Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4p22_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 6.A N PRO 209.A O no hydrogen 2.838 N/A ARG 8.A N GLN 208.A OE1 no hydrogen 2.651 N/A GLN 9.A N LEU 5.A O no hydrogen 2.782 N/A GLN 9.A NE2 GLY 4.A O no hydrogen 2.903 N/A GLN 9.A NE2 GLU 211.A OE2 no hydrogen 3.547 N/A LEU 10.A N TYR 6.A O no hydrogen 3.132 N/A TYR 11.A N SER 7.A O no hydrogen 3.284 N/A VAL 12.A N ARG 8.A O no hydrogen 3.245 N/A LEU 13.A N GLN 9.A O no hydrogen 3.054 N/A GLY 14.A N LEU 10.A O no hydrogen 3.177 N/A HIS 15.A N VAL 12.A O no hydrogen 3.351 N/A GLU 16.A N TYR 11.A O no hydrogen 2.922 N/A ARG 20.A N MET 18.A O no hydrogen 2.769 N/A GLN 22.A NE2 MET 18.A O no hydrogen 3.003 N/A GLN 22.A NE2 ARG 20.A O no hydrogen 2.627 N/A SER 24.A OG CYS 353.A O no hydrogen 2.966 N/A SER 25.A N GLN 111.A OE1 no hydrogen 2.598 N/A VAL 26.A N ALA 49.A O no hydrogen 3.073 N/A LEU 27.A N VAL 112.A O no hydrogen 2.936 N/A VAL 28.A N THR 51.A O no hydrogen 2.833 N/A SER 29.A N VAL 114.A O no hydrogen 2.738 N/A SER 29.A OG HIS 53.A ND1 no hydrogen 2.713 N/A GLY 30.A N HIS 53.A O no hydrogen 2.869 N/A LEU 31.A N ASP 54.A OD1 no hydrogen 2.821 N/A ARG 32.A NE ASN 117.A OD1 no hydrogen 3.051 N/A ARG 32.A NH1 ASP 62.A OD1 no hydrogen 2.991 N/A VAL 36.A N ARG 32.A O no hydrogen 3.224 N/A GLU 37.A N GLY 33.A O no hydrogen 3.041 N/A ILE 38.A N LEU 34.A O no hydrogen 3.093 N/A ALA 39.A N GLY 35.A O no hydrogen 2.745 N/A LYS 40.A N VAL 36.A O no hydrogen 2.923 N/A LYS 40.A NZ GLU 37.A OE1 no hydrogen 3.065 N/A ASN 41.A N GLU 37.A O no hydrogen 3.092 N/A ASN 41.A ND2 GLY 342.A O no hydrogen 3.051 N/A ILE 42.A N ILE 38.A O no hydrogen 3.019 N/A ILE 42.A N ALA 39.A O no hydrogen 3.194 N/A ILE 43.A N ALA 39.A O no hydrogen 2.964 N/A LEU 44.A N LYS 40.A O no hydrogen 3.071 N/A GLY 45.A N ASN 41.A O no hydrogen 3.002 N/A GLY 46.A N ILE 43.A O no hydrogen 3.022 N/A VAL 50.A N PRO 94.A O no hydrogen 3.035 N/A THR 51.A N VAL 26.A O no hydrogen 2.922 N/A LEU 52.A N THR 96.A O no hydrogen 2.680 N/A HIS 53.A N VAL 28.A O no hydrogen 2.978 N/A HIS 53.A ND1 SER 29.A OG no hydrogen 2.713 N/A HIS 53.A NE2 GLY 100.A O no hydrogen 2.616 N/A ASP 54.A N TYR 98.A O no hydrogen 3.232 N/A GLY 56.A N ASP 54.A OD2 no hydrogen 2.850 N/A ALA 58.A N LYS 76.A O no hydrogen 2.838 N/A GLN 59.A N ASP 62.A OD2 no hydrogen 3.031 N/A GLN 59.A NE2 THR 57.A O no hydrogen 3.556 N/A GLN 59.A NE2 ALA 58.A O no hydrogen 3.289 N/A ASP 62.A N GLN 59.A O no hydrogen 2.870 N/A LEU 63.A N TRP 60.A O no hydrogen 3.095 N/A GLN 66.A N ASP 62.A O no hydrogen 3.352 N/A GLN 66.A NE2 LEU 31.A O no hydrogen 3.181 N/A GLN 66.A NE2 SER 82.A OG no hydrogen 2.901 N/A TYR 68.A N GLN 66.A OE1 no hydrogen 2.803 N/A LEU 69.A N GLN 66.A O no hydrogen 3.242 N/A ARG 70.A N ASP 73.A OD2 no hydrogen 2.993 N/A ARG 70.A NH2 PHE 67.A O no hydrogen 3.383 N/A ASP 73.A N ARG 70.A O no hydrogen 3.456 N/A GLY 75.A N ALA 58.A O no hydrogen 2.757 N/A LYS 76.A N ASP 73.A O no hydrogen 2.787 N/A ASN 77.A ND2 ASP 54.A O no hydrogen 3.010 N/A ARG 78.A N GLY 56.A O no hydrogen 3.126 N/A ARG 78.A NE ASP 54.A OD1 no hydrogen 2.943 N/A ARG 78.A NH1 ASP 62.A OD2 no hydrogen 2.736 N/A ARG 78.A NH2 ASP 54.A OD1 no hydrogen 3.405 N/A ARG 78.A NH2 ASP 54.A OD2 no hydrogen 3.205 N/A ALA 79.A N ASN 77.A OD1 no hydrogen 3.182 N/A VAL 81.A N ASN 77.A O no hydrogen 3.013 N/A SER 82.A N ARG 78.A O no hydrogen 3.079 N/A SER 82.A OG ARG 78.A O no hydrogen 2.912 N/A GLN 83.A N ALA 79.A O no hydrogen 2.977 N/A ARG 85.A NE VAL 81.A O no hydrogen 3.279 N/A LEU 86.A N SER 82.A O no hydrogen 2.949 N/A ALA 87.A N GLN 83.A O no hydrogen 2.803 N/A GLU 88.A N PRO 84.A O no hydrogen 3.337 N/A LEU 89.A N LEU 86.A O no hydrogen 3.249 N/A VAL 93.A N ASN 90.A OD1 no hydrogen 3.084 N/A THR 96.A N VAL 50.A O no hydrogen 2.934 N/A TYR 98.A N LEU 52.A O no hydrogen 2.846 N/A TYR 98.A OH PRO 101.A O no hydrogen 2.976 N/A VAL 103.A N PRO 101.A O no hydrogen 2.775 N/A PHE 106.A N VAL 103.A O no hydrogen 2.948 N/A LEU 107.A N VAL 103.A O no hydrogen 3.103 N/A SER 108.A N GLU 104.A O no hydrogen 3.092 N/A GLY 109.A N PHE 106.A O no hydrogen 2.998 N/A GLN 111.A N SER 25.A O no hydrogen 3.258 N/A VAL 112.A N SER 25.A O no hydrogen 3.223 N/A VAL 113.A N LYS 136.A O no hydrogen 2.813 N/A VAL 114.A N LEU 27.A O no hydrogen 2.659 N/A LEU 115.A N VAL 138.A O no hydrogen 2.760 N/A THR 118.A OG1 THR 116.A O no hydrogen 2.796 N/A GLN 123.A N PRO 119.A O no hydrogen 3.027 N/A GLN 123.A NE2 THR 118.A O no hydrogen 2.613 N/A LEU 124.A N LEU 120.A O no hydrogen 2.914 N/A ARG 125.A N GLU 121.A O no hydrogen 2.866 N/A ARG 125.A NH2 ASP 122.A OD2 no hydrogen 2.427 N/A VAL 126.A N ASP 122.A O no hydrogen 2.836 N/A GLY 127.A N GLN 123.A O no hydrogen 2.773 N/A GLU 128.A N LEU 124.A O no hydrogen 2.907 N/A PHE 129.A N ARG 125.A O no hydrogen 3.223 N/A CYS 130.A N VAL 126.A O no hydrogen 2.878 N/A CYS 130.A SG VAL 126.A O no hydrogen 3.538 N/A HIS 131.A N GLY 127.A O no hydrogen 3.077 N/A HIS 131.A ND1 ASP 152.A OD1 no hydrogen 2.937 N/A HIS 131.A ND1 ASP 152.A OD2 no hydrogen 2.791 N/A HIS 131.A NE2 GLU 155.A OE2 no hydrogen 3.339 N/A ASN 132.A N GLU 128.A O no hydrogen 3.027 N/A ARG 133.A N PHE 129.A O no hydrogen 2.886 N/A ARG 133.A NH1 ASP 105.A OD2 no hydrogen 3.408 N/A ARG 133.A NH2 ASP 105.A OD2 no hydrogen 3.066 N/A ILE 135.A N CYS 130.A O no hydrogen 2.704 N/A LYS 136.A N GLN 111.A O no hydrogen 3.160 N/A LYS 136.A NZ ALA 352.A O no hydrogen 3.116 N/A LEU 137.A N ASP 152.A O no hydrogen 2.990 N/A VAL 138.A N VAL 113.A O no hydrogen 2.856 N/A VAL 139.A N PHE 150.A O no hydrogen 2.867 N/A ALA 140.A N LEU 115.A O no hydrogen 3.011 N/A ASP 141.A N GLN 148.A O no hydrogen 2.960 N/A THR 142.A OG1 ASN 338.A OD1 no hydrogen 3.545 N/A ARG 143.A N PHE 146.A O no hydrogen 2.705 N/A ARG 143.A NH1 ASP 141.A OD2 no hydrogen 2.834 N/A GLY 144.A N GLY 332.A O no hydrogen 3.004 N/A PHE 146.A N ARG 143.A O no hydrogen 3.078 N/A GLY 147.A N PHE 366.A O no hydrogen 3.093 N/A GLN 148.A N ASP 141.A O no hydrogen 2.762 N/A GLN 148.A NE2 TYR 365.A OH no hydrogen 3.158 N/A LEU 149.A N LEU 364.A O no hydrogen 2.942 N/A PHE 150.A N VAL 139.A O no hydrogen 2.720 N/A CYS 151.A N GLN 362.A O no hydrogen 2.966 N/A CYS 151.A SG GLU 348.A OE1 no hydrogen 3.339 N/A ASP 152.A N LEU 137.A O no hydrogen 3.038 N/A GLY 154.A N ASP 152.A OD1 no hydrogen 2.802 N/A MET 157.A N ILE 246.A O no hydrogen 3.159 N/A LEU 159.A N LYS 244.A O no hydrogen 2.603 N/A ASP 161.A N VAL 242.A O no hydrogen 2.826 N/A SER 165.A OG PRO 163.A O no hydrogen 3.562 N/A ALA 166.A N VAL 237.A O no hydrogen 3.241 N/A VAL 168.A N GLY 235.A O no hydrogen 2.811 N/A SER 169.A N THR 180.A O no hydrogen 3.036 N/A MET 170.A N THR 180.A O no hydrogen 3.326 N/A THR 172.A N VAL 178.A O no hydrogen 3.386 N/A LYS 173.A NZ PHE 228.A O no hydrogen 3.409 N/A ASP 174.A N THR 172.A OG1 no hydrogen 3.259 N/A VAL 178.A N THR 172.A OG1 no hydrogen 3.013 N/A VAL 179.A N PHE 220.A O no hydrogen 3.125 N/A THR 180.A N MET 170.A O no hydrogen 2.564 N/A THR 180.A OG1 MET 170.A O no hydrogen 3.278 N/A CYS 181.A SG LEU 182.A O no hydrogen 3.811 N/A CYS 181.A SG TYR 218.A O no hydrogen 3.488 N/A GLY 190.A N ILE 212.A O no hydrogen 3.052 N/A PHE 192.A N LYS 241.A O no hydrogen 3.050 N/A VAL 193.A N MET 210.A O no hydrogen 3.024 N/A SER 194.A N SER 238.A O no hydrogen 3.326 N/A SER 196.A N ILE 236.A O no hydrogen 3.131 N/A VAL 198.A N ASN 205.A OD1 no hydrogen 2.711 N/A LEU 204.A N MET 201.A O no hydrogen 3.330 N/A ASN 205.A N VAL 202.A O no hydrogen 2.949 N/A ASN 205.A ND2 VAL 198.A O no hydrogen 3.218 N/A ASN 205.A ND2 VAL 202.A O no hydrogen 2.734 N/A ASN 207.A ND2 GLU 203.A O no hydrogen 3.202 N/A GLN 208.A N ASN 207.A OD1 no hydrogen 2.929 N/A MET 210.A N VAL 193.A O no hydrogen 3.079 N/A ILE 212.A N ASP 191.A O no hydrogen 2.779 N/A LYS 213.A N SER 221.A O no hydrogen 2.949 N/A VAL 214.A N GLU 188.A O no hydrogen 2.850 N/A LEU 215.A N THR 219.A O no hydrogen 3.075 N/A GLY 216.A N THR 219.A O no hydrogen 3.173 N/A SER 221.A N LYS 213.A O no hydrogen 2.787 N/A SER 221.A OG LYS 213.A O no hydrogen 2.542 N/A ILE 222.A N GLY 177.A O no hydrogen 3.107 N/A CYS 223.A SG ASP 224.A O no hydrogen 3.385 N/A THR 225.A N ASP 174.A O no hydrogen 3.075 N/A THR 225.A OG1 THR 172.A O no hydrogen 2.965 N/A THR 225.A OG1 ASP 174.A O no hydrogen 3.131 N/A SER 226.A OG LYS 173.A O no hydrogen 3.372 N/A SER 226.A OG ASN 175.A OD1 no hydrogen 3.497 N/A PHE 228.A N THR 225.A O no hydrogen 3.100 N/A SER 229.A N GLU 203.A OE2 no hydrogen 2.372 N/A SER 229.A OG GLU 203.A OE2 no hydrogen 3.352 N/A ASP 230.A N ASP 230.A OD2 no hydrogen 2.559 N/A ILE 232.A N GLN 199.A O no hydrogen 2.843 N/A ILE 236.A N SER 196.A O no hydrogen 2.854 N/A VAL 237.A N ALA 166.A O no hydrogen 3.197 N/A SER 238.A N SER 194.A O no hydrogen 2.931 N/A VAL 240.A N PHE 192.A O no hydrogen 2.827 N/A LYS 241.A N PHE 192.A O no hydrogen 3.276 N/A LYS 241.A NZ TYR 6.A OH no hydrogen 2.961 N/A VAL 242.A N ASP 161.A O no hydrogen 3.063 N/A LYS 244.A N LEU 159.A O no hydrogen 2.732 N/A ILE 246.A N MET 157.A O no hydrogen 2.742 N/A SER 247.A OG GLU 155.A O no hydrogen 2.550 N/A LYS 249.A N GLN 362.A OE1 no hydrogen 2.678 N/A LYS 249.A NZ GLN 362.A OE1 no hydrogen 2.961 N/A ALA 253.A N SER 250.A OG no hydrogen 3.213 N/A SER 254.A N SER 250.A O no hydrogen 2.814 N/A LEU 255.A N LEU 251.A O no hydrogen 2.824 N/A ALA 256.A N ALA 253.A O no hydrogen 3.130 N/A GLU 257.A N ALA 253.A O no hydrogen 2.939 N/A LEU 269.A N ARG 265.A O no hydrogen 3.412 N/A HIS 270.A N PRO 266.A O no hydrogen 2.713 N/A HIS 270.A ND1 TYR 365.A OH no hydrogen 2.694 N/A HIS 270.A NE2 LEU 255.A O no hydrogen 2.881 N/A ILE 271.A N ALA 267.A O no hydrogen 2.911 N/A GLY 272.A N GLN 268.A O no hydrogen 2.655 N/A PHE 273.A N LEU 269.A O no hydrogen 2.568 N/A GLN 274.A N HIS 270.A O no hydrogen 3.087 N/A ALA 275.A N ILE 271.A O no hydrogen 3.047 N/A LEU 276.A N GLY 272.A O no hydrogen 2.978 N/A HIS 277.A N PHE 273.A O no hydrogen 3.103 N/A GLN 278.A N GLN 274.A O no hydrogen 3.040 N/A PHE 279.A N ALA 275.A O no hydrogen 2.808 N/A CYS 280.A N LEU 276.A O no hydrogen 2.912 N/A CYS 280.A SG LEU 276.A O no hydrogen 3.346 N/A CYS 280.A SG ARG 285.A O no hydrogen 3.675 N/A ALA 281.A N HIS 277.A O no hydrogen 2.895 N/A GLN 282.A N GLN 278.A O no hydrogen 3.038 N/A GLN 282.A N PHE 279.A O no hydrogen 2.950 N/A HIS 283.A N PHE 279.A O no hydrogen 2.875 N/A HIS 283.A NE2 GLU 297.A OE1 no hydrogen 2.746 N/A HIS 283.A NE2 GLU 297.A OE2 no hydrogen 2.903 N/A GLY 284.A N CYS 280.A O no hydrogen 2.796 N/A ARG 285.A NH2 ASP 294.A OD2 no hydrogen 2.656 N/A ARG 288.A N ASP 294.A OD2 no hydrogen 3.179 N/A ARG 288.A NE ASP 294.A OD2 no hydrogen 3.104 N/A ARG 288.A NH2 ASP 294.A OD1 no hydrogen 3.401 N/A ASP 294.A N ASN 291.A OD1 no hydrogen 3.434 N/A ALA 295.A N ASN 291.A O no hydrogen 3.405 N/A ALA 296.A N ASP 292.A O no hydrogen 3.271 N/A GLU 297.A N GLU 293.A O no hydrogen 2.870 N/A LEU 298.A N ASP 294.A O no hydrogen 2.909 N/A VAL 299.A N ALA 295.A O no hydrogen 3.097 N/A ALA 300.A N ALA 296.A O no hydrogen 2.990 N/A LEU 301.A N GLU 297.A O no hydrogen 2.888 N/A ALA 302.A N LEU 298.A O no hydrogen 2.759 N/A GLN 303.A N VAL 299.A O no hydrogen 2.846 N/A ALA 304.A N ALA 300.A O no hydrogen 3.103 N/A VAL 305.A N LEU 301.A O no hydrogen 2.878 N/A ASN 306.A N ALA 302.A O no hydrogen 2.742 N/A ASN 306.A ND2 GLN 315.A O no hydrogen 2.895 N/A ALA 307.A N GLN 303.A O no hydrogen 2.768 N/A ARG 308.A N ALA 304.A O no hydrogen 2.993 N/A ALA 309.A N ASN 306.A O no hydrogen 3.245 N/A GLN 314.A N LEU 310.A O no hydrogen 2.976 N/A GLN 314.A NE2 ASN 306.A O no hydrogen 3.116 N/A GLN 315.A N ASN 306.A OD1 no hydrogen 2.836 N/A GLN 315.A NE2 VAL 313.A O no hydrogen 2.999 N/A ASP 319.A N GLN 268.A OE1 no hydrogen 2.831 N/A LEU 322.A N ASP 319.A OD2 no hydrogen 2.869 N/A ILE 323.A N ASP 319.A O no hydrogen 3.087 N/A ARG 324.A N GLU 320.A O no hydrogen 2.971 N/A LYS 325.A N ASP 321.A O no hydrogen 2.973 N/A LYS 325.A NZ LEU 369.A O no hydrogen 3.164 N/A LEU 326.A N LEU 322.A O no hydrogen 3.054 N/A ALA 327.A N ILE 323.A O no hydrogen 3.069 N/A TYR 328.A N ARG 324.A O no hydrogen 3.037 N/A ALA 330.A N ALA 327.A O no hydrogen 3.250 N/A ASN 338.A N LEU 334.A O no hydrogen 3.114 N/A ASN 338.A ND2 SER 65.A OG no hydrogen 2.569 N/A ASN 338.A ND2 ASP 333.A OD2 no hydrogen 3.418 N/A ALA 339.A N ALA 335.A O no hydrogen 2.831 N/A PHE 340.A N PRO 336.A O no hydrogen 3.004 N/A ILE 341.A N ILE 337.A O no hydrogen 2.834 N/A GLY 342.A N ASN 338.A O no hydrogen 2.735 N/A GLY 343.A N ALA 339.A O no hydrogen 2.861 N/A GLY 343.A N PHE 340.A O no hydrogen 3.003 N/A LEU 344.A N PHE 340.A O no hydrogen 3.242 N/A ALA 345.A N ILE 341.A O no hydrogen 2.798 N/A ALA 346.A N GLY 342.A O no hydrogen 3.172 N/A GLN 347.A N GLY 343.A O no hydrogen 3.248 N/A GLU 348.A N LEU 344.A O no hydrogen 3.099 N/A VAL 349.A N ALA 345.A O no hydrogen 2.898 N/A MET 350.A N ALA 346.A O no hydrogen 2.849 N/A LYS 351.A N GLN 347.A O no hydrogen 2.990 N/A LYS 351.A NZ GLU 348.A OE2 no hydrogen 2.941 N/A LYS 351.A NZ MET 358.A O no hydrogen 3.011 N/A ALA 352.A N GLU 348.A O no hydrogen 2.886 N/A CYS 353.A N VAL 349.A O no hydrogen 2.883 N/A CYS 353.A N MET 350.A O no hydrogen 3.160 N/A CYS 353.A SG VAL 349.A O no hydrogen 3.542 N/A SER 354.A N MET 350.A O no hydrogen 3.321 N/A ILE 360.A N GLU 348.A OE1 no hydrogen 3.258 N/A GLN 362.A N ILE 360.A O no hydrogen 2.732 N/A GLN 362.A NE2 CYS 151.A O no hydrogen 3.349 N/A GLN 362.A NE2 LYS 249.A O no hydrogen 2.930 N/A TRP 363.A N ASP 259.A O no hydrogen 3.284 N/A TRP 363.A N MET 361.A O no hydrogen 2.803 N/A LEU 364.A N LEU 149.A O no hydrogen 2.842 N/A TYR 365.A OH HIS 270.A ND1 no hydrogen 2.694 N/A PHE 366.A N GLY 147.A O no hydrogen 3.032 N/A ALA 368.A N LEU 145.A O no hydrogen 3.005 N/A GLU 370.A N GLU 370.A OE2 no hydrogen 2.747 N/A