Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4cc4_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A OG GLU 2.A O no hydrogen 2.824 N/A ILE 4.A N GLN 38.A OE1.A no hydrogen 2.865 N/A ILE 4.A N GLN 38.A OE1.B no hydrogen 3.291 N/A THR 8.A N VAL 36.A O no hydrogen 3.125 N/A THR 8.A OG1 ARG 6.A O no hydrogen 2.612 N/A ILE 10.A N ASP 34.A O no hydrogen 3.044 N/A ASN 11.A N VAL 32.A O no hydrogen 3.134 N/A GLN 12.A N PRO 9.A O no hydrogen 3.246 N/A VAL 13.A N PRO 9.A O no hydrogen 3.394 N/A PHE 14.A N ILE 10.A O no hydrogen 2.906 N/A LEU 19.A N ASP 16.A OD2 no hydrogen 2.991 N/A ALA 20.A N ASP 16.A O no hydrogen 2.894 N/A ASN 21.A N PRO 17.A O no hydrogen 3.045 N/A ALA 22.A N GLY 18.A O no hydrogen 3.223 N/A VAL 23.A N LEU 19.A O no hydrogen 2.874 N/A LYS 24.A N ALA 20.A O no hydrogen 2.979 N/A LYS 24.A NZ ASN 21.A OD1 no hydrogen 3.527 N/A GLN 25.A N ASN 21.A O no hydrogen 2.991 N/A ASN 26.A N ALA 22.A O no hydrogen 2.838 N/A ASN 26.A ND2 ALA 22.A O no hydrogen 2.648 N/A ASN 26.A ND2 ASN 48.A O no hydrogen 3.104 N/A LEU 27.A N VAL 23.A O no hydrogen 2.836 N/A GLY 28.A N GLN 25.A O no hydrogen 3.156 N/A LYS 29.A N LYS 24.A O no hydrogen 2.952 N/A LYS 29.A NZ LEU 35.A O no hydrogen 3.447 N/A LYS 29.A NZ GLU 40.A OE2 no hydrogen 3.036 N/A SER 31.A N ASP 34.A OD2 no hydrogen 2.791 N/A THR 33.A N SER 31.A OG no hydrogen 2.908 N/A ASP 34.A N SER 31.A O no hydrogen 3.041 N/A VAL 36.A N THR 8.A O no hydrogen 3.051 N/A SER 37.A N GLU 40.A OE1 no hydrogen 2.968 N/A SER 37.A OG GLU 40.A OE1 no hydrogen 3.050 N/A GLN 38.A NE2.B GLN 38.A O no hydrogen 3.072 N/A GLN 38.A NE2.B SER 42.A OG no hydrogen 2.535 N/A GLN 38.A NE2.B PHE 62.A O no hydrogen 3.175 N/A GLU 40.A N SER 37.A OG no hydrogen 3.276 N/A LEU 41.A N SER 37.A O no hydrogen 3.081 N/A SER 42.A N GLN 38.A O no hydrogen 2.732 N/A SER 42.A OG GLN 38.A O no hydrogen 3.117 N/A GLY 43.A N LYS 39.A O no hydrogen 3.112 N/A GLY 43.A N GLU 40.A O no hydrogen 3.154 N/A VAL 44.A N LEU 41.A O no hydrogen 3.485 N/A ASN 46.A ND2 HIS 70.A NE2 no hydrogen 3.555 N/A PHE 47.A N GLU 68.A O no hydrogen 3.026 N/A ASN 48.A N ASN 26.A OD1 no hydrogen 3.172 N/A GLY 49.A N HIS 70.A O no hydrogen 2.628 N/A ASP 50.A N ASN 48.A OD1 no hydrogen 3.002 N/A ASN 51.A N SER 72.A O no hydrogen 2.992 N/A SER 52.A N ASN 74.A OD1 no hydrogen 3.032 N/A SER 52.A OG GLY 49.A O no hydrogen 3.072 N/A SER 52.A OG ASP 50.A O no hydrogen 2.651 N/A ILE 54.A N ASN 74.A OD1 no hydrogen 2.839 N/A GLN 55.A N ASP 16.A OD1 no hydrogen 3.101 N/A GLN 55.A N ASP 16.A OD2 no hydrogen 3.368 N/A ALA 58.A N SER 56.A OG no hydrogen 2.913 N/A GLY 59.A N GLN 61.A OE1 no hydrogen 2.816 N/A MET 60.A N LEU 57.A O no hydrogen 2.637 N/A GLN 61.A N GLN 61.A OE1 no hydrogen 2.573 N/A PHE 62.A N GLY 59.A O no hydrogen 2.967 N/A PHE 63.A N MET 60.A O no hydrogen 3.149 N/A THR 64.A OG1 PHE 62.A O no hydrogen 3.526 N/A ASN 65.A ND2 SER 42.A O no hydrogen 2.786 N/A LEU 66.A N PHE 63.A O no hydrogen 3.205 N/A LYS 67.A N GLN 45.A O no hydrogen 2.715 N/A GLU 68.A N GLN 45.A O no hydrogen 2.981 N/A LEU 69.A N GLU 90.A O no hydrogen 3.065 N/A HIS 70.A N PHE 47.A O no hydrogen 2.771 N/A HIS 70.A NE2 GLU 68.A OE2 no hydrogen 3.139 N/A LEU 71.A N SER 92.A O no hydrogen 2.865 N/A SER 72.A N ASP 50.A OD1 no hydrogen 2.708 N/A HIS 73.A N ASN 94.A O no hydrogen 3.041 N/A ASN 74.A ND2 GLY 49.A O no hydrogen 2.785 N/A ASN 74.A ND2 LEU 71.A O no hydrogen 3.087 N/A GLN 75.A N ILE 54.A O no hydrogen 2.989 N/A ILE 76.A N ASN 96.A OD1 no hydrogen 2.885 N/A SER 80.A N ASP 78.A OD1 no hydrogen 2.630 N/A SER 80.A OG ASP 78.A OD1 no hydrogen 2.473 N/A SER 80.A OG ASP 78.A OD2 no hydrogen 3.086 N/A LEU 82.A N LEU 79.A O no hydrogen 2.910 N/A LYS 83.A N SER 80.A O no hydrogen 3.010 N/A LEU 85.A N LEU 82.A O no hydrogen 3.277 N/A LYS 87.A NZ ASN 65.A OD1 no hydrogen 3.206 N/A GLU 89.A N LYS 67.A O no hydrogen 2.867 N/A GLU 90.A N LYS 67.A O no hydrogen 3.178 N/A LEU 91.A N ARG 110.A O no hydrogen 3.009 N/A SER 92.A N LEU 69.A O no hydrogen 3.004 N/A SER 92.A OG SER 72.A OG no hydrogen 3.101 N/A VAL 93.A N PHE 112.A O no hydrogen 2.651 N/A ARG 95.A N ASP 114.A O no hydrogen 2.842 N/A ASN 96.A ND2 LEU 71.A O no hydrogen 3.142 N/A ASN 96.A ND2 VAL 93.A O no hydrogen 2.722 N/A ARG 97.A N ILE 76.A O no hydrogen 2.957 N/A LEU 98.A N ASN 116.A OD1 no hydrogen 2.840 N/A LEU 101.A N SER 123.A OG no hydrogen 2.968 N/A ASN 102.A N ASN 100.A OD1 no hydrogen 2.772 N/A ILE 104.A N LEU 101.A O no hydrogen 3.076 N/A SER 109.A N GLU 89.A O no hydrogen 2.860 N/A ARG 110.A N GLU 89.A O no hydrogen 3.106 N/A ARG 110.A NE GLU 90.A OE1 no hydrogen 2.899 N/A ARG 110.A NH2 GLU 89.A OE1 no hydrogen 3.529 N/A LEU 111.A N ILE 132.A O no hydrogen 3.018 N/A PHE 112.A N LEU 91.A O no hydrogen 3.196 N/A LEU 113.A N SER 134.A O no hydrogen 2.942 N/A ASP 114.A N ASN 94.A OD1 no hydrogen 2.704 N/A ASN 115.A N ARG 136.A O no hydrogen 2.885 N/A ASN 116.A ND2 VAL 93.A O no hydrogen 2.926 N/A ASN 116.A ND2 LEU 113.A O no hydrogen 3.298 N/A ASN 116.A ND2 ASP 114.A O no hydrogen 3.301 N/A GLU 117.A N LEU 98.A O no hydrogen 2.793 N/A LEU 118.A N ASN 138.A OD1 no hydrogen 2.843 N/A THR 121.A N SER 142.A O no hydrogen 3.185 N/A THR 121.A OG1 SER 142.A O no hydrogen 3.435 N/A ASP 122.A N ASP 120.A OD1 no hydrogen 2.951 N/A LEU 124.A N THR 121.A O no hydrogen 3.032 N/A LEU 127.A N LEU 124.A O no hydrogen 2.965 N/A LYS 128.A NZ ILE 125.A O no hydrogen 2.738 N/A ASN 129.A ND2 SER 106.A O no hydrogen 3.570 N/A ASN 129.A ND2 ALA 107.A O no hydrogen 3.067 N/A LEU 130.A N LEU 127.A O no hydrogen 3.236 N/A GLU 131.A N SER 109.A O no hydrogen 2.872 N/A ILE 132.A N SER 109.A O no hydrogen 3.109 N/A LEU 133.A N VAL 154.A O no hydrogen 2.908 N/A SER 134.A N LEU 111.A O no hydrogen 2.849 N/A SER 134.A OG ASP 114.A OD1 no hydrogen 2.353 N/A SER 134.A OG ASP 114.A OD2 no hydrogen 3.366 N/A ILE 135.A N ASP 156.A O no hydrogen 2.835 N/A ARG 136.A N ASP 114.A OD1 no hydrogen 2.845 N/A ARG 136.A NH1 ASP 156.A OD1 no hydrogen 3.352 N/A ARG 136.A NH1 ASP 156.A OD2 no hydrogen 2.788 N/A ASN 137.A N HIS 158.A O no hydrogen 2.925 N/A ASN 138.A ND2 LEU 113.A O no hydrogen 3.005 N/A ASN 138.A ND2 ARG 136.A O no hydrogen 3.192 N/A LYS 139.A N LEU 118.A O no hydrogen 2.858 N/A LEU 140.A N ASN 160.A OD1 no hydrogen 3.217 N/A LYS 141.A N ARG 119.A O no hydrogen 2.756 N/A LYS 141.A NZ GLU 161.A OE1 no hydrogen 3.554 N/A MET 145.A N THR 121.A OG1 no hydrogen 3.400 N/A LEU 146.A N ILE 143.A O no hydrogen 2.971 N/A PHE 148.A N MET 145.A O no hydrogen 2.875 N/A LEU 149.A N LEU 146.A O no hydrogen 2.941 N/A LYS 151.A NZ ASN 129.A OD1 no hydrogen 2.864 N/A LEU 152.A N LEU 149.A O no hydrogen 3.133 N/A GLU 153.A N GLU 131.A O no hydrogen 2.616 N/A VAL 154.A N GLU 131.A O no hydrogen 3.054 N/A LEU 155.A N TRP 176.A O no hydrogen 2.992 N/A ASP 156.A N LEU 133.A O no hydrogen 2.934 N/A LEU 157.A N ASP 178.A O no hydrogen 2.869 N/A HIS 158.A N ASP 156.A OD1 no hydrogen 3.018 N/A HIS 158.A ND1 THR 180.A OG1 no hydrogen 2.528 N/A GLY 159.A N THR 180.A O no hydrogen 3.040 N/A ASN 160.A ND2 ILE 135.A O no hydrogen 3.005 N/A ASN 160.A ND2 LEU 157.A O no hydrogen 2.824 N/A GLU 161.A N LEU 140.A O no hydrogen 2.893 N/A ILE 162.A N GLN 182.A OE1 no hydrogen 3.084 N/A THR 163.A OG1 THR 199.A OG1 no hydrogen 3.400 N/A THR 165.A N LYS 201.A O no hydrogen 3.251 N/A THR 165.A OG1 LYS 201.A O no hydrogen 3.062 N/A GLY 166.A N ASN 164.A OD1 no hydrogen 2.785 N/A LEU 168.A N THR 165.A O no hydrogen 3.497 N/A ARG 170.A N GLY 167.A O no hydrogen 3.154 N/A LEU 171.A N LEU 168.A O no hydrogen 3.211 N/A LYS 172.A NZ THR 169.A O no hydrogen 2.732 N/A ASN 175.A N GLU 153.A O no hydrogen 2.616 N/A TRP 176.A N GLU 153.A O no hydrogen 3.283 N/A ASP 178.A N LEU 155.A O no hydrogen 3.079 N/A THR 180.A N ASP 178.A OD1 no hydrogen 2.933 N/A THR 180.A OG1 HIS 158.A ND1 no hydrogen 2.528 N/A THR 180.A OG1 ASP 178.A OD1 no hydrogen 2.724 N/A GLY 181.A N ASP 253.A OD1 no hydrogen 2.712 N/A GLN 182.A N ASP 253.A O no hydrogen 2.896 N/A GLN 182.A NE2 LEU 157.A O no hydrogen 3.249 N/A GLN 182.A NE2 LEU 179.A O no hydrogen 2.907 N/A LYS 183.A N ASN 160.A O no hydrogen 2.819 N/A ASN 185.A N THR 257.A O no hydrogen 2.993 N/A ASN 185.A ND2 GLN 258.A OE1 no hydrogen 2.962 N/A VAL 188.A N PRO 259.A O no hydrogen 3.247 N/A TYR 190.A OH LEU 228.A O no hydrogen 2.616 N/A LEU 194.A N TRP 226.A O no hydrogen 3.068 N/A ILE 196.A N VAL 224.A O no hydrogen 3.055 N/A ASN 198.A N GLY 222.A O no hydrogen 3.240 N/A ASN 198.A ND2 ILE 208.A O no hydrogen 3.008 N/A ASN 198.A ND2 TYR 219.A OH no hydrogen 3.405 N/A THR 199.A OG1 THR 163.A OG1 no hydrogen 3.400 N/A VAL 200.A N ASN 198.A OD1 no hydrogen 3.272 N/A LYS 201.A N THR 163.A O no hydrogen 2.773 N/A LYS 201.A NZ GLY 205.A O no hydrogen 3.432 N/A ASP 202.A N ARG 206.A O no hydrogen 2.831 N/A ASP 204.A N ASP 202.A OD1 no hydrogen 2.830 N/A GLY 205.A N ASP 202.A O no hydrogen 3.047 N/A ARG 206.A N ASP 202.A OD1 no hydrogen 2.967 N/A ILE 208.A N VAL 200.A O no hydrogen 2.824 N/A ALA 211.A N LYS 238.A O no hydrogen 2.743 N/A ALA 212.A N LYS 238.A O no hydrogen 3.464 N/A SER 214.A N SER 236.A O no hydrogen 2.942 N/A SER 214.A OG SER 236.A O no hydrogen 3.096 N/A ASN 215.A ND2 SER 214.A OG no hydrogen 2.607 N/A GLY 217.A N SER 214.A O no hydrogen 3.280 N/A SER 218.A N LEU 225.A O no hydrogen 3.030 N/A SER 218.A OG.A LEU 225.A O no hydrogen 3.127 N/A VAL 220.A N CYS 223.A O no hydrogen 2.936 N/A CYS 223.A N VAL 220.A O no hydrogen 2.873 N/A CYS 223.A SG ASP 221.A O no hydrogen 3.919 N/A VAL 224.A N ILE 196.A O no hydrogen 2.866 N/A LEU 225.A N SER 218.A O no hydrogen 2.747 N/A TRP 226.A N LEU 194.A O no hydrogen 3.012 N/A TRP 226.A NE1 SER 214.A O no hydrogen 2.918 N/A LEU 228.A N PRO 192.A O no hydrogen 2.721 N/A VAL 235.A N GLN 258.A O no hydrogen 3.090 N/A SER 236.A N SER 214.A OG no hydrogen 2.898 N/A TYR 237.A N VAL 256.A O no hydrogen 2.935 N/A TYR 237.A OH ASN 198.A OD1 no hydrogen 2.574 N/A LYS 238.A N ALA 212.A O no hydrogen 2.917 N/A PHE 239.A N GLY 254.A O no hydrogen 2.922 N/A GLU 241.A N PHE 252.A O no hydrogen 3.068 N/A ILE 243.A N ALA 250.A O no hydrogen 2.839 N/A VAL 245.A N THR 248.A O no hydrogen 2.806 N/A THR 248.A N VAL 245.A O no hydrogen 2.879 N/A GLU 249.A N THR 248.A OG1 no hydrogen 2.482 N/A ALA 250.A N ILE 243.A O no hydrogen 3.096 N/A PHE 252.A N GLU 241.A O no hydrogen 2.962 N/A GLY 254.A N PHE 239.A O no hydrogen 2.980 N/A THR 255.A N GLN 182.A O no hydrogen 2.919 N/A VAL 256.A N TYR 237.A O no hydrogen 2.995 N/A GLN 258.A N VAL 235.A O no hydrogen 2.717 N/A GLN 258.A NE2 GLU 186.A O no hydrogen 3.126 N/A GLN 258.A NE2 PRO 259.A O no hydrogen 2.745 N/A ILE 260.A N ASP 233.A O no hydrogen 2.816 N/A LYS 261.A N VAL 188.A O no hydrogen 3.057 N/A