Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3fsp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 3.A N PHE 1.A O no hydrogen 2.545 N/A PHE 6.A N PRO 2.A O no hydrogen 2.773 N/A GLN 7.A N ALA 3.A O no hydrogen 2.667 N/A ARG 8.A N GLU 5.A O no hydrogen 2.691 N/A ASP 9.A N GLU 5.A O no hydrogen 3.285 N/A LEU 10.A N PHE 6.A O no hydrogen 3.337 N/A ASP 12.A N.A ARG 8.A O no hydrogen 3.145 N/A ASP 12.A N.B ARG 8.A O no hydrogen 3.130 N/A TRP 13.A N ASP 9.A O no hydrogen 3.453 N/A PHE 14.A N LEU 10.A O no hydrogen 2.916 N/A ALA 15.A N LEU 11.A O no hydrogen 3.257 N/A ARG 16.A NE ASP 12.A OD2.B no hydrogen 3.338 N/A ARG 16.A NH2 ASP 12.A OD2.B no hydrogen 2.726 N/A GLU 17.A N PHE 14.A O no hydrogen 3.252 N/A ARG 18.A N PHE 14.A O no hydrogen 2.953 N/A ARG 19.A N GLU 185.A OE1 no hydrogen 3.085 N/A ARG 19.A NE GLU 185.A OE1 no hydrogen 2.853 N/A ARG 19.A NH2 GLU 185.A OE2 no hydrogen 2.746 N/A ARG 24.A N LEU 21.A O no hydrogen 2.849 N/A ARG 24.A NH1 ARG 19.A O no hydrogen 2.974 N/A ARG 24.A NH1 GLU 185.A OE1 no hydrogen 2.960 N/A ARG 24.A NH2 GLU 185.A OE2 no hydrogen 2.676 N/A LYS 25.A N PRO 22.A O no hydrogen 3.463 N/A ASP 28.A N ASP 26.A OD1 no hydrogen 2.776 N/A TYR 30.A N ASP 28.A OD1 no hydrogen 3.095 N/A TYR 30.A OH PHE 58.A O no hydrogen 2.636 N/A LYS 31.A NZ ASP 26.A OD2 no hydrogen 3.245 N/A LYS 31.A NZ ASP 28.A OD2 no hydrogen 3.040 N/A VAL 32.A N ASP 28.A O no hydrogen 2.992 N/A TRP 33.A N PRO 29.A O no hydrogen 2.844 N/A VAL 34.A N TYR 30.A O no hydrogen 2.920 N/A SER 35.A N LYS 31.A O no hydrogen 2.927 N/A SER 35.A OG LYS 31.A O no hydrogen 3.566 N/A SER 35.A OG VAL 32.A O no hydrogen 2.744 N/A GLU 36.A N VAL 32.A O no hydrogen 2.918 N/A VAL 37.A N TRP 33.A O no hydrogen 3.111 N/A MET 38.A N VAL 34.A O no hydrogen 3.031 N/A LEU 39.A N SER 35.A O no hydrogen 2.960 N/A GLN 40.A N VAL 37.A O no hydrogen 3.275 N/A THR 42.A N LEU 39.A O no hydrogen 3.194 N/A THR 42.A OG1 GLN 40.A O no hydrogen 2.958 N/A THR 46.A N ARG 43.A O no hydrogen 3.080 N/A VAL 47.A N ARG 43.A O no hydrogen 3.050 N/A ILE 48.A N VAL 44.A O no hydrogen 3.027 N/A TYR 50.A OH GLU 77.A O no hydrogen 2.762 N/A PHE 51.A N VAL 47.A O no hydrogen 2.824 N/A GLU 52.A N ILE 48.A O no hydrogen 3.128 N/A GLN 53.A N PRO 49.A O no hydrogen 3.172 N/A PHE 54.A N TYR 50.A O no hydrogen 2.948 N/A ILE 55.A N PHE 51.A O no hydrogen 2.976 N/A ASP 56.A N GLU 52.A O no hydrogen 3.070 N/A ARG 57.A N GLN 53.A O no hydrogen 2.770 N/A PHE 58.A N PHE 54.A O no hydrogen 2.612 N/A ALA 63.A N THR 60.A OG1 no hydrogen 3.052 N/A LEU 64.A N THR 60.A O no hydrogen 3.084 N/A ALA 65.A N LEU 61.A O no hydrogen 2.812 N/A ASP 66.A N GLU 62.A O no hydrogen 2.998 N/A ALA 67.A N LEU 64.A O no hydrogen 3.229 N/A VAL 72.A N ASP 68.A O no hydrogen 3.111 N/A LEU 73.A N GLU 69.A O no hydrogen 2.919 N/A LYS 74.A N ASP 70.A O no hydrogen 2.887 N/A LYS 74.A NZ GLU 77.A OE1 no hydrogen 2.646 N/A LYS 74.A NZ LYS 333.A O no hydrogen 3.214 N/A LYS 74.A NZ TYR 335.A O no hydrogen 3.362 N/A ALA 75.A N VAL 72.A O no hydrogen 3.238 N/A TRP 76.A N LEU 73.A O no hydrogen 3.185 N/A GLU 77.A N LYS 74.A O no hydrogen 3.242 N/A GLY 78.A N TYR 82.A OH no hydrogen 3.054 N/A LEU 79.A N TRP 76.A O no hydrogen 2.970 N/A TYR 81.A OH SER 301.A OG no hydrogen 2.927 N/A ARG 84.A N TYR 81.A O no hydrogen 3.104 N/A ARG 84.A NE TYR 81.A O no hydrogen 3.255 N/A ARG 84.A NH1 VAL 37.A O no hydrogen 2.722 N/A ARG 84.A NH1 MET 38.A O no hydrogen 2.770 N/A ARG 84.A NH2 GLY 80.A O no hydrogen 2.993 N/A VAL 85.A N TYR 82.A O no hydrogen 3.214 N/A ARG 86.A N.A TYR 82.A O no hydrogen 3.401 N/A ARG 86.A N.B TYR 82.A O no hydrogen 3.392 N/A ASN 87.A N SER 83.A O no hydrogen 2.815 N/A LEU 88.A N ARG 84.A O no hydrogen 2.983 N/A HIS 89.A N VAL 85.A O no hydrogen 3.045 N/A ALA 90.A N ARG 86.A O.A no hydrogen 3.195 N/A ALA 90.A N ARG 86.A O.B no hydrogen 3.076 N/A ALA 91.A N ASN 87.A O no hydrogen 2.840 N/A VAL 92.A N LEU 88.A O no hydrogen 2.834 N/A LYS 93.A N HIS 89.A O no hydrogen 2.905 N/A LYS 93.A NZ ALA 65.A O no hydrogen 3.217 N/A GLU 94.A N ALA 90.A O no hydrogen 3.028 N/A VAL 95.A N ALA 91.A O no hydrogen 2.880 N/A LYS 96.A N VAL 92.A O no hydrogen 3.000 N/A LYS 96.A NZ ASP 66.A OD1 no hydrogen 2.894 N/A THR 97.A N LYS 93.A O no hydrogen 3.152 N/A THR 97.A OG1 LYS 93.A O no hydrogen 2.979 N/A ARG 98.A N GLU 94.A O no hydrogen 3.098 N/A TYR 99.A N VAL 95.A O no hydrogen 2.949 N/A GLY 100.A N LYS 96.A O no hydrogen 2.730 N/A GLY 101.A N VAL 95.A O no hydrogen 2.979 N/A LYS 102.A N TYR 99.A O no hydrogen 3.338 N/A GLU 109.A N ASP 106.A OD2 no hydrogen 3.082 N/A PHE 110.A N ASP 106.A O no hydrogen 2.773 N/A SER 111.A N PRO 107.A O no hydrogen 2.911 N/A LEU 113.A N PHE 110.A O no hydrogen 3.162 N/A VAL 116.A N LEU 113.A O no hydrogen 3.271 N/A TYR 119.A OH GLU 36.A OE2 no hydrogen 2.595 N/A VAL 121.A N GLY 117.A O no hydrogen 3.071 N/A GLY 122.A N PRO 118.A O no hydrogen 3.302 N/A ALA 123.A N TYR 119.A O no hydrogen 2.848 N/A VAL 124.A N THR 120.A O no hydrogen 2.882 N/A LEU 125.A N VAL 121.A O no hydrogen 3.009 N/A SER 126.A N GLY 122.A O no hydrogen 2.990 N/A SER 126.A OG GLY 122.A O no hydrogen 2.764 N/A LEU 127.A N ALA 123.A O no hydrogen 3.200 N/A ALA 128.A N VAL 124.A O no hydrogen 3.034 N/A TYR 129.A N LEU 125.A O no hydrogen 2.782 N/A TYR 129.A OH VAL 103.A O no hydrogen 2.621 N/A GLY 130.A N SER 126.A O no hydrogen 2.965 N/A GLU 133.A N VAL 131.A O no hydrogen 2.977 N/A ASN 139.A ND2 ASP 137.A OD2 no hydrogen 3.072 N/A VAL 140.A N ASP 137.A OD1 no hydrogen 2.852 N/A MET 141.A N ASP 137.A O no hydrogen 3.038 N/A ARG 142.A N GLY 138.A O no hydrogen 3.202 N/A ARG 142.A NE CYS 191.A O no hydrogen 2.817 N/A ARG 142.A NH2 ASN 139.A OD1 no hydrogen 2.875 N/A ARG 142.A NH2 GLY 187.A O no hydrogen 2.839 N/A ARG 142.A NH2 CYS 191.A O no hydrogen 3.412 N/A VAL 143.A N ASN 139.A O no hydrogen 3.019 N/A LEU 144.A N VAL 140.A O no hydrogen 2.835 N/A SER 145.A N MET 141.A O no hydrogen 2.918 N/A SER 145.A OG ARG 142.A O no hydrogen 2.957 N/A ARG 146.A N VAL 143.A O no hydrogen 3.077 N/A ARG 146.A NE ALA 215.A O no hydrogen 2.953 N/A ARG 146.A NH1 THR 192.A O no hydrogen 2.920 N/A ARG 146.A NH2 THR 192.A O no hydrogen 3.147 N/A ARG 146.A NH2 PRO 193.A O no hydrogen 3.387 N/A ARG 146.A NH2 LEU 218.A O no hydrogen 3.103 N/A LEU 147.A N VAL 143.A O no hydrogen 2.805 N/A PHE 148.A N LEU 144.A O no hydrogen 2.942 N/A LEU 149.A N ARG 146.A O no hydrogen 3.316 N/A ILE 154.A N VAL 220.A O no hydrogen 3.096 N/A ALA 155.A N ASP 153.A OD1 no hydrogen 2.674 N/A LYS 156.A N ASP 153.A O no hydrogen 3.078 N/A THR 159.A N LYS 156.A O no hydrogen 2.830 N/A THR 159.A OG1 ASP 153.A O no hydrogen 2.486 N/A ARG 160.A NH2 GLU 164.A OE1 no hydrogen 3.075 N/A LYS 161.A N PRO 157.A O no hydrogen 3.266 N/A ARG 162.A N SER 158.A O no hydrogen 3.007 N/A ARG 162.A NH2 ASP 152.A OD2 no hydrogen 2.885 N/A PHE 163.A N THR 159.A O no hydrogen 2.993 N/A GLU 164.A N ARG 160.A O no hydrogen 2.803 N/A GLN 165.A N LYS 161.A O no hydrogen 3.207 N/A GLN 165.A N ARG 162.A O no hydrogen 3.070 N/A ILE 166.A N ARG 162.A O no hydrogen 3.208 N/A VAL 167.A N PHE 163.A O no hydrogen 3.135 N/A ARG 168.A N GLU 164.A O no hydrogen 3.391 N/A ARG 168.A NH1 GLU 133.A OE2 no hydrogen 3.186 N/A GLU 169.A N GLN 165.A O no hydrogen 2.909 N/A GLU 169.A N ILE 166.A O no hydrogen 3.026 N/A ILE 170.A N VAL 167.A O no hydrogen 3.071 N/A TYR 173.A OH ARG 168.A O no hydrogen 2.072 N/A GLU 174.A N GLU 174.A OE1 no hydrogen 2.359 N/A ALA 178.A N ASN 175.A OD1 no hydrogen 3.148 N/A PHE 179.A N ASN 175.A O no hydrogen 3.156 N/A ASN 180.A N PRO 176.A O no hydrogen 2.774 N/A ASN 180.A ND2 SER 126.A OG no hydrogen 3.055 N/A ASN 180.A ND2 GLU 133.A O no hydrogen 2.933 N/A GLU 181.A N GLY 177.A O no hydrogen 3.131 N/A ALA 182.A N ALA 178.A O no hydrogen 3.187 N/A LEU 183.A N PHE 179.A O no hydrogen 3.148 N/A ILE 184.A N ASN 180.A O no hydrogen 3.156 N/A GLU 185.A N GLU 181.A O no hydrogen 2.744 N/A LEU 186.A N ALA 182.A O no hydrogen 2.806 N/A GLY 187.A N LEU 183.A O no hydrogen 3.119 N/A ALA 188.A N ILE 184.A O no hydrogen 2.976 N/A LEU 189.A N GLU 185.A O no hydrogen 2.856 N/A LEU 189.A N LEU 186.A O no hydrogen 3.206 N/A VAL 190.A N LEU 186.A O no hydrogen 2.737 N/A CYS 191.A N LEU 186.A O no hydrogen 2.986 N/A THR 192.A N VAL 190.A O no hydrogen 2.771 N/A THR 192.A OG1 ARG 194.A O no hydrogen 2.611 N/A ARG 194.A NH1 PRO 193.A O no hydrogen 3.245 N/A ARG 195.A N GLU 216.A OE2 no hydrogen 3.251 N/A SER 197.A N VAL 190.A O no hydrogen 3.092 N/A LEU 200.A N SER 197.A O no hydrogen 2.844 N/A CYS 201.A N SER 197.A O no hydrogen 2.925 N/A CYS 201.A N CYS 198.A O no hydrogen 3.173 N/A GLN 204.A N CYS 201.A O no hydrogen 3.250 N/A GLN 204.A NE2 CYS 198.A O no hydrogen 3.678 N/A TYR 206.A N VAL 203.A O no hydrogen 3.102 N/A TYR 206.A OH ASP 9.A OD2 no hydrogen 2.278 N/A CYS 207.A N GLN 204.A O no hydrogen 2.917 N/A GLN 208.A N LEU 147.A O no hydrogen 3.317 N/A ALA 209.A N ARG 146.A O no hydrogen 2.922 N/A PHE 210.A N CYS 207.A O no hydrogen 3.026 N/A ALA 211.A N CYS 207.A O no hydrogen 3.110 N/A GLU 212.A N GLN 208.A O no hydrogen 3.206 N/A GLY 213.A N PHE 210.A O no hydrogen 2.678 N/A VAL 214.A N ALA 209.A O no hydrogen 2.921 N/A GLU 217.A N VAL 214.A O no hydrogen 2.868 N/A LEU 218.A N ALA 215.A O no hydrogen 3.083 N/A LYS 223.A NZ LYS 221.A O no hydrogen 3.317 N/A LYS 224.A NZ SER 301.A O no hydrogen 2.894 N/A VAL 230.A N VAL 304.A O no hydrogen 2.823 N/A LEU 232.A N GLN 306.A O no hydrogen 2.785 N/A ALA 233.A N CYS 264.A O no hydrogen 2.663 N/A VAL 234.A N THR 308.A O no hydrogen 3.235 N/A ALA 235.A N PRO 262.A O no hydrogen 2.840 N/A VAL 236.A N PHE 310.A O no hydrogen 3.014 N/A ALA 238.A N GLY 312.A O no hydrogen 3.057 N/A ASP 239.A N ARG 243.A O no hydrogen 2.704 N/A GLY 242.A N ASP 239.A O no hydrogen 3.275 N/A ARG 243.A NE ASP 239.A OD1 no hydrogen 3.246 N/A ARG 243.A NH2 ASP 239.A OD1 no hydrogen 3.483 N/A VAL 244.A N ALA 327.A O no hydrogen 2.457 N/A LEU 245.A N LEU 237.A O no hydrogen 3.056 N/A ILE 246.A N ARG 325.A O no hydrogen 3.176 N/A ARG 247.A N GLU 260.A O no hydrogen 2.974 N/A LYS 248.A N PRO 323.A O no hydrogen 3.504 N/A ARG 249.A N LEU 258.A O no hydrogen 2.983 N/A ARG 249.A NE LEU 254.A O no hydrogen 3.150 N/A ARG 249.A NH1 GLU 260.A OE1 no hydrogen 2.868 N/A ARG 249.A NH2 LEU 254.A O no hydrogen 3.423 N/A THR 252.A N ASP 250.A OD1 no hydrogen 3.381 N/A THR 252.A OG1 ASP 250.A OD1 no hydrogen 3.096 N/A THR 252.A OG1 ASP 250.A OD2 no hydrogen 2.769 N/A ALA 256.A N GLY 253.A O no hydrogen 3.297 N/A LEU 258.A N LEU 255.A O no hydrogen 3.195 N/A TRP 259.A N ALA 336.A O no hydrogen 3.169 N/A GLU 260.A N ARG 247.A O no hydrogen 2.955 N/A PHE 261.A N HIS 341.A ND1 no hydrogen 2.772 N/A SER 263.A OG GLU 260.A OE1 no hydrogen 3.249 N/A CYS 264.A N ALA 233.A O no hydrogen 2.953 N/A CYS 264.A SG GLU 265.A O no hydrogen 3.989 N/A THR 266.A N PRO 231.A O no hydrogen 3.169 N/A THR 266.A OG1 GLY 268.A O no hydrogen 2.367 N/A LYS 272.A NZ GLU 276.A OE1 no hydrogen 2.551 N/A GLU 276.A N LYS 272.A O no hydrogen 2.572 N/A GLN 277.A N GLU 273.A O no hydrogen 2.426 N/A MET 278.A N LYS 274.A O no hydrogen 2.533 N/A VAL 279.A N LEU 275.A O no hydrogen 2.758 N/A GLY 280.A N GLU 276.A O no hydrogen 2.780 N/A LEU 289.A N GLU 276.A OE2 no hydrogen 2.743 N/A THR 290.A N PRO 311.A O no hydrogen 3.234 N/A THR 290.A OG1 GLU 291.A O no hydrogen 3.014 N/A THR 290.A OG1 GLU 291.A OE1 no hydrogen 3.121 N/A THR 290.A OG1 PRO 311.A O no hydrogen 3.501 N/A GLU 291.A N GLU 291.A OE1 no hydrogen 3.140 N/A SER 295.A OG LEU 307.A O no hydrogen 3.307 N/A SER 295.A OG THR 308.A OG1 no hydrogen 2.986 N/A PHE 296.A N LEU 307.A O no hydrogen 3.184 N/A HIS 298.A N TRP 305.A O no hydrogen 2.717 N/A PHE 300.A N LEU 303.A O no hydrogen 2.738 N/A SER 301.A OG TYR 81.A OH no hydrogen 2.927 N/A VAL 304.A N LYS 228.A O no hydrogen 3.025 N/A TRP 305.A N HIS 298.A O no hydrogen 2.765 N/A GLN 306.A N VAL 230.A O no hydrogen 2.660 N/A GLN 306.A NE2 GLU 297.A OE2 no hydrogen 3.224 N/A LEU 307.A N PHE 296.A O no hydrogen 2.890 N/A THR 308.A N LEU 232.A O no hydrogen 3.107 N/A THR 308.A OG1 SER 295.A OG no hydrogen 2.986 N/A VAL 309.A N VAL 294.A O no hydrogen 2.948 N/A PHE 310.A N VAL 234.A O no hydrogen 2.842 N/A GLY 312.A N VAL 236.A O no hydrogen 3.343 N/A LEU 314.A N ALA 238.A O no hydrogen 2.802 N/A HIS 316.A NE2 ASP 239.A OD1 no hydrogen 2.458 N/A TYR 324.A N GLU 321.A O no hydrogen 2.786 N/A ARG 325.A N ILE 246.A O no hydrogen 3.005 N/A ARG 325.A NE TYR 335.A OH no hydrogen 3.366 N/A ALA 327.A N VAL 244.A O no hydrogen 2.745 N/A GLU 331.A N PRO 328.A O no hydrogen 2.618 N/A LEU 332.A N GLU 329.A O no hydrogen 2.832 N/A ALA 334.A N GLU 331.A O no hydrogen 3.225 N/A TYR 335.A N LEU 332.A O no hydrogen 3.071 N/A PHE 337.A N GLU 77.A OE2 no hydrogen 2.773 N/A GLN 342.A N PRO 338.A O no hydrogen 3.042 N/A GLN 342.A NE2 PHE 337.A O no hydrogen 2.862 N/A ARG 343.A N VAL 339.A O no hydrogen 3.242 N/A ARG 343.A N SER 340.A O no hydrogen 3.133 N/A VAL 344.A N SER 340.A O no hydrogen 3.162 N/A TRP 345.A N HIS 341.A O no hydrogen 3.239 N/A ARG 346.A N.A GLN 342.A O no hydrogen 3.280 N/A ARG 346.A N.B GLN 342.A O no hydrogen 3.280 N/A ARG 346.A N.B ARG 343.A O no hydrogen 2.599 N/A ARG 346.A NH1.B GLU 350.A OE1 no hydrogen 3.436 N/A GLU 347.A N ARG 343.A O no hydrogen 2.651 N/A TYR 348.A N VAL 344.A O no hydrogen 3.248 N/A LYS 349.A N TRP 345.A O no hydrogen 3.115 N/A GLU 350.A N ARG 346.A O.A no hydrogen 3.250 N/A GLU 350.A N ARG 346.A O.B no hydrogen 3.250 N/A TRP 351.A N GLU 347.A O no hydrogen 3.379 N/A ALA 352.A N TYR 348.A O no hydrogen 3.020 N/A SER 353.A OG LYS 349.A O no hydrogen 3.408 N/A SER 353.A OG ALA 352.A O no hydrogen 2.626 N/A