Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3l74_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 10.A N ASP 125.A OD2 no hydrogen 3.013 N/A TRP 12.A N PHE 10.A O no hydrogen 2.801 N/A TRP 12.A NE1 ASP 125.A OD2 no hydrogen 2.550 N/A HIS 14.A NE2 GLU 124.A OE2 no hydrogen 2.703 N/A GLY 15.A N TRP 12.A O no hydrogen 3.106 N/A SER 19.A N GLY 16.A O no hydrogen 2.978 N/A LEU 21.A N ASP 199.A OD1 no hydrogen 2.851 N/A HIS 23.A ND1 VAL 54.A O no hydrogen 2.729 N/A HIS 23.A NE2 ASP 199.A OD2 no hydrogen 2.978 N/A SER 25.A N ASP 22.A OD1 no hydrogen 3.011 N/A SER 25.A OG ASP 185.A OD1 no hydrogen 2.668 N/A SER 25.A OG THR 188.A OG1 no hydrogen 3.332 N/A VAL 26.A N ASP 22.A O no hydrogen 2.916 N/A ARG 27.A N HIS 23.A O no hydrogen 2.828 N/A ARG 27.A NH1 THR 55.A O no hydrogen 2.513 N/A ARG 27.A NH1 GLU 60.A OE2 no hydrogen 3.002 N/A ARG 27.A NH2 GLU 60.A OE1 no hydrogen 2.769 N/A ARG 28.A N SER 24.A O no hydrogen 2.996 N/A ARG 28.A NE ASP 185.A OD1 no hydrogen 3.367 N/A ARG 28.A NE ASP 185.A OD2 no hydrogen 2.805 N/A ARG 28.A NH1 ASP 173.A OD2 no hydrogen 2.933 N/A ARG 28.A NH2 ASP 185.A OD1 no hydrogen 3.183 N/A GLY 29.A N SER 25.A O no hydrogen 2.817 N/A PHE 30.A N VAL 26.A O no hydrogen 2.976 N/A GLN 31.A N ARG 27.A O no hydrogen 3.278 N/A GLN 31.A NE2 GLU 170.A O no hydrogen 2.823 N/A VAL 32.A N ARG 28.A O no hydrogen 3.131 N/A TYR 33.A N GLY 29.A O no hydrogen 3.022 N/A TYR 33.A OH HIS 41.A O no hydrogen 2.782 N/A LYS 34.A N PHE 30.A O no hydrogen 2.786 N/A LYS 34.A NZ GLU 67.A OE1 no hydrogen 3.056 N/A GLN 35.A N GLN 31.A O no hydrogen 2.774 N/A VAL 36.A N VAL 32.A O no hydrogen 2.876 N/A CYS 37.A N VAL 32.A O no hydrogen 3.391 N/A CYS 37.A SG VAL 32.A O no hydrogen 3.723 N/A SER 38.A N TYR 33.A O no hydrogen 2.717 N/A SER 38.A OG TYR 33.A O no hydrogen 2.957 N/A SER 38.A OG LYS 34.A O no hydrogen 2.504 N/A ALA 39.A N VAL 36.A O no hydrogen 3.443 N/A CYS 40.A N CYS 37.A O no hydrogen 3.063 N/A HIS 41.A N CYS 37.A O no hydrogen 2.790 N/A HIS 41.A ND1 PRO 111.A O no hydrogen 2.691 N/A SER 42.A OG ASP 112.A OD2 no hydrogen 2.612 N/A ASP 44.A N ASP 112.A OD2 no hydrogen 2.668 N/A TYR 45.A N SER 114.A OG no hydrogen 3.143 N/A VAL 46.A N MET 43.A O no hydrogen 3.195 N/A PHE 48.A N ASP 89.A O no hydrogen 3.092 N/A ARG 49.A N ILE 87.A O no hydrogen 2.802 N/A ASN 50.A N ALA 47.A O no hydrogen 2.942 N/A ASN 50.A ND2 ALA 47.A O no hydrogen 3.183 N/A LEU 51.A N PHE 48.A O no hydrogen 3.109 N/A ILE 52.A N ARG 49.A O no hydrogen 3.107 N/A GLY 53.A N HIS 56.A O no hydrogen 2.873 N/A VAL 54.A N LEU 51.A O no hydrogen 2.942 N/A THR 55.A N LEU 51.A O no hydrogen 2.881 N/A THR 55.A OG1 HIS 56.A ND1 no hydrogen 2.817 N/A HIS 56.A N LEU 51.A O no hydrogen 3.193 N/A HIS 56.A ND1 THR 55.A OG1 no hydrogen 2.817 N/A THR 57.A N GLU 60.A OE2 no hydrogen 2.821 N/A GLU 60.A N THR 57.A OG1 no hydrogen 3.145 N/A ALA 61.A N THR 57.A O no hydrogen 2.926 N/A LYS 62.A N GLU 58.A O no hydrogen 3.030 N/A ALA 63.A N ALA 59.A O no hydrogen 3.197 N/A LEU 64.A N GLU 60.A O no hydrogen 2.898 N/A ALA 65.A N ALA 61.A O no hydrogen 2.973 N/A GLU 66.A N LYS 62.A O no hydrogen 2.923 N/A GLU 67.A N ALA 63.A O no hydrogen 3.118 N/A GLU 67.A N LEU 64.A O no hydrogen 3.270 N/A VAL 68.A N ALA 65.A O no hydrogen 3.183 N/A VAL 70.A N ARG 83.A O no hydrogen 2.809 N/A ASP 72.A N PHE 81.A O no hydrogen 2.792 N/A GLY 73.A N ASP 72.A OD1 no hydrogen 2.602 N/A ASP 75.A N GLU 79.A O no hydrogen 2.735 N/A ASN 77.A N ASP 75.A OD1 no hydrogen 2.673 N/A GLY 78.A N ASP 75.A O no hydrogen 3.069 N/A GLU 79.A N ASP 75.A OD1 no hydrogen 2.893 N/A PHE 81.A N ASP 72.A O no hydrogen 2.954 N/A ARG 83.A N VAL 70.A O no hydrogen 2.907 N/A ARG 83.A NE ASP 72.A OD2 no hydrogen 2.620 N/A ARG 83.A NH1 PRO 84.A O no hydrogen 2.933 N/A ARG 83.A NH1 ASP 89.A OD2 no hydrogen 3.230 N/A ARG 83.A NH2 ASP 72.A OD2 no hydrogen 3.514 N/A ARG 83.A NH2 ASP 89.A OD1 no hydrogen 2.982 N/A ARG 83.A NH2 ASP 89.A OD2 no hydrogen 3.400 N/A GLY 85.A N VAL 68.A O no hydrogen 2.879 N/A LYS 86.A N ASP 89.A OD2 no hydrogen 2.677 N/A ASP 89.A N LYS 86.A O no hydrogen 2.723 N/A PHE 91.A N VAL 46.A O no hydrogen 2.917 N/A ALA 100.A N ASN 97.A OD1 no hydrogen 2.734 N/A ALA 101.A N ASN 97.A O no hydrogen 3.110 N/A ARG 102.A N PRO 98.A O no hydrogen 2.795 N/A ARG 102.A NH1 GLY 107.A O no hydrogen 2.641 N/A ALA 103.A N GLU 99.A O no hydrogen 2.910 N/A ALA 104.A N ALA 100.A O no hydrogen 2.961 N/A ALA 104.A N ALA 101.A O no hydrogen 2.988 N/A ASN 105.A N ARG 102.A O no hydrogen 2.757 N/A ASN 105.A ND2 TYR 95.A OH no hydrogen 2.959 N/A ASN 105.A ND2 ALA 101.A O no hydrogen 2.834 N/A GLY 107.A N ARG 102.A O no hydrogen 2.845 N/A ALA 108.A N ASN 105.A O no hydrogen 3.044 N/A LEU 113.A N SER 42.A O no hydrogen 2.924 N/A SER 114.A N ASP 112.A OD1 no hydrogen 2.955 N/A SER 114.A OG ASP 112.A OD1 no hydrogen 2.697 N/A ILE 116.A N LEU 113.A O no hydrogen 3.197 N/A ASN 118.A N TYR 115.A O no hydrogen 2.814 N/A ALA 119.A N TYR 115.A O no hydrogen 2.879 N/A ALA 119.A N ILE 116.A O no hydrogen 3.120 N/A ARG 120.A NH1 ALA 119.A O no hydrogen 3.019 N/A GLY 123.A N ARG 120.A O no hydrogen 3.120 N/A GLU 124.A N GLU 124.A OE1 no hydrogen 2.569 N/A TYR 126.A N GLY 122.A O no hydrogen 3.071 N/A TYR 126.A N GLY 123.A O no hydrogen 2.926 N/A VAL 127.A N GLY 123.A O no hydrogen 2.980 N/A PHE 128.A N GLU 124.A O no hydrogen 2.771 N/A SER 129.A N ASP 125.A O no hydrogen 3.160 N/A SER 129.A OG ASP 125.A O no hydrogen 3.103 N/A LEU 130.A N TYR 126.A O no hydrogen 2.972 N/A LEU 131.A N VAL 127.A O no hydrogen 3.028 N/A THR 132.A N PHE 128.A O no hydrogen 3.102 N/A THR 132.A OG1 PHE 128.A O no hydrogen 3.038 N/A GLY 133.A N LEU 130.A O no hydrogen 3.395 N/A TYR 134.A OH MET 160.A O no hydrogen 2.434 N/A CYS 135.A SG ASP 136.A O no hydrogen 3.680 N/A VAL 141.A N PRO 138.A O no hydrogen 3.055 N/A LEU 147.A N ARG 144.A O no hydrogen 3.080 N/A HIS 148.A N ILE 158.A O no hydrogen 2.805 N/A ASN 150.A N GLN 156.A O no hydrogen 2.698 N/A ASN 150.A ND2 LEU 130.A O no hydrogen 2.961 N/A TYR 152.A N ASN 150.A OD1 no hydrogen 3.019 N/A PHE 153.A N ASN 150.A O no hydrogen 3.308 N/A GLN 156.A N PHE 153.A O no hydrogen 2.713 N/A GLN 156.A NE2 LEU 3.A O no hydrogen 3.665 N/A GLN 156.A NE2 PHE 153.A O no hydrogen 3.481 N/A ILE 158.A N HIS 148.A O no hydrogen 2.945 N/A GLU 167.A N ALA 177.A O no hydrogen 2.751 N/A ILE 168.A N TYR 165.A O no hydrogen 3.165 N/A GLY 174.A N TYR 171.A O no hydrogen 2.880 N/A THR 175.A N ASP 173.A OD1 no hydrogen 2.912 N/A THR 175.A OG1 ASP 173.A OD1 no hydrogen 2.978 N/A THR 175.A OG1 ASP 173.A OD2 no hydrogen 2.843 N/A THR 178.A N PRO 176.A O no hydrogen 2.712 N/A MET 179.A N ASN 166.A OD1 no hydrogen 2.901 N/A GLN 181.A NE2 ASP 185.A OD2 no hydrogen 2.753 N/A ILE 182.A N THR 178.A O no hydrogen 2.879 N/A ALA 183.A N MET 179.A O no hydrogen 2.945 N/A LYS 184.A N SER 180.A O no hydrogen 2.936 N/A LYS 184.A NZ SER 25.A OG no hydrogen 3.021 N/A ASP 185.A N GLN 181.A O no hydrogen 3.052 N/A VAL 186.A N ILE 182.A O no hydrogen 2.954 N/A CYS 187.A N ALA 183.A O no hydrogen 2.875 N/A CYS 187.A SG GLU 124.A O no hydrogen 4.021 N/A CYS 187.A SG ALA 183.A O no hydrogen 3.264 N/A THR 188.A N LYS 184.A O no hydrogen 3.152 N/A THR 188.A OG1 SER 25.A OG no hydrogen 3.332 N/A THR 188.A OG1 LYS 184.A O no hydrogen 2.820 N/A PHE 189.A N ASP 185.A O no hydrogen 2.813 N/A LEU 190.A N VAL 186.A O no hydrogen 2.825 N/A ARG 191.A N CYS 187.A O no hydrogen 2.946 N/A ARG 191.A NE GLU 124.A OE1 no hydrogen 3.414 N/A ARG 191.A NE GLU 124.A OE2 no hydrogen 3.054 N/A ARG 191.A NH1 ASN 118.A OD1 no hydrogen 3.212 N/A ARG 191.A NH2 ASN 118.A OD1 no hydrogen 3.516 N/A ARG 191.A NH2 GLU 124.A OE1 no hydrogen 2.877 N/A TRP 192.A N THR 188.A O no hydrogen 3.079 N/A ALA 193.A N PHE 189.A O no hydrogen 2.777 N/A ALA 194.A N LEU 190.A O no hydrogen 2.925 N/A GLU 195.A N ARG 191.A O no hydrogen 2.991 N/A GLU 197.A N GLU 197.A OE1 no hydrogen 2.602 N/A HIS 198.A N GLU 195.A O no hydrogen 2.657 N/A HIS 198.A ND1 ASP 199.A OD1 no hydrogen 3.018 N/A ARG 201.A N GLU 197.A O no hydrogen 2.889 N/A LYS 202.A N HIS 198.A O no hydrogen 3.200 N/A LYS 202.A NZ GLY 16.A O no hydrogen 2.735 N/A LYS 202.A NZ SER 19.A O no hydrogen 3.083 N/A LYS 202.A NZ HIS 198.A NE2 no hydrogen 3.051 N/A ARG 203.A N ASP 199.A O no hydrogen 3.112 N/A MET 204.A N GLN 200.A O no hydrogen 2.927 N/A GLY 205.A N ARG 201.A O no hydrogen 2.889 N/A LEU 206.A N LYS 202.A O no hydrogen 3.045 N/A LYS 207.A N ARG 203.A O no hydrogen 3.244 N/A MET 208.A N MET 204.A O no hydrogen 2.715 N/A LEU 209.A N GLY 205.A O no hydrogen 3.003 N/A LEU 210.A N LEU 206.A O no hydrogen 3.097 N/A ILE 211.A N LYS 207.A O no hydrogen 2.850 N/A SER 212.A N MET 208.A O no hydrogen 2.907 N/A ALA 213.A N LEU 209.A O no hydrogen 2.998 N/A LEU 214.A N LEU 210.A O no hydrogen 3.056 N/A LEU 215.A N ILE 211.A O no hydrogen 2.756 N/A THR 216.A N SER 212.A O no hydrogen 2.833 N/A THR 216.A OG1 SER 212.A O no hydrogen 2.747 N/A SER 217.A N ALA 213.A O no hydrogen 3.142 N/A SER 217.A OG ALA 213.A O no hydrogen 2.901 N/A LEU 218.A N LEU 214.A O no hydrogen 2.976 N/A LEU 219.A N LEU 215.A O no hydrogen 2.955 N/A TYR 220.A N THR 216.A O no hydrogen 2.873 N/A TYR 221.A N SER 217.A O no hydrogen 2.997 N/A MET 222.A N LEU 218.A O no hydrogen 3.017 N/A LYS 223.A N LEU 219.A O no hydrogen 3.020 N/A ARG 224.A N TYR 220.A O no hydrogen 3.016 N/A HIS 225.A N TYR 221.A O no hydrogen 2.657 N/A LYS 226.A N MET 222.A O no hydrogen 3.053 N/A TRP 227.A N LYS 223.A O no hydrogen 2.923 N/A SER 228.A N ARG 224.A O no hydrogen 2.771 N/A SER 228.A N HIS 225.A O no hydrogen 3.322 N/A SER 228.A OG HIS 225.A O no hydrogen 2.634 N/A LYS 231.A N TRP 227.A O no hydrogen 2.823 N/A SER 232.A N SER 228.A O no hydrogen 3.038 N/A SER 232.A OG SER 228.A O no hydrogen 2.914 N/A ARG 233.A N LEU 230.A O no hydrogen 3.180 N/A