Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4x6d_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A OG CYS 91.A O no hydrogen 3.570 N/A PHE 4.A N CYS 91.A O no hydrogen 3.176 N/A HIS 5.A N TRP 20.A O no hydrogen 2.804 N/A HIS 5.A NE2 SER 22.A O no hydrogen 2.988 N/A VAL 6.A N GLY 89.A O no hydrogen 2.660 N/A ILE 7.A N SER 18.A O no hydrogen 2.812 N/A TRP 8.A N VAL 87.A O no hydrogen 2.750 N/A TRP 8.A NE1 THR 63.A OG1 no hydrogen 3.230 N/A ILE 9.A N LEU 16.A O no hydrogen 3.017 N/A ALA 10.A N ILE 85.A O no hydrogen 2.845 N/A SER 11.A N GLN 14.A O no hydrogen 3.204 N/A SER 11.A OG GLU 84.A OE1 no hydrogen 3.050 N/A PHE 12.A N PHE 83.A O no hydrogen 3.288 N/A LEU 16.A N ILE 9.A O no hydrogen 2.965 N/A SER 18.A N ILE 7.A O no hydrogen 3.219 N/A GLY 19.A N HIS 27.A O no hydrogen 2.953 N/A TRP 20.A N HIS 5.A O no hydrogen 2.723 N/A TRP 20.A NE1 SER 18.A OG no hydrogen 2.739 N/A LEU 21.A N LEU 24.A O no hydrogen 2.659 N/A SER 22.A N SER 3.A O no hydrogen 2.632 N/A LEU 24.A N LEU 21.A O no hydrogen 2.925 N/A GLN 25.A NE2 HIS 27.A O no hydrogen 3.223 N/A THR 26.A N GLY 19.A O no hydrogen 2.990 N/A THR 26.A OG1 GLY 19.A O no hydrogen 3.294 N/A THR 26.A OG1 HIS 27.A ND1 no hydrogen 3.425 N/A HIS 27.A N GLY 19.A O no hydrogen 2.894 N/A THR 28.A N VAL 37.A O no hydrogen 2.995 N/A TRP 29.A N VAL 17.A O no hydrogen 3.222 N/A ASP 30.A N THR 35.A O no hydrogen 3.026 N/A SER 33.A N ASP 30.A OD2 no hydrogen 3.223 N/A SER 33.A OG ASP 30.A OD2 no hydrogen 2.353 N/A SER 33.A OG THR 35.A OG1 no hydrogen 3.254 N/A THR 35.A OG1 SER 33.A O no hydrogen 3.219 N/A THR 35.A OG1 SER 33.A OG no hydrogen 3.254 N/A ILE 36.A N GLU 56.A OE2 no hydrogen 3.167 N/A VAL 37.A N THR 28.A O no hydrogen 2.578 N/A LEU 39.A N THR 26.A O no hydrogen 3.446 N/A LEU 39.A N SER 43.A OG no hydrogen 3.359 N/A TRP 40.A N SER 43.A OG no hydrogen 3.338 N/A SER 43.A N TRP 40.A O no hydrogen 2.655 N/A SER 43.A OG THR 26.A O no hydrogen 2.208 N/A ARG 44.A NH1 ASN 49.A OD1 no hydrogen 3.088 N/A SER 48.A N GLU 51.A OE1 no hydrogen 3.019 N/A SER 48.A OG GLU 51.A OE1 no hydrogen 2.815 N/A GLU 50.A N GLU 50.A OE1 no hydrogen 2.909 N/A TRP 52.A N SER 48.A O no hydrogen 2.832 N/A TRP 52.A NE1 ARG 44.A O no hydrogen 3.103 N/A LYS 53.A N ASN 49.A O no hydrogen 3.038 N/A GLU 54.A N GLU 50.A O no hydrogen 3.278 N/A LEU 55.A N GLU 51.A O no hydrogen 2.857 N/A GLU 56.A N TRP 52.A O no hydrogen 2.807 N/A THR 57.A N LYS 53.A O no hydrogen 2.897 N/A THR 57.A OG1 LYS 53.A O no hydrogen 2.739 N/A LEU 58.A N GLU 54.A O no hydrogen 3.055 N/A PHE 59.A N LEU 55.A O no hydrogen 2.709 N/A ARG 60.A N GLU 56.A O no hydrogen 2.965 N/A ARG 60.A N THR 57.A O no hydrogen 3.094 N/A ILE 61.A N THR 57.A O no hydrogen 3.162 N/A ARG 62.A N LEU 58.A O no hydrogen 3.200 N/A ARG 62.A NH1 THR 147.A OG1 no hydrogen 3.314 N/A ARG 62.A NH2 THR 147.A OG1 no hydrogen 3.110 N/A THR 63.A N PHE 59.A O no hydrogen 3.172 N/A THR 63.A OG1 PHE 59.A O no hydrogen 3.103 N/A ILE 64.A N ARG 60.A O no hydrogen 3.055 N/A ARG 65.A N ILE 61.A O no hydrogen 2.890 N/A SER 66.A N ARG 62.A O no hydrogen 2.997 N/A SER 66.A OG ARG 62.A O no hydrogen 2.710 N/A PHE 67.A N THR 63.A O no hydrogen 2.709 N/A GLU 68.A N ILE 64.A O no hydrogen 2.830 N/A GLY 69.A N ARG 65.A O no hydrogen 3.001 N/A ILE 70.A N PHE 67.A O no hydrogen 3.065 N/A ARG 72.A N GLU 68.A O no hydrogen 3.229 N/A LEU 77.A N TYR 73.A O no hydrogen 2.927 N/A GLU 84.A N GLN 108.A OE1 no hydrogen 2.953 N/A ILE 85.A N ALA 10.A O no hydrogen 3.112 N/A GLN 86.A N ALA 106.A O no hydrogen 3.044 N/A VAL 87.A N TRP 8.A O no hydrogen 2.999 N/A THR 88.A N GLN 104.A O no hydrogen 2.990 N/A GLY 89.A N VAL 6.A O no hydrogen 3.061 N/A GLY 90.A N PHE 102.A O no hydrogen 3.027 N/A CYS 91.A N PHE 4.A O no hydrogen 3.200 N/A GLU 92.A N GLY 100.A O no hydrogen 3.165 N/A LEU 93.A N LEU 2.A O no hydrogen 2.763 N/A HIS 94.A N LYS 97.A O no hydrogen 2.912 N/A SER 99.A N GLU 92.A O no hydrogen 2.991 N/A SER 99.A OG SER 99.A O no hydrogen 2.373 N/A SER 101.A OG LEU 151.A O no hydrogen 3.176 N/A PHE 102.A N GLY 90.A O no hydrogen 2.957 N/A GLN 104.A N THR 88.A O no hydrogen 2.895 N/A LEU 105.A N VAL 113.A O no hydrogen 2.820 N/A ALA 106.A N GLN 86.A O no hydrogen 2.744 N/A TYR 107.A N SER 110.A O no hydrogen 3.013 N/A GLN 108.A N GLU 84.A O no hydrogen 3.082 N/A GLN 108.A NE2 PRO 82.A O no hydrogen 3.588 N/A SER 110.A N TYR 107.A O no hydrogen 3.113 N/A SER 110.A OG ASP 111.A O no hydrogen 3.366 N/A PHE 112.A N LEU 105.A O no hydrogen 3.003 N/A VAL 113.A N LEU 105.A O no hydrogen 3.363 N/A SER 114.A N LEU 121.A O no hydrogen 2.798 N/A PHE 115.A N LEU 103.A O no hydrogen 2.883 N/A GLN 116.A N SER 119.A O no hydrogen 2.891 N/A SER 119.A N GLN 116.A O no hydrogen 2.969 N/A TRP 120.A N ASN 138.A OD1 no hydrogen 2.790 N/A LEU 121.A N SER 114.A O no hydrogen 2.696 N/A TYR 123.A N PHE 112.A O no hydrogen 3.182 N/A ALA 126.A N TYR 123.A O no hydrogen 3.139 N/A GLY 127.A N PRO 124.A O no hydrogen 3.351 N/A HIS 132.A N MET 129.A O no hydrogen 2.915 N/A PHE 133.A N MET 129.A O no hydrogen 2.792 N/A CYS 134.A N ALA 130.A O no hydrogen 3.174 N/A CYS 134.A SG ALA 130.A O no hydrogen 3.563 N/A VAL 136.A N HIS 132.A O no hydrogen 3.256 N/A VAL 136.A N PHE 133.A O no hydrogen 3.285 N/A LEU 137.A N PHE 133.A O no hydrogen 3.166 N/A ASN 138.A N CYS 134.A O no hydrogen 2.775 N/A ASN 138.A ND2 TRP 120.A O no hydrogen 3.019 N/A GLN 139.A N VAL 136.A O no hydrogen 3.142 N/A GLN 141.A NE2 ASN 118.A O no hydrogen 3.333 N/A GLN 141.A NE2 ASN 118.A OD1 no hydrogen 3.290 N/A GLN 141.A NE2 ASP 145.A OD1 no hydrogen 3.063 N/A HIS 142.A N ASN 140.A OD1 no hydrogen 3.259 N/A ASN 144.A ND2 ASN 138.A OD1 no hydrogen 3.149 N/A ASN 144.A ND2 GLN 141.A OE1 no hydrogen 3.354 N/A ASP 145.A N GLN 141.A O no hydrogen 2.776 N/A ILE 146.A N HIS 142.A O no hydrogen 3.206 N/A THR 147.A N GLU 143.A O no hydrogen 3.184 N/A THR 147.A OG1 GLU 143.A O no hydrogen 3.164 N/A HIS 148.A N ASN 144.A O no hydrogen 2.902 N/A ASN 149.A N ASP 145.A O no hydrogen 2.933 N/A LEU 150.A N ILE 146.A O no hydrogen 3.179 N/A LEU 151.A N THR 147.A O no hydrogen 3.167 N/A SER 152.A N HIS 148.A O no hydrogen 3.059 N/A SER 152.A OG HIS 148.A O no hydrogen 2.743 N/A ASP 153.A N ASN 149.A O no hydrogen 2.976 N/A THR 154.A N ASN 149.A O no hydrogen 3.058 N/A THR 154.A OG1 ASN 149.A O no hydrogen 3.552 N/A CYS 155.A N LEU 150.A O no hydrogen 2.851 N/A ARG 157.A N ASP 153.A O no hydrogen 3.468 N/A ARG 157.A NE ASP 153.A OD1 no hydrogen 3.179 N/A PHE 158.A N THR 154.A O no hydrogen 2.936 N/A ILE 159.A N CYS 155.A O no hydrogen 2.914 N/A LEU 160.A N PRO 156.A O no hydrogen 3.372 N/A GLY 161.A N ARG 157.A O no hydrogen 3.379 N/A LEU 162.A N PHE 158.A O no hydrogen 2.948 N/A LEU 163.A N ILE 159.A O no hydrogen 2.908 N/A ASP 164.A N LEU 160.A O no hydrogen 3.187 N/A ALA 165.A N GLY 161.A O no hydrogen 2.800 N/A GLY 166.A N LEU 162.A O no hydrogen 2.970 N/A HIS 169.A N GLY 166.A O no hydrogen 2.875 N/A LEU 170.A N GLY 166.A O no hydrogen 3.071 N/A ARG 172.A NE HIS 169.A O no hydrogen 2.662 N/A VAL 174.A N TYR 201.A O no hydrogen 2.850 N/A GLU 177.A N SER 198.A O no hydrogen 2.987 N/A TRP 179.A N HIS 196.A O no hydrogen 3.066 N/A SER 181.A N VAL 194.A O no hydrogen 2.926 N/A SER 181.A OG HIS 182.A O no hydrogen 3.030 N/A SER 181.A OG HIS 196.A NE2 no hydrogen 3.264 N/A GLY 183.A N GLN 192.A O no hydrogen 2.935 N/A SER 185.A OG GLY 187.A O no hydrogen 3.174 N/A HIS 190.A N GLY 187.A O no hydrogen 3.222 N/A HIS 190.A ND1 PRO 188.A O no hydrogen 2.967 N/A LEU 191.A N VAL 240.A O no hydrogen 2.772 N/A GLN 192.A NE2 PRO 184.A O no hydrogen 3.421 N/A LEU 193.A N LEU 238.A O no hydrogen 2.871 N/A VAL 194.A N SER 181.A O no hydrogen 2.839 N/A CYS 195.A N ALA 236.A O no hydrogen 3.016 N/A HIS 196.A N TRP 179.A O no hydrogen 2.779 N/A HIS 196.A ND1 TYR 233.A OH no hydrogen 2.482 N/A HIS 196.A NE2 SER 181.A OG no hydrogen 3.264 N/A VAL 197.A N LEU 234.A O no hydrogen 3.051 N/A SER 198.A N GLU 177.A O no hydrogen 2.898 N/A PHE 200.A N TRP 232.A O no hydrogen 3.188 N/A TYR 201.A N VAL 174.A O no hydrogen 3.315 N/A LYS 203.A NZ ASP 23.A OD2 no hydrogen 3.034 N/A TRP 206.A N LYS 253.A O no hydrogen 2.961 N/A MET 208.A N ARG 251.A O no hydrogen 3.080 N/A TRP 209.A N THR 219.A OG1 no hydrogen 3.193 N/A TRP 209.A NE1 ALA 236.A O no hydrogen 2.992 N/A MET 210.A N SER 249.A O no hydrogen 2.830 N/A ARG 211.A N GLN 214.A O no hydrogen 2.997 N/A ARG 211.A NE ASP 247.A OD2 no hydrogen 3.348 N/A GLN 214.A N ARG 211.A O no hydrogen 2.996 N/A GLN 216.A N TRP 209.A O no hydrogen 2.916 N/A GLN 216.A NE2 GLN 214.A O no hydrogen 3.151 N/A THR 219.A N GLN 216.A O no hydrogen 3.331 N/A THR 219.A OG1 GLN 216.A O no hydrogen 2.687 N/A GLN 220.A N THR 237.A O no hydrogen 2.769 N/A ARG 221.A NH2 VAL 205.A O no hydrogen 3.177 N/A GLY 222.A N ARG 235.A O no hydrogen 2.937 N/A LEU 225.A N TYR 233.A O no hydrogen 2.742 N/A GLY 230.A N SER 227.A O no hydrogen 3.109 N/A THR 231.A N ASP 229.A OD1 no hydrogen 3.040 N/A THR 231.A OG1 ASP 229.A OD1 no hydrogen 2.362 N/A TRP 232.A N PHE 200.A O no hydrogen 2.935 N/A TYR 233.A N LEU 225.A O no hydrogen 2.772 N/A TYR 233.A OH HIS 196.A ND1 no hydrogen 2.482 N/A LEU 234.A N VAL 197.A O no hydrogen 2.830 N/A ARG 235.A NH1 TYR 233.A OH no hydrogen 2.865 N/A ALA 236.A N CYS 195.A O no hydrogen 3.144 N/A THR 237.A N GLN 220.A O no hydrogen 2.941 N/A THR 237.A OG1 GLN 192.A OE1 no hydrogen 3.429 N/A LEU 238.A N LEU 193.A O no hydrogen 3.025 N/A VAL 240.A N LEU 191.A O no hydrogen 3.053 N/A ALA 242.A N GLY 189.A O no hydrogen 2.871 N/A GLU 244.A N ALA 241.A O no hydrogen 3.103 N/A ALA 245.A N ALA 242.A O no hydrogen 3.299 N/A LEU 248.A N ALA 245.A O no hydrogen 2.832 N/A SER 249.A N MET 210.A O no hydrogen 2.970 N/A SER 249.A OG MET 210.A O no hydrogen 3.313 N/A CYS 250.A N LEU 264.A O no hydrogen 2.732 N/A ARG 251.A N MET 208.A O no hydrogen 2.996 N/A VAL 252.A N ILE 262.A O no hydrogen 2.848 N/A LYS 253.A N TRP 206.A O no hydrogen 2.744 N/A LYS 253.A NZ ASP 261.A OD1 no hydrogen 3.302 N/A LYS 253.A NZ ASP 261.A OD2 no hydrogen 2.447 N/A HIS 254.A ND1 SER 256.A OG no hydrogen 2.503 N/A HIS 254.A NE2 PRO 202.A O no hydrogen 2.937 N/A SER 255.A OG GLN 173.A OE1 no hydrogen 2.441 N/A SER 256.A N HIS 254.A ND1 no hydrogen 3.125 N/A SER 256.A OG HIS 254.A ND1 no hydrogen 2.503 N/A LEU 257.A N HIS 254.A O no hydrogen 3.110 N/A GLN 260.A N LEU 257.A O no hydrogen 3.078 N/A ILE 262.A N VAL 252.A O no hydrogen 3.105 N/A LEU 264.A N CYS 250.A O no hydrogen 2.885 N/A TRP 266.A N LEU 248.A O no hydrogen 3.054 N/A