 6.A O no hydrogen 2.644 N/A ASN 23.A ND2 ASN 23.A O no hydrogen 2.788 N/A VAL 24.A N ASP 225.A O no hydrogen 3.384 N/A ALA 29.A N ASP 25.A O no hydrogen 3.360 N/A ASN 30.A N LEU 26.A O no hydrogen 2.902 N/A SER 31.A N ALA 27.A O no hydrogen 2.896 N/A SER 31.A OG ALA 27.A O no hydrogen 3.309 N/A LEU 32.A N MET 28.A O no hydrogen 2.852 N/A ARG 33.A N ALA 29.A O no hydrogen 3.366 N/A ARG 34.A N ASN 30.A O no hydrogen 2.948 N/A VAL 35.A N SER 31.A O no hydrogen 2.932 N/A MET 36.A N LEU 32.A O no hydrogen 2.826 N/A ILE 37.A N ARG 33.A O no hydrogen 2.906 N/A ALA 38.A N ARG 34.A O no hydrogen 2.935 N/A GLU 39.A N VAL 35.A O no hydrogen 2.991 N/A THR 42.A N GLY 161.A O no hydrogen 2.941 N/A THR 42.A OG1 PRO 41.A O no hydrogen 2.749 N/A LEU 43.A N SER 73.A OG no hydrogen 2.669 N/A ALA 44.A N LYS 159.A O no hydrogen 3.212 N/A ASP 46.A N VAL 157.A O no hydrogen 2.984 N/A SER 47.A N VAL 157.A O no hydrogen 2.978 N/A SER 47.A OG ASP 46.A O no hydrogen 2.877 N/A GLU 49.A N THR 155.A O no hydrogen 2.916 N/A GLU 51.A N LYS 153.A O no hydrogen 2.885 N/A THR 52.A N LYS 153.A O no hydrogen 3.267 N/A ASN 53.A ND2 LEU 57.A O no hydrogen 3.092 N/A THR 54.A N GLU 151.A O no hydrogen 3.213 N/A THR 54.A OG1 GLU 151.A O no hydrogen 2.942 N/A ILE 62.A N ALA 58.A O no hydrogen 3.163 N/A ALA 63.A N ASP 59.A O no hydrogen 2.876 N/A HIS 64.A N GLU 60.A O no hydrogen 2.884 N/A ARG 65.A N PHE 61.A O no hydrogen 2.967 N/A ARG 65.A NH2 LEU 142.A O no hydrogen 2.625 N/A LEU 66.A N ILE 62.A O no hydrogen 2.876 N/A GLY 67.A N ALA 63.A O no hydrogen 2.919 N/A LEU 68.A N ARG 65.A O no hydrogen 3.167 N/A ILE 69.A N LEU 66.A O no hydrogen 3.173 N/A GLN 72.A N HIS 130.A O no hydrogen 2.757 N/A SER 73.A N SER 236.A O no hydrogen 3.130 N/A SER 73.A OG LEU 71.A O no hydrogen 3.361 N/A MET 74.A N GLN 72.A OE1 no hydrogen 2.854 N/A ASP 75.A N ASN 127.A O no hydrogen 3.256 N/A GLN 78.A N ASP 75.A O no hydrogen 3.264 N/A LEU 79.A N ILE 76.A O no hydrogen 2.961 N/A GLU 80.A N LYS 93.A O no hydrogen 3.000 N/A ASP 84.A N TYR 81.A O no hydrogen 2.852 N/A CYS 85.A N TYR 81.A O no hydrogen 2.862 N/A CYS 94.A SG SER 82.A OG no hydrogen 3.725 N/A CYS 94.A SG CYS 91.A O no hydrogen 3.767 N/A SER 95.A N CYS 91.A O no hydrogen 3.004 N/A SER 95.A OG CYS 91.A O no hydrogen 2.493 N/A VAL 96.A N ALA 158.A O no hydrogen 2.942 N/A LEU 98.A N CYS 156.A O no hydrogen 2.816 N/A THR 99.A N VAL 118.A O no hydrogen 2.555 N/A THR 99.A OG1 LEU 154.A O no hydrogen 3.205 N/A LEU 100.A N LEU 154.A O no hydrogen 2.905 N/A ALA 102.A N LEU 152.A O no hydrogen 2.927 N/A GLY 104.A N GLN 150.A O no hydrogen 2.615 N/A SER 106.A OG SER 108.A O no hydrogen 2.674 N/A SER 106.A OG THR 110.A OG1 no hydrogen 2.379 N/A THR 110.A N LEU 146.A O no hydrogen 2.877 N/A THR 110.A OG1 SER 106.A OG no hydrogen 2.379 N/A ASN 111.A ND2 TYR 113.A OH no hydrogen 2.789 N/A VAL 112.A N CYS 144.A O no hydrogen 2.878 N/A LYS 115.A NZ ASP 116.A OD1 no hydrogen 2.541 N/A LEU 117.A N SER 114.A O no hydrogen 3.230 N/A VAL 118.A N THR 99.A O no hydrogen 2.812 N/A VAL 120.A N VAL 97.A O no hydrogen 2.714 N/A SER 121.A N VAL 97.A O no hydrogen 3.253 N/A SER 121.A OG ASP 92.A OD1 no hydrogen 2.389 N/A SER 121.A OG ASN 122.A O no hydrogen 3.558 N/A MET 124.A N ASN 122.A OD1 no hydrogen 2.896 N/A ARG 126.A NE LEU 123.A O no hydrogen 2.827 N/A ASN 127.A N ASP 75.A OD2 no hydrogen 2.736 N/A GLY 129.A N GLN 72.A O no hydrogen 2.892 N/A ILE 132.A N PRO 70.A O no hydrogen 3.073 N/A GLU 137.A N ASP 135.A OD1 no hydrogen 3.298 N/A GLY 138.A N ASP 135.A O no hydrogen 3.388 N/A ILE 143.A N VAL 112.A O no hydrogen 2.672 N/A CYS 144.A N VAL 112.A O no hydrogen 3.030 N/A CYS 144.A SG LYS 145.A O no hydrogen 3.330 N/A LEU 146.A N THR 110.A O no hydrogen 2.909 N/A ARG 147.A N GLN 150.A OE1 no hydrogen 2.461 N/A GLY 149.A N GLY 104.A O no hydrogen 3.149 N/A GLU 151.A N THR 54.A OG1 no hydrogen 2.601 N/A LEU 152.A N ALA 102.A O no hydrogen 2.871 N/A LYS 153.A N THR 52.A O no hydrogen 2.919 N/A LYS 153.A NZ GLU 51.A OE1 no hydrogen 2.670 N/A LYS 153.A NZ GLU 51.A OE2 no hydrogen 3.141 N/A LEU 154.A N LEU 100.A O no hydrogen 2.930 N/A THR 155.A N GLU 49.A O no hydrogen 2.913 N/A CYS 156.A N LEU 98.A O no hydrogen 2.862 N/A VAL 157.A N SER 47.A O no hydrogen 2.888 N/A ALA 158.A N VAL 96.A O no hydrogen 2.867 N/A LYS 159.A N ALA 44.A O no hydrogen 3.072 N/A LYS 160.A NZ ILE 76.A O no hydrogen 3.111 N/A LYS 160.A NZ LEU 79.A O no hydrogen 2.975 N/A GLY 161.A N THR 42.A O no hydrogen 3.104 N/A GLU 165.A N ILE 162.A O no hydrogen 3.217 N/A LYS 168.A N HIS 166.A ND1 no hydrogen 3.047 N/A LYS 168.A NZ ILE 45.A O no hydrogen 2.531 N/A LYS 168.A NZ ASP 46.A OD1 no hydrogen 2.862 N/A TRP 169.A N HIS 166.A O no hydrogen 3.262 N/A GLY 170.A N ALA 167.A O no hydrogen 3.030 N/A ALA 173.A N GLU 232.A O no hydrogen 3.131 N/A GLU 176.A N ASN 230.A O no hydrogen 2.858 N/A GLU 178.A N TYR 228.A O no hydrogen 2.955 N/A TRP 182.A NE1 GLU 209.A O no hydrogen 3.026 N/A ASN 183.A N ASP 180.A O no hydrogen 3.079 N/A ASN 183.A ND2 THR 188.A O no hydrogen 2.665 N/A LYS 184.A N ASP 180.A OD1 no hydrogen 3.037 N/A LYS 184.A NZ ASP 210.A O no hydrogen 2.484 N/A LEU 185.A N ASP 180.A OD2 no hydrogen 2.584 N/A LYS 186.A N ASN 183.A O no hydrogen 3.328 N/A HIS 187.A N ASN 183.A OD1 no hydrogen 2.871 N/A GLU 193.A N GLU 199.A OE1 no hydrogen 2.511 N/A GLN 194.A N GLU 199.A OE2 no hydrogen 2.475 N/A ASP 195.A N GLU 199.A OE2 no hydrogen 3.215 N/A LYS 198.A NZ ASP 195.A OD2 no hydrogen 2.398 N/A GLU 199.A N ASP 195.A O no hydrogen 3.011 N/A TRP 200.A N SER 196.A O no hydrogen 3.153 N/A TRP 200.A NE1 TRP 191.A O no hydrogen 2.424 N/A SER 203.A OG GLU 178.A OE1 no hydrogen 2.857 N/A SER 203.A OG GLU 178.A OE2 no hydrogen 3.318 N/A ASN 205.A N SER 203.A OG no hydrogen 2.925 N/A ASN 205.A ND2 GLU 178.A OE1 no hydrogen 2.500 N/A CYS 206.A N SER 203.A O no hydrogen 3.262 N/A CYS 206.A SG PRO 181.A O no hydrogen 3.511 N/A CYS 206.A SG SER 203.A O no hydrogen 3.391 N/A GLU 207.A N LYS 204.A O no hydrogen 3.174 N/A TYR 208.A N ASN 205.A O no hydrogen 3.259 N/A GLU 214.A N GLU 214.A OE1 no hydrogen 2.559 N/A ASP 216.A N ASN 213.A O no hydrogen 3.024 N/A THR 226.A OG1 ASP 225.A OD1 no hydrogen 3.464 N/A THR 226.A OG1 ASP 225.A OD2 no hydrogen 3.191 N/A PHE 227.A N LEU 21.A O no hydrogen 2.897 N/A TYR 228.A N GLU 178.A O no hydrogen 2.880 N/A TYR 228.A OH TYR 208.A O no hydrogen 2.787 N/A TYR 228.A OH GLU 209.A OE1 no hydrogen 3.004 N/A MET 229.A N PHE 19.A O no hydrogen 2.980 N/A ASN 230.A N GLU 176.A O no hydrogen 2.908 N/A ASN 230.A ND2 ASN 16.A OD1 no hydrogen 3.564 N/A VAL 231.A N VAL 17.A O no hydrogen 2.851 N/A SER 233.A N ASP 15.A O no hydrogen 3.250 N/A SER 233.A OG PRO 171.A O no hydrogen 3.364 N/A SER 233.A OG ILE 237.A O no hydrogen 2.727 N/A GLY 235.A N SER 233.A OG no hydrogen 3.068 N/A GLN 241.A NE2 ASP 240.A OD2 no hydrogen 3.547 N/A VAL 242.A N PRO 238.A O no hydrogen 2.901 N/A VAL 244.A N ASP 240.A O no hydrogen 2.915 N/A ARG 245.A N GLN 241.A O no hydrogen 2.833 N/A ARG 245.A NH1 MET 74.A O no hydrogen 3.030 N/A ARG 245.A NH2 GLN 241.A OE1 no hydrogen 2.449 N/A GLY 246.A N VAL 242.A O no hydrogen 2.904 N/A ILE 247.A N VAL 243.A O no hydrogen 2.905 N/A ASP 248.A N VAL 244.A O no hydrogen 2.908 N/A THR 249.A N ARG 245.A O no hydrogen 2.832 N/A THR 249.A OG1 ARG 245.A O no hydrogen 2.318 N/A LEU 250.A N GLY 246.A O no hydrogen 2.928 N/A GLN 251.A N ILE 247.A O no hydrogen 2.906 N/A LYS 252.A N ASP 248.A O no hydrogen 2.877 N/A LYS 252.A NZ ASP 248.A OD2 no hydrogen 3.168 N/A LYS 253.A N THR 249.A O no hydrogen 2.857 N/A LYS 253.A NZ GLU 39.A OE1 no hydrogen 3.294 N/A LYS 253.A NZ GLU 39.A OE2 no hydrogen 3.208 N/A VAL 254.A N LEU 250.A O no hydrogen 2.978 N/A ALA 255.A N GLN 251.A O no hydrogen 2.867 N/A SER 256.A N LYS 252.A O no hydrogen 2.925 N/A SER 256.A OG LYS 252.A O no hydrogen 3.473 N/A SER 256.A OG LYS 253.A O no hydrogen 2.691 N/A LEU 258.A N VAL 254.A O no hydrogen 2.974 N/A LEU 259.A N ALA 255.A O no hydrogen 2.865 N/A ALA 260.A N SER 256.A O no hydrogen 2.928 N/A LEU 261.A N ILE 257.A O no hydrogen 2.920 N/A THR 262.A N LEU 258.A O no hydrogen 3.275 N/A THR 262.A OG1 LEU 258.A O no hydrogen 2.966 N/A GLN 263.A N LEU 259.A O no hydrogen 2.950 N/A MET 264.A N ALA 260.A O no hydrogen 2.968 N/A ASP 265.A N THR 262.A O no hydrogen 3.458 N/A ASP 267.A N ASP 267.A OD1 no hydrogen 2.523 N/A