Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3jrp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N GLY 286.A O no hydrogen 2.805 N/A GLU 8.A N HIS 6.A O no hydrogen 2.852 N/A LEU 9.A N ASN 7.A O no hydrogen 3.109 N/A HIS 11.A N CYS 25.A O no hydrogen 2.853 N/A ASP 12.A N CYS 25.A O no hydrogen 3.363 N/A VAL 14.A N ALA 23.A O no hydrogen 2.869 N/A ASP 16.A N ARG 21.A O no hydrogen 2.923 N/A GLY 19.A N ASP 16.A OD1 no hydrogen 2.960 N/A LYS 20.A N ASP 16.A OD1 no hydrogen 2.882 N/A LYS 20.A NZ GLU 37.A OE1 no hydrogen 3.548 N/A ARG 21.A N ASP 16.A OD1 no hydrogen 2.891 N/A LEU 22.A N PHE 34.A O no hydrogen 2.821 N/A ALA 23.A N VAL 14.A O no hydrogen 3.102 N/A THR 24.A N LYS 32.A O no hydrogen 3.093 N/A CYS 25.A N ASP 12.A O no hydrogen 2.928 N/A CYS 25.A SG ASP 12.A O no hydrogen 3.763 N/A CYS 25.A SG VAL 54.A O no hydrogen 3.589 N/A SER 26.A N THR 30.A O no hydrogen 3.368 N/A SER 27.A N LEU 9.A O no hydrogen 3.458 N/A SER 27.A OG LEU 9.A O no hydrogen 3.509 N/A LYS 29.A N SER 26.A O no hydrogen 3.390 N/A THR 30.A N ASP 28.A OD1 no hydrogen 3.052 N/A THR 30.A OG1 ASP 28.A OD1 no hydrogen 2.606 N/A ILE 31.A N LEU 47.A O no hydrogen 3.065 N/A LYS 32.A N THR 24.A O no hydrogen 2.921 N/A ILE 33.A N ASP 45.A O no hydrogen 2.823 N/A PHE 34.A N LEU 22.A O no hydrogen 2.650 N/A GLU 35.A N LYS 42.A O no hydrogen 2.507 N/A VAL 36.A N LYS 20.A O no hydrogen 2.800 N/A GLU 37.A N THR 40.A O no hydrogen 3.510 N/A LYS 42.A N GLU 35.A O no hydrogen 3.016 N/A ILE 44.A N ILE 33.A O no hydrogen 2.915 N/A LEU 47.A N ILE 31.A O no hydrogen 2.609 N/A HIS 50.A ND1 ASP 74.A OD2 no hydrogen 3.212 N/A HIS 50.A NE2 SER 70.A OG no hydrogen 2.833 N/A GLU 51.A N ASP 74.A OD2 no hydrogen 2.920 N/A VAL 54.A N SER 26.A O no hydrogen 3.115 N/A TRP 55.A N CYS 71.A O no hydrogen 3.019 N/A TRP 55.A NE1 SER 99.A OG no hydrogen 3.130 N/A VAL 57.A N ASP 12.A OD2 no hydrogen 2.796 N/A ASP 58.A N ALA 69.A O no hydrogen 2.844 N/A TRP 59.A NE1 VAL 14.A O no hydrogen 2.900 N/A ALA 60.A N ILE 67.A O no hydrogen 2.905 N/A PHE 64.A N HIS 61.A O no hydrogen 2.867 N/A GLY 65.A N PRO 62.A O no hydrogen 2.769 N/A LEU 68.A N TRP 80.A O no hydrogen 2.827 N/A ALA 69.A N ASP 58.A O no hydrogen 2.939 N/A SER 70.A N LEU 78.A O no hydrogen 3.033 N/A SER 70.A OG HIS 50.A NE2 no hydrogen 2.833 N/A SER 70.A OG LEU 78.A O no hydrogen 3.465 N/A CYS 71.A N ARG 56.A O no hydrogen 3.290 N/A CYS 71.A SG VAL 100.A O no hydrogen 3.381 N/A SER 72.A N LYS 76.A O no hydrogen 3.138 N/A SER 72.A OG GLY 52.A O no hydrogen 2.993 N/A SER 72.A OG PRO 53.A O no hydrogen 2.786 N/A TYR 73.A N PRO 53.A O no hydrogen 2.870 N/A TYR 73.A OH GLU 298.A OE1 no hydrogen 2.627 N/A TYR 73.A OH GLU 298.A OE2 no hydrogen 3.175 N/A ASP 74.A N SER 72.A OG no hydrogen 3.175 N/A GLY 75.A N SER 72.A O no hydrogen 3.084 N/A LYS 76.A N ASP 74.A OD1 no hydrogen 2.917 N/A LYS 76.A NZ GLU 51.A OE1 no hydrogen 3.539 N/A VAL 77.A N HIS 93.A O no hydrogen 3.024 N/A LEU 78.A N SER 70.A O no hydrogen 2.805 N/A ILE 79.A N ALA 91.A O no hydrogen 3.241 N/A TRP 80.A N LEU 68.A O no hydrogen 2.798 N/A TRP 80.A NE1 SER 70.A OG no hydrogen 2.986 N/A LYS 81.A N SER 88.A O no hydrogen 2.931 N/A GLU 82.A N THR 66.A O no hydrogen 3.249 N/A GLU 83.A N ARG 86.A O no hydrogen 2.821 N/A ARG 86.A N GLU 83.A O no hydrogen 2.716 N/A ARG 86.A NH2 TRP 87.A O no hydrogen 2.967 N/A SER 88.A N LYS 81.A O no hydrogen 2.901 N/A ILE 90.A N ILE 79.A O no hydrogen 2.908 N/A HIS 93.A N VAL 77.A O no hydrogen 2.784 N/A HIS 93.A NE2 SER 124.A OG no hydrogen 2.916 N/A HIS 96.A NE2 SER 124.A OG no hydrogen 2.700 N/A SER 97.A N ASP 120.A OD2 no hydrogen 3.278 N/A SER 99.A OG ASN 101.A OD1 no hydrogen 2.684 N/A VAL 100.A N SER 72.A O no hydrogen 3.020 N/A ASN 101.A N ALA 117.A O no hydrogen 2.759 N/A ASN 101.A ND2 SER 119.A OG no hydrogen 2.838 N/A ASN 101.A ND2 VAL 146.A O no hydrogen 2.691 N/A GLN 104.A N LEU 115.A O no hydrogen 3.019 N/A TRP 105.A N ASP 58.A OD2 no hydrogen 2.827 N/A TRP 105.A NE1 ASP 58.A O no hydrogen 2.928 N/A ALA 106.A N LEU 113.A O no hydrogen 2.707 N/A GLU 109.A N GLU 109.A OE2 no hydrogen 2.688 N/A TYR 110.A N PRO 107.A O no hydrogen 2.877 N/A GLY 111.A N HIS 108.A O no hydrogen 2.887 N/A LEU 113.A N GLY 111.A O no hydrogen 2.707 N/A LEU 114.A N VAL 126.A O no hydrogen 3.102 N/A LEU 115.A N GLN 104.A O no hydrogen 2.798 N/A VAL 116.A N SER 124.A O no hydrogen 2.914 N/A ALA 117.A N SER 102.A O no hydrogen 3.087 N/A SER 118.A N LYS 122.A O no hydrogen 3.295 N/A SER 118.A OG ALA 98.A O no hydrogen 3.011 N/A SER 118.A OG SER 99.A O no hydrogen 3.150 N/A SER 119.A N SER 99.A O no hydrogen 2.733 N/A ASP 120.A N SER 118.A OG no hydrogen 3.094 N/A GLY 121.A N SER 118.A O no hydrogen 3.266 N/A LYS 122.A N ASP 120.A OD1 no hydrogen 2.893 N/A VAL 123.A N ILE 139.A O no hydrogen 2.738 N/A SER 124.A N VAL 116.A O no hydrogen 3.077 N/A SER 124.A OG HIS 93.A NE2 no hydrogen 2.916 N/A SER 124.A OG HIS 96.A NE2 no hydrogen 2.700 N/A VAL 125.A N ILE 137.A O no hydrogen 2.667 N/A VAL 126.A N LEU 114.A O no hydrogen 3.200 N/A GLY 132.A N LYS 129.A O no hydrogen 2.743 N/A THR 134.A OG1 GLU 127.A O no hydrogen 3.452 N/A ILE 137.A N VAL 125.A O no hydrogen 2.623 N/A ILE 139.A N VAL 123.A O no hydrogen 2.809 N/A ALA 141.A N GLY 121.A O no hydrogen 3.039 N/A HIS 142.A N GLY 121.A O no hydrogen 3.059 N/A HIS 142.A ND1 ASP 167.A OD1 no hydrogen 2.688 N/A HIS 142.A ND1 ASP 167.A OD2 no hydrogen 3.169 N/A HIS 142.A NE2 THR 163.A OG1 no hydrogen 2.940 N/A GLY 145.A N HIS 142.A O no hydrogen 2.541 N/A VAL 146.A N SER 118.A O no hydrogen 2.746 N/A ASN 147.A N GLY 164.A O no hydrogen 2.833 N/A ASN 147.A ND2 VAL 195.A O no hydrogen 3.187 N/A SER 148.A N GLY 164.A O no hydrogen 3.312 N/A SER 148.A OG ASP 197.A OD1 no hydrogen 2.779 N/A ALA 149.A N SER 102.A OG no hydrogen 3.248 N/A SER 150.A N VAL 162.A O no hydrogen 2.795 N/A SER 150.A OG GLN 104.A OE1 no hydrogen 3.398 N/A SER 150.A OG TRP 151.A O no hydrogen 3.452 N/A TRP 151.A N GLN 104.A OE1 no hydrogen 3.014 N/A TRP 151.A NE1 GLN 104.A O no hydrogen 2.999 N/A ALA 152.A N LYS 160.A O no hydrogen 2.948 N/A ARG 159.A N LYS 156.A O no hydrogen 3.030 N/A ARG 159.A NH1 GLU 127.A OE2 no hydrogen 3.196 N/A LYS 160.A NZ GLU 227.A OE2 no hydrogen 3.078 N/A PHE 161.A N TRP 173.A O no hydrogen 2.974 N/A VAL 162.A N SER 150.A O no hydrogen 2.799 N/A THR 163.A N LYS 171.A O no hydrogen 2.739 N/A THR 163.A OG1 HIS 142.A NE2 no hydrogen 2.940 N/A THR 163.A OG1 LYS 171.A O no hydrogen 3.381 N/A GLY 164.A N SER 148.A O no hydrogen 2.886 N/A GLY 165.A N LEU 169.A O no hydrogen 3.102 N/A ALA 166.A N GLY 145.A O no hydrogen 2.908 N/A LEU 169.A N ASP 167.A OD1 no hydrogen 3.450 N/A VAL 170.A N LEU 188.A O no hydrogen 3.036 N/A LYS 171.A N THR 163.A O no hydrogen 2.984 N/A LYS 171.A NZ ALA 141.A O no hydrogen 3.103 N/A ILE 172.A N SER 186.A O no hydrogen 2.985 N/A TRP 173.A N PHE 161.A O no hydrogen 2.838 N/A TRP 173.A NE1 THR 163.A OG1 no hydrogen 3.064 N/A LYS 174.A N VAL 183.A O no hydrogen 3.091 N/A TYR 175.A N ARG 159.A O no hydrogen 2.917 N/A ASN 176.A N THR 181.A O no hydrogen 2.798 N/A SER 177.A OG GLU 157.A OE2 no hydrogen 3.271 N/A ALA 179.A N ASN 176.A OD1 no hydrogen 2.742 N/A GLN 180.A N SER 177.A O no hydrogen 2.979 N/A THR 181.A N ASN 176.A O no hydrogen 3.310 N/A VAL 183.A N LYS 174.A O no hydrogen 2.734 N/A GLU 185.A N ILE 172.A O no hydrogen 2.912 N/A SER 186.A OG GLU 185.A O no hydrogen 2.610 N/A LEU 188.A N VAL 170.A O no hydrogen 2.764 N/A HIS 191.A NE2 SER 212.A OG no hydrogen 2.642 N/A SER 192.A N ASP 216.A OD2 no hydrogen 2.903 N/A SER 192.A OG ASP 216.A OD2 no hydrogen 3.417 N/A TRP 194.A N ASP 193.A OD1 no hydrogen 2.594 N/A VAL 195.A N GLY 165.A O no hydrogen 3.198 N/A ARG 196.A N VAL 213.A O no hydrogen 2.634 N/A ARG 196.A NE GLN 215.A OE1 no hydrogen 2.886 N/A ARG 196.A NH1 ARG 299.A O no hydrogen 3.097 N/A ARG 196.A NH2 GLN 215.A OE1 no hydrogen 3.371 N/A ARG 196.A NH2 ARG 299.A O no hydrogen 2.587 N/A ASP 197.A N VAL 213.A O no hydrogen 3.326 N/A ALA 199.A N ALA 211.A O no hydrogen 2.878 N/A SER 201.A N TYR 209.A O no hydrogen 2.896 N/A THR 203.A N SER 201.A OG no hydrogen 3.169 N/A ARG 207.A NH2 GLU 274.A OE2 no hydrogen 3.199 N/A SER 208.A N GLN 224.A O no hydrogen 2.887 N/A TYR 209.A OH GLU 271.A OE1 no hydrogen 3.143 N/A LEU 210.A N TRP 222.A O no hydrogen 2.907 N/A ALA 211.A N ALA 199.A O no hydrogen 2.918 N/A SER 212.A N ILE 220.A O no hydrogen 2.810 N/A SER 212.A OG HIS 191.A NE2 no hydrogen 2.642 N/A SER 212.A OG ILE 220.A O no hydrogen 3.283 N/A VAL 213.A N ASP 197.A O no hydrogen 2.899 N/A SER 214.A N THR 218.A O no hydrogen 3.348 N/A SER 214.A OG ASP 193.A O no hydrogen 3.007 N/A SER 214.A OG TRP 194.A O no hydrogen 2.902 N/A GLN 215.A N TRP 194.A O no hydrogen 2.685 N/A GLN 215.A NE2 ARG 300.A O no hydrogen 3.449 N/A ASP 216.A N SER 214.A OG no hydrogen 3.009 N/A ARG 217.A N SER 214.A O no hydrogen 3.399 N/A ARG 217.A NH1 PHE 241.A O no hydrogen 2.670 N/A THR 218.A N ASP 216.A OD1 no hydrogen 3.080 N/A THR 218.A OG1 ASP 216.A OD1 no hydrogen 2.724 N/A THR 218.A OG1 ASP 216.A OD2 no hydrogen 3.487 N/A CYS 219.A SG SER 212.A O no hydrogen 3.674 N/A ILE 220.A N SER 212.A O no hydrogen 2.902 N/A ILE 221.A N THR 234.A O no hydrogen 2.754 N/A TRP 222.A N LEU 210.A O no hydrogen 2.581 N/A TRP 222.A NE1 SER 212.A OG no hydrogen 2.689 N/A THR 223.A N LYS 232.A O no hydrogen 3.053 N/A GLN 224.A N SER 208.A O no hydrogen 3.339 N/A GLY 229.A N ASN 226.A O no hydrogen 2.872 N/A LYS 232.A N THR 223.A O no hydrogen 2.749 N/A THR 234.A N ILE 221.A O no hydrogen 3.072 N/A LEU 236.A N CYS 219.A O no hydrogen 2.948 N/A LYS 240.A NZ ASP 216.A O no hydrogen 3.427 N/A PHE 241.A N ARG 217.A O no hydrogen 2.784 N/A TRP 246.A N SER 260.A O no hydrogen 2.682 N/A ARG 247.A N SER 260.A O no hydrogen 3.333 N/A ARG 247.A NH1 ASP 12.A OD1 no hydrogen 3.190 N/A ARG 247.A NH2 ASP 12.A OD1 no hydrogen 3.222 N/A ALA 248.A N ASP 197.A OD2 no hydrogen 2.953 N/A SER 249.A N ALA 258.A O no hydrogen 3.075 N/A TRP 250.A NE1 ALA 199.A O no hydrogen 2.942 N/A SER 251.A N VAL 256.A O no hydrogen 2.939 N/A SER 251.A OG SER 253.A O no hydrogen 2.765 N/A SER 251.A OG VAL 256.A O no hydrogen 3.410 N/A SER 251.A OG THR 334.A OG1 no hydrogen 3.385 N/A VAL 256.A N SER 251.A OG no hydrogen 2.925 N/A LEU 257.A N TRP 269.A O no hydrogen 2.791 N/A ALA 258.A N SER 249.A O no hydrogen 2.866 N/A LEU 259.A N THR 267.A O no hydrogen 2.888 N/A SER 260.A N ARG 247.A O no hydrogen 3.018 N/A GLY 262.A N VAL 244.A O no hydrogen 3.000 N/A LYS 265.A NZ GLU 282.A OE1 no hydrogen 3.326 N/A LYS 265.A NZ GLU 282.A OE2 no hydrogen 3.420 N/A VAL 266.A N VAL 283.A O no hydrogen 3.203 N/A LEU 268.A N GLY 281.A O no hydrogen 2.816 N/A TRP 269.A N LEU 257.A O no hydrogen 2.759 N/A TRP 269.A NE1 THR 267.A OG1 no hydrogen 2.912 N/A LYS 270.A N GLU 278.A O no hydrogen 3.181 N/A GLY 275.A N GLU 271.A OE2 no hydrogen 3.078 N/A LYS 276.A N LEU 273.A O no hydrogen 3.036 N/A GLU 278.A N LYS 270.A O no hydrogen 3.275 N/A ALA 280.A N LEU 268.A O no hydrogen 2.851 N/A VAL 283.A N VAL 266.A O no hydrogen 2.923 N/A GLY 286.A N ALA 5.A O no hydrogen 3.274 N/A CYS 288.A N ALA 3.A O no hydrogen 3.056 N/A ILE 295.A N ASN 291.A O no hydrogen 3.420 N/A MET 296.A N ALA 292.A O no hydrogen 2.985 N/A LYS 297.A N LYS 293.A O no hydrogen 3.100 N/A LYS 297.A N LEU 294.A O no hydrogen 2.770 N/A GLU 298.A N LEU 294.A O no hydrogen 3.190 N/A ARG 299.A N ILE 295.A O no hydrogen 3.005 N/A ARG 300.A N LYS 297.A O no hydrogen 3.023 N/A ARG 300.A NH1 ASP 193.A OD1 no hydrogen 3.101 N/A ARG 300.A NH2 ASP 193.A OD2 no hydrogen 3.279 N/A PHE 301.A N MET 296.A O no hydrogen 2.826 N/A THR 302.A OG1 SER 304.A OG no hydrogen 3.140 N/A SER 304.A N THR 302.A OG1 no hydrogen 3.330 N/A SER 304.A OG ASP 243.A OD1 no hydrogen 2.748 N/A SER 304.A OG THR 302.A OG1 no hydrogen 3.140 N/A TYR 305.A OH HIS 11.A O no hydrogen 2.652 N/A THR 306.A OG1 SER 304.A O no hydrogen 3.230 N/A LYS 309.A N LEU 317.A O no hydrogen 2.973 N/A LYS 309.A NZ ASP 12.A OD1 no hydrogen 3.171 N/A LYS 309.A NZ ASP 12.A OD2 no hydrogen 3.427 N/A LYS 309.A NZ ALA 13.A O no hydrogen 2.894 N/A PHE 310.A N SER 249.A OG no hydrogen 2.899 N/A SER 311.A N MET 315.A O no hydrogen 2.798 N/A SER 311.A OG LEU 15.A O no hydrogen 3.536 N/A SER 311.A OG THR 312.A O no hydrogen 3.333 N/A THR 312.A OG1 TYR 17.A O no hydrogen 2.505 N/A SER 314.A N SER 311.A O no hydrogen 3.193 N/A SER 314.A OG LEU 332.A O no hydrogen 2.485 N/A MET 315.A N SER 311.A O no hydrogen 3.188 N/A LEU 316.A N LYS 330.A O no hydrogen 2.964 N/A LEU 317.A N LYS 309.A O no hydrogen 2.939 N/A THR 318.A N SER 328.A O no hydrogen 2.939 N/A LYS 319.A N PHE 307.A O no hydrogen 3.402 N/A LYS 319.A NZ ILE 10.A O no hydrogen 3.024 N/A ASP 320.A N GLY 326.A O no hydrogen 2.836 N/A VAL 322.A N ASP 320.A OD2 no hydrogen 3.423 N/A GLY 323.A N ASP 320.A O no hydrogen 3.074 N/A LYS 324.A NZ THR 40.A OG1 no hydrogen 3.203 N/A SER 325.A OG HIS 41.A ND1 no hydrogen 2.901 N/A GLY 326.A N GLY 323.A O no hydrogen 3.289 N/A SER 328.A N THR 318.A O no hydrogen 2.968 N/A LYS 330.A N LEU 316.A O no hydrogen 3.128 N/A LEU 332.A N SER 314.A O no hydrogen 2.701 N/A THR 334.A OG1 SER 251.A OG no hydrogen 3.385 N/A THR 334.A OG1 SER 253.A O no hydrogen 2.665 N/A