Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3frr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 5.A N SER 3.A OG no hydrogen 3.009 N/A LYS 6.A N GLN 122.A OE1 no hydrogen 2.698 N/A LEU 10.A N LYS 6.A O no hydrogen 3.126 N/A ARG 11.A N ALA 7.A O no hydrogen 2.946 N/A ARG 11.A NE GLU 8.A OE1 no hydrogen 3.014 N/A ARG 11.A NH2 GLU 8.A OE2 no hydrogen 2.997 N/A VAL 12.A N GLU 8.A O no hydrogen 2.996 N/A ASN 13.A N ARG 9.A O no hydrogen 3.071 N/A ASN 13.A ND2 ARG 9.A O no hydrogen 2.839 N/A LEU 14.A N LEU 10.A O no hydrogen 2.904 N/A ARG 15.A N ARG 11.A O no hydrogen 3.389 N/A LEU 16.A N VAL 12.A O no hydrogen 3.056 N/A VAL 17.A N ASN 13.A O no hydrogen 2.827 N/A ILE 18.A N LEU 14.A O no hydrogen 3.096 N/A ASN 19.A N ARG 15.A O no hydrogen 3.101 N/A ARG 20.A N LEU 16.A O no hydrogen 2.943 N/A ARG 20.A NE GLU 112.A O no hydrogen 2.808 N/A ARG 20.A NH2 GLU 112.A O no hydrogen 2.873 N/A LEU 21.A N VAL 17.A O no hydrogen 2.889 N/A LYS 22.A N ILE 18.A O no hydrogen 2.988 N/A LEU 23.A N ASN 19.A O no hydrogen 3.041 N/A LEU 24.A N ARG 20.A O no hydrogen 2.883 N/A GLU 25.A N LEU 21.A O no hydrogen 2.860 N/A LYS 26.A N LYS 22.A O no hydrogen 3.412 N/A LYS 27.A N LEU 23.A O no hydrogen 3.027 N/A LYS 28.A N LEU 24.A O no hydrogen 2.845 N/A LYS 28.A NZ GLU 61.A OE1 no hydrogen 2.778 N/A LYS 28.A NZ GLU 112.A OE1 no hydrogen 2.792 N/A LYS 28.A NZ GLU 112.A OE2 no hydrogen 3.274 N/A THR 29.A N GLU 25.A O no hydrogen 3.111 N/A THR 29.A OG1 GLU 25.A O no hydrogen 2.683 N/A GLU 30.A N LYS 26.A O no hydrogen 3.052 N/A LEU 31.A N.A LYS 27.A O no hydrogen 2.927 N/A LEU 31.A N.B LYS 27.A O no hydrogen 2.935 N/A ALA 32.A N LYS 28.A O no hydrogen 2.925 N/A GLN 33.A N THR 29.A O no hydrogen 3.378 N/A GLN 33.A N GLU 30.A O no hydrogen 3.269 N/A ALA 35.A N LEU 31.A O.A no hydrogen 3.024 N/A ALA 35.A N LEU 31.A O.B no hydrogen 2.990 N/A ARG 36.A N ALA 32.A O no hydrogen 2.975 N/A ARG 36.A NH1 GLU 167.A OE2.B no hydrogen 2.792 N/A ARG 36.A NH2 ASP 62.A OD2 no hydrogen 2.914 N/A LYS 37.A N GLN 33.A O no hydrogen 3.123 N/A GLU 38.A N LYS 34.A O no hydrogen 3.068 N/A ILE 39.A N ALA 35.A O no hydrogen 3.051 N/A ALA 40.A N ARG 36.A O no hydrogen 2.889 N/A ASP 41.A N LYS 37.A O no hydrogen 2.918 N/A TYR 42.A N GLU 38.A O no hydrogen 2.986 N/A LEU 43.A N ILE 39.A O no hydrogen 2.972 N/A ALA 44.A N ALA 40.A O no hydrogen 2.852 N/A ALA 45.A N TYR 42.A O no hydrogen 2.954 N/A LYS 47.A N TYR 42.A O no hydrogen 2.778 N/A ASP 48.A N GLY 46.A O no hydrogen 2.900 N/A ARG 50.A NH2 TYR 42.A OH no hydrogen 3.428 N/A ALA 51.A N LYS 47.A O no hydrogen 2.953 N/A ARG 52.A N ASP 48.A O no hydrogen 3.033 N/A ARG 52.A NE GLU 162.A OE1 no hydrogen 3.141 N/A ILE 53.A N GLU 49.A O no hydrogen 3.390 N/A ARG 54.A N ARG 50.A O no hydrogen 2.974 N/A VAL 55.A N ALA 51.A O no hydrogen 2.872 N/A GLU 56.A N ILE 53.A O no hydrogen 3.072 N/A HIS 57.A N ARG 54.A O no hydrogen 3.305 N/A ILE 59.A N VAL 55.A O no hydrogen 3.178 N/A ARG 60.A N GLU 56.A O no hydrogen 3.029 N/A GLU 61.A N HIS 57.A O no hydrogen 2.910 N/A ASP 62.A N ILE 58.A O no hydrogen 2.884 N/A TYR 63.A N ILE 59.A O no hydrogen 3.017 N/A LEU 64.A N ARG 60.A O no hydrogen 2.886 N/A VAL 65.A N GLU 61.A O no hydrogen 3.060 N/A GLU 66.A N ASP 62.A O no hydrogen 3.345 N/A ALA 67.A N TYR 63.A O no hydrogen 2.920 N/A MET 68.A N LEU 64.A O no hydrogen 2.834 N/A GLU 69.A N VAL 65.A O no hydrogen 3.172 N/A ILE 70.A N GLU 66.A O no hydrogen 3.252 N/A LEU 71.A N ALA 67.A O no hydrogen 2.917 N/A GLU 72.A N MET 68.A O no hydrogen 2.856 N/A LEU 73.A N GLU 69.A O no hydrogen 3.202 N/A TYR 74.A N ILE 70.A O no hydrogen 3.180 N/A CYS 75.A N LEU 71.A O no hydrogen 2.993 N/A CYS 75.A SG LEU 71.A O no hydrogen 3.477 N/A ASP 76.A N GLU 72.A O no hydrogen 3.055 N/A LEU 77.A N LEU 73.A O no hydrogen 2.917 N/A LEU 78.A N TYR 74.A O no hydrogen 3.036 N/A LEU 79.A N CYS 75.A O no hydrogen 3.014 N/A ALA 80.A N ASP 76.A O no hydrogen 2.923 N/A ARG 81.A N LEU 77.A O no hydrogen 2.803 N/A PHE 82.A N LEU 79.A O no hydrogen 3.369 N/A LEU 84.A N ARG 81.A O no hydrogen 2.951 N/A ILE 85.A N PHE 82.A O no hydrogen 2.924 N/A GLN 86.A N PHE 82.A O no hydrogen 3.025 N/A SER 87.A N GLY 83.A O no hydrogen 2.924 N/A SER 87.A OG.A GLY 83.A O no hydrogen 2.703 N/A GLY 94.A N ASP 92.A OD2 no hydrogen 2.980 N/A LEU 95.A N ASP 92.A O no hydrogen 2.913 N/A SER 98.A OG.B LEU 95.A O no hydrogen 2.717 N/A VAL 99.A N LEU 95.A O no hydrogen 2.846 N/A SER 100.A N ALA 96.A O no hydrogen 2.881 N/A SER 100.A OG.A ALA 96.A O no hydrogen 2.952 N/A SER 100.A OG.A TYR 131.A OH no hydrogen 2.507 N/A SER 100.A OG.A THR 142.A OG1 no hydrogen 2.819 N/A SER 100.A OG.B ALA 96.A O no hydrogen 2.757 N/A SER 100.A OG.B GLU 97.A O no hydrogen 3.249 N/A SER 100.A OG.B THR 142.A OG1 no hydrogen 2.831 N/A THR 101.A N GLU 97.A O no hydrogen 2.925 N/A THR 101.A OG1 GLU 97.A O no hydrogen 2.680 N/A LEU 102.A N SER 98.A O no hydrogen 3.014 N/A ILE 103.A N VAL 99.A O no hydrogen 3.077 N/A TRP 104.A N SER 100.A O no hydrogen 2.879 N/A ALA 105.A N THR 101.A O no hydrogen 2.805 N/A ALA 106.A N LEU 102.A O no hydrogen 3.016 N/A ARG 108.A NH1 TRP 104.A O no hydrogen 2.895 N/A ARG 108.A NH1 ARG 136.A O no hydrogen 2.995 N/A ARG 108.A NH2 ARG 136.A O no hydrogen 3.417 N/A LEU 109.A N ALA 105.A O no hydrogen 3.013 N/A LEU 109.A N ALA 106.A O no hydrogen 3.116 N/A GLN 110.A N ALA 106.A O no hydrogen 2.742 N/A GLU 112.A N LEU 109.A O no hydrogen 2.879 N/A VAL 113.A N LEU 109.A O no hydrogen 2.910 N/A GLU 115.A N GLU 115.A OE1 no hydrogen 2.778 N/A LEU 116.A N VAL 113.A O no hydrogen 3.023 N/A LYS 117.A N ALA 114.A O no hydrogen 3.096 N/A LYS 117.A NZ.A ASP 121.A OD2 no hydrogen 2.700 N/A LYS 117.A NZ.B ASP 121.A OD1 no hydrogen 3.239 N/A LYS 117.A NZ.B ASP 121.A OD2 no hydrogen 3.381 N/A VAL 119.A N GLU 115.A O no hydrogen 2.978 N/A ALA 120.A N LEU 116.A O no hydrogen 2.980 N/A ASP 121.A N LYS 117.A O no hydrogen 2.808 N/A GLN 122.A N ILE 118.A O no hydrogen 2.992 N/A LEU 123.A N VAL 119.A O no hydrogen 2.956 N/A CYS 124.A N ALA 120.A O no hydrogen 2.856 N/A CYS 124.A SG ALA 120.A O no hydrogen 3.192 N/A ALA 125.A N ASP 121.A O no hydrogen 2.805 N/A LYS 126.A N GLN 122.A O no hydrogen 2.912 N/A LYS 126.A NZ ILE 85.A O no hydrogen 2.892 N/A LYS 126.A NZ MET 88.A O no hydrogen 2.866 N/A TYR 127.A N LEU 123.A O no hydrogen 2.859 N/A SER 128.A OG TYR 127.A O no hydrogen 2.352 N/A GLU 130.A N GLU 130.A OE1 no hydrogen 2.726 N/A TYR 131.A N SER 128.A OG no hydrogen 3.168 N/A GLY 132.A N SER 128.A O no hydrogen 3.021 N/A LYS 133.A N LYS 129.A O no hydrogen 2.914 N/A LEU 134.A N GLU 130.A O no hydrogen 3.285 N/A CYS 135.A N TYR 131.A O no hydrogen 2.969 N/A CYS 135.A SG SER 100.A OG.A no hydrogen 3.453 N/A CYS 135.A SG TYR 131.A O no hydrogen 3.450 N/A ARG 136.A N GLY 132.A O no hydrogen 3.029 N/A THR 137.A OG1 LYS 133.A O no hydrogen 3.286 N/A THR 137.A OG1 LEU 134.A O no hydrogen 3.317 N/A THR 137.A OG1 GLN 139.A OE1 no hydrogen 2.622 N/A ASN 138.A N CYS 135.A O no hydrogen 3.023 N/A GLN 139.A N THR 137.A OG1 no hydrogen 3.261 N/A ILE 140.A N LEU 134.A O no hydrogen 3.027 N/A GLY 141.A N ASN 138.A O no hydrogen 3.049 N/A THR 142.A OG1 SER 100.A OG.A no hydrogen 2.819 N/A THR 142.A OG1 SER 100.A OG.B no hydrogen 2.831 N/A VAL 143.A N ASN 138.A OD1 no hydrogen 3.046 N/A ASN 144.A N THR 101.A OG1 no hydrogen 2.924 N/A ASN 144.A ND2 GLU 97.A OE2 no hydrogen 2.779 N/A LEU 147.A N ASN 144.A OD1 no hydrogen 2.911 N/A MET 148.A N ASN 144.A O no hydrogen 3.087 N/A HIS 149.A N ASP 145.A O no hydrogen 3.019 N/A LYS 150.A N ARG 146.A O no hydrogen 3.071 N/A LYS 150.A NZ GLU 66.A OE1 no hydrogen 2.777 N/A LEU 151.A N LEU 147.A O no hydrogen 3.151 N/A LEU 151.A N MET 148.A O no hydrogen 3.125 N/A SER 152.A N HIS 149.A O no hydrogen 3.194 N/A SER 152.A OG.A MET 148.A O no hydrogen 3.317 N/A SER 152.A OG.A HIS 149.A O no hydrogen 3.482 N/A GLU 154.A N SER 152.A OG.B no hydrogen 2.994 N/A LEU 160.A N PRO 157.A O no hydrogen 3.000 N/A VAL 161.A N PRO 157.A O no hydrogen 3.214 N/A GLU 162.A N LYS 158.A O no hydrogen 2.887 N/A ARG 163.A N ILE 159.A O no hydrogen 2.864 N/A TYR 164.A N LEU 160.A O no hydrogen 2.951 N/A TYR 164.A OH ASP 62.A OD2 no hydrogen 3.018 N/A LEU 165.A N VAL 161.A O no hydrogen 3.101 N/A ILE 166.A N GLU 162.A O no hydrogen 2.855 N/A GLU 167.A N ARG 163.A O no hydrogen 3.085 N/A ILE 168.A N TYR 164.A O no hydrogen 2.964 N/A ALA 169.A N LEU 165.A O no hydrogen 2.849 N/A LYS 170.A N ILE 166.A O no hydrogen 3.043 N/A LYS 170.A NZ GLU 167.A OE1.A no hydrogen 3.405 N/A ASN 171.A N GLU 167.A O no hydrogen 2.961 N/A TYR 172.A N ILE 168.A O no hydrogen 3.007 N/A TYR 172.A OH GLN 33.A OE1 no hydrogen 2.734 N/A ASN 173.A N LYS 170.A O no hydrogen 3.227 N/A VAL 174.A N ALA 169.A O no hydrogen 2.998 N/A TYR 176.A OH GLU 162.A OE1 no hydrogen 3.234 N/A TYR 176.A OH GLU 162.A OE2 no hydrogen 2.639 N/A ASP 179.A N GLU 162.A OE2 no hydrogen 3.151 N/A VAL 182.A N ASP 179.A OD1 no hydrogen 3.473 N/A MET 183.A N ASP 179.A O no hydrogen 3.065 N/A ALA 184.A N SER 180.A O no hydrogen 2.834 N/A GLU 185.A N VAL 181.A O no hydrogen 2.958 N/A ALA 186.A N MET 183.A O no hydrogen 3.457 N/A