Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1p84_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N THR 2.A O no hydrogen 3.000 N/A HIS 6.A N THR 2.A O no hydrogen 3.216 N/A GLY 7.A N ALA 3.A O no hydrogen 2.806 N/A LEU 8.A N PRO 155.A O no hydrogen 2.831 N/A TYR 13.A N ASP 128.A OD1 no hydrogen 3.129 N/A TRP 15.A N TYR 13.A O no hydrogen 3.048 N/A TRP 15.A NE1 ASP 128.A OD1 no hydrogen 2.815 N/A ASN 18.A N TRP 15.A O no hydrogen 3.109 N/A GLU 22.A N GLY 19.A O no hydrogen 3.108 N/A THR 23.A OG1 PHE 24.A O no hydrogen 3.140 N/A PHE 24.A N ASP 203.A OD1 no hydrogen 2.772 N/A HIS 26.A ND1 VAL 57.A O no hydrogen 2.764 N/A HIS 26.A NE2 ASP 203.A OD2 no hydrogen 2.786 N/A ALA 27.A N ASP 25.A OD2 no hydrogen 3.100 N/A SER 28.A N ASP 25.A OD2 no hydrogen 3.100 N/A SER 28.A OG ASP 189.A OD1 no hydrogen 2.792 N/A ILE 29.A N ASP 25.A O no hydrogen 3.112 N/A ARG 30.A N HIS 26.A O no hydrogen 3.000 N/A ARG 30.A NH1 GLU 63.A OE1 no hydrogen 2.929 N/A ARG 30.A NH1 GLU 176.A OE1 no hydrogen 2.895 N/A ARG 30.A NH2 SER 58.A O no hydrogen 2.869 N/A ARG 30.A NH2 GLU 63.A OE1 no hydrogen 3.374 N/A ARG 30.A NH2 GLU 63.A OE2 no hydrogen 3.306 N/A ARG 31.A N ALA 27.A O no hydrogen 3.022 N/A ARG 31.A NE ASP 177.A OD2 no hydrogen 3.470 N/A ARG 31.A NH2 ASP 189.A OD2 no hydrogen 3.194 N/A GLY 32.A N SER 28.A O no hydrogen 2.887 N/A TYR 33.A N ILE 29.A O no hydrogen 2.947 N/A GLN 34.A N ARG 30.A O no hydrogen 3.434 N/A GLN 34.A NE2 GLU 38.A OE2 no hydrogen 3.257 N/A GLN 34.A NE2 GLU 174.A O no hydrogen 3.108 N/A VAL 35.A N ARG 31.A O no hydrogen 3.132 N/A TYR 36.A N GLY 32.A O no hydrogen 2.941 N/A TYR 36.A OH HIS 44.A O no hydrogen 2.717 N/A ARG 37.A N TYR 33.A O no hydrogen 2.917 N/A ARG 37.A NE TYR 33.A OH no hydrogen 3.286 N/A ARG 37.A NH1 TYR 33.A OH no hydrogen 3.278 N/A GLU 38.A N GLN 34.A O no hydrogen 2.814 N/A VAL 39.A N VAL 35.A O no hydrogen 2.968 N/A CYS 40.A SG VAL 35.A O no hydrogen 3.833 N/A ALA 41.A N TYR 36.A O no hydrogen 2.675 N/A CYS 43.A N CYS 40.A O no hydrogen 2.895 N/A HIS 44.A N CYS 40.A O no hydrogen 2.905 N/A HIS 44.A ND1 PRO 114.A O no hydrogen 2.831 N/A SER 45.A OG ASP 115.A OD1 no hydrogen 2.687 N/A ASP 47.A N ASP 115.A OD1 no hydrogen 2.859 N/A ARG 48.A N SER 117.A OG no hydrogen 3.132 N/A VAL 49.A N LEU 46.A O no hydrogen 3.131 N/A TRP 51.A N ASP 92.A O no hydrogen 3.049 N/A TRP 51.A NE1 TYR 73.A OH no hydrogen 2.763 N/A ARG 52.A N LEU 90.A O no hydrogen 3.089 N/A THR 53.A N ALA 50.A O no hydrogen 2.935 N/A THR 53.A OG1 ALA 50.A O no hydrogen 2.751 N/A LEU 54.A N TRP 51.A O no hydrogen 2.915 N/A VAL 55.A N ARG 52.A O no hydrogen 3.208 N/A GLY 56.A N HIS 59.A O no hydrogen 2.989 N/A VAL 57.A N LEU 54.A O no hydrogen 2.934 N/A SER 58.A N LEU 54.A O no hydrogen 3.090 N/A SER 58.A OG HIS 59.A ND1 no hydrogen 2.634 N/A HIS 59.A N LEU 54.A O no hydrogen 3.411 N/A HIS 59.A ND1 SER 58.A OG no hydrogen 2.634 N/A THR 60.A N GLU 63.A OE2 no hydrogen 3.021 N/A THR 60.A OG1 GLU 63.A OE2 no hydrogen 3.270 N/A GLU 63.A N THR 60.A OG1 no hydrogen 3.110 N/A VAL 64.A N THR 60.A O no hydrogen 3.090 N/A ARG 65.A N ASN 61.A O no hydrogen 3.164 N/A ASN 66.A N GLU 62.A O no hydrogen 3.033 N/A MET 67.A N GLU 63.A O no hydrogen 3.081 N/A ALA 68.A N VAL 64.A O no hydrogen 2.919 N/A GLU 69.A N ARG 65.A O no hydrogen 3.183 N/A GLU 70.A N MET 67.A O no hydrogen 3.458 N/A PHE 71.A N ALA 68.A O no hydrogen 3.263 N/A TYR 73.A N ARG 86.A O no hydrogen 2.871 N/A TYR 73.A OH TYR 93.A O no hydrogen 3.220 N/A ASP 75.A N LYS 84.A O no hydrogen 3.018 N/A GLU 76.A N ASP 75.A OD2 no hydrogen 2.678 N/A ASP 78.A N ASN 82.A O no hydrogen 3.350 N/A GLY 81.A N ASP 78.A O no hydrogen 2.976 N/A LYS 84.A NZ ASP 75.A OD1 no hydrogen 3.563 N/A ARG 86.A NH2 ASP 92.A OD2 no hydrogen 3.410 N/A LYS 89.A N ASP 92.A OD2 no hydrogen 3.106 N/A ASP 92.A N LYS 89.A O no hydrogen 3.061 N/A ILE 94.A N VAL 49.A O no hydrogen 3.080 N/A ALA 103.A N ASN 100.A OD1 no hydrogen 2.802 N/A ALA 104.A N ASN 100.A O no hydrogen 3.227 N/A ARG 105.A N GLU 101.A O no hydrogen 3.089 N/A ARG 105.A NH1 GLU 101.A OE2 no hydrogen 3.090 N/A ARG 105.A NH2 GLY 110.A O no hydrogen 3.186 N/A ALA 106.A N GLN 102.A O no hydrogen 3.063 N/A ALA 107.A N ALA 103.A O no hydrogen 3.273 N/A ASN 108.A N ARG 105.A O no hydrogen 2.884 N/A ASN 108.A ND2 TYR 98.A OH no hydrogen 3.344 N/A ASN 108.A ND2 ALA 104.A O no hydrogen 2.776 N/A GLY 110.A N ARG 105.A O no hydrogen 2.799 N/A ALA 111.A N ASN 108.A O no hydrogen 2.978 N/A LEU 116.A N SER 45.A O no hydrogen 3.209 N/A SER 117.A N ASP 115.A OD2 no hydrogen 2.886 N/A SER 117.A OG ASP 115.A OD2 no hydrogen 2.726 N/A LYS 121.A N LEU 118.A O no hydrogen 2.689 N/A ALA 122.A N LEU 118.A O no hydrogen 2.968 N/A ALA 122.A N ILE 119.A O no hydrogen 3.275 N/A ARG 123.A NH2 ALA 122.A O no hydrogen 2.906 N/A GLY 126.A N ARG 123.A O no hydrogen 3.189 N/A CYS 127.A SG ASN 195.A OD1 no hydrogen 3.127 N/A TYR 129.A N GLY 125.A O no hydrogen 3.353 N/A ILE 130.A N GLY 126.A O no hydrogen 3.161 N/A PHE 131.A N CYS 127.A O no hydrogen 3.013 N/A SER 132.A N ASP 128.A O no hydrogen 3.131 N/A SER 132.A OG ASP 128.A O no hydrogen 2.783 N/A LEU 133.A N TYR 129.A O no hydrogen 2.862 N/A LEU 134.A N ILE 130.A O no hydrogen 3.108 N/A THR 135.A N PHE 131.A O no hydrogen 3.030 N/A THR 135.A OG1 PHE 131.A O no hydrogen 3.123 N/A GLY 136.A N LEU 133.A O no hydrogen 3.408 N/A TYR 137.A OH MET 164.A O no hydrogen 2.433 N/A VAL 145.A N PRO 142.A O no hydrogen 3.324 N/A SER 151.A N PRO 148.A O no hydrogen 3.161 N/A SER 151.A OG SER 161.A OG no hydrogen 3.186 N/A ASN 152.A N ILE 162.A O no hydrogen 2.848 N/A ASN 152.A ND2 ILE 162.A O no hydrogen 3.531 N/A ASN 154.A N GLY 160.A O no hydrogen 3.046 N/A ASN 154.A ND2 LEU 133.A O no hydrogen 2.763 N/A TYR 156.A N ASN 154.A OD1 no hydrogen 3.155 N/A GLY 159.A N ALA 4.A O no hydrogen 2.816 N/A GLY 160.A N PHE 157.A O no hydrogen 2.964 N/A SER 161.A N GLY 159.A O no hydrogen 2.804 N/A ILE 162.A N ASN 152.A O no hydrogen 2.926 N/A ARG 166.A NE LEU 168.A O no hydrogen 2.782 N/A ARG 166.A NH1 LEU 168.A O no hydrogen 3.388 N/A ASP 171.A N ALA 181.A O no hydrogen 2.839 N/A GLY 178.A N TYR 175.A O no hydrogen 3.001 N/A THR 179.A OG1 ASP 177.A OD1 no hydrogen 3.118 N/A THR 179.A OG1 ASP 177.A OD2 no hydrogen 2.749 N/A THR 182.A N PRO 180.A O no hydrogen 2.954 N/A GLN 185.A N THR 182.A OG1 no hydrogen 3.287 N/A GLN 185.A NE2 ASP 189.A OD2 no hydrogen 3.364 N/A MET 186.A N THR 182.A O no hydrogen 3.029 N/A ALA 187.A N THR 183.A O no hydrogen 3.062 N/A LYS 188.A N SER 184.A O no hydrogen 2.924 N/A ASP 189.A N GLN 185.A O no hydrogen 3.117 N/A VAL 190.A N MET 186.A O no hydrogen 2.970 N/A THR 191.A N ALA 187.A O no hydrogen 3.153 N/A THR 191.A OG1 ALA 187.A O no hydrogen 3.231 N/A THR 192.A OG1 LYS 188.A O no hydrogen 2.779 N/A PHE 193.A N ASP 189.A O no hydrogen 3.002 N/A LEU 194.A N VAL 190.A O no hydrogen 2.620 N/A ASN 195.A N THR 191.A O no hydrogen 2.822 N/A ASN 195.A N THR 192.A O no hydrogen 3.176 N/A ASN 195.A ND2 GLU 199.A OE2 no hydrogen 3.342 N/A TRP 196.A N THR 192.A O no hydrogen 3.065 N/A CYS 197.A N PHE 193.A O no hydrogen 3.024 N/A CYS 197.A SG PHE 193.A O no hydrogen 3.173 N/A ALA 198.A N LEU 194.A O no hydrogen 3.229 N/A GLU 199.A N ASN 195.A O no hydrogen 2.869 N/A GLU 201.A N GLU 201.A OE1 no hydrogen 2.947 N/A HIS 202.A N GLU 199.A O no hydrogen 2.935 N/A HIS 202.A ND1 ASP 203.A OD1 no hydrogen 3.101 N/A ARG 205.A N GLU 201.A O no hydrogen 2.760 N/A ARG 205.A NE GLU 201.A OE2 no hydrogen 2.933 N/A ARG 205.A NH1 GLU 201.A OE2 no hydrogen 3.168 N/A LYS 206.A N HIS 202.A O no hydrogen 3.132 N/A LYS 206.A NZ HIS 17.A O no hydrogen 2.893 N/A LYS 206.A NZ GLY 19.A O no hydrogen 2.620 N/A LYS 206.A NZ GLU 22.A O no hydrogen 3.270 N/A ARG 207.A N ASP 203.A O no hydrogen 3.323 N/A ARG 207.A N GLU 204.A O no hydrogen 3.025 N/A ARG 207.A NH2 GLU 204.A OE1 no hydrogen 2.602 N/A LEU 208.A N GLU 204.A O no hydrogen 3.016 N/A GLY 209.A N ARG 205.A O no hydrogen 2.985 N/A LEU 210.A N LYS 206.A O no hydrogen 3.241 N/A LYS 211.A N ARG 207.A O no hydrogen 3.378 N/A THR 212.A N LEU 208.A O no hydrogen 2.992 N/A THR 212.A OG1 LEU 208.A O no hydrogen 2.824 N/A VAL 213.A N GLY 209.A O no hydrogen 2.905 N/A ILE 214.A N LEU 210.A O no hydrogen 3.287 N/A ILE 215.A N LYS 211.A O no hydrogen 3.162 N/A LEU 216.A N THR 212.A O no hydrogen 3.097 N/A SER 217.A N VAL 213.A O no hydrogen 3.068 N/A SER 217.A OG VAL 213.A O no hydrogen 2.884 N/A SER 218.A N ILE 214.A O no hydrogen 3.111 N/A SER 218.A OG ILE 214.A O no hydrogen 2.948 N/A LEU 219.A N ILE 215.A O no hydrogen 2.820 N/A TYR 220.A N LEU 216.A O no hydrogen 2.864 N/A LEU 221.A N SER 217.A O no hydrogen 3.008 N/A LEU 222.A N SER 218.A O no hydrogen 2.906 N/A SER 223.A N LEU 219.A O no hydrogen 2.941 N/A SER 223.A OG TYR 220.A O no hydrogen 2.683 N/A ILE 224.A N TYR 220.A O no hydrogen 3.411 N/A ILE 224.A N LEU 221.A O no hydrogen 3.192 N/A TRP 225.A N LEU 221.A O no hydrogen 3.442 N/A VAL 226.A N LEU 222.A O no hydrogen 3.052 N/A LYS 227.A N SER 223.A O no hydrogen 2.852 N/A LYS 228.A N ILE 224.A O no hydrogen 2.966 N/A PHE 229.A N TRP 225.A O no hydrogen 3.098 N/A LYS 230.A N VAL 226.A O no hydrogen 3.017 N/A TRP 231.A N LYS 227.A O no hydrogen 2.968 N/A TRP 231.A N LYS 228.A O no hydrogen 3.216 N/A ALA 232.A N LYS 228.A O no hydrogen 2.957 N/A ALA 232.A N PHE 229.A O no hydrogen 3.298 N/A ILE 234.A N TRP 231.A O no hydrogen 2.908 N/A LYS 235.A N TRP 231.A O no hydrogen 3.025 N/A THR 236.A N ALA 232.A O no hydrogen 3.265 N/A THR 236.A OG1 ALA 232.A O no hydrogen 2.893 N/A ARG 237.A N ILE 234.A O no hydrogen 3.215 N/A