Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4cxp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 1.A N HIS 6.A NE2 no hydrogen 3.472 N/A TRP 1.A N ASP 118.A OD1 no hydrogen 2.957 N/A TRP 1.A N ASP 152.A OD1 no hydrogen 3.137 N/A TRP 1.A NE1 GLY 117.A O no hydrogen 2.824 N/A GLY 2.A N ASP 152.A O no hydrogen 2.936 N/A LYS 3.A NZ GLU 7.A OE1.A no hydrogen 3.476 N/A LYS 3.A NZ GLU 7.A OE1.B no hydrogen 3.538 N/A LYS 3.A NZ GLU 7.A OE2.A no hydrogen 2.883 N/A GLU 4.A N GLU 4.A OE1 no hydrogen 2.853 N/A HIS 6.A N GLY 2.A O no hydrogen 3.267 N/A GLU 7.A N LYS 3.A O no hydrogen 2.967 N/A ILE 8.A N GLU 4.A O no hydrogen 2.966 N/A ILE 9.A N GLY 5.A O no hydrogen 3.045 N/A CYS 10.A N HIS 6.A O no hydrogen 2.927 N/A CYS 10.A SG.B HIS 6.A O no hydrogen 3.506 N/A LYS 11.A N GLU 7.A O no hydrogen 2.847 N/A LYS 11.A NZ.A GLU 169.A OE2 no hydrogen 2.710 N/A LYS 11.A NZ.B GLU 7.A OE2.B no hydrogen 2.684 N/A LYS 11.A NZ.B GLU 169.A OE2 no hydrogen 2.695 N/A ILE 12.A N ILE 8.A O no hydrogen 2.992 N/A ALA 13.A N ILE 9.A O no hydrogen 2.917 N/A GLN 14.A N CYS 10.A O no hydrogen 2.919 N/A GLN 14.A NE2 GLY 35.A O no hydrogen 2.929 N/A THR 15.A N LYS 11.A O no hydrogen 3.427 N/A THR 15.A OG1 LYS 11.A O no hydrogen 3.443 N/A THR 15.A OG1 ILE 12.A O no hydrogen 3.024 N/A ARG 16.A N ALA 13.A O no hydrogen 2.948 N/A ARG 16.A NH2 GLU 191.A OE2 no hydrogen 2.841 N/A LEU 17.A N GLN 14.A O no hydrogen 3.431 N/A ASP 18.A N ASN 252.A OD1 no hydrogen 2.870 N/A THR 20.A OG1 ASP 18.A OD1 no hydrogen 3.170 N/A ALA 21.A N ASP 18.A OD1 no hydrogen 2.996 N/A ALA 22.A N ASP 18.A O no hydrogen 2.804 N/A LYS 23.A N GLU 19.A O no hydrogen 2.964 N/A LYS 23.A NZ GLU 27.A OE2 no hydrogen 2.745 N/A ALA 24.A N THR 20.A O no hydrogen 3.078 N/A VAL 25.A N ALA 21.A O no hydrogen 2.912 N/A LYS 26.A N ALA 22.A O no hydrogen 3.023 N/A LYS 26.A NZ GLY 35.A O no hydrogen 2.843 N/A GLU 27.A N LYS 23.A O no hydrogen 3.008 N/A LEU 28.A N ALA 24.A O no hydrogen 2.884 N/A LEU 29.A N VAL 25.A O no hydrogen 3.013 N/A ALA 33.A N PRO 30.A O no hydrogen 2.987 N/A GLU 34.A N GLU 31.A O no hydrogen 2.973 N/A ASP 36.A N ALA 33.A O no hydrogen 3.030 N/A LEU 37.A N GLN 14.A OE1 no hydrogen 2.923 N/A SER 38.A N ASP 36.A OD1 no hydrogen 3.010 N/A SER 38.A OG ASP 36.A OD1 no hydrogen 2.665 N/A SER 38.A OG ASP 36.A OD2 no hydrogen 3.358 N/A SER 39.A N ASP 36.A O no hydrogen 3.076 N/A SER 39.A OG ALA 33.A O no hydrogen 3.564 N/A SER 39.A OG ASP 36.A O no hydrogen 2.759 N/A LEU 40.A N LEU 37.A O no hydrogen 2.999 N/A CYS 41.A N SER 38.A O no hydrogen 3.490 N/A CYS 41.A SG.A LEU 37.A O no hydrogen 3.341 N/A CYS 41.A SG.A SER 113.A OG.B no hydrogen 3.512 N/A CYS 41.A SG.B SER 38.A O no hydrogen 3.019 N/A TRP 43.A N LEU 40.A O no hydrogen 3.080 N/A ARG 46.A N TRP 43.A O no hydrogen 2.842 N/A VAL 47.A N ALA 44.A O no hydrogen 3.269 N/A LYS 48.A NZ ASP 45.A OD1 no hydrogen 3.296 N/A ARG 50.A NH2 ARG 46.A O no hydrogen 2.856 N/A TYR 51.A N VAL 47.A O no hydrogen 2.841 N/A TYR 51.A OH GLU 107.A OE2 no hydrogen 2.614 N/A HIS 52.A ND1.A LYS 48.A O no hydrogen 3.144 N/A SER 54.A N TYR 51.A O no hydrogen 2.825 N/A SER 54.A OG VAL 47.A O no hydrogen 3.420 N/A SER 54.A OG TYR 51.A O no hydrogen 2.675 N/A SER 55.A N.A HIS 52.A O no hydrogen 3.132 N/A SER 55.A N.B HIS 52.A O no hydrogen 3.145 N/A SER 55.A OG.A LYS 48.A O no hydrogen 2.799 N/A SER 55.A OG.B HIS 52.A O no hydrogen 2.930 N/A LEU 57.A N SER 54.A O no hydrogen 3.037 N/A HIS 58.A N SER 55.A O.A no hydrogen 3.433 N/A HIS 58.A N SER 55.A O.B no hydrogen 3.442 N/A HIS 58.A ND1 ASP 118.A OD2 no hydrogen 3.184 N/A ILE 60.A N HIS 124.A O no hydrogen 2.810 N/A THR 62.A N SER 126.A O no hydrogen 2.855 N/A THR 62.A OG1 PRO 63.A O no hydrogen 2.931 N/A ALA 65.A N PRO 63.A O no hydrogen 2.823 N/A TYR 68.A OH ASP 200.A OD1 no hydrogen 2.706 N/A GLN 69.A N ASP 73.A OD2 no hydrogen 3.012 N/A ARG 72.A NE ASP 73.A OD1 no hydrogen 2.833 N/A ARG 72.A NE ASP 73.A OD2 no hydrogen 3.396 N/A ARG 72.A NH1 SER 67.A OG no hydrogen 3.265 N/A ARG 72.A NH2 SER 67.A OG no hydrogen 3.025 N/A ARG 72.A NH2 ASP 73.A OD1 no hydrogen 3.562 N/A ARG 72.A NH2 ASP 73.A OD2 no hydrogen 2.863 N/A ASP 73.A N GLN 69.A O no hydrogen 2.836 N/A CYS 74.A N TYR 70.A O no hydrogen 2.821 N/A LYS 75.A N ASP 73.A O no hydrogen 2.931 N/A LYS 75.A NZ.A ARG 72.A O no hydrogen 2.951 N/A ASP 76.A N GLU 80.A O no hydrogen 3.264 N/A SER 78.A OG ASP 76.A OD1 no hydrogen 2.672 N/A SER 78.A OG ASP 76.A OD2 no hydrogen 3.536 N/A GLY 79.A N ASP 76.A O no hydrogen 2.899 N/A GLU 80.A N ASP 76.A OD1 no hydrogen 3.066 N/A GLY 82.A N CYS 74.A O no hydrogen 2.849 N/A ARG 83.A N GLU 80.A O no hydrogen 3.404 N/A ARG 83.A NH2 TRP 53.A O no hydrogen 2.958 N/A CYS 84.A N GLY 82.A O no hydrogen 3.011 N/A VAL 85.A N TYR 59.A O no hydrogen 3.043 N/A ALA 88.A N CYS 84.A O no hydrogen 2.881 N/A ILE 89.A N VAL 85.A O no hydrogen 2.991 N/A TYR 90.A N ALA 86.A O no hydrogen 3.065 N/A TYR 90.A OH ASP 200.A OD2 no hydrogen 2.847 N/A ASN 91.A N GLY 87.A O no hydrogen 2.966 N/A TYR 92.A N ALA 88.A O no hydrogen 2.924 N/A THR 93.A N ILE 89.A O no hydrogen 2.990 N/A THR 93.A OG1.A ILE 89.A O no hydrogen 2.688 N/A THR 93.A OG1.A TYR 90.A O no hydrogen 3.105 N/A THR 94.A N TYR 90.A O no hydrogen 3.066 N/A THR 94.A OG1 TYR 90.A O no hydrogen 2.971 N/A GLN 95.A N ASN 91.A O no hydrogen 3.054 N/A GLN 95.A NE2 ASN 91.A OD1 no hydrogen 3.046 N/A LEU 96.A N TYR 92.A O no hydrogen 3.069 N/A LEU 97.A N THR 93.A O no hydrogen 3.185 N/A LEU 97.A N THR 94.A O no hydrogen 3.192 N/A SER 98.A N GLN 95.A O no hydrogen 3.061 N/A SER 98.A OG GLN 95.A O no hydrogen 2.699 N/A TYR 99.A N LEU 96.A O no hydrogen 2.999 N/A TYR 99.A OH GLU 27.A OE1 no hydrogen 2.547 N/A LYS 100.A NZ GLU 27.A OE1 no hydrogen 3.449 N/A LYS 100.A NZ GLU 27.A OE2 no hydrogen 3.554 N/A THR 106.A OG1 LEU 28.A O no hydrogen 2.687 N/A GLU 107.A N ASN 104.A OD1 no hydrogen 3.016 N/A ALA 108.A N ASN 104.A O no hydrogen 3.054 N/A LEU 109.A N LEU 105.A O no hydrogen 2.973 N/A LEU 110.A N THR 106.A O no hydrogen 3.021 N/A PHE 111.A N GLU 107.A O no hydrogen 2.803 N/A VAL 112.A N ALA 108.A O no hydrogen 2.879 N/A SER 113.A N LEU 109.A O no hydrogen 2.986 N/A SER 113.A OG.A LEU 109.A O no hydrogen 2.834 N/A SER 113.A OG.B LEU 109.A O no hydrogen 3.181 N/A SER 113.A OG.B LEU 110.A O no hydrogen 2.951 N/A HIS 114.A N LEU 110.A O no hydrogen 3.109 N/A HIS 114.A ND1 CYS 41.A O no hydrogen 2.783 N/A PHE 115.A N PHE 111.A O no hydrogen 2.818 N/A MET 116.A N VAL 112.A O no hydrogen 2.858 N/A GLY 117.A N SER 113.A O no hydrogen 3.385 N/A ASP 118.A N HIS 114.A O no hydrogen 2.882 N/A ILE 119.A N PHE 115.A O no hydrogen 2.913 N/A HIS 120.A N GLY 117.A O no hydrogen 2.948 N/A HIS 120.A ND1 MET 116.A O no hydrogen 2.841 N/A GLN 121.A N ASP 118.A O no hydrogen 3.015 N/A GLN 121.A NE2 ASP 152.A OD1 no hydrogen 2.855 N/A LEU 123.A N GLN 121.A OE1 no hydrogen 2.834 N/A HIS 124.A N GLN 121.A O no hydrogen 2.857 N/A HIS 124.A ND1 HIS 58.A O no hydrogen 2.744 N/A VAL 125.A N PRO 122.A O no hydrogen 3.056 N/A SER 126.A N ILE 60.A O no hydrogen 3.239 N/A SER 126.A OG LEU 123.A O no hydrogen 2.977 N/A SER 126.A OG TYR 215.A OH no hydrogen 3.275 N/A TYR 127.A N TYR 215.A OH no hydrogen 3.003 N/A ALA 128.A N THR 62.A O no hydrogen 3.026 N/A SER 129.A OG ASP 64.A OD1 no hydrogen 2.644 N/A SER 129.A OG ASP 64.A OD2 no hydrogen 3.548 N/A ASP 130.A N TYR 127.A O no hydrogen 3.382 N/A LYS 131.A N ALA 128.A O no hydrogen 3.157 N/A GLY 132.A N TYR 127.A O no hydrogen 3.001 N/A GLY 133.A N ASP 130.A OD1 no hydrogen 2.885 N/A ASN 134.A N LYS 131.A O no hydrogen 3.058 N/A ASN 134.A ND2 LYS 131.A O no hydrogen 2.833 N/A THR 135.A N ASP 130.A O no hydrogen 3.130 N/A THR 135.A OG1 ASP 130.A O no hydrogen 3.229 N/A ILE 136.A N GLY 133.A O no hydrogen 3.158 N/A GLU 137.A N GLU 220.A OE1 no hydrogen 2.913 N/A VAL 138.A N ALA 145.A O no hydrogen 2.896 N/A HIS 139.A N ASP 222.A O no hydrogen 2.885 N/A TRP 140.A N ARG 143.A O no hydrogen 2.787 N/A TRP 140.A NE1 THR 158.A OG1 no hydrogen 2.881 N/A TYR 141.A N LEU 224.A O no hydrogen 2.823 N/A TYR 141.A OH ASP 226.A OD1 no hydrogen 2.618 N/A ARG 143.A N TRP 140.A O no hydrogen 3.069 N/A ALA 145.A N VAL 138.A O no hydrogen 3.037 N/A LEU 147.A N ILE 136.A O no hydrogen 2.943 N/A HIS 148.A N GLY 133.A O no hydrogen 3.332 N/A HIS 148.A ND1 GLY 132.A O no hydrogen 2.775 N/A HIS 149.A N ASN 146.A OD1 no hydrogen 2.854 N/A ILE 150.A N ASN 146.A O no hydrogen 3.062 N/A TRP 151.A N LEU 147.A O no hydrogen 3.220 N/A TRP 151.A NE1 TYR 228.A OH no hydrogen 2.878 N/A ASP 152.A N HIS 148.A O no hydrogen 2.840 N/A SER 153.A N HIS 149.A O no hydrogen 2.821 N/A ASN 154.A N HIS 149.A O no hydrogen 3.204 N/A ASN 154.A ND2 HIS 149.A ND1 no hydrogen 2.812 N/A ILE 155.A N ILE 150.A O no hydrogen 3.031 N/A GLU 157.A N SER 153.A O no hydrogen 2.879 N/A THR 158.A N ASN 154.A O no hydrogen 2.910 N/A THR 158.A OG1 ASN 154.A O no hydrogen 2.913 N/A ALA 159.A N ILE 155.A O no hydrogen 2.964 N/A GLU 160.A N ILE 156.A O no hydrogen 2.837 N/A ALA 161.A N GLU 157.A O no hydrogen 3.085 N/A ASP 162.A N THR 158.A O no hydrogen 2.856 N/A LEU 163.A N ALA 159.A O no hydrogen 2.874 N/A TYR 164.A N ALA 159.A O no hydrogen 3.041 N/A TYR 164.A OH TYR 237.A OH no hydrogen 2.701 N/A SER 166.A N.A GLU 160.A O no hydrogen 2.854 N/A SER 166.A N.B GLU 160.A O no hydrogen 2.840 N/A SER 166.A OG.A ASN 165.A O no hydrogen 2.517 N/A ALA 167.A N TYR 164.A O no hydrogen 2.906 N/A GLY 170.A N ALA 167.A O no hydrogen 3.267 N/A ASP 173.A N GLU 169.A O no hydrogen 2.913 N/A ALA 174.A N GLY 170.A O no hydrogen 3.073 N/A LEU 175.A N MET 171.A O no hydrogen 2.913 N/A LYS 176.A N VAL 172.A O no hydrogen 2.911 N/A LYS 177.A N ASP 173.A O no hydrogen 2.995 N/A ASN 178.A N ALA 174.A O no hydrogen 3.044 N/A ILE 179.A N LEU 175.A O no hydrogen 2.873 N/A THR 180.A N LYS 176.A O no hydrogen 3.251 N/A THR 180.A OG1 LYS 176.A O no hydrogen 3.270 N/A THR 181.A N LYS 177.A O no hydrogen 2.884 N/A THR 181.A OG1 LYS 177.A O no hydrogen 2.981 N/A GLU 182.A N ASN 178.A O no hydrogen 2.910 N/A TRP 183.A N ASN 178.A O no hydrogen 2.913 N/A GLN 186.A N GLN 186.A OE1.B no hydrogen 2.779 N/A VAL 187.A N TRP 183.A O no hydrogen 2.833 N/A LYS 188.A N ALA 184.A O no hydrogen 3.270 N/A TRP 190.A N GLN 186.A O no hydrogen 2.832 N/A GLU 191.A N VAL 187.A O no hydrogen 3.019 N/A THR 192.A N ARG 189.A O no hydrogen 3.308 N/A THR 192.A OG1 LYS 188.A O no hydrogen 2.886 N/A CYS 193.A SG.A LYS 195.A O no hydrogen 3.755 N/A CYS 193.A SG.B LYS 195.A O no hydrogen 3.003 N/A LYS 195.A NZ TYR 90.A OH no hydrogen 3.495 N/A CYS 198.A SG.B TYR 202.A OH no hydrogen 3.241 N/A ILE 201.A N CYS 198.A O no hydrogen 3.140 N/A ALA 203.A N PRO 199.A O no hydrogen 2.970 N/A SER 204.A N ASP 200.A O no hydrogen 3.030 N/A SER 204.A OG.A ASP 200.A O no hydrogen 3.211 N/A GLU 205.A N ILE 201.A O no hydrogen 3.178 N/A GLY 206.A N TYR 202.A O no hydrogen 3.020 N/A ILE 207.A N ALA 203.A O no hydrogen 3.021 N/A GLN 208.A N SER 204.A O no hydrogen 3.383 N/A GLN 208.A NE2 ASP 212.A OD1 no hydrogen 3.540 N/A GLN 208.A NE2 ASP 212.A OD2 no hydrogen 2.838 N/A ALA 209.A N GLU 205.A O no hydrogen 2.971 N/A ALA 210.A N GLY 206.A O no hydrogen 2.801 N/A CYS 211.A N.A ILE 207.A O no hydrogen 2.994 N/A CYS 211.A N.B ILE 207.A O no hydrogen 3.026 N/A CYS 211.A SG.A ALA 65.A O no hydrogen 3.730 N/A CYS 211.A SG.A TYR 127.A OH no hydrogen 3.679 N/A CYS 211.A SG.A ILE 207.A O no hydrogen 3.735 N/A CYS 211.A SG.B ALA 65.A O no hydrogen 3.549 N/A CYS 211.A SG.B TYR 127.A OH no hydrogen 3.187 N/A CYS 211.A SG.B ILE 207.A O no hydrogen 3.510 N/A ASP 212.A N GLN 208.A O no hydrogen 2.934 N/A TRP 213.A N ALA 209.A O no hydrogen 2.830 N/A ALA 214.A N ALA 209.A O no hydrogen 3.147 N/A TYR 215.A N ALA 210.A O no hydrogen 2.815 N/A TYR 215.A OH ASP 130.A OD1 no hydrogen 2.665 N/A VAL 218.A N TYR 215.A O no hydrogen 3.047 N/A THR 219.A N ASP 222.A OD2 no hydrogen 2.844 N/A GLY 221.A N GLU 137.A O no hydrogen 2.851 N/A ASP 222.A N THR 219.A O no hydrogen 2.946 N/A LEU 224.A N HIS 139.A O no hydrogen 2.824 N/A TYR 228.A OH TRP 213.A O no hydrogen 3.428 N/A TYR 228.A OH ALA 214.A O no hydrogen 2.735 N/A PHE 229.A N GLU 225.A O no hydrogen 2.891 N/A TYR 230.A N ASP 226.A O no hydrogen 2.874 N/A SER 231.A N GLU 227.A O no hydrogen 3.222 N/A SER 231.A OG GLU 227.A O no hydrogen 2.787 N/A SER 231.A OG TYR 228.A O no hydrogen 3.243 N/A ARG 232.A N TYR 228.A O no hydrogen 2.945 N/A ARG 232.A NE TRP 213.A O no hydrogen 2.838 N/A ARG 232.A NH1 SER 231.A OG no hydrogen 2.850 N/A ARG 232.A NH2 TRP 213.A O no hydrogen 3.264 N/A LEU 233.A N PHE 229.A O no hydrogen 2.958 N/A ILE 235.A N ARG 232.A O no hydrogen 3.119 N/A VAL 236.A N ARG 232.A O no hydrogen 3.159 N/A TYR 237.A N LEU 233.A O no hydrogen 2.896 N/A GLN 238.A N PRO 234.A O no hydrogen 2.916 N/A GLN 238.A NE2 GLN 242.A OE1 no hydrogen 2.979 N/A ARG 239.A N ILE 235.A O no hydrogen 2.948 N/A ARG 239.A NE HIS 120.A O no hydrogen 2.845 N/A ARG 239.A NH1 GLU 205.A OE1 no hydrogen 2.828 N/A ARG 239.A NH1 GLN 242.A OE1 no hydrogen 2.882 N/A ARG 239.A NH2 TYR 202.A O no hydrogen 2.977 N/A LEU 240.A N VAL 236.A O no hydrogen 2.959 N/A ALA 241.A N TYR 237.A O no hydrogen 2.939 N/A GLN 242.A N GLN 238.A O no hydrogen 2.828 N/A GLY 243.A N ARG 239.A O no hydrogen 2.893 N/A GLY 244.A N LEU 240.A O no hydrogen 3.003 N/A VAL 245.A N ALA 241.A O no hydrogen 2.934 N/A ARG 246.A N GLN 242.A O no hydrogen 2.838 N/A ARG 246.A NE TRP 190.A O no hydrogen 3.082 N/A ARG 246.A NH1 HIS 120.A NE2 no hydrogen 2.974 N/A ARG 246.A NH1 GLU 205.A OE1 no hydrogen 2.819 N/A ARG 246.A NH2 GLU 205.A OE1 no hydrogen 3.528 N/A ARG 246.A NH2 GLU 205.A OE2 no hydrogen 2.890 N/A LEU 247.A N GLY 243.A O no hydrogen 2.870 N/A ALA 248.A N GLY 244.A O no hydrogen 3.126 N/A ALA 249.A N VAL 245.A O no hydrogen 2.952 N/A THR 250.A N ARG 246.A O no hydrogen 2.927 N/A THR 250.A OG1 ARG 246.A O no hydrogen 2.781 N/A LEU 251.A N LEU 247.A O no hydrogen 2.948 N/A ASN 252.A N ALA 248.A O no hydrogen 2.827 N/A ASN 252.A ND2 ARG 16.A O no hydrogen 3.214 N/A ARG 253.A N ALA 249.A O no hydrogen 3.039 N/A ARG 253.A NE THR 196.A O no hydrogen 2.859 N/A ARG 253.A NH1 GLU 191.A O no hydrogen 2.792 N/A ARG 253.A NH2 THR 196.A O no hydrogen 3.175 N/A ILE 254.A N THR 250.A O no hydrogen 2.900 N/A PHE 255.A N LEU 251.A O no hydrogen 2.959 N/A