Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4mst_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A OG SER 6.A OG no hydrogen 3.406 N/A SER 4.A OG THR 7.A OG1 no hydrogen 3.009 N/A ARG 5.A NH1 ASP 29.A OD1 no hydrogen 3.517 N/A ARG 5.A NH2 ASP 29.A OD1 no hydrogen 2.939 N/A SER 6.A OG SER 4.A OG no hydrogen 3.406 N/A THR 7.A N SER 4.A OG no hydrogen 3.285 N/A THR 7.A OG1 SER 4.A OG no hydrogen 3.009 N/A PHE 8.A N SER 4.A O no hydrogen 3.145 N/A GLU 9.A N ARG 5.A O no hydrogen 3.056 N/A GLU 10.A N SER 6.A O no hydrogen 3.126 N/A MET 11.A N THR 7.A O no hydrogen 2.975 N/A LEU 12.A N PHE 8.A O no hydrogen 3.099 N/A LYS 13.A NZ GLU 10.A OE2 no hydrogen 2.999 N/A HIS 14.A NE2 ASP 74.A OD2 no hydrogen 2.908 N/A ARG 15.A N LEU 12.A O no hydrogen 3.471 N/A ARG 15.A NE TYR 26.A O no hydrogen 3.122 N/A ARG 15.A NH1 GLU 9.A OE1 no hydrogen 3.059 N/A ARG 15.A NH1 LEU 12.A O no hydrogen 3.109 N/A ARG 15.A NH2 GLU 9.A OE1 no hydrogen 3.162 N/A ARG 15.A NH2 GLU 9.A OE2 no hydrogen 3.442 N/A ARG 15.A NH2 TYR 26.A O no hydrogen 3.311 N/A ASP 17.A N HIS 14.A O no hydrogen 3.148 N/A ALA 19.A N ASP 17.A OD1 no hydrogen 2.891 N/A CYS 20.A N ASP 17.A O no hydrogen 3.010 N/A CYS 20.A SG HIS 14.A O no hydrogen 3.858 N/A ALA 22.A N CYS 82.A O no hydrogen 3.157 N/A LYS 23.A N.A CYS 20.A O no hydrogen 3.209 N/A LYS 23.A N.B CYS 20.A O no hydrogen 3.217 N/A LYS 23.A NZ.A ASN 16.A O no hydrogen 2.968 N/A LYS 23.A NZ.B ALA 18.A O no hydrogen 3.182 N/A LYS 23.A NZ.B CYS 20.A O no hydrogen 2.559 N/A GLY 24.A N ASN 16.A OD1 no hydrogen 2.846 N/A PHE 25.A N ALA 22.A O no hydrogen 2.946 N/A TYR 26.A OH TYR 83.A O no hydrogen 2.934 N/A TYR 28.A OH ILE 3.A O no hydrogen 2.760 N/A ALA 30.A N THR 27.A OG1 no hydrogen 3.087 N/A PHE 31.A N THR 27.A O no hydrogen 3.194 N/A ILE 32.A N TYR 28.A O no hydrogen 3.049 N/A SER 33.A N ASP 29.A O no hydrogen 3.240 N/A ALA 34.A N ALA 30.A O no hydrogen 3.104 N/A ALA 35.A N PHE 31.A O no hydrogen 2.978 N/A ALA 37.A N ALA 34.A O no hydrogen 3.053 N/A PHE 38.A N ALA 35.A O no hydrogen 2.944 N/A PHE 41.A N PHE 38.A O no hydrogen 3.022 N/A GLY 42.A N GLU 53.A OE1 no hydrogen 2.994 N/A THR 43.A N ALA 40.A O no hydrogen 3.452 N/A THR 43.A OG1 PRO 39.A O no hydrogen 2.784 N/A THR 44.A OG1 ALA 40.A O no hydrogen 2.769 N/A THR 49.A N ASP 46.A OD1 no hydrogen 2.972 N/A THR 49.A OG1 ASP 46.A OD1 no hydrogen 2.944 N/A CYS 50.A N ASP 46.A O no hydrogen 3.073 N/A CYS 50.A SG GLY 42.A O no hydrogen 3.644 N/A CYS 50.A SG THR 44.A O no hydrogen 3.629 N/A CYS 50.A SG GLY 45.A O no hydrogen 3.826 N/A CYS 50.A SG ASP 46.A O no hydrogen 3.668 N/A LYS 51.A N VAL 47.A O no hydrogen 3.272 N/A LYS 51.A NZ PHE 223.A O no hydrogen 3.134 N/A ARG 52.A N ASP 48.A O no hydrogen 3.014 N/A ARG 52.A NH1 GLY 226.A O no hydrogen 3.087 N/A GLU 53.A N THR 49.A O no hydrogen 2.995 N/A ILE 54.A N CYS 50.A O no hydrogen 3.238 N/A ALA 55.A N LYS 51.A O no hydrogen 2.973 N/A ALA 56.A N ARG 52.A O no hydrogen 2.999 N/A PHE 57.A N GLU 53.A O no hydrogen 3.000 N/A PHE 58.A N ILE 54.A O no hydrogen 3.104 N/A GLY 59.A N ALA 55.A O no hydrogen 2.904 N/A GLN 60.A N ALA 56.A O no hydrogen 3.069 N/A GLN 60.A NE2 THR 192.A OG1 no hydrogen 3.059 N/A THR 61.A N PHE 57.A O no hydrogen 3.210 N/A THR 61.A OG1 PHE 57.A O no hydrogen 2.951 N/A THR 61.A OG1 PHE 58.A O no hydrogen 3.532 N/A THR 61.A OG1 TYR 81.A OH no hydrogen 2.783 N/A SER 62.A N PHE 58.A O no hydrogen 2.992 N/A SER 62.A OG PHE 58.A O no hydrogen 2.664 N/A SER 62.A OG TYR 219.A OH no hydrogen 2.909 N/A HIS 63.A N GLY 59.A O no hydrogen 3.247 N/A HIS 63.A ND1 ASP 211.A OD2 no hydrogen 2.813 N/A ALA 64.A N GLN 60.A O no hydrogen 3.240 N/A THR 65.A N SER 62.A O no hydrogen 3.191 N/A THR 65.A OG1 THR 61.A O no hydrogen 2.968 N/A THR 65.A OG1 SER 62.A O no hydrogen 3.467 N/A THR 66.A N HIS 63.A O no hydrogen 3.361 N/A THR 66.A OG1 TRP 79.A O no hydrogen 3.560 N/A GLY 67.A N TRP 79.A O no hydrogen 3.042 N/A GLY 68.A N THR 66.A OG1 no hydrogen 3.023 N/A ALA 72.A N TRP 69.A O no hydrogen 3.155 N/A GLY 75.A N ALA 72.A O no hydrogen 2.925 N/A ALA 78.A N GLY 75.A O no hydrogen 3.307 N/A TRP 79.A NE1 PRO 73.A O no hydrogen 3.073 N/A TYR 81.A N THR 65.A OG1 no hydrogen 2.881 N/A TYR 81.A OH THR 61.A OG1 no hydrogen 2.783 N/A CYS 82.A N THR 65.A O no hydrogen 2.916 N/A TYR 83.A N THR 65.A O no hydrogen 3.285 N/A LYS 84.A NZ ALA 141.A O no hydrogen 3.034 N/A GLU 86.A N GLY 110.A O no hydrogen 3.008 N/A GLN 89.A NE2 GLU 86.A O no hydrogen 3.056 N/A ALA 90.A N ASN 88.A OD1 no hydrogen 3.050 N/A TYR 93.A N SER 91.A OG no hydrogen 3.153 N/A TYR 93.A OH GLU 86.A OE2 no hydrogen 2.784 N/A SER 95.A N ASN 119.A OD1 no hydrogen 2.836 N/A TYR 100.A N SER 97.A OG no hydrogen 3.114 N/A ALA 103.A N TYR 108.A OH no hydrogen 3.165 N/A LYS 106.A N ALA 103.A O no hydrogen 3.163 N/A LYS 107.A NZ GLN 89.A O no hydrogen 3.020 N/A LYS 107.A NZ ALA 90.A O no hydrogen 3.490 N/A TYR 108.A N SER 92.A O no hydrogen 2.894 N/A TYR 108.A OH LEU 134.A O no hydrogen 2.773 N/A GLY 110.A N GLU 86.A OE1 no hydrogen 3.003 N/A ARG 111.A N LEU 116.A O no hydrogen 3.347 N/A ARG 111.A NH1 LYS 107.A O no hydrogen 3.039 N/A ARG 111.A NH1 TYR 122.A OH no hydrogen 3.153 N/A ARG 111.A NH2 LYS 107.A O no hydrogen 3.184 N/A ARG 111.A NH2 ASP 138.A OD1 no hydrogen 2.978 N/A GLY 112.A N LYS 84.A O no hydrogen 2.881 N/A GLN 115.A N GLY 112.A O no hydrogen 3.101 N/A GLN 115.A NE2 LYS 84.A O no hydrogen 3.471 N/A GLN 115.A NE2 GLY 112.A O no hydrogen 2.835 N/A LEU 116.A N ARG 111.A O no hydrogen 3.108 N/A SER 117.A OG GLN 115.A O no hydrogen 3.014 N/A TRP 118.A N TYR 108.A O no hydrogen 3.011 N/A ASN 119.A N TYR 93.A O no hydrogen 3.363 N/A ASN 119.A ND2 SER 95.A O no hydrogen 3.049 N/A ASN 119.A ND2 TYR 100.A O no hydrogen 2.884 N/A ASN 121.A N TRP 118.A O no hydrogen 3.118 N/A ASN 121.A ND2 SER 117.A O no hydrogen 2.951 N/A TYR 122.A N TRP 118.A O no hydrogen 3.291 N/A TYR 122.A OH TYR 109.A O no hydrogen 3.020 N/A TYR 122.A OH LEU 116.A O no hydrogen 2.967 N/A GLY 123.A N ASN 119.A O no hydrogen 2.878 N/A GLN 124.A N TYR 120.A O no hydrogen 3.094 N/A CYS 125.A N ASN 121.A O no hydrogen 3.068 N/A GLY 126.A N TYR 122.A O no hydrogen 2.943 N/A GLN 127.A N GLY 123.A O no hydrogen 3.120 N/A ALA 128.A N GLN 124.A O no hydrogen 3.076 N/A LEU 129.A N CYS 125.A O no hydrogen 3.059 N/A GLY 130.A N GLN 127.A O no hydrogen 3.465 N/A LEU 131.A N GLY 126.A O no hydrogen 2.914 N/A ASN 135.A N ASP 132.A OD1 no hydrogen 3.341 N/A ASN 136.A N ASP 132.A O no hydrogen 2.971 N/A LEU 139.A N ASN 136.A O no hydrogen 3.316 N/A VAL 140.A N PRO 137.A O no hydrogen 3.168 N/A ALA 141.A N ASP 138.A O no hydrogen 2.874 N/A THR 142.A N ASP 138.A O no hydrogen 3.026 N/A THR 142.A OG1 ASP 138.A O no hydrogen 3.284 N/A ASP 143.A N LEU 139.A O no hydrogen 3.153 N/A ARG 144.A NE GLY 24.A O no hydrogen 3.459 N/A ARG 144.A NE PHE 25.A O no hydrogen 3.306 N/A ARG 144.A NH2 GLY 24.A O no hydrogen 3.009 N/A VAL 145.A N ASP 143.A OD2 no hydrogen 3.222 N/A ILE 146.A N ASP 143.A OD2 no hydrogen 2.910 N/A SER 147.A N ASP 143.A O no hydrogen 3.118 N/A SER 147.A OG VAL 140.A O no hydrogen 2.874 N/A LYS 149.A N VAL 145.A O no hydrogen 2.987 N/A ALA 150.A N ILE 146.A O no hydrogen 2.974 N/A ILE 152.A N PHE 148.A O no hydrogen 3.030 N/A TRP 153.A N LYS 149.A O no hydrogen 2.907 N/A PHE 154.A N ALA 150.A O no hydrogen 3.212 N/A TRP 155.A N ALA 151.A O no hydrogen 3.157 N/A TRP 155.A NE1 GLU 53.A OE2 no hydrogen 3.008 N/A MET 156.A N ILE 152.A O no hydrogen 3.064 N/A MET 156.A N TRP 153.A O no hydrogen 3.237 N/A THR 157.A N PHE 154.A O no hydrogen 3.341 N/A THR 157.A OG1 TRP 153.A O no hydrogen 2.777 N/A GLN 159.A N LYS 162.A O no hydrogen 3.105 N/A GLN 159.A NE2 ASN 121.A OD1 no hydrogen 2.996 N/A LYS 162.A N GLN 159.A O no hydrogen 2.831 N/A LYS 162.A NZ ILE 194.A O no hydrogen 2.857 N/A HIS 166.A N TRP 155.A O no hydrogen 3.183 N/A HIS 166.A ND1 GLU 53.A OE2 no hydrogen 2.702 N/A ASP 167.A N SER 164.A OG no hydrogen 3.060 N/A VAL 168.A N SER 164.A O no hydrogen 3.233 N/A ILE 169.A N CYS 165.A O no hydrogen 3.059 N/A THR 170.A N HIS 166.A O no hydrogen 3.080 N/A THR 170.A OG1 HIS 166.A O no hydrogen 2.814 N/A THR 170.A OG1 ASP 167.A O no hydrogen 3.545 N/A GLY 171.A N VAL 168.A O no hydrogen 3.342 N/A GLN 172.A N ASP 167.A O no hydrogen 2.935 N/A GLN 172.A NE2 THR 170.A OG1 no hydrogen 2.962 N/A THR 176.A N ASP 179.A OD2 no hydrogen 3.104 N/A THR 176.A OG1 ASP 179.A OD2 no hydrogen 3.081 N/A ASP 179.A N THR 176.A OG1 no hydrogen 3.335 N/A ILE 180.A N THR 176.A O no hydrogen 3.083 N/A SER 181.A N GLY 177.A O no hydrogen 3.183 N/A SER 181.A OG HIS 178.A O no hydrogen 3.431 N/A ALA 182.A N ASP 179.A O no hydrogen 3.214 N/A GLY 183.A N ILE 180.A O no hydrogen 3.095 N/A ARG 184.A N ASP 179.A O no hydrogen 3.046 N/A ARG 184.A NE ASP 179.A OD1 no hydrogen 2.971 N/A ARG 184.A NH1 THR 237.A O no hydrogen 2.949 N/A ARG 184.A NH2 ASP 179.A OD1 no hydrogen 3.094 N/A TYR 188.A OH ARG 212.A O no hydrogen 2.925 N/A GLY 189.A N ASN 230.A O no hydrogen 3.079 N/A THR 192.A N TYR 188.A O no hydrogen 3.220 N/A ASN 193.A N GLY 189.A O no hydrogen 3.101 N/A ASN 193.A ND2 GLN 236.A OE1 no hydrogen 3.130 N/A ASN 193.A ND2 THR 237.A O no hydrogen 3.243 N/A ILE 194.A N VAL 190.A O no hydrogen 2.933 N/A ILE 195.A N ILE 191.A O no hydrogen 3.080 N/A ASN 196.A N THR 192.A O no hydrogen 2.970 N/A ASN 196.A ND2 GLU 200.A OE2 no hydrogen 2.807 N/A GLY 197.A N ASN 193.A O no hydrogen 2.923 N/A LEU 199.A N ASN 196.A O no hydrogen 3.252 N/A GLU 200.A N ASN 196.A O no hydrogen 3.223 N/A CYS 201.A N GLY 197.A O no hydrogen 3.143 N/A GLY 202.A N CYS 233.A O no hydrogen 2.967 N/A ARG 203.A NE.B LEU 199.A O no hydrogen 3.413 N/A ARG 203.A NH1.A GLY 198.A O no hydrogen 3.140 N/A ARG 203.A NH2.A GLY 198.A O no hydrogen 2.597 N/A ARG 203.A NH2.B LEU 199.A O no hydrogen 3.082 N/A ARG 203.A NH2.B ASP 206.A OD2 no hydrogen 2.765 N/A GLY 204.A N TYR 234.A O no hydrogen 3.356 N/A TRP 205.A NE1 GLU 210.A OE1 no hydrogen 3.278 N/A ARG 208.A N ASP 206.A OD1 no hydrogen 3.115 N/A ARG 208.A NE ASP 206.A OD1 no hydrogen 2.989 N/A ARG 208.A NH2 ASP 206.A OD2 no hydrogen 3.046 N/A GLU 210.A N ASP 206.A O no hydrogen 3.183 N/A ASP 211.A N ALA 207.A O no hydrogen 3.119 N/A ASP 211.A N ARG 208.A O no hydrogen 3.269 N/A ARG 212.A N ARG 208.A O no hydrogen 3.189 N/A ARG 212.A NE GLU 200.A OE1 no hydrogen 2.948 N/A ARG 212.A NH1 GLN 60.A OE1 no hydrogen 2.719 N/A ARG 212.A NH2 GLU 200.A OE1 no hydrogen 3.491 N/A ARG 212.A NH2 GLU 200.A OE2 no hydrogen 2.936 N/A ILE 213.A N VAL 209.A O no hydrogen 3.266 N/A GLY 214.A N GLU 210.A O no hydrogen 3.050 N/A PHE 215.A N ASP 211.A O no hydrogen 3.315 N/A TYR 216.A N ARG 212.A O no hydrogen 3.342 N/A TYR 216.A OH TYR 227.A O no hydrogen 2.883 N/A LYS 217.A N ILE 213.A O no hydrogen 3.018 N/A ARG 218.A N GLY 214.A O no hydrogen 3.199 N/A ARG 218.A NH1 MET 11.A O no hydrogen 3.116 N/A ARG 218.A NH1 TYR 77.A O no hydrogen 2.947 N/A ARG 218.A NH2 GLU 10.A O no hydrogen 3.151 N/A TYR 219.A N PHE 215.A O no hydrogen 3.105 N/A TYR 219.A OH SER 62.A OG no hydrogen 2.909 N/A CYS 220.A N TYR 216.A O no hydrogen 2.982 N/A CYS 220.A SG TYR 216.A O no hydrogen 3.505 N/A ASP 221.A N LYS 217.A O no hydrogen 2.981 N/A MET 222.A N ARG 218.A O no hydrogen 3.127 N/A PHE 223.A N TYR 219.A O no hydrogen 3.204 N/A PHE 223.A N CYS 220.A O no hydrogen 3.223 N/A ALA 224.A N ASP 221.A O no hydrogen 3.279 N/A VAL 225.A N CYS 220.A O no hydrogen 3.150 N/A TYR 227.A OH ASP 221.A OD1 no hydrogen 2.895 N/A ASN 230.A ND2 PRO 186.A O no hydrogen 3.147 N/A TYR 234.A N ASP 232.A OD1 no hydrogen 2.983 N/A GLN 236.A N CYS 233.A O no hydrogen 3.282 N/A THR 237.A N ALA 182.A O no hydrogen 3.068 N/A PHE 239.A N ASN 193.A OD1 no hydrogen 3.404 N/A