Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2w2n_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 4.A NE1 GLU 193.A O no hydrogen 3.110 N/A TRP 4.A NE1 ASP 194.A O no hydrogen 3.121 N/A ASN 5.A ND2 HIS 218.A NE2 no hydrogen 2.947 N/A LEU 6.A N PRO 3.A O no hydrogen 3.020 N/A GLU 7.A N PRO 3.A O no hydrogen 3.239 N/A ARG 8.A N TRP 4.A O no hydrogen 2.901 N/A ARG 8.A NH1 ALA 168.A O no hydrogen 2.993 N/A ARG 8.A NH1 ASP 170.A OD1 no hydrogen 3.132 N/A ARG 8.A NH1 ASP 170.A OD2 no hydrogen 3.207 N/A ARG 8.A NH2 ALA 168.A O no hydrogen 3.007 N/A ILE 9.A N ASN 5.A O no hydrogen 3.269 N/A THR 10.A OG1 LEU 6.A O no hydrogen 2.828 N/A GLU 16.A N PRO 109.A O no hydrogen 3.132 N/A VAL 17.A N SER 73.A O no hydrogen 3.180 N/A TYR 18.A N VAL 111.A O no hydrogen 2.666 N/A LEU 19.A N ARG 75.A O no hydrogen 2.913 N/A LEU 20.A N LEU 113.A O no hydrogen 3.141 N/A ASP 21.A N LEU 77.A O no hydrogen 3.157 N/A THR 22.A OG1 ASP 21.A OD1 no hydrogen 3.148 N/A THR 22.A OG1 SER 23.A O no hydrogen 3.046 N/A GLN 25.A N THR 55.A OG1 no hydrogen 2.883 N/A GLN 25.A NE2 ASP 27.A OD1 no hydrogen 3.068 N/A HIS 28.A N GLN 25.A O no hydrogen 3.267 N/A HIS 28.A ND1 GLN 25.A OE1 no hydrogen 3.188 N/A ARG 29.A N SER 203.A O no hydrogen 2.954 N/A ILE 31.A N HIS 28.A O no hydrogen 2.927 N/A ARG 34.A N ILE 31.A O no hydrogen 2.978 N/A ARG 34.A NH1 SER 73.A OG no hydrogen 3.209 N/A VAL 35.A N ILE 31.A O no hydrogen 3.209 N/A MET 36.A N MET 74.A O no hydrogen 2.751 N/A THR 38.A N SER 76.A O no hydrogen 3.142 N/A THR 38.A OG1 SER 76.A O no hydrogen 2.839 N/A PHE 40.A N THR 38.A OG1 no hydrogen 3.246 N/A ASN 42.A N ARG 78.A O no hydrogen 2.879 N/A ASP 47.A N GLN 83.A OE1 no hydrogen 3.131 N/A SER 48.A OG ASP 201.A OD1 no hydrogen 3.281 N/A SER 52.A N LYS 49.A O no hydrogen 3.150 N/A SER 52.A OG LYS 49.A O no hydrogen 2.790 N/A HIS 53.A ND1 ASP 21.A OD1 no hydrogen 2.694 N/A HIS 53.A ND1 ASP 21.A OD2 no hydrogen 2.777 N/A GLY 54.A N THR 22.A OG1 no hydrogen 2.908 N/A THR 55.A N ASP 51.A O no hydrogen 3.109 N/A THR 55.A OG1 ASP 51.A O no hydrogen 2.658 N/A HIS 56.A N SER 52.A O no hydrogen 3.170 N/A HIS 56.A NE2 ILE 195.A O no hydrogen 2.814 N/A HIS 56.A NE2 VAL 207.A O no hydrogen 3.166 N/A LEU 57.A N HIS 53.A O no hydrogen 3.153 N/A ALA 58.A N GLY 54.A O no hydrogen 2.977 N/A GLY 59.A N THR 55.A O no hydrogen 3.034 N/A VAL 60.A N HIS 56.A O no hydrogen 2.861 N/A VAL 61.A N LEU 57.A O no hydrogen 2.986 N/A SER 62.A N ALA 58.A O no hydrogen 2.949 N/A SER 62.A OG ALA 58.A O no hydrogen 2.802 N/A GLY 63.A N GLY 59.A O no hydrogen 2.671 N/A ARG 64.A N GLU 30.A O no hydrogen 3.109 N/A ASP 65.A N GLU 30.A OE1 no hydrogen 2.838 N/A ALA 66.A N GLU 30.A OE2 no hydrogen 2.966 N/A GLY 67.A N GLY 63.A O no hydrogen 2.910 N/A VAL 68.A N VAL 60.A O no hydrogen 2.861 N/A ALA 69.A N VAL 61.A O no hydrogen 2.817 N/A LYS 70.A NZ GLY 67.A O no hydrogen 2.702 N/A GLY 71.A N SER 62.A O no hydrogen 2.971 N/A ALA 72.A N ALA 69.A O no hydrogen 3.062 N/A MET 74.A N ARG 34.A O no hydrogen 3.072 N/A ARG 75.A N VAL 17.A O no hydrogen 2.973 N/A SER 76.A N MET 36.A O no hydrogen 2.916 N/A LEU 77.A N LEU 19.A O no hydrogen 2.844 N/A ARG 78.A N PHE 40.A O no hydrogen 3.172 N/A ARG 78.A NE LEU 80.A O no hydrogen 3.323 N/A ARG 78.A NH2 GLU 41.A OE1 no hydrogen 3.054 N/A VAL 79.A N ASP 21.A O no hydrogen 2.995 N/A LEU 80.A N ASP 21.A O no hydrogen 3.111 N/A ASN 81.A N LYS 85.A O no hydrogen 2.766 N/A ASN 81.A ND2 PRO 44.A O no hydrogen 3.250 N/A CYS 82.A N GLU 46.A OE1 no hydrogen 3.238 N/A GLN 83.A N ASN 81.A OD1 no hydrogen 2.936 N/A GLN 83.A NE2 ASP 47.A O no hydrogen 2.697 N/A GLY 84.A N ASN 81.A O no hydrogen 2.960 N/A LYS 85.A N ASN 81.A OD1 no hydrogen 2.936 N/A LYS 85.A NZ ASP 47.A OD1 no hydrogen 2.662 N/A LYS 85.A NZ ASP 47.A OD2 no hydrogen 3.184 N/A THR 87.A OG1 SER 89.A OG no hydrogen 3.326 N/A SER 89.A OG THR 87.A OG1 no hydrogen 3.326 N/A GLY 90.A N THR 87.A OG1 no hydrogen 3.016 N/A THR 91.A N THR 87.A O no hydrogen 3.055 N/A THR 91.A OG1 THR 87.A O no hydrogen 2.830 N/A LEU 92.A N VAL 88.A O no hydrogen 2.896 N/A ILE 93.A N SER 89.A O no hydrogen 3.182 N/A GLY 94.A N GLY 90.A O no hydrogen 3.086 N/A LEU 95.A N THR 91.A O no hydrogen 2.875 N/A GLU 96.A N LEU 92.A O no hydrogen 2.970 N/A PHE 97.A N ILE 93.A O no hydrogen 3.009 N/A ILE 98.A N GLY 94.A O no hydrogen 3.164 N/A ARG 99.A N LEU 95.A O no hydrogen 3.084 N/A ARG 99.A NH1 GLN 102.A OE1 no hydrogen 3.127 N/A LYS 100.A N GLU 96.A O no hydrogen 2.991 N/A SER 101.A N PHE 97.A O no hydrogen 3.012 N/A SER 101.A OG PHE 97.A O no hydrogen 2.732 N/A GLN 102.A N ILE 98.A O no hydrogen 2.883 N/A GLN 102.A NE2 ALA 134.A O no hydrogen 3.242 N/A LEU 103.A N ARG 99.A O no hydrogen 3.272 N/A LEU 103.A N LYS 100.A O no hydrogen 3.094 N/A VAL 104.A N LYS 100.A O no hydrogen 2.819 N/A GLN 105.A N SER 101.A O no hydrogen 3.263 N/A VAL 111.A N GLU 16.A O no hydrogen 2.855 N/A VAL 112.A N VAL 137.A O no hydrogen 2.821 N/A LEU 113.A N TYR 18.A O no hydrogen 2.685 N/A LEU 114.A N VAL 139.A O no hydrogen 2.856 N/A GLY 118.A N SER 153.A O no hydrogen 2.783 N/A TYR 120.A N LEU 151.A O no hydrogen 3.080 N/A SER 121.A N SER 153.A OG no hydrogen 2.971 N/A LEU 124.A N SER 121.A OG no hydrogen 3.111 N/A ASN 125.A N SER 121.A O no hydrogen 3.112 N/A ASN 125.A ND2 SER 156.A OG no hydrogen 2.931 N/A ALA 126.A N ARG 122.A O no hydrogen 3.009 N/A ALA 127.A N VAL 123.A O no hydrogen 2.921 N/A CYS 128.A N LEU 124.A O no hydrogen 3.176 N/A CYS 128.A SG LEU 124.A O no hydrogen 3.319 N/A GLN 129.A N ASN 125.A O no hydrogen 3.102 N/A GLN 129.A NE2 GLU 159.A OE2.B no hydrogen 2.778 N/A ARG 130.A N ALA 126.A O no hydrogen 3.002 N/A ARG 130.A NH1 ARG 130.A O no hydrogen 3.353 N/A LEU 131.A N ALA 127.A O no hydrogen 3.074 N/A ALA 132.A N CYS 128.A O no hydrogen 2.795 N/A ARG 133.A N GLN 129.A O no hydrogen 2.905 N/A GLY 135.A N ALA 132.A O no hydrogen 2.899 N/A VAL 136.A N LEU 131.A O no hydrogen 3.204 N/A VAL 137.A N LEU 110.A O no hydrogen 3.007 N/A VAL 139.A N VAL 112.A O no hydrogen 2.889 N/A THR 140.A N ILE 161.A O no hydrogen 2.785 N/A THR 140.A OG1 LEU 114.A O no hydrogen 2.840 N/A THR 140.A OG1 ALA 141.A O no hydrogen 3.531 N/A ALA 141.A N LEU 114.A O no hydrogen 3.333 N/A ALA 142.A N VAL 163.A O no hydrogen 2.952 N/A GLY 143.A N THR 212.A OG1 no hydrogen 3.259 N/A PHE 145.A N ASN 181.A OD1 no hydrogen 3.152 N/A ARG 146.A N GLY 179.A O no hydrogen 2.927 N/A ARG 146.A NH2 TRP 255.A O no hydrogen 3.247 N/A ASP 147.A N ASN 181.A OD1 no hydrogen 2.900 N/A ASP 148.A N ASP 147.A OD1 no hydrogen 2.807 N/A ALA 149.A N PHE 182.A O no hydrogen 2.918 N/A CYS 150.A N ASP 148.A OD1 no hydrogen 3.110 N/A CYS 150.A SG ASP 148.A OD1 no hydrogen 3.457 N/A LEU 151.A N ASP 148.A O no hydrogen 3.057 N/A TYR 152.A N ALA 149.A O no hydrogen 3.233 N/A TYR 152.A OH ASP 147.A OD2 no hydrogen 2.616 N/A SER 153.A N GLY 118.A O no hydrogen 2.824 N/A SER 153.A OG ASN 125.A OD1 no hydrogen 2.519 N/A SER 153.A OG SER 156.A OG no hydrogen 3.244 N/A SER 156.A N TYR 152.A O no hydrogen 2.940 N/A SER 156.A OG TYR 152.A O no hydrogen 2.707 N/A ALA 157.A N PRO 154.A O no hydrogen 2.976 N/A VAL 160.A N ALA 157.A O no hydrogen 3.176 N/A ILE 161.A N LEU 138.A O no hydrogen 2.803 N/A THR 162.A N ASP 187.A OD2 no hydrogen 2.647 N/A THR 162.A OG1 ALA 155.A O no hydrogen 2.625 N/A VAL 163.A N THR 140.A O no hydrogen 3.011 N/A GLY 164.A N LEU 188.A O no hydrogen 2.955 N/A ALA 165.A N THR 180.A OG1 no hydrogen 2.956 N/A THR 166.A N ALA 190.A O no hydrogen 2.935 N/A ASN 167.A N GLN 171.A O no hydrogen 2.925 N/A GLN 169.A N ASN 167.A OD1 no hydrogen 2.965 N/A ASP 170.A N ASN 167.A O no hydrogen 2.875 N/A GLN 171.A N ASN 167.A OD1 no hydrogen 3.127 N/A GLN 171.A NE2 GLN 169.A O no hydrogen 3.016 N/A GLN 171.A NE2 VAL 250.A O no hydrogen 3.142 N/A VAL 173.A N ALA 165.A O no hydrogen 3.055 N/A LEU 175.A N LEU 178.A O no hydrogen 3.091 N/A THR 180.A N VAL 173.A O no hydrogen 2.936 N/A THR 180.A OG1 ASN 181.A O no hydrogen 3.044 N/A ASN 181.A N GLY 143.A O no hydrogen 2.864 N/A ASN 181.A ND2 ALA 142.A O no hydrogen 2.851 N/A PHE 182.A N ASP 147.A O no hydrogen 3.098 N/A GLY 183.A N THR 264.A OG1 no hydrogen 3.012 N/A VAL 186.A N GLY 183.A O no hydrogen 3.048 N/A ASP 187.A N THR 162.A O no hydrogen 2.790 N/A LEU 188.A N THR 162.A O no hydrogen 3.470 N/A PHE 189.A N LEU 267.A O no hydrogen 2.865 N/A ALA 190.A N GLY 164.A O no hydrogen 2.921 N/A GLY 192.A N THR 166.A O no hydrogen 2.927 N/A ASP 194.A N SER 210.A OG no hydrogen 3.157 N/A ILE 195.A N GLN 209.A O no hydrogen 3.033 N/A GLY 197.A N VAL 207.A O no hydrogen 3.008 N/A SER 199.A N CYS 205.A O no hydrogen 2.917 N/A SER 200.A OG SER 48.A O no hydrogen 2.720 N/A SER 200.A OG ASP 51.A OD1 no hydrogen 3.038 N/A ASP 201.A N SER 199.A OG no hydrogen 3.229 N/A CYS 205.A N CYS 202.A O no hydrogen 3.231 N/A VAL 207.A N GLY 197.A O no hydrogen 2.949 N/A SER 208.A OG.A ASP 194.A OD1.B no hydrogen 2.930 N/A SER 208.A OG.B ASP 194.A OD1.B no hydrogen 2.465 N/A GLN 209.A N ILE 195.A O no hydrogen 3.135 N/A GLY 211.A N GLY 192.A O no hydrogen 2.869 N/A THR 212.A N ASN 144.A OD1 no hydrogen 3.058 N/A THR 212.A OG1 ASN 144.A OD1 no hydrogen 2.738 N/A SER 213.A OG HIS 53.A NE2 no hydrogen 3.265 N/A SER 213.A OG PRO 115.A O no hydrogen 2.899 N/A GLN 214.A N GLN 214.A OE1 no hydrogen 2.963 N/A GLN 214.A NE2 HIS 56.A ND1 no hydrogen 3.177 N/A GLN 214.A NE2 GLN 209.A OE1 no hydrogen 3.389 N/A ALA 215.A N GLY 211.A O no hydrogen 3.227 N/A ALA 216.A N THR 212.A O no hydrogen 2.832 N/A ALA 217.A N SER 213.A O no hydrogen 2.905 N/A HIS 218.A N GLN 214.A O no hydrogen 3.260 N/A HIS 218.A N ALA 215.A O no hydrogen 2.964 N/A HIS 218.A ND1 GLN 214.A O no hydrogen 2.795 N/A VAL 219.A N ALA 215.A O no hydrogen 3.340 N/A ALA 220.A N ALA 216.A O no hydrogen 2.904 N/A GLY 221.A N ALA 217.A O no hydrogen 3.210 N/A ILE 222.A N HIS 218.A O no hydrogen 2.901 N/A ALA 223.A N VAL 219.A O no hydrogen 2.834 N/A ALA 224.A N ALA 220.A O no hydrogen 3.063 N/A MET 225.A N GLY 221.A O no hydrogen 3.016 N/A MET 226.A N ILE 222.A O no hydrogen 2.911 N/A LEU 227.A N ALA 223.A O no hydrogen 2.927 N/A SER 228.A N ALA 224.A O no hydrogen 2.924 N/A SER 228.A OG ALA 224.A O no hydrogen 2.793 N/A ALA 229.A N MET 225.A O no hydrogen 3.325 N/A GLU 230.A N MET 226.A O no hydrogen 3.032 N/A LEU 233.A N GLU 230.A O no hydrogen 3.308 N/A THR 234.A N GLU 237.A OE1 no hydrogen 3.428 N/A GLU 237.A N THR 234.A OG1 no hydrogen 3.161 N/A LEU 238.A N THR 234.A O no hydrogen 3.081 N/A ARG 239.A N LEU 235.A O no hydrogen 3.152 N/A ARG 239.A NH2 PRO 158.A O no hydrogen 2.917 N/A ARG 239.A NH2 VAL 160.A O no hydrogen 3.028 N/A ARG 239.A NH2 ASP 187.A OD1 no hydrogen 3.167 N/A GLN 240.A N ALA 236.A O no hydrogen 3.311 N/A ARG 241.A N GLU 237.A O no hydrogen 3.171 N/A LEU 242.A N LEU 238.A O no hydrogen 2.914 N/A ILE 243.A N ARG 239.A O no hydrogen 3.149 N/A HIS 244.A N GLN 240.A O no hydrogen 2.819 N/A PHE 245.A N ARG 241.A O no hydrogen 3.020 N/A SER 246.A N ILE 243.A O no hydrogen 3.324 N/A SER 246.A OG LEU 242.A O no hydrogen 2.758 N/A SER 246.A OG VAL 268.A O no hydrogen 3.526 N/A ALA 247.A N VAL 268.A O no hydrogen 2.806 N/A LYS 248.A NZ ILE 243.A O no hydrogen 2.687 N/A LYS 248.A NZ HIS 244.A O no hydrogen 2.917 N/A LYS 248.A NZ SER 246.A O no hydrogen 2.533 N/A ASP 249.A N ASN 266.A O no hydrogen 3.130 N/A VAL 250.A N ASN 266.A OD1 no hydrogen 3.038 N/A ILE 251.A N ASN 266.A OD1 no hydrogen 2.929 N/A ASN 252.A N GLN 171.A OE1 no hydrogen 2.681 N/A GLU 253.A N GLU 253.A OE1 no hydrogen 2.840 N/A TRP 255.A N ASN 252.A O no hydrogen 3.452 N/A TRP 255.A NE1 THR 174.A OG1 no hydrogen 3.105 N/A PHE 256.A N GLU 253.A O no hydrogen 2.973 N/A GLN 260.A N PRO 257.A O no hydrogen 2.948 N/A GLN 260.A NE2 ASP 259.A OD2 no hydrogen 3.520 N/A ARG 261.A N GLU 258.A O no hydrogen 3.228 N/A ARG 261.A NE PHE 256.A O no hydrogen 3.189 N/A ARG 261.A NH2 ALA 254.A O no hydrogen 3.199 N/A ARG 261.A NH2 PHE 256.A O no hydrogen 3.242 N/A THR 264.A N GLN 260.A O no hydrogen 2.950 N/A THR 264.A OG1 GLN 260.A O no hydrogen 2.664 N/A ASN 266.A ND2 ILE 251.A O no hydrogen 2.648 N/A VAL 268.A N ALA 247.A O no hydrogen 2.895 N/A ALA 269.A N PHE 189.A O no hydrogen 2.755 N/A LEU 271.A N ILE 9.A O no hydrogen 2.730 N/A