Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3mkc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 7.A N ASN 5.A OD1 no hydrogen 2.947 N/A VAL 8.A N ASN 5.A O no hydrogen 3.319 N/A ALA 9.A N ALA 7.A O no hydrogen 2.799 N/A ILE 11.A N ARG 73.A O no hydrogen 2.839 N/A LYS 12.A N THR 32.A O no hydrogen 2.686 N/A SER 13.A N THR 32.A O no hydrogen 3.110 N/A GLU 15.A N LYS 30.A O no hydrogen 2.891 N/A ILE 17.A N VAL 28.A O no hydrogen 2.628 N/A VAL 19.A N THR 26.A O no hydrogen 2.796 N/A TYR 21.A N GLN 24.A O no hydrogen 3.094 N/A THR 26.A N VAL 19.A O no hydrogen 2.935 N/A THR 26.A OG1 GLU 42.A OE1 no hydrogen 2.689 N/A VAL 28.A N ILE 17.A O no hydrogen 2.904 N/A VAL 29.A N GLY 41.A O no hydrogen 2.777 N/A LYS 30.A N GLU 15.A O no hydrogen 2.864 N/A VAL 31.A N GLY 39.A O no hydrogen 3.000 N/A THR 32.A N SER 13.A O no hydrogen 2.896 N/A ASP 33.A N VAL 37.A O no hydrogen 2.746 N/A GLU 34.A N PRO 10.A O no hydrogen 3.014 N/A ASN 35.A N ASP 33.A OD1 no hydrogen 2.619 N/A GLY 36.A N ASP 33.A O no hydrogen 3.026 N/A VAL 37.A N ASP 33.A OD1 no hydrogen 2.949 N/A TYR 38.A OH ASP 362.A OD1 no hydrogen 2.520 N/A GLY 39.A N VAL 31.A O no hydrogen 2.823 N/A LEU 40.A N ASP 107.A OD2 no hydrogen 2.777 N/A GLY 41.A N VAL 29.A O no hydrogen 2.934 N/A ALA 43.A N VAL 27.A O no hydrogen 2.988 N/A ASP 44.A N ASN 276.A O no hydrogen 3.103 N/A ILE 50.A N SER 46.A O no hydrogen 2.896 N/A LEU 51.A N PRO 47.A O no hydrogen 2.858 N/A ALA 52.A N ASP 48.A O no hydrogen 3.163 N/A TYR 53.A N ALA 49.A O no hydrogen 2.948 N/A ALA 54.A N ILE 50.A O no hydrogen 2.887 N/A ASN 55.A N ALA 52.A O no hydrogen 3.027 N/A ASN 55.A ND2 LEU 51.A O no hydrogen 2.933 N/A ILE 56.A N TYR 53.A O no hydrogen 3.420 N/A THR 58.A OG1 GLU 68.A OE1 no hydrogen 2.520 N/A GLU 59.A N LEU 63.A O no hydrogen 2.800 N/A TRP 62.A N HIS 60.A ND1 no hydrogen 3.124 N/A LEU 63.A N HIS 60.A O no hydrogen 2.972 N/A THR 64.A N ALA 87.A O no hydrogen 2.929 N/A THR 64.A OG1 HIS 60.A O no hydrogen 3.445 N/A THR 64.A OG1 LYS 61.A O no hydrogen 3.539 N/A THR 64.A OG1 ALA 87.A O no hydrogen 2.741 N/A ASN 65.A N THR 58.A OG1 no hydrogen 3.003 N/A ASN 65.A ND2 ALA 54.A O no hydrogen 2.868 N/A ASN 65.A ND2 ILE 56.A O no hydrogen 2.854 N/A THR 67.A N ASN 65.A OD1 no hydrogen 2.933 N/A THR 67.A OG1 ASN 65.A OD1 no hydrogen 2.721 N/A GLU 68.A N ASN 65.A O no hydrogen 3.262 N/A ALA 70.A N THR 67.A O no hydrogen 2.929 N/A ILE 71.A N THR 67.A O no hydrogen 3.107 N/A GLY 72.A N ILE 11.A O no hydrogen 2.821 N/A ARG 73.A N ALA 70.A O no hydrogen 2.987 N/A ARG 73.A NH2 GLU 77.A OE1 no hydrogen 3.068 N/A GLU 77.A N LEU 74.A O no hydrogen 3.019 N/A ILE 81.A N GLU 77.A O no hydrogen 2.947 N/A TRP 82.A N ILE 78.A O no hydrogen 2.995 N/A TRP 82.A NE1 GLY 279.A O no hydrogen 2.771 N/A ASP 83.A N ASN 79.A O no hydrogen 3.206 N/A ALA 84.A N ALA 80.A O no hydrogen 2.955 N/A ASP 86.A N ASP 83.A O no hydrogen 2.845 N/A ALA 87.A N ALA 84.A O no hydrogen 3.187 N/A THR 88.A N TYR 85.A O no hydrogen 3.178 N/A THR 88.A OG1 TYR 85.A O no hydrogen 3.262 N/A GLN 89.A NE2 ASP 86.A O no hydrogen 3.137 N/A TRP 90.A N TRP 62.A O no hydrogen 2.821 N/A GLN 91.A N THR 88.A O no hydrogen 3.119 N/A GLY 92.A N THR 88.A O no hydrogen 2.722 N/A ALA 98.A N LEU 95.A O no hydrogen 3.434 N/A LEU 99.A N GLY 96.A O no hydrogen 3.178 N/A GLY 101.A N PHE 97.A O no hydrogen 3.076 N/A ILE 102.A N ALA 98.A O no hydrogen 3.320 N/A ASP 103.A N LEU 99.A O no hydrogen 2.941 N/A LEU 105.A N ILE 102.A O no hydrogen 3.049 N/A LEU 105.A N ASP 103.A O no hydrogen 3.108 N/A TYR 106.A N ASP 103.A O no hydrogen 3.415 N/A TYR 106.A OH THR 282.A OG1 no hydrogen 2.748 N/A LEU 108.A N ALA 104.A O no hydrogen 2.910 N/A ALA 109.A N LEU 105.A O no hydrogen 2.717 N/A GLY 110.A N TYR 106.A O no hydrogen 3.157 N/A LYS 111.A N ASP 107.A O no hydrogen 3.020 N/A LYS 111.A NZ TYR 38.A O no hydrogen 2.732 N/A GLN 112.A N LEU 108.A O no hydrogen 2.943 N/A GLN 112.A NE2 ALA 9.A O no hydrogen 3.012 N/A GLN 112.A NE2 ASP 33.A OD2 no hydrogen 2.960 N/A LEU 113.A N ALA 109.A O no hydrogen 3.068 N/A VAL 115.A N GLY 110.A O no hydrogen 2.935 N/A ALA 117.A N GLY 358.A O no hydrogen 2.831 N/A TYR 118.A N HIS 312.A ND1 no hydrogen 2.929 N/A GLN 119.A N PRO 116.A O no hydrogen 3.090 N/A LEU 120.A N ALA 117.A O no hydrogen 2.910 N/A LEU 121.A N ALA 117.A O no hydrogen 3.182 N/A GLY 122.A N GLN 119.A O no hydrogen 3.084 N/A GLY 123.A N TYR 118.A O no hydrogen 2.909 N/A THR 124.A OG1 PHE 315.A O no hydrogen 2.707 N/A LYS 126.A N THR 124.A OG1 no hydrogen 2.927 N/A LYS 126.A NZ GLN 314.A O no hydrogen 2.780 N/A LYS 126.A NZ GLY 318.A O no hydrogen 2.844 N/A LYS 128.A NZ VAL 347.A O no hydrogen 2.912 N/A LYS 128.A NZ GLY 350.A O no hydrogen 3.455 N/A VAL 129.A N PHE 351.A O no hydrogen 3.037 N/A TYR 132.A N PHE 323.A O no hydrogen 2.931 N/A LEU 133.A N ALA 165.A O no hydrogen 2.907 N/A THR 134.A OG1 GLU 324.A OE2 no hydrogen 2.535 N/A LEU 135.A N LYS 167.A O no hydrogen 2.883 N/A ALA 147.A N SER 143.A O no hydrogen 2.789 N/A ILE 148.A N LEU 144.A O no hydrogen 3.035 N/A LYS 149.A N ASP 145.A O no hydrogen 2.984 N/A GLY 150.A N VAL 146.A O no hydrogen 3.060 N/A TYR 151.A N ALA 147.A O no hydrogen 3.076 N/A TYR 151.A OH LEU 135.A O no hydrogen 2.571 N/A ALA 152.A N ILE 148.A O no hydrogen 2.942 N/A LEU 155.A N TYR 151.A O no hydrogen 2.905 N/A GLU 156.A N ALA 152.A O no hydrogen 2.892 N/A LYS 157.A N PRO 153.A O no hydrogen 3.007 N/A LYS 157.A NZ GLU 329.A O no hydrogen 2.799 N/A ALA 158.A N LEU 154.A O no hydrogen 3.020 N/A LYS 159.A N LEU 155.A O no hydrogen 3.174 N/A LYS 159.A NZ ILE 191.A O no hydrogen 3.280 N/A LYS 159.A NZ LEU 192.A O no hydrogen 3.410 N/A ALA 160.A N GLU 156.A O no hydrogen 2.989 N/A HIS 161.A N LYS 157.A O no hydrogen 3.017 N/A HIS 161.A N ALA 158.A O no hydrogen 3.194 N/A HIS 161.A ND1 LYS 157.A O no hydrogen 2.889 N/A ASN 162.A N LYS 159.A O no hydrogen 3.029 N/A ILE 163.A N ALA 158.A O no hydrogen 2.898 N/A ARG 164.A NH2 ASP 348.A OD2 no hydrogen 3.513 N/A VAL 166.A N ASP 197.A O no hydrogen 3.028 N/A LYS 167.A N LEU 133.A O no hydrogen 2.935 N/A LYS 167.A NZ TYR 132.A OH no hydrogen 3.078 N/A LYS 167.A NZ GLU 226.A OE1 no hydrogen 2.689 N/A LYS 167.A NZ GLU 226.A OE2 no hydrogen 3.299 N/A LYS 167.A NZ GLU 324.A OE2 no hydrogen 3.313 N/A CYS 169.A N TYR 151.A OH no hydrogen 2.949 N/A VAL 170.A N ASP 199.A O no hydrogen 3.037 N/A ALA 174.A N PRO 171.A O no hydrogen 3.117 N/A SER 177.A N GLU 180.A OE1 no hydrogen 2.562 N/A GLU 180.A N SER 177.A OG no hydrogen 3.309 N/A VAL 181.A N SER 177.A O no hydrogen 3.052 N/A ALA 182.A N THR 178.A O no hydrogen 3.013 N/A TYR 183.A N LYS 179.A O no hydrogen 3.021 N/A TYR 184.A N GLU 180.A O no hydrogen 2.799 N/A TYR 184.A OH CYS 169.A O no hydrogen 2.895 N/A LEU 185.A N VAL 181.A O no hydrogen 2.970 N/A ARG 186.A N ALA 182.A O no hydrogen 2.994 N/A ARG 186.A NH1 ASP 219.A OD2 no hydrogen 2.720 N/A ARG 186.A NH2 SER 216.A O no hydrogen 2.837 N/A ARG 186.A NH2 ASP 219.A OD1 no hydrogen 2.755 N/A ARG 186.A NH2 ASP 219.A OD2 no hydrogen 3.285 N/A GLU 187.A N TYR 183.A O no hydrogen 2.922 N/A LEU 188.A N TYR 184.A O no hydrogen 2.998 N/A ARG 189.A N LEU 185.A O no hydrogen 2.973 N/A ARG 189.A NE LEU 220.A O no hydrogen 2.937 N/A ARG 189.A NH1 GLY 193.A O no hydrogen 2.793 N/A ARG 189.A NH1 THR 196.A O no hydrogen 2.743 N/A ARG 189.A NH2 LEU 220.A O no hydrogen 2.967 N/A ARG 189.A NH2 GLU 221.A O no hydrogen 3.098 N/A GLY 190.A N ARG 186.A O no hydrogen 2.952 N/A ILE 191.A N GLU 187.A O no hydrogen 3.027 N/A LEU 192.A N LEU 188.A O no hydrogen 2.876 N/A GLY 193.A N ARG 189.A O no hydrogen 2.824 N/A ASP 197.A N ARG 164.A O no hydrogen 3.138 N/A ASP 199.A N VAL 168.A O no hydrogen 2.923 N/A TYR 200.A N GLU 226.A O no hydrogen 2.843 N/A LEU 201.A N ASP 199.A OD1 no hydrogen 2.779 N/A TYR 202.A N ALA 227.A O no hydrogen 2.802 N/A TYR 202.A OH GLU 252.A OE1 no hydrogen 2.510 N/A ARG 203.A N TYR 200.A O no hydrogen 3.333 N/A ARG 203.A NH1 ILE 172.A O no hydrogen 3.401 N/A ARG 203.A NH1 ALA 174.A O no hydrogen 3.554 N/A ARG 203.A NH2 ALA 174.A O no hydrogen 2.714 N/A ARG 203.A NH2 TRP 176.A O no hydrogen 3.315 N/A TYR 208.A N ASP 206.A OD1 no hydrogen 3.265 N/A VAL 210.A N ASP 206.A O no hydrogen 3.255 N/A ALA 211.A N TRP 207.A O no hydrogen 2.841 N/A ARG 212.A N TYR 208.A O no hydrogen 3.074 N/A LEU 213.A N GLU 209.A O no hydrogen 3.161 N/A LEU 214.A N VAL 210.A O no hydrogen 2.829 N/A ASN 215.A N ALA 211.A O no hydrogen 2.778 N/A ASN 215.A ND2 ASN 243.A O no hydrogen 3.233 N/A SER 216.A N ARG 212.A O no hydrogen 3.058 N/A SER 216.A N LEU 213.A O no hydrogen 3.156 N/A SER 216.A OG ARG 212.A O no hydrogen 3.545 N/A SER 216.A OG LEU 213.A O no hydrogen 2.822 N/A ILE 217.A N LEU 214.A O no hydrogen 3.344 N/A LEU 220.A N ILE 217.A O no hydrogen 3.019 N/A GLU 221.A N GLU 218.A O no hydrogen 2.966 N/A TYR 223.A OH GLN 296.A OE1 no hydrogen 2.630 N/A ALA 225.A N ARG 247.A O no hydrogen 2.850 N/A GLU 226.A N VAL 198.A O no hydrogen 2.745 N/A ASP 233.A N GLN 230.A O no hydrogen 3.042 N/A LEU 234.A N ASP 232.A O no hydrogen 2.899 N/A SER 235.A OG ASP 233.A OD1 no hydrogen 3.499 N/A GLY 236.A N ASP 233.A OD1 no hydrogen 2.898 N/A HIS 237.A N ASP 233.A O no hydrogen 3.211 N/A HIS 237.A ND1 ASP 233.A O no hydrogen 2.811 N/A ALA 238.A N LEU 234.A O no hydrogen 3.159 N/A LYS 239.A N SER 235.A O no hydrogen 3.272 N/A LEU 240.A N GLY 236.A O no hydrogen 3.205 N/A VAL 241.A N HIS 237.A O no hydrogen 2.946 N/A GLU 242.A N ALA 238.A O no hydrogen 2.819 N/A ASN 243.A N LYS 239.A O no hydrogen 2.778 N/A ASN 243.A ND2 LYS 239.A O no hydrogen 2.786 N/A THR 244.A OG1 LEU 240.A O no hydrogen 2.694 N/A ARG 247.A NH1 TYR 223.A O no hydrogen 2.948 N/A ILE 248.A N HIS 269.A ND1 no hydrogen 2.945 N/A CYS 249.A N ALA 225.A O no hydrogen 3.183 N/A CYS 249.A SG ALA 225.A O no hydrogen 3.772 N/A GLY 250.A N LEU 270.A O no hydrogen 3.037 N/A SER 253.A OG ALA 251.A O no hydrogen 2.706 N/A THR 254.A N GLU 258.A OE1 no hydrogen 3.031 N/A THR 255.A N CYS 278.A O no hydrogen 2.995 N/A THR 255.A OG1 THR 254.A O no hydrogen 2.451 N/A ARG 256.A N GLU 283.A OE2 no hydrogen 2.670 N/A ARG 256.A NH1 GLU 283.A OE1 no hydrogen 3.154 N/A ARG 256.A NH1 GLU 283.A OE2 no hydrogen 2.957 N/A PHE 257.A N THR 255.A OG1 no hydrogen 3.220 N/A ALA 259.A N THR 255.A O no hydrogen 3.297 N/A GLU 260.A N ARG 256.A O no hydrogen 2.873 N/A GLU 261.A N PHE 257.A O no hydrogen 3.405 N/A TRP 262.A N GLU 258.A O no hydrogen 3.014 N/A ILE 263.A N ALA 259.A O no hydrogen 2.984 N/A THR 264.A N GLU 260.A O no hydrogen 2.976 N/A THR 264.A OG1 GLU 260.A O no hydrogen 3.296 N/A THR 264.A OG1 GLU 260.A OE2 no hydrogen 2.852 N/A LYS 265.A N GLU 261.A O no hydrogen 2.830 N/A GLY 266.A N GLU 261.A O no hydrogen 3.175 N/A LYS 267.A NZ GLU 242.A OE2 no hydrogen 2.685 N/A HIS 269.A N ILE 248.A O no hydrogen 2.898 N/A LEU 270.A N ILE 248.A O no hydrogen 3.393 N/A LEU 271.A N GLN 296.A O no hydrogen 2.875 N/A GLN 272.A N GLY 250.A O no hydrogen 2.928 N/A GLN 272.A NE2 GLU 226.A OE1 no hydrogen 2.885 N/A ASN 276.A N ASP 274.A OD1 no hydrogen 2.885 N/A ASN 276.A ND2 THR 306.A OG1 no hydrogen 3.165 N/A ARG 277.A N ASP 274.A O no hydrogen 3.091 N/A ARG 277.A NH1 ASP 44.A OD2 no hydrogen 2.841 N/A CYS 278.A N ASP 274.A O no hydrogen 2.928 N/A CYS 278.A SG ASP 274.A O no hydrogen 3.193 N/A GLY 279.A N SER 100.A OG no hydrogen 2.721 N/A THR 282.A N ASP 103.A OD2 no hydrogen 2.914 N/A THR 282.A OG1 ASP 103.A OD1 no hydrogen 2.566 N/A THR 282.A OG1 ASP 103.A OD2 no hydrogen 3.381 N/A THR 282.A OG1 TYR 106.A OH no hydrogen 2.748 N/A LEU 284.A N GLY 280.A O no hydrogen 2.954 N/A ARG 285.A N LEU 281.A O no hydrogen 2.882 N/A ARG 286.A N THR 282.A O no hydrogen 3.313 N/A ARG 286.A NE GLU 283.A OE1 no hydrogen 2.831 N/A ARG 286.A NH2 GLU 283.A OE1 no hydrogen 2.840 N/A ILE 287.A N GLU 283.A O no hydrogen 2.818 N/A THR 288.A N LEU 284.A O no hydrogen 2.849 N/A THR 288.A OG1 LEU 284.A O no hydrogen 2.673 N/A THR 288.A OG1 TYR 313.A OH no hydrogen 2.774 N/A GLU 289.A N ARG 285.A O no hydrogen 3.057 N/A THR 291.A N THR 288.A O no hydrogen 2.766 N/A THR 291.A OG1 THR 288.A O no hydrogen 3.125 N/A ALA 292.A N GLU 289.A O no hydrogen 3.266 N/A ASN 293.A N ALA 290.A O no hydrogen 2.835 N/A ASN 294.A N THR 291.A O no hydrogen 3.108 N/A VAL 295.A N ALA 290.A O no hydrogen 2.899 N/A GLN 296.A N HIS 269.A O no hydrogen 2.923 N/A VAL 297.A N ASN 319.A OD1 no hydrogen 2.942 N/A HIS 299.A N GLN 272.A O no hydrogen 2.995 N/A ASN 300.A N GLU 324.A OE1 no hydrogen 2.781 N/A ASN 300.A ND2 GLU 324.A O no hydrogen 3.060 N/A LYS 302.A NZ ASN 25.A O no hydrogen 3.076 N/A LYS 302.A NZ ASP 44.A OD1 no hydrogen 3.156 N/A THR 303.A N GLU 42.A OE2 no hydrogen 3.161 N/A THR 303.A OG1 GLU 42.A OE1 no hydrogen 2.802 N/A THR 303.A OG1 GLU 42.A OE2 no hydrogen 3.196 N/A ILE 305.A N THR 303.A OG1 no hydrogen 3.199 N/A THR 306.A N GLU 42.A OE2 no hydrogen 3.088 N/A THR 306.A OG1 GLU 42.A OE2 no hydrogen 2.480 N/A SER 307.A N THR 303.A O no hydrogen 3.268 N/A ALA 308.A N GLY 304.A O no hydrogen 3.093 N/A ALA 309.A N ILE 305.A O no hydrogen 3.297 N/A ALA 310.A N THR 306.A O no hydrogen 2.825 N/A ILE 311.A N SER 307.A O no hydrogen 3.240 N/A HIS 312.A N ALA 308.A O no hydrogen 3.218 N/A TYR 313.A N ALA 309.A O no hydrogen 2.732 N/A TYR 313.A OH THR 288.A OG1 no hydrogen 2.774 N/A GLN 314.A N ALA 310.A O no hydrogen 2.920 N/A GLN 314.A NE2 ALA 320.A O no hydrogen 2.838 N/A PHE 315.A N ILE 311.A O no hydrogen 3.129 N/A ALA 316.A N HIS 312.A O no hydrogen 3.181 N/A VAL 317.A N TYR 313.A O no hydrogen 2.695 N/A GLY 318.A N TYR 313.A O no hydrogen 2.853 N/A ASN 319.A ND2 THR 291.A OG1 no hydrogen 2.918 N/A ASN 319.A ND2 VAL 295.A O no hydrogen 2.939 N/A TYR 322.A OH ASP 197.A OD2 no hydrogen 2.674 N/A TYR 325.A N TYR 132.A O no hydrogen 3.148 N/A TYR 325.A OH GLU 343.A OE2 no hydrogen 2.954 N/A GLU 329.A N HIS 327.A ND1 no hydrogen 2.910 N/A PHE 330.A N HIS 327.A O no hydrogen 2.996 N/A CYS 331.A SG HIS 327.A O no hydrogen 3.060 N/A ARG 336.A NE VAL 326.A O no hydrogen 3.229 N/A ARG 336.A NH1 ARG 336.A O no hydrogen 2.624 N/A ARG 336.A NH1 GLU 343.A OE1 no hydrogen 2.856 N/A ARG 336.A NH1 GLU 343.A OE2 no hydrogen 3.428 N/A ARG 336.A NH2 VAL 326.A O no hydrogen 2.932 N/A ARG 336.A NH2 GLU 343.A OE2 no hydrogen 2.662 N/A LYS 337.A N GLY 333.A O no hydrogen 2.939 N/A TYR 338.A N GLU 334.A O no hydrogen 2.758 N/A LEU 339.A N LEU 335.A O no hydrogen 3.104 N/A THR 341.A N ASP 362.A O no hydrogen 2.905 N/A VAL 347.A N GLY 350.A O no hydrogen 2.802 N/A GLY 350.A N VAL 347.A O no hydrogen 2.879 N/A PHE 351.A N VAL 129.A O no hydrogen 2.773 N/A GLY 358.A N VAL 115.A O no hydrogen 2.913 N/A LEU 359.A N ASP 107.A OD1 no hydrogen 2.780 N/A GLY 360.A N PRO 357.A O no hydrogen 3.137 N/A ASP 362.A N THR 341.A O no hydrogen 2.864 N/A LEU 363.A N ASP 362.A OD1 no hydrogen 2.909 N/A ASN 364.A N LEU 339.A O no hydrogen 2.882 N/A ASN 364.A ND2 TYR 338.A O no hydrogen 3.113 N/A PHE 367.A N ASN 364.A OD1 no hydrogen 3.420 N/A LEU 368.A N ASN 364.A O no hydrogen 3.153 N/A ALA 369.A N GLN 365.A O no hydrogen 2.840 N/A SER 370.A N GLU 366.A O no hydrogen 3.109 N/A SER 370.A OG PHE 367.A O no hydrogen 2.523 N/A LEU 371.A N LEU 368.A O no hydrogen 2.600 N/A