Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4m5w_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ LEU 60.A O no hydrogen 2.576 N/A LYS 1.A NZ SER 63.A O no hydrogen 2.786 N/A LYS 2.A NZ ASP 276.A O no hydrogen 3.306 N/A LYS 2.A NZ VAL 278.A O no hydrogen 3.418 N/A TYR 6.A N THR 4.A OG1 no hydrogen 3.152 N/A LEU 9.A N ASP 275.A O no hydrogen 2.861 N/A LYS 10.A N VAL 67.A O no hydrogen 2.724 N/A GLY 13.A N ASN 11.A OD1 no hydrogen 3.371 N/A THR 15.A N GLY 13.A O no hydrogen 2.842 N/A CYS 16.A SG ALA 14.A O no hydrogen 3.617 N/A TYR 17.A OH PHE 84.A O no hydrogen 2.710 N/A MET 18.A N THR 15.A O no hydrogen 2.986 N/A ASN 19.A ND2 LYS 10.A O no hydrogen 3.204 N/A ASN 19.A ND2 ASP 275.A OD1 no hydrogen 2.937 N/A LEU 21.A N TYR 17.A O no hydrogen 2.961 N/A LEU 22.A N MET 18.A O no hydrogen 2.884 N/A GLN 23.A N ASN 19.A O no hydrogen 3.149 N/A GLN 23.A NE2 VAL 7.A O no hydrogen 3.555 N/A THR 24.A N SER 20.A O no hydrogen 3.128 N/A THR 24.A OG1 SER 20.A O no hydrogen 2.788 N/A LEU 25.A N LEU 21.A O no hydrogen 2.956 N/A PHE 26.A N LEU 22.A O no hydrogen 2.787 N/A PHE 27.A N GLN 23.A O no hydrogen 3.083 N/A THR 28.A N LEU 25.A O no hydrogen 3.072 N/A THR 28.A OG1 THR 24.A O no hydrogen 3.015 N/A ASN 29.A ND2 GLN 318.A O no hydrogen 2.948 N/A GLN 30.A N VAL 316.A O no hydrogen 3.075 N/A ARG 32.A N THR 28.A O no hydrogen 2.987 N/A ARG 32.A NE PHE 26.A O no hydrogen 2.931 N/A ARG 32.A NH1 GLN 61.A OE1 no hydrogen 2.873 N/A ARG 32.A NH2 PHE 26.A O no hydrogen 3.101 N/A LYS 33.A N ASN 29.A O no hydrogen 3.017 N/A ALA 34.A N GLN 30.A O no hydrogen 3.224 N/A VAL 35.A N LEU 31.A O no hydrogen 2.830 N/A TYR 36.A N ARG 32.A O no hydrogen 2.901 N/A TYR 36.A OH GLN 61.A OE1 no hydrogen 2.909 N/A MET 37.A N ALA 34.A O no hydrogen 3.001 N/A MET 38.A N VAL 35.A O no hydrogen 3.418 N/A THR 40.A N MET 38.A O no hydrogen 2.646 N/A THR 40.A OG1 MET 38.A O no hydrogen 3.335 N/A THR 40.A OG1 GLN 54.A OE1 no hydrogen 2.528 N/A ASP 43.A N THR 40.A O no hydrogen 3.119 N/A SER 46.A N ASP 44.A OD2 no hydrogen 3.155 N/A SER 46.A OG ASP 44.A OD2 no hydrogen 2.611 N/A LYS 47.A N ASP 44.A O no hydrogen 3.082 N/A SER 48.A N ASP 44.A O no hydrogen 2.851 N/A SER 48.A OG ASP 43.A OD2 no hydrogen 3.280 N/A LEU 51.A N SER 48.A OG no hydrogen 2.866 N/A ALA 52.A N SER 48.A O no hydrogen 3.156 N/A LEU 53.A N VAL 49.A O no hydrogen 3.009 N/A LEU 53.A N PRO 50.A O no hydrogen 3.266 N/A GLN 54.A N PRO 50.A O no hydrogen 3.055 N/A GLN 54.A NE2 VAL 35.A O no hydrogen 3.103 N/A GLN 54.A NE2 MET 38.A O no hydrogen 3.111 N/A ARG 55.A N LEU 51.A O no hydrogen 2.933 N/A ARG 55.A NE GLU 336.A OE1 no hydrogen 3.123 N/A ARG 55.A NH2 GLU 336.A OE1 no hydrogen 3.543 N/A VAL 56.A N ALA 52.A O no hydrogen 3.224 N/A PHE 57.A N LEU 53.A O no hydrogen 3.040 N/A TYR 58.A N GLN 54.A O no hydrogen 2.922 N/A GLU 59.A N ARG 55.A O no hydrogen 2.941 N/A LEU 60.A N VAL 56.A O no hydrogen 2.832 N/A GLN 61.A N PHE 57.A O no hydrogen 3.037 N/A GLN 61.A N TYR 58.A O no hydrogen 3.205 N/A GLN 61.A NE2 THR 321.A O no hydrogen 3.481 N/A HIS 62.A N TYR 58.A O no hydrogen 3.104 N/A HIS 62.A N GLU 59.A O no hydrogen 3.185 N/A SER 63.A N GLU 59.A O no hydrogen 2.709 N/A SER 63.A OG LYS 65.A O no hydrogen 2.766 N/A ASP 64.A N ASP 64.A OD1 no hydrogen 2.355 N/A LYS 65.A N SER 63.A OG no hydrogen 3.042 N/A VAL 67.A N GLY 8.A O no hydrogen 3.023 N/A THR 69.A N GLN 12.A OE1 no hydrogen 2.709 N/A THR 69.A OG1 GLN 12.A OE1 no hydrogen 2.885 N/A LYS 71.A NZ GLU 336.A OE1 no hydrogen 3.389 N/A LYS 71.A NZ GLU 340.A OE2 no hydrogen 3.016 N/A LEU 72.A N THR 69.A O no hydrogen 2.778 N/A THR 73.A N THR 69.A O no hydrogen 3.129 N/A THR 73.A OG1 LYS 70.A O no hydrogen 2.986 N/A LYS 74.A N LYS 70.A O no hydrogen 3.091 N/A SER 75.A N LYS 71.A O no hydrogen 3.185 N/A SER 75.A OG LYS 71.A O no hydrogen 2.894 N/A SER 75.A OG LEU 72.A O no hydrogen 2.485 N/A PHE 76.A N LEU 72.A O no hydrogen 3.408 N/A GLY 77.A N LYS 74.A O no hydrogen 2.922 N/A TRP 78.A N THR 73.A O no hydrogen 3.077 N/A THR 80.A OG1 ASP 82.A OD1 no hydrogen 3.316 N/A SER 83.A N THR 80.A O no hydrogen 3.280 N/A SER 83.A OG THR 80.A O no hydrogen 2.958 N/A GLN 86.A N ASP 82.A O no hydrogen 3.228 N/A HIS 87.A N PHE 84.A O no hydrogen 3.438 N/A HIS 87.A ND1 SER 83.A O no hydrogen 3.041 N/A ASP 88.A N GLU 91.A OE2 no hydrogen 3.051 N/A GLN 90.A N GLN 90.A OE1 no hydrogen 2.928 N/A GLU 91.A N ASP 88.A O no hydrogen 3.226 N/A LEU 92.A N ASP 88.A O no hydrogen 3.279 N/A CYS 93.A N VAL 89.A O no hydrogen 3.017 N/A ARG 94.A N GLN 90.A O no hydrogen 3.173 N/A ARG 94.A NH2 ASP 142.A OD2 no hydrogen 3.390 N/A VAL 95.A N GLU 91.A O no hydrogen 3.040 N/A LEU 96.A N LEU 92.A O no hydrogen 2.918 N/A LEU 97.A N CYS 93.A O no hydrogen 2.893 N/A ASP 98.A N ARG 94.A O no hydrogen 2.882 N/A ASN 99.A N VAL 95.A O no hydrogen 3.304 N/A ASN 99.A ND2 VAL 95.A O no hydrogen 2.966 N/A VAL 100.A N LEU 96.A O no hydrogen 3.051 N/A GLU 101.A N LEU 97.A O no hydrogen 2.774 N/A ASN 102.A N ASP 98.A O no hydrogen 3.040 N/A LYS 103.A N ASN 99.A O no hydrogen 3.009 N/A LYS 103.A NZ ASP 43.A OD1 no hydrogen 3.116 N/A LYS 103.A NZ ASP 43.A OD2 no hydrogen 3.314 N/A MET 104.A N VAL 100.A O no hydrogen 2.897 N/A LYS 105.A N GLU 101.A O no hydrogen 3.123 N/A GLY 106.A N GLU 110.A OE1 no hydrogen 2.973 N/A THR 107.A N MET 104.A O no hydrogen 2.983 N/A THR 107.A OG1 MET 104.A O no hydrogen 2.507 N/A VAL 109.A N THR 107.A OG1 no hydrogen 3.190 N/A GLU 110.A N THR 107.A O no hydrogen 2.809 N/A THR 112.A N VAL 109.A O no hydrogen 3.089 N/A THR 112.A OG1 VAL 109.A O no hydrogen 2.798 N/A LYS 115.A N GLY 111.A O no hydrogen 3.052 N/A LEU 116.A N THR 112.A O no hydrogen 3.079 N/A PHE 117.A N ILE 113.A O no hydrogen 2.932 N/A ARG 118.A N PRO 114.A O no hydrogen 2.982 N/A GLY 119.A N TYR 140.A O no hydrogen 2.864 N/A LYS 120.A N THR 190.A O no hydrogen 3.308 N/A LYS 120.A N THR 190.A OG1 no hydrogen 2.565 N/A MET 121.A N GLU 138.A O no hydrogen 2.751 N/A VAL 122.A N LYS 187.A O no hydrogen 2.790 N/A SER 123.A N ARG 136.A O no hydrogen 2.930 N/A SER 123.A OG GLU 138.A OE2 no hydrogen 3.524 N/A TYR 124.A N GLY 185.A O no hydrogen 3.112 N/A ILE 125.A N SER 134.A O no hydrogen 3.265 N/A GLN 126.A N GLU 183.A O no hydrogen 2.577 N/A GLN 126.A NE2 CYS 127.A O no hydrogen 3.408 N/A CYS 127.A N TYR 132.A O no hydrogen 3.269 N/A CYS 127.A SG TYR 132.A O no hydrogen 3.977 N/A LYS 128.A N GLU 181.A O no hydrogen 2.834 N/A LYS 128.A NZ GLN 165.A OE1 no hydrogen 3.336 N/A ARG 133.A NE GLN 126.A OE1 no hydrogen 2.611 N/A ARG 133.A NH1 ASP 135.A OD1 no hydrogen 3.246 N/A ARG 133.A NH2 GLN 126.A OE1 no hydrogen 3.481 N/A SER 134.A N ILE 125.A O no hydrogen 3.132 N/A ARG 136.A N SER 123.A O no hydrogen 2.978 N/A ARG 137.A NE ASP 139.A OD1 no hydrogen 2.877 N/A ARG 137.A NH2 ASP 139.A OD1 no hydrogen 3.435 N/A ARG 137.A NH2 ASP 139.A OD2 no hydrogen 2.707 N/A GLU 138.A N MET 121.A O no hydrogen 2.756 N/A TYR 140.A N GLY 119.A O no hydrogen 3.117 N/A TYR 140.A OH THR 190.A O no hydrogen 2.691 N/A ILE 143.A N HIS 196.A O no hydrogen 2.939 N/A GLN 144.A NE2 ASP 142.A OD2 no hydrogen 2.846 N/A GLN 144.A NE2 GLN 198.A OE1 no hydrogen 2.965 N/A LEU 145.A N GLN 198.A O no hydrogen 2.854 N/A LYS 148.A NZ ASP 216.A OD2 no hydrogen 2.916 N/A LYS 150.A N ILE 147.A O no hydrogen 3.187 N/A LYS 151.A N GLU 155.A OE1 no hydrogen 2.768 N/A ILE 153.A N GLU 219.A O no hydrogen 3.124 N/A GLU 155.A N ASN 152.A OD1 no hydrogen 3.105 N/A SER 156.A N ASN 152.A O no hydrogen 3.154 N/A SER 156.A OG SER 146.A O no hydrogen 2.689 N/A SER 156.A OG ASN 152.A O no hydrogen 3.384 N/A PHE 157.A N ILE 153.A O no hydrogen 2.941 N/A VAL 158.A N PHE 154.A O no hydrogen 2.801 N/A ASP 159.A N GLU 155.A O no hydrogen 2.805 N/A TYR 160.A N SER 156.A O no hydrogen 2.839 N/A VAL 161.A N PHE 157.A O no hydrogen 3.127 N/A VAL 161.A N VAL 158.A O no hydrogen 3.238 N/A ALA 162.A N ASP 159.A O no hydrogen 3.353 N/A GLU 164.A N LYS 184.A O no hydrogen 2.773 N/A LEU 166.A N ALA 182.A O no hydrogen 2.651 N/A ASN 170.A N ASP 167.A O no hydrogen 2.567 N/A TYR 172.A N GLN 180.A O no hydrogen 3.138 N/A ALA 174.A N GLY 178.A O no hydrogen 2.923 N/A GLY 175.A N ASP 173.A OD1 no hydrogen 3.327 N/A HIS 177.A N ALA 174.A O no hydrogen 3.190 N/A GLY 178.A N GLY 175.A O no hydrogen 2.653 N/A GLN 180.A N TYR 172.A O no hydrogen 2.911 N/A GLN 180.A NE2 HIS 177.A O no hydrogen 2.522 N/A ALA 182.A N LEU 166.A O no hydrogen 2.817 N/A GLU 183.A N GLN 126.A O no hydrogen 2.543 N/A LYS 184.A N GLU 164.A O no hydrogen 2.958 N/A GLY 185.A N TYR 124.A O no hydrogen 3.224 N/A LYS 187.A N VAL 122.A O no hydrogen 2.958 N/A LYS 187.A NZ GLN 231.A OE1 no hydrogen 3.104 N/A LEU 189.A N LYS 120.A O no hydrogen 2.921 N/A THR 190.A N LYS 120.A O no hydrogen 3.160 N/A VAL 194.A N LEU 116.A O no hydrogen 2.926 N/A LEU 195.A N TYR 307.A O no hydrogen 2.826 N/A LEU 197.A N LEU 305.A O no hydrogen 2.761 N/A GLN 198.A N ILE 143.A O no hydrogen 2.963 N/A LEU 199.A N TYR 303.A O no hydrogen 2.620 N/A MET 200.A N LEU 145.A O no hydrogen 2.962 N/A ARG 201.A N LEU 199.A O no hydrogen 2.760 N/A ARG 201.A NE ALA 302.A O no hydrogen 2.944 N/A ARG 201.A NH1 ILE 214.A O no hydrogen 2.898 N/A ARG 201.A NH1 ASP 216.A O no hydrogen 2.690 N/A ARG 201.A NH2 ASP 216.A O no hydrogen 2.890 N/A MET 203.A N ILE 212.A O no hydrogen 2.921 N/A GLN 207.A N ASP 205.A O no hydrogen 2.344 N/A THR 208.A N PRO 206.A O no hydrogen 2.554 N/A THR 208.A OG1 THR 208.A O no hydrogen 2.624 N/A ILE 212.A N MET 203.A O no hydrogen 3.143 N/A LYS 213.A NZ ASN 215.A OD1 no hydrogen 2.839 N/A LYS 213.A NZ HIS 249.A ND1 no hydrogen 2.924 N/A LYS 213.A NZ HIS 249.A O no hydrogen 3.277 N/A LYS 213.A NZ GLY 251.A O no hydrogen 3.456 N/A LYS 213.A NZ ASN 301.A OD1 no hydrogen 2.761 N/A ILE 214.A N ARG 201.A O no hydrogen 2.656 N/A ASN 215.A ND2 GLY 251.A O no hydrogen 3.580 N/A ARG 217.A NE GLU 219.A OE2 no hydrogen 3.280 N/A ARG 217.A NH2 GLU 219.A OE2 no hydrogen 3.274 N/A PHE 218.A N TYR 291.A O no hydrogen 2.697 N/A GLU 219.A N LYS 151.A O no hydrogen 3.141 N/A LEU 224.A N TYR 241.A O no hydrogen 2.724 N/A LEU 226.A N ALA 239.A O no hydrogen 2.835 N/A PHE 229.A N LEU 226.A O no hydrogen 3.063 N/A LEU 230.A N ASP 227.A O no hydrogen 2.904 N/A GLN 231.A N PHE 188.A O no hydrogen 3.000 N/A LYS 236.A N ASP 234.A OD1 no hydrogen 2.989 N/A ASP 237.A N ASP 234.A O no hydrogen 3.319 N/A ALA 239.A N ASP 227.A OD1 no hydrogen 2.811 N/A ASN 240.A N PRO 238.A O no hydrogen 2.815 N/A TYR 241.A N LEU 224.A O no hydrogen 2.807 N/A TYR 241.A OH PRO 192.A O no hydrogen 2.462 N/A ILE 242.A N ILE 308.A O no hydrogen 2.918 N/A LEU 243.A N GLU 222.A O no hydrogen 2.904 N/A HIS 244.A N VAL 306.A O no hydrogen 2.860 N/A ALA 245.A N VAL 306.A O no hydrogen 3.281 N/A VAL 246.A N TYR 261.A O no hydrogen 2.878 N/A LEU 247.A N MET 304.A O no hydrogen 2.797 N/A VAL 248.A N VAL 259.A O no hydrogen 2.668 N/A HIS 249.A N ASN 301.A O no hydrogen 2.928 N/A SER 250.A N HIS 257.A O no hydrogen 2.809 N/A SER 250.A OG THR 300.A OG1 no hydrogen 2.900 N/A GLY 251.A N CYS 299.A O no hydrogen 2.921 N/A ASN 253.A ND2 ASN 211.A O no hydrogen 2.690 N/A HIS 257.A N SER 250.A O no hydrogen 2.849 N/A HIS 257.A NE2 ASP 274.A OD2 no hydrogen 3.145 N/A VAL 259.A N VAL 248.A O no hydrogen 2.983 N/A VAL 260.A N PHE 273.A O no hydrogen 3.124 N/A TYR 261.A N VAL 246.A O no hydrogen 2.910 N/A TYR 261.A OH GLU 285.A OE2 no hydrogen 3.066 N/A LEU 262.A N CYS 271.A O no hydrogen 2.936 N/A ASN 263.A N HIS 244.A O no hydrogen 3.283 N/A GLY 266.A N ASN 263.A O no hydrogen 2.777 N/A ASP 267.A N ASP 267.A OD1 no hydrogen 2.457 N/A LYS 269.A N ASP 267.A OD1 no hydrogen 3.492 N/A CYS 271.A N LEU 262.A O no hydrogen 2.724 N/A LYS 272.A N SER 279.A O no hydrogen 2.652 N/A PHE 273.A N VAL 260.A O no hydrogen 2.719 N/A ASP 274.A N VAL 277.A O no hydrogen 2.964 N/A VAL 277.A N ASP 274.A O no hydrogen 3.005 N/A SER 279.A N LYS 272.A O no hydrogen 3.155 N/A CYS 281.A N TRP 270.A O no hydrogen 3.079 N/A CYS 281.A SG TRP 270.A O no hydrogen 3.697 N/A CYS 281.A SG THR 282.A O no hydrogen 3.685 N/A LYS 283.A NZ GLU 222.A OE2 no hydrogen 3.121 N/A GLU 284.A N GLU 284.A OE1 no hydrogen 2.717 N/A GLU 285.A N THR 282.A O no hydrogen 3.190 N/A GLU 285.A N THR 282.A OG1 no hydrogen 3.342 N/A ALA 286.A N THR 282.A O no hydrogen 3.430 N/A ILE 287.A N GLU 284.A O no hydrogen 3.218 N/A GLU 288.A N GLU 288.A OE1 no hydrogen 2.685 N/A HIS 289.A N GLU 284.A O no hydrogen 2.983 N/A ASN 290.A N ILE 287.A O no hydrogen 2.818 N/A ASN 290.A ND2 ALA 286.A O no hydrogen 2.899 N/A TYR 291.A N GLU 288.A O no hydrogen 2.929 N/A TYR 291.A OH PHE 220.A O no hydrogen 2.540 N/A GLY 293.A N ASN 215.A O no hydrogen 2.975 N/A HIS 294.A N ASP 295.A OD1 no hydrogen 3.253 N/A THR 300.A OG1 SER 250.A OG no hydrogen 2.900 N/A ASN 301.A N HIS 249.A O no hydrogen 3.125 N/A ASN 301.A ND2 ASN 215.A OD1 no hydrogen 3.144 N/A ALA 302.A N ASN 290.A O no hydrogen 3.262 N/A TYR 303.A N LEU 247.A O no hydrogen 2.917 N/A LEU 305.A N LEU 197.A O no hydrogen 2.706 N/A VAL 306.A N ALA 245.A O no hydrogen 3.071 N/A TYR 307.A N LEU 195.A O no hydrogen 2.958 N/A TYR 307.A OH PRO 221.A O no hydrogen 2.545 N/A ILE 308.A N ILE 242.A O no hydrogen 2.950 N/A ARG 309.A N PRO 193.A O no hydrogen 2.780 N/A ARG 309.A NE ASP 237.A OD1 no hydrogen 3.401 N/A ARG 309.A NH1 TYR 241.A OH no hydrogen 3.267 N/A ARG 309.A NH2 ASP 237.A O no hydrogen 3.273 N/A GLU 310.A N ASN 240.A O no hydrogen 2.779 N/A SER 311.A OG ASP 237.A OD1 no hydrogen 2.970 N/A LYS 312.A N ARG 309.A O no hydrogen 2.781 N/A LEU 313.A N GLU 310.A O no hydrogen 3.320 N/A VAL 316.A N LYS 312.A O no hydrogen 2.946 N/A LEU 317.A N LEU 313.A O no hydrogen 2.976 N/A GLN 318.A N GLU 315.A O no hydrogen 2.969 N/A THR 321.A N ASP 324.A OD2 no hydrogen 2.607 N/A THR 321.A OG1 ASP 324.A OD2 no hydrogen 3.413 N/A ASP 324.A N THR 321.A O no hydrogen 3.053 N/A ILE 325.A N ASP 322.A O no hydrogen 3.117 N/A VAL 330.A N PRO 326.A O no hydrogen 3.035 N/A GLU 331.A N GLN 327.A O no hydrogen 2.815 N/A ARG 332.A N GLN 328.A O no hydrogen 3.126 N/A ARG 332.A N LEU 329.A O no hydrogen 3.219 N/A ARG 332.A NH2 ASP 43.A O no hydrogen 3.026 N/A LEU 333.A N LEU 329.A O no hydrogen 3.287 N/A GLN 334.A N VAL 330.A O no hydrogen 3.070 N/A GLU 335.A N GLU 331.A O no hydrogen 3.007 N/A GLU 336.A N ARG 332.A O no hydrogen 3.132 N/A LYS 337.A N LEU 333.A O no hydrogen 3.156 N/A LYS 337.A NZ GLU 59.A OE2 no hydrogen 3.182 N/A ARG 338.A N GLN 334.A O no hydrogen 3.060 N/A ARG 338.A NH1 GLU 335.A OE1 no hydrogen 3.022 N/A ILE 339.A N GLU 335.A O no hydrogen 2.847 N/A GLU 340.A N GLU 336.A O no hydrogen 2.852 N/A ALA 341.A N LYS 337.A O no hydrogen 2.818 N/A GLN 342.A N ILE 339.A O no hydrogen 2.971 N/A LYS 343.A N GLU 340.A O no hydrogen 2.793 N/A