Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1say_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 2.A N GLU 68.A OE2 no hydrogen 3.375 N/A ILE 3.A N THR 32.A O no hydrogen 2.828 N/A GLY 4.A N MET 69.A O no hydrogen 2.863 N/A VAL 5.A N PHE 34.A O no hydrogen 2.674 N/A LYS 7.A N GLU 36.A OE1 no hydrogen 2.773 N/A LYS 10.A NZ GLU 75.A OE2 no hydrogen 2.563 N/A GLU 13.A N LYS 10.A O no hydrogen 3.138 N/A ARG 15.A N GLU 13.A OE2 no hydrogen 2.743 N/A ARG 15.A NE GLU 13.A OE2 no hydrogen 2.940 N/A ARG 15.A NH2 GLU 13.A OE1 no hydrogen 2.830 N/A VAL 23.A N SER 19.A O no hydrogen 2.942 N/A ARG 24.A N PRO 20.A O no hydrogen 2.946 N/A ARG 24.A NE GLU 28.A OE2 no hydrogen 2.740 N/A THR 25.A N SER 21.A O no hydrogen 3.224 N/A THR 25.A OG1 SER 21.A O no hydrogen 3.256 N/A LEU 26.A N SER 22.A O no hydrogen 3.080 N/A VAL 27.A N VAL 23.A O no hydrogen 2.854 N/A GLU 28.A N ARG 24.A O no hydrogen 2.991 N/A ALA 29.A N LEU 26.A O no hydrogen 3.027 N/A GLY 30.A N VAL 27.A O no hydrogen 2.925 N/A HIS 31.A N LEU 26.A O no hydrogen 3.221 N/A THR 32.A N MET 1.A O no hydrogen 2.922 N/A PHE 34.A N ILE 3.A O no hydrogen 2.670 N/A ILE 35.A N GLN 56.A O no hydrogen 2.991 N/A GLU 36.A N VAL 5.A O no hydrogen 2.925 N/A THR 37.A N VAL 58.A O no hydrogen 2.667 N/A THR 37.A OG1 ASP 47.A OD2 no hydrogen 2.842 N/A GLN 38.A N ASP 47.A OD1 no hydrogen 2.801 N/A GLN 38.A NE2 THR 37.A OG1 no hydrogen 3.254 N/A ALA 39.A N GLU 36.A O no hydrogen 2.863 N/A ILE 41.A N GLN 38.A O no hydrogen 3.217 N/A ALA 43.A N GLY 40.A O no hydrogen 2.936 N/A GLY 44.A N ILE 41.A O no hydrogen 3.116 N/A PHE 45.A N GLY 40.A O no hydrogen 2.989 N/A ALA 46.A N ASP 49.A OD2 no hydrogen 3.204 N/A TYR 50.A N ALA 46.A O no hydrogen 3.241 N/A TYR 50.A OH LEU 18.A O no hydrogen 2.704 N/A VAL 51.A N ASP 47.A O no hydrogen 2.733 N/A GLN 52.A N GLN 48.A O no hydrogen 2.787 N/A ALA 53.A N TYR 50.A O no hydrogen 3.223 N/A GLY 54.A N TYR 50.A O no hydrogen 3.256 N/A GLY 54.A N VAL 51.A O no hydrogen 2.987 N/A ALA 55.A N TYR 50.A O no hydrogen 3.044 N/A GLN 56.A N VAL 33.A O no hydrogen 2.934 N/A VAL 58.A N ILE 35.A O no hydrogen 2.649 N/A SER 60.A OG ASP 63.A OD2 no hydrogen 2.185 N/A ASP 63.A N SER 60.A OG no hydrogen 3.105 N/A ALA 64.A N SER 60.A O no hydrogen 3.223 N/A ALA 64.A N ALA 61.A O no hydrogen 2.922 N/A TRP 65.A N ALA 61.A O no hydrogen 2.697 N/A SER 66.A N LYS 62.A O no hydrogen 3.013 N/A SER 66.A OG LYS 62.A O no hydrogen 3.224 N/A SER 66.A OG ASP 63.A O no hydrogen 3.084 N/A ARG 67.A NE ASP 63.A O no hydrogen 2.958 N/A ARG 67.A NH2 ASP 63.A O no hydrogen 3.348 N/A VAL 70.A N LEU 89.A O no hydrogen 2.822 N/A VAL 71.A N GLY 4.A O no hydrogen 3.240 N/A LYS 72.A N PHE 91.A O no hydrogen 3.076 N/A LYS 72.A NZ GLU 8.A OE1 no hydrogen 3.271 N/A LYS 72.A NZ GLU 8.A OE2 no hydrogen 3.216 N/A VAL 73.A N GLU 8.A OE2 no hydrogen 2.876 N/A LYS 74.A N GLU 8.A OE1 no hydrogen 3.139 N/A GLU 75.A N GLU 75.A OE1 no hydrogen 2.520 N/A LEU 77.A N GLU 80.A OE2 no hydrogen 2.853 N/A GLU 80.A N LEU 77.A O no hydrogen 2.625 N/A TYR 81.A N PRO 78.A O no hydrogen 2.636 N/A LEU 83.A N GLU 80.A O no hydrogen 2.948 N/A GLN 88.A N GLN 85.A O no hydrogen 3.464 N/A LEU 89.A N GLU 68.A O no hydrogen 2.876 N/A LEU 90.A N THR 112.A O no hydrogen 2.824 N/A PHE 91.A N VAL 70.A O no hydrogen 3.041 N/A THR 92.A N ILE 114.A O no hydrogen 3.269 N/A THR 92.A OG1 LYS 74.A O no hydrogen 2.790 N/A TYR 93.A N VAL 73.A O no hydrogen 3.029 N/A TYR 93.A OH LEU 128.A O no hydrogen 2.607 N/A LEU 94.A N GLU 117.A OE1 no hydrogen 3.135 N/A LEU 94.A N GLU 117.A OE2 no hydrogen 3.328 N/A HIS 95.A N GLU 117.A OE2 no hydrogen 2.561 N/A ALA 98.A N HIS 95.A O no hydrogen 3.198 N/A ALA 99.A N LEU 96.A O no hydrogen 2.833 N/A ARG 100.A NH1 GLU 104.A OE1 no hydrogen 2.943 N/A ARG 100.A NH2 ASP 359.A OD1 no hydrogen 3.252 N/A THR 103.A N ALA 99.A O no hydrogen 2.921 N/A THR 103.A OG1 LEU 96.A O no hydrogen 3.424 N/A THR 103.A OG1 ALA 99.A O no hydrogen 2.738 N/A GLU 104.A N ARG 100.A O no hydrogen 2.755 N/A GLN 105.A N GLU 101.A O no hydrogen 2.646 N/A LEU 106.A N LEU 102.A O no hydrogen 2.817 N/A MET 107.A N THR 103.A O no hydrogen 3.002 N/A ARG 108.A N GLU 104.A O no hydrogen 2.805 N/A ARG 108.A NH2 GLN 105.A OE1 no hydrogen 2.419 N/A VAL 109.A N GLN 105.A O no hydrogen 3.247 N/A GLY 110.A N LEU 106.A O no hydrogen 3.209 N/A THR 112.A N GLN 88.A O no hydrogen 2.906 N/A ALA 113.A N VAL 343.A O no hydrogen 2.835 N/A ILE 114.A N LEU 90.A O no hydrogen 2.684 N/A ALA 115.A N GLY 340.A O no hydrogen 2.965 N/A TYR 116.A N THR 92.A O no hydrogen 2.813 N/A TYR 116.A OH LYS 72.A O no hydrogen 2.669 N/A GLU 117.A N GLU 117.A OE1 no hydrogen 2.779 N/A THR 118.A N ALA 115.A O no hydrogen 3.295 N/A THR 118.A OG1 LYS 339.A O no hydrogen 3.238 N/A THR 118.A OG1 ASN 342.A OD1 no hydrogen 3.120 N/A GLU 120.A N ALA 336.A O no hydrogen 3.425 N/A LEU 121.A N SER 125.A O no hydrogen 2.917 N/A ARG 124.A N LEU 121.A O no hydrogen 2.676 N/A LEU 129.A N LEU 126.A O no hydrogen 3.078 N/A THR 130.A N LEU 126.A O no hydrogen 3.414 N/A THR 130.A OG1 PRO 127.A O no hydrogen 3.547 N/A MET 132.A N LEU 129.A O no hydrogen 2.881 N/A SER 133.A N LEU 129.A O no hydrogen 3.038 N/A SER 133.A OG LEU 129.A O no hydrogen 3.488 N/A ILE 134.A N THR 130.A O no hydrogen 2.898 N/A ILE 135.A N PRO 131.A O no hydrogen 3.398 N/A ALA 136.A N MET 132.A O no hydrogen 2.966 N/A GLY 137.A N SER 133.A O no hydrogen 3.028 N/A ARG 138.A N ILE 134.A O no hydrogen 3.118 N/A ARG 138.A NE GLU 181.A OE1 no hydrogen 2.779 N/A ARG 138.A NH2 GLU 181.A OE1 no hydrogen 2.880 N/A LEU 139.A N ILE 135.A O no hydrogen 2.943 N/A SER 140.A N ALA 136.A O no hydrogen 3.016 N/A SER 140.A OG GLY 137.A O no hydrogen 2.569 N/A PHE 143.A N LEU 139.A O no hydrogen 2.814 N/A GLY 144.A N SER 140.A O no hydrogen 3.014 N/A ALA 145.A N VAL 141.A O no hydrogen 2.851 N/A ARG 146.A N GLN 142.A O no hydrogen 3.281 N/A ARG 146.A NE GLN 152.A OE1 no hydrogen 3.113 N/A ARG 146.A NH2 GLN 152.A OE1 no hydrogen 3.441 N/A PHE 147.A N PHE 143.A O no hydrogen 3.046 N/A LEU 148.A N GLY 144.A O no hydrogen 3.161 N/A LEU 148.A N ALA 145.A O no hydrogen 3.306 N/A GLU 149.A N ARG 146.A O no hydrogen 3.323 N/A ARG 150.A NH1 ARG 155.A O no hydrogen 3.359 N/A GLN 151.A N GLN 151.A OE1 no hydrogen 2.816 N/A GLN 152.A N GLU 149.A O no hydrogen 3.064 N/A GLY 153.A N ARG 150.A O no hydrogen 3.030 N/A GLY 154.A N GLU 149.A O no hydrogen 3.108 N/A ARG 155.A N GLY 260.A O no hydrogen 3.018 N/A ARG 155.A NH1 ASP 232.A OD1 no hydrogen 3.486 N/A GLY 156.A N LEU 148.A O no hydrogen 2.551 N/A VAL 157.A N LEU 148.A O no hydrogen 3.140 N/A GLY 161.A N LEU 158.A O no hydrogen 3.029 N/A VAL 165.A N VAL 162.A O no hydrogen 2.711 N/A GLY 168.A N LEU 159.A O no hydrogen 2.671 N/A LYS 169.A N ASP 232.A OD2 no hydrogen 2.785 N/A LYS 169.A NZ GLU 230.A OE1 no hydrogen 2.741 N/A VAL 170.A N GLN 192.A O no hydrogen 2.896 N/A VAL 171.A N LEU 233.A O no hydrogen 2.968 N/A ILE 172.A N GLN 194.A O no hydrogen 2.787 N/A LEU 173.A N ILE 235.A O no hydrogen 2.972 N/A GLY 174.A N PHE 196.A O no hydrogen 2.852 N/A GLY 175.A N ASP 197.A OD2 no hydrogen 2.784 N/A THR 180.A N GLY 176.A O no hydrogen 2.772 N/A THR 180.A OG1 GLY 175.A O no hydrogen 2.989 N/A THR 180.A OG1 GLY 176.A O no hydrogen 2.846 N/A GLU 181.A N VAL 177.A O no hydrogen 2.992 N/A ALA 182.A N VAL 178.A O no hydrogen 3.037 N/A ALA 183.A N GLY 179.A O no hydrogen 2.988 N/A LYS 184.A N THR 180.A O no hydrogen 3.049 N/A LYS 184.A NZ GLU 181.A OE1 no hydrogen 3.502 N/A LYS 184.A NZ GLU 181.A OE2 no hydrogen 2.721 N/A MET 185.A N GLU 181.A O no hydrogen 3.287 N/A ALA 186.A N ALA 182.A O no hydrogen 2.926 N/A VAL 187.A N ALA 183.A O no hydrogen 2.884 N/A GLY 188.A N LYS 184.A O no hydrogen 3.062 N/A LEU 189.A N MET 185.A O no hydrogen 3.066 N/A GLY 190.A N VAL 187.A O no hydrogen 2.910 N/A ALA 191.A N ALA 186.A O no hydrogen 3.080 N/A GLN 192.A N GLY 168.A O no hydrogen 2.870 N/A GLN 194.A N VAL 170.A O no hydrogen 3.038 N/A GLN 194.A NE2 GLU 215.A OE1 no hydrogen 2.936 N/A ILE 195.A N GLU 215.A O no hydrogen 2.892 N/A PHE 196.A N ILE 172.A O no hydrogen 2.760 N/A ASP 197.A N LEU 217.A O no hydrogen 3.120 N/A ASN 199.A N ASP 197.A OD1 no hydrogen 2.767 N/A GLU 201.A N ASN 199.A OD1 no hydrogen 3.083 N/A ARG 202.A NE GLY 175.A O no hydrogen 2.766 N/A ARG 202.A NH2 GLY 175.A O no hydrogen 3.321 N/A ARG 202.A NH2 THR 180.A OG1 no hydrogen 3.015 N/A LEU 203.A N ASN 199.A O no hydrogen 2.971 N/A SER 204.A N VAL 200.A O no hydrogen 2.765 N/A SER 204.A OG VAL 200.A O no hydrogen 3.415 N/A TYR 205.A N GLU 201.A O no hydrogen 2.882 N/A LEU 206.A N ARG 202.A O no hydrogen 2.852 N/A GLU 207.A N LEU 203.A O no hydrogen 3.144 N/A GLU 207.A N SER 204.A O no hydrogen 3.169 N/A THR 208.A N TYR 205.A O no hydrogen 2.906 N/A THR 208.A OG1 TYR 205.A O no hydrogen 2.630 N/A LEU 209.A N LEU 206.A O no hydrogen 2.885 N/A PHE 210.A N LEU 206.A O no hydrogen 2.832 N/A GLY 211.A N GLU 207.A O no hydrogen 2.707 N/A ARG 213.A N PHE 210.A O no hydrogen 3.283 N/A ARG 213.A NH1 ALA 191.A O no hydrogen 3.038 N/A ARG 213.A NH1 ARG 213.A O no hydrogen 3.085 N/A ARG 213.A NH2 ALA 191.A O no hydrogen 2.947 N/A GLU 215.A N VAL 193.A O no hydrogen 2.843 N/A LEU 217.A N ILE 195.A O no hydrogen 3.000 N/A SER 219.A N ASP 197.A O no hydrogen 2.818 N/A ILE 224.A N ASN 220.A O no hydrogen 2.917 N/A GLU 225.A N SER 221.A O no hydrogen 2.985 N/A THR 226.A N ALA 222.A O no hydrogen 3.465 N/A THR 226.A OG1 ALA 222.A O no hydrogen 3.471 N/A ALA 227.A N GLU 223.A O no hydrogen 3.047 N/A VAL 228.A N ILE 224.A O no hydrogen 2.950 N/A ALA 229.A N GLU 225.A O no hydrogen 3.217 N/A GLU 230.A N ALA 227.A O no hydrogen 2.912 N/A ALA 231.A N VAL 228.A O no hydrogen 3.137 N/A ASP 232.A N LYS 169.A O no hydrogen 2.881 N/A LEU 233.A N LYS 169.A O no hydrogen 3.154 N/A LEU 234.A N VAL 262.A O no hydrogen 2.843 N/A ILE 235.A N VAL 171.A O no hydrogen 2.916 N/A GLY 236.A N VAL 264.A O no hydrogen 2.769 N/A ALA 237.A N LEU 173.A O no hydrogen 2.794 N/A GLY 242.A N VAL 240.A O no hydrogen 2.819 N/A LEU 248.A N CYS 273.A O no hydrogen 2.677 N/A VAL 249.A N CYS 273.A O no hydrogen 2.625 N/A ALA 251.A N GLU 275.A OE1 no hydrogen 2.874 N/A LEU 253.A N PRO 250.A O no hydrogen 2.702 N/A VAL 254.A N PRO 250.A O no hydrogen 3.001 N/A GLU 255.A N ALA 251.A O no hydrogen 2.843 N/A GLN 256.A N LEU 253.A O no hydrogen 2.866 N/A GLN 256.A NE2 SER 252.A O no hydrogen 3.164 N/A MET 257.A N VAL 254.A O no hydrogen 3.013 N/A ARG 258.A NH2 GLU 230.A O no hydrogen 3.036 N/A GLY 260.A N GLY 291.A O no hydrogen 2.854 N/A SER 261.A N ARG 258.A O no hydrogen 3.211 N/A SER 261.A OG ALA 231.A O no hydrogen 2.869 N/A SER 261.A OG ARG 258.A O no hydrogen 3.025 N/A VAL 262.A N ASP 232.A O no hydrogen 2.836 N/A ILE 263.A N VAL 293.A O no hydrogen 2.953 N/A VAL 264.A N LEU 234.A O no hydrogen 2.949 N/A VAL 266.A N GLY 236.A O no hydrogen 2.871 N/A ALA 267.A N ASP 265.A OD1 no hydrogen 2.735 N/A VAL 268.A N ASP 265.A O no hydrogen 3.221 N/A GLN 270.A N ALA 267.A O no hydrogen 3.015 N/A GLY 271.A N ALA 267.A O no hydrogen 2.777 N/A CYS 273.A N ASP 265.A OD2 no hydrogen 3.087 N/A GLU 275.A N VAL 249.A O no hydrogen 2.559 N/A THR 276.A OG1 HIS 294.A NE2 no hydrogen 3.166 N/A LEU 277.A N VAL 274.A O no hydrogen 3.356 N/A HIS 278.A N TYR 287.A OH no hydrogen 2.877 N/A HIS 278.A ND1 PRO 279.A O no hydrogen 2.928 N/A THR 280.A N GLY 296.A O no hydrogen 2.960 N/A THR 280.A OG1 PRO 285.A O no hydrogen 2.629 N/A SER 281.A OG THR 283.A OG1 no hydrogen 3.248 N/A THR 283.A OG1 SER 281.A OG no hydrogen 3.248 N/A GLN 284.A N SER 281.A O no hydrogen 3.038 N/A TYR 287.A N HIS 294.A O no hydrogen 2.867 N/A TYR 287.A OH THR 276.A O no hydrogen 2.575 N/A VAL 289.A N VAL 292.A O no hydrogen 3.057 N/A VAL 292.A N VAL 289.A O no hydrogen 3.128 N/A VAL 293.A N SER 261.A O no hydrogen 2.988 N/A HIS 294.A N TYR 287.A O no hydrogen 2.594 N/A HIS 294.A ND1 VAL 292.A O no hydrogen 2.750 N/A HIS 294.A NE2 THR 276.A OG1 no hydrogen 3.166 N/A TYR 295.A N ILE 263.A O no hydrogen 3.161 N/A GLY 296.A N PRO 285.A O no hydrogen 3.196 N/A GLY 302.A N ASN 299.A O no hydrogen 3.105 N/A ALA 303.A N MET 300.A O no hydrogen 3.039 N/A VAL 304.A N PRO 301.A O no hydrogen 3.158 N/A ALA 308.A N VAL 304.A O no hydrogen 2.786 N/A THR 309.A N PRO 305.A O no hydrogen 2.966 N/A THR 309.A OG1 PRO 305.A O no hydrogen 2.695 N/A GLN 310.A NE2 TRP 306.A O no hydrogen 3.363 N/A ALA 311.A N THR 307.A O no hydrogen 3.031 N/A LEU 312.A N ALA 308.A O no hydrogen 2.948 N/A ASN 313.A N THR 309.A O no hydrogen 2.918 N/A ASN 313.A ND2 GLY 17.A O no hydrogen 3.696 N/A ASN 313.A ND2 SER 22.A OG no hydrogen 2.706 N/A ASN 314.A N GLN 310.A O no hydrogen 2.869 N/A SER 315.A N LEU 312.A O no hydrogen 2.789 N/A THR 316.A N LEU 312.A O no hydrogen 2.819 N/A THR 316.A OG1 LEU 312.A O no hydrogen 3.433 N/A THR 316.A OG1 ASN 313.A O no hydrogen 3.506 N/A LEU 317.A N ASN 313.A O no hydrogen 2.848 N/A TYR 319.A N THR 316.A O no hydrogen 2.859 N/A VAL 320.A N THR 316.A O no hydrogen 2.934 N/A VAL 321.A N LEU 317.A O no hydrogen 2.981 N/A LYS 322.A N PRO 318.A O no hydrogen 3.184 N/A LYS 322.A NZ ASP 334.A OD2 no hydrogen 2.346 N/A LEU 323.A N TYR 319.A O no hydrogen 3.037 N/A ALA 324.A N VAL 320.A O no hydrogen 2.867 N/A ASN 325.A N VAL 321.A O no hydrogen 2.841 N/A GLN 326.A N LYS 322.A O no hydrogen 2.753 N/A GLY 327.A N LEU 323.A O no hydrogen 2.690 N/A LYS 329.A N GLN 326.A O no hydrogen 2.948 N/A ALA 330.A N GLY 327.A O no hydrogen 3.195 N/A LEU 331.A N LEU 328.A O no hydrogen 3.256 N/A GLU 332.A N LYS 329.A O no hydrogen 2.700 N/A THR 333.A N ALA 330.A O no hydrogen 3.241 N/A THR 333.A OG1 GLN 326.A OE1 no hydrogen 3.123 N/A THR 333.A OG1 LYS 329.A O no hydrogen 3.486 N/A THR 333.A OG1 ALA 330.A O no hydrogen 2.788 N/A ASP 334.A N ALA 330.A O no hydrogen 2.711 N/A LEU 337.A N ASP 334.A OD1 no hydrogen 2.811 N/A ALA 338.A N ASP 334.A O no hydrogen 2.904 N/A LYS 339.A N ASP 335.A O no hydrogen 2.999 N/A LYS 339.A NZ GLU 120.A OE2 no hydrogen 3.514 N/A GLY 340.A N LEU 337.A O no hydrogen 2.780 N/A LEU 341.A N LEU 337.A O no hydrogen 3.275 N/A LEU 341.A N ALA 338.A O no hydrogen 3.202 N/A ASN 342.A N ALA 113.A O no hydrogen 2.864 N/A VAL 343.A N ALA 113.A O no hydrogen 3.403 N/A GLN 344.A N ARG 347.A O no hydrogen 2.939 N/A ALA 345.A N GLY 110.A O no hydrogen 3.108 N/A ARG 347.A N GLN 344.A O no hydrogen 2.770 N/A VAL 349.A N ASN 342.A O no hydrogen 2.765 N/A HIS 350.A N ASN 342.A O no hydrogen 3.123 N/A HIS 350.A ND1 LEU 341.A O no hydrogen 3.231 N/A VAL 353.A N HIS 350.A O no hydrogen 2.771 N/A GLN 354.A N HIS 350.A O no hydrogen 2.854 N/A GLN 354.A NE2 LEU 348.A O no hydrogen 2.884 N/A GLN 355.A N PRO 351.A O no hydrogen 3.224 N/A VAL 356.A N VAL 353.A O no hydrogen 2.929 N/A PHE 357.A N VAL 353.A O no hydrogen 2.898 N/A LEU 360.A N PHE 357.A O no hydrogen 2.487 N/A