Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5jrq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 4.A N PHE 1.A O no hydrogen 2.765 N/A GLU 5.A N ASP 2.A O no hydrogen 3.277 N/A ILE 6.A N TYR 73.A O no hydrogen 2.653 N/A GLN 10.A N PRO 7.A O no hydrogen 2.908 N/A THR 12.A N LYS 29.A O no hydrogen 2.911 N/A GLY 14.A N LYS 27.A O no hydrogen 2.593 N/A ILE 17.A N VAL 25.A O no hydrogen 2.500 N/A GLY 18.A N VAL 25.A O no hydrogen 3.206 N/A SER 21.A N ASP 148.A OD1 no hydrogen 2.971 N/A THR 24.A N MET 38.A O no hydrogen 2.839 N/A VAL 25.A N GLY 18.A O no hydrogen 2.684 N/A TYR 26.A N VAL 36.A O no hydrogen 3.000 N/A LYS 27.A N GLN 15.A O no hydrogen 2.852 N/A LYS 27.A NZ ASP 33.A OD2 no hydrogen 3.389 N/A GLY 28.A N VAL 34.A O no hydrogen 2.865 N/A LYS 29.A N THR 12.A O no hydrogen 2.879 N/A TRP 30.A N GLY 32.A O no hydrogen 2.661 N/A VAL 34.A N GLY 28.A O no hydrogen 2.947 N/A ALA 35.A N THR 83.A O no hydrogen 2.864 N/A VAL 36.A N TYR 26.A O no hydrogen 3.009 N/A LYS 37.A N ILE 81.A O no hydrogen 2.719 N/A LYS 37.A NZ SER 21.A O no hydrogen 2.721 N/A LYS 37.A NZ ASP 148.A OD2 no hydrogen 2.282 N/A MET 38.A N THR 24.A O no hydrogen 2.726 N/A LEU 39.A N LEU 79.A O no hydrogen 2.886 N/A VAL 41.A N LEU 39.A O no hydrogen 2.744 N/A THR 42.A OG1 PRO 77.A O no hydrogen 2.607 N/A THR 45.A N GLN 48.A OE1 no hydrogen 2.899 N/A GLN 47.A N GLN 47.A OE1 no hydrogen 2.706 N/A GLN 48.A N THR 45.A OG1 no hydrogen 3.191 N/A LEU 49.A N THR 45.A O no hydrogen 2.906 N/A GLN 50.A N PRO 46.A O no hydrogen 2.930 N/A GLN 50.A NE2 ASN 54.A OD1 no hydrogen 2.820 N/A ALA 51.A N GLN 47.A O no hydrogen 2.999 N/A PHE 52.A N GLN 48.A O no hydrogen 2.813 N/A LYS 53.A N LEU 49.A O no hydrogen 2.710 N/A ASN 54.A N GLN 50.A O no hydrogen 2.932 N/A GLU 55.A N ALA 51.A O no hydrogen 3.144 N/A VAL 56.A N PHE 52.A O no hydrogen 2.984 N/A GLY 57.A N LYS 53.A O no hydrogen 2.844 N/A VAL 58.A N ASN 54.A O no hydrogen 3.113 N/A LEU 59.A N GLU 55.A O no hydrogen 2.975 N/A ARG 60.A N VAL 56.A O no hydrogen 2.850 N/A LYS 61.A N VAL 58.A O no hydrogen 3.005 N/A THR 62.A N LEU 59.A O no hydrogen 3.264 N/A THR 62.A OG1 LEU 59.A O no hydrogen 2.643 N/A ARG 63.A N TYR 120.A OH no hydrogen 2.639 N/A ASN 66.A N HIS 64.A ND1 no hydrogen 2.937 N/A ASN 66.A ND2 GLN 113.A OE1 no hydrogen 2.873 N/A ASN 66.A ND2 VAL 144.A O no hydrogen 3.001 N/A ILE 67.A N HIS 64.A O no hydrogen 3.080 N/A LEU 68.A N ILE 146.A O no hydrogen 2.945 N/A LEU 69.A N GLN 84.A OE1 no hydrogen 2.640 N/A MET 71.A N VAL 82.A O no hydrogen 2.802 N/A GLY 72.A N VAL 82.A O no hydrogen 3.307 N/A TYR 73.A N TRP 4.A O no hydrogen 2.961 N/A SER 74.A N ALA 80.A O no hydrogen 3.096 N/A SER 74.A OG ILE 6.A O no hydrogen 2.502 N/A THR 75.A OG1 GLU 5.A OE2 no hydrogen 3.542 N/A GLN 78.A NE2 LEU 39.A O no hydrogen 2.409 N/A LEU 79.A N VAL 41.A O no hydrogen 2.989 N/A ALA 80.A N SER 74.A O no hydrogen 2.933 N/A ILE 81.A N LYS 37.A O no hydrogen 2.894 N/A VAL 82.A N GLY 72.A O no hydrogen 2.846 N/A THR 83.A N ALA 35.A O no hydrogen 2.973 N/A THR 83.A OG1 GLN 84.A O no hydrogen 3.222 N/A GLN 84.A N LEU 69.A O no hydrogen 3.221 N/A GLY 88.A N LEU 138.A O no hydrogen 2.770 N/A SER 89.A N CYS 86.A O no hydrogen 3.306 N/A SER 89.A OG GLY 88.A O no hydrogen 2.743 N/A LEU 91.A N ILE 136.A O no hydrogen 2.691 N/A TYR 92.A N SER 133.A O no hydrogen 2.973 N/A HIS 93.A N SER 90.A OG no hydrogen 3.006 N/A HIS 94.A N SER 90.A O no hydrogen 2.943 N/A HIS 94.A ND1 THR 100.A OG1 no hydrogen 3.078 N/A HIS 94.A NE2 GLY 88.A O no hydrogen 2.589 N/A LEU 95.A N LEU 91.A O no hydrogen 2.901 N/A HIS 96.A N TYR 92.A O no hydrogen 2.887 N/A HIS 96.A NE2 GLU 187.A OE1 no hydrogen 2.787 N/A ALA 97.A N HIS 93.A O no hydrogen 2.979 N/A SER 98.A N HIS 93.A O no hydrogen 2.987 N/A SER 98.A OG HIS 93.A O no hydrogen 3.277 N/A THR 100.A OG1 HIS 94.A ND1 no hydrogen 3.078 N/A LYS 106.A N GLU 103.A O no hydrogen 2.960 N/A LYS 106.A NZ ASN 142.A OD1 no hydrogen 3.398 N/A LEU 107.A N GLU 103.A O no hydrogen 3.152 N/A ILE 108.A N MET 104.A O no hydrogen 2.886 N/A ASP 109.A N LYS 105.A O no hydrogen 3.020 N/A ILE 110.A N LYS 106.A O no hydrogen 2.734 N/A ALA 111.A N LEU 107.A O no hydrogen 2.946 N/A ARG 112.A N ILE 108.A O no hydrogen 2.957 N/A ARG 112.A NH2 ASP 109.A OD1 no hydrogen 2.666 N/A GLN 113.A N ASP 109.A O no hydrogen 2.982 N/A GLN 113.A NE2 ASP 109.A OD1 no hydrogen 3.563 N/A GLN 113.A NE2 ASP 109.A OD2 no hydrogen 2.949 N/A GLN 113.A NE2 ASN 142.A O no hydrogen 3.565 N/A THR 114.A N ILE 110.A O no hydrogen 3.101 N/A THR 114.A OG1 ILE 110.A O no hydrogen 2.680 N/A ALA 115.A N ALA 111.A O no hydrogen 3.026 N/A ARG 116.A N ARG 112.A O no hydrogen 2.887 N/A ARG 116.A NH1 GLU 254.A OE1 no hydrogen 2.913 N/A GLY 117.A N GLN 113.A O no hydrogen 2.836 N/A MET 118.A N THR 114.A O no hydrogen 2.823 N/A ASP 119.A N ALA 115.A O no hydrogen 2.704 N/A TYR 120.A N ARG 116.A O no hydrogen 2.954 N/A LEU 121.A N GLY 117.A O no hydrogen 2.891 N/A HIS 122.A N MET 118.A O no hydrogen 3.004 N/A HIS 122.A NE2 ASP 177.A OD2 no hydrogen 2.658 N/A ALA 123.A N ASP 119.A O no hydrogen 2.892 N/A LYS 124.A N TYR 120.A O no hydrogen 3.085 N/A LYS 124.A N LEU 121.A O no hydrogen 2.882 N/A LYS 124.A NZ LYS 61.A O no hydrogen 3.210 N/A LYS 124.A NZ TYR 120.A OH no hydrogen 3.512 N/A SER 125.A N HIS 122.A O no hydrogen 3.038 N/A ILE 126.A N LEU 121.A O no hydrogen 2.985 N/A HIS 128.A N ASP 177.A OD2 no hydrogen 3.012 N/A HIS 128.A NE2 GLY 147.A O no hydrogen 2.541 N/A ARG 129.A N ASP 177.A OD1 no hydrogen 2.946 N/A ASP 130.A N HIS 128.A ND1 no hydrogen 2.927 N/A LYS 132.A N ASN 135.A OD1 no hydrogen 3.124 N/A LYS 132.A NZ SER 158.A OG no hydrogen 2.707 N/A SER 133.A OG ASN 134.A OD1 no hydrogen 3.421 N/A SER 133.A OG GLU 187.A OE1 no hydrogen 2.682 N/A SER 133.A OG GLU 187.A OE2 no hydrogen 3.420 N/A ASN 135.A N LYS 132.A O no hydrogen 3.047 N/A ASN 135.A ND2 ASP 130.A O no hydrogen 2.612 N/A ASN 135.A ND2 ASP 148.A OD1 no hydrogen 3.499 N/A ILE 136.A N SER 133.A O no hydrogen 3.199 N/A PHE 137.A N LYS 145.A O no hydrogen 2.775 N/A LEU 138.A N SER 89.A O no hydrogen 2.956 N/A HIS 139.A N THR 143.A O no hydrogen 2.868 N/A ASP 141.A N HIS 139.A ND1 no hydrogen 2.935 N/A ASN 142.A N HIS 139.A O no hydrogen 3.187 N/A THR 143.A N ASP 141.A OD1 no hydrogen 2.991 N/A THR 143.A OG1 ASP 141.A OD1 no hydrogen 2.597 N/A VAL 144.A N GLN 113.A OE1 no hydrogen 3.128 N/A LYS 145.A N PHE 137.A O no hydrogen 2.718 N/A LYS 145.A NZ VAL 65.A O no hydrogen 3.055 N/A LYS 145.A NZ THR 143.A OG1 no hydrogen 3.139 N/A ILE 146.A N ASN 66.A O no hydrogen 2.989 N/A GLY 147.A N ASN 135.A O no hydrogen 3.040 N/A GLU 154.A N LEU 151.A O no hydrogen 3.256 N/A LYS 155.A N LEU 151.A O no hydrogen 3.060 N/A LYS 155.A NZ HIS 128.A O no hydrogen 3.108 N/A LYS 155.A NZ ASP 148.A O no hydrogen 2.840 N/A LYS 155.A NZ GLY 150.A O no hydrogen 2.912 N/A SER 156.A N ALA 152.A O no hydrogen 2.878 N/A ARG 157.A N THR 153.A O no hydrogen 2.876 N/A TRP 161.A N SER 158.A O no hydrogen 3.223 N/A TRP 161.A NE1 GLU 187.A OE2 no hydrogen 2.780 N/A MET 162.A N ILE 159.A O no hydrogen 2.923 N/A GLU 165.A N GLU 165.A OE1 no hydrogen 2.720 N/A VAL 166.A N ALA 163.A O no hydrogen 3.019 N/A ILE 167.A N ALA 163.A O no hydrogen 3.157 N/A ILE 167.A N PRO 164.A O no hydrogen 2.838 N/A ARG 168.A N PRO 164.A O no hydrogen 3.066 N/A ARG 168.A NE GLY 209.A O no hydrogen 2.945 N/A SER 173.A N SER 176.A OG no hydrogen 3.278 N/A GLN 175.A N SER 173.A OG no hydrogen 3.075 N/A SER 176.A N SER 173.A OG no hydrogen 3.330 N/A SER 176.A OG SER 173.A O no hydrogen 3.076 N/A ASP 177.A N SER 173.A O no hydrogen 3.309 N/A VAL 178.A N PHE 174.A O no hydrogen 3.119 N/A TYR 179.A N GLN 175.A O no hydrogen 3.045 N/A ALA 180.A N SER 176.A O no hydrogen 3.080 N/A PHE 181.A N ASP 177.A O no hydrogen 3.010 N/A GLY 182.A N VAL 178.A O no hydrogen 2.970 N/A ILE 183.A N TYR 179.A O no hydrogen 3.049 N/A VAL 184.A N ALA 180.A O no hydrogen 3.105 N/A VAL 184.A N PHE 181.A O no hydrogen 2.905 N/A LEU 185.A N PHE 181.A O no hydrogen 2.957 N/A TYR 186.A N GLY 182.A O no hydrogen 3.006 N/A TYR 186.A OH ASP 216.A O no hydrogen 3.043 N/A GLU 187.A N ILE 183.A O no hydrogen 3.022 N/A LEU 188.A N VAL 184.A O no hydrogen 2.764 N/A MET 189.A N LEU 185.A O no hydrogen 2.806 N/A THR 190.A N TYR 186.A O no hydrogen 2.859 N/A THR 190.A OG1 TYR 186.A O no hydrogen 2.505 N/A GLN 192.A N THR 190.A OG1 no hydrogen 3.151 N/A ILE 198.A N TYR 195.A O no hydrogen 2.983 N/A ILE 205.A N ARG 201.A O no hydrogen 3.240 N/A GLU 206.A N ASP 202.A O no hydrogen 3.216 N/A MET 207.A N GLN 203.A O no hydrogen 3.099 N/A VAL 208.A N ILE 204.A O no hydrogen 2.818 N/A GLY 209.A N ILE 205.A O no hydrogen 2.748 N/A ARG 210.A N MET 207.A O no hydrogen 3.188 N/A ARG 210.A NE SER 212.A OG no hydrogen 2.615 N/A ARG 210.A NH2 SER 212.A OG no hydrogen 3.387 N/A GLY 211.A N VAL 208.A O no hydrogen 3.021 N/A SER 212.A N MET 207.A O no hydrogen 3.217 N/A SER 212.A OG MET 207.A O no hydrogen 3.424 N/A SER 218.A OG ASP 216.A OD1 no hydrogen 2.973 N/A SER 218.A OG ASP 216.A OD2 no hydrogen 2.613 N/A LYS 219.A N ASP 216.A O no hydrogen 3.306 N/A VAL 220.A N LEU 217.A O no hydrogen 3.164 N/A ARG 221.A N MET 189.A O no hydrogen 3.089 N/A ARG 221.A NE MET 189.A O no hydrogen 3.185 N/A ARG 221.A NH2 LEU 188.A O no hydrogen 2.918 N/A CYS 224.A SG PRO 225.A O no hydrogen 3.794 N/A ARG 227.A NE GLU 252.A OE2 no hydrogen 3.124 N/A ARG 227.A NH1 GLU 252.A OE1 no hydrogen 2.688 N/A ARG 227.A NH1 GLU 252.A OE2 no hydrogen 3.466 N/A MET 228.A N PRO 225.A O no hydrogen 2.841 N/A LYS 229.A N PRO 225.A O no hydrogen 3.148 N/A ARG 230.A N LYS 226.A O no hydrogen 2.848 N/A LEU 231.A N ARG 227.A O no hydrogen 2.795 N/A MET 232.A N MET 228.A O no hydrogen 2.800 N/A ALA 233.A N LYS 229.A O no hydrogen 2.937 N/A GLU 234.A N ARG 230.A O no hydrogen 2.760 N/A CYS 235.A N LEU 231.A O no hydrogen 2.826 N/A CYS 235.A SG LEU 231.A O no hydrogen 3.344 N/A LEU 236.A N MET 232.A O no hydrogen 3.145 N/A LEU 236.A N ALA 233.A O no hydrogen 3.188 N/A LYS 237.A N GLU 234.A O no hydrogen 3.289 N/A LYS 238.A NZ GLY 211.A O no hydrogen 2.227 N/A GLU 242.A N LYS 239.A O no hydrogen 2.879 N/A ARG 243.A N ARG 240.A O no hydrogen 3.276 N/A ARG 243.A NE LYS 237.A O no hydrogen 2.784 N/A ARG 243.A NH1 GLU 165.A OE2 no hydrogen 2.969 N/A ARG 243.A NH1 GLN 175.A O no hydrogen 3.056 N/A ARG 243.A NH2 GLU 165.A OE1 no hydrogen 2.928 N/A ARG 243.A NH2 GLU 165.A OE2 no hydrogen 3.528 N/A ARG 243.A NH2 LYS 237.A O no hydrogen 3.101 N/A ARG 243.A NH2 LYS 238.A O no hydrogen 3.056 N/A ILE 249.A N SER 245.A O no hydrogen 2.860 N/A LEU 250.A N PHE 246.A O no hydrogen 2.789 N/A ALA 251.A N PRO 247.A O no hydrogen 3.233 N/A GLU 252.A N ARG 248.A O no hydrogen 2.943 N/A ILE 253.A N ILE 249.A O no hydrogen 3.020 N/A GLU 254.A N LEU 250.A O no hydrogen 2.783 N/A GLU 255.A N ALA 251.A O no hydrogen 2.947 N/A GLU 255.A N GLU 252.A O no hydrogen 3.221 N/A LEU 256.A N GLU 252.A O no hydrogen 2.872 N/A ALA 257.A N ILE 253.A O no hydrogen 2.869 N/A ARG 258.A N GLU 255.A O no hydrogen 3.342 N/A ARG 258.A NH1 GLU 254.A O no hydrogen 2.885 N/A ARG 258.A NH1 GLU 254.A OE2 no hydrogen 3.105 N/A