Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3t4k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 8.A N ALA 4.A O no hydrogen 3.256 N/A ARG 8.A NH2 ASN 5.A OD1 no hydrogen 2.527 N/A ARG 9.A N ASN 5.A O no hydrogen 2.888 N/A ARG 9.A NH1.B ASP 242.A OD2 no hydrogen 3.241 N/A ARG 9.A NH2.A ASP 242.A OD2 no hydrogen 2.747 N/A ARG 9.A NH2.A GLN 268.A O no hydrogen 2.895 N/A ARG 9.A NH2.B ASP 242.A OD2 no hydrogen 2.935 N/A GLU 10.A N LYS 6.A O no hydrogen 3.197 N/A GLU 11.A N ILE 7.A O no hydrogen 3.012 N/A VAL 12.A N ARG 8.A O no hydrogen 2.956 N/A LEU 13.A N ARG 9.A O no hydrogen 3.189 N/A VAL 14.A N GLU 10.A O no hydrogen 2.953 N/A SER 15.A N GLU 11.A O no hydrogen 3.084 N/A MET 16.A N VAL 12.A O no hydrogen 2.833 N/A CYS 17.A N LEU 13.A O no hydrogen 2.936 N/A CYS 17.A SG HIS 247.A O no hydrogen 3.954 N/A CYS 17.A SG SER 249.A OG no hydrogen 3.303 N/A ASP 18.A N VAL 14.A O no hydrogen 2.940 N/A GLN 19.A N SER 15.A O no hydrogen 2.984 N/A ARG 20.A N MET 16.A O no hydrogen 3.095 N/A ARG 20.A NH1 MET 16.A O no hydrogen 2.979 N/A ARG 20.A NH2 ALA 212.A O no hydrogen 3.045 N/A ALA 21.A N CYS 17.A O no hydrogen 2.875 N/A ARG 22.A N ASP 18.A O no hydrogen 2.973 N/A MET 23.A N GLN 19.A O no hydrogen 2.948 N/A LEU 24.A N ARG 20.A O no hydrogen 2.947 N/A GLN 25.A N ALA 21.A O no hydrogen 2.942 N/A ASP 26.A N ARG 22.A O no hydrogen 2.905 N/A GLN 27.A N MET 23.A O no hydrogen 2.980 N/A GLN 27.A NE2.B ASP 26.A OD2.B no hydrogen 2.865 N/A PHE 28.A N LEU 24.A O no hydrogen 2.957 N/A SER 29.A N GLN 25.A O no hydrogen 2.997 N/A VAL 30.A N ASP 26.A O no hydrogen 2.934 N/A SER 31.A N GLN 27.A O no hydrogen 3.104 N/A SER 31.A OG GLN 27.A O no hydrogen 3.054 N/A VAL 32.A N PHE 28.A O no hydrogen 2.834 N/A ASN 33.A N SER 29.A O no hydrogen 2.996 N/A HIS 34.A N VAL 30.A O no hydrogen 3.090 N/A HIS 34.A ND1 VAL 30.A O no hydrogen 2.825 N/A VAL 35.A N SER 31.A O no hydrogen 2.957 N/A HIS 36.A N VAL 32.A O no hydrogen 2.908 N/A ALA 37.A N ASN 33.A O no hydrogen 3.185 N/A LEU 38.A N HIS 34.A O no hydrogen 3.070 N/A ALA 39.A N VAL 35.A O no hydrogen 2.966 N/A ILE 40.A N HIS 36.A O no hydrogen 3.039 N/A LEU 41.A N ALA 37.A O no hydrogen 2.743 N/A VAL 42.A N LEU 38.A O no hydrogen 2.869 N/A SER 43.A N ALA 39.A O no hydrogen 3.023 N/A THR 44.A N ILE 40.A O no hydrogen 2.825 N/A THR 44.A OG1 ILE 40.A O no hydrogen 3.141 N/A PHE 45.A N LEU 41.A O no hydrogen 2.862 N/A HIS 46.A N VAL 42.A O no hydrogen 2.922 N/A HIS 46.A ND1 SER 52.A OG no hydrogen 2.693 N/A TYR 47.A N VAL 42.A O no hydrogen 3.227 N/A TYR 47.A OH TYR 78.A OH no hydrogen 2.692 N/A TYR 47.A OH GLU 80.A OE1 no hydrogen 2.770 N/A HIS 48.A N SER 43.A O no hydrogen 2.899 N/A LYS 49.A N THR 44.A O no hydrogen 3.178 N/A SER 52.A OG HIS 46.A ND1 no hydrogen 2.693 N/A SER 52.A OG ILE 54.A O no hydrogen 3.117 N/A ALA 53.A N PHE 45.A O no hydrogen 2.818 N/A ILE 54.A N SER 52.A OG no hydrogen 2.992 N/A GLN 56.A NE2 SER 119.A O no hydrogen 2.902 N/A THR 58.A N ASP 55.A OD1 no hydrogen 2.845 N/A THR 58.A OG1 ASP 55.A OD1 no hydrogen 2.688 N/A PHE 59.A N ASP 55.A O no hydrogen 2.993 N/A ALA 60.A N GLN 56.A O no hydrogen 2.876 N/A GLU 61.A N GLU 57.A O no hydrogen 2.957 N/A TYR 62.A N THR 58.A O no hydrogen 2.984 N/A THR 63.A N PHE 59.A O no hydrogen 3.031 N/A THR 63.A OG1 PHE 59.A O no hydrogen 2.779 N/A THR 63.A OG1 ALA 60.A O no hydrogen 3.313 N/A ALA 64.A N ALA 60.A O no hydrogen 2.991 N/A ARG 65.A N GLU 61.A O no hydrogen 2.987 N/A ARG 65.A NH1 GLU 61.A OE1 no hydrogen 3.429 N/A THR 66.A N TYR 62.A O no hydrogen 3.133 N/A THR 66.A OG1 TYR 62.A O no hydrogen 2.776 N/A THR 66.A OG1 THR 63.A O no hydrogen 3.411 N/A ALA 67.A N ALA 64.A O no hydrogen 3.191 N/A GLU 69.A N THR 66.A O no hydrogen 2.852 N/A ARG 70.A N ALA 67.A O no hydrogen 2.944 N/A ARG 70.A NH1 THR 66.A OG1 no hydrogen 2.803 N/A ARG 70.A NH2 THR 63.A O no hydrogen 2.698 N/A ARG 70.A NH2 GLN 120.A OE1 no hydrogen 3.528 N/A LEU 72.A N SER 31.A OG no hydrogen 3.289 N/A LEU 73.A N ARG 70.A O no hydrogen 3.072 N/A SER 74.A N ALA 197.A O no hydrogen 2.886 N/A SER 74.A OG ALA 197.A O no hydrogen 3.450 N/A VAL 76.A N GLN 120.A OE1 no hydrogen 3.250 N/A ALA 77.A N GLY 195.A O no hydrogen 2.916 N/A TYR 78.A N PHE 118.A O no hydrogen 2.891 N/A TYR 78.A OH TYR 47.A OH no hydrogen 2.692 N/A ALA 79.A N TYR 193.A O no hydrogen 2.855 N/A GLU 80.A N PRO 115.A O no hydrogen 2.993 N/A LYS 81.A N ALA 191.A O no hydrogen 2.975 N/A LYS 81.A NZ ILE 187.A O no hydrogen 2.995 N/A VAL 82.A N TYR 113.A O no hydrogen 3.066 N/A VAL 83.A N GLU 86.A OE1 no hydrogen 3.119 N/A ASN 84.A N ASP 111.A O no hydrogen 2.864 N/A GLU 86.A N VAL 83.A O no hydrogen 2.915 N/A ARG 87.A N ASN 84.A O no hydrogen 2.999 N/A ARG 87.A NE GLU 91.A OE2 no hydrogen 2.679 N/A ARG 87.A NH1 SER 107.A O no hydrogen 3.009 N/A ARG 87.A NH1 PRO 108.A O no hydrogen 3.163 N/A ARG 87.A NH1 TYR 113.A OH no hydrogen 3.032 N/A ARG 87.A NH2 GLU 91.A OE2 no hydrogen 3.284 N/A ARG 87.A NH2 SER 107.A O no hydrogen 2.900 N/A PHE 90.A N GLU 86.A O no hydrogen 2.893 N/A GLU 91.A N ARG 87.A O no hydrogen 2.919 N/A ARG 92.A N GLU 88.A O no hydrogen 2.992 N/A ARG 92.A NH2.B GLU 88.A OE1 no hydrogen 2.814 N/A GLN 93.A N MET 89.A O no hydrogen 3.015 N/A HIS 94.A N PHE 90.A O no hydrogen 3.014 N/A TRP 96.A N GLU 91.A O no hydrogen 3.276 N/A ILE 98.A N GLU 91.A OE2 no hydrogen 2.932 N/A LYS 99.A N SER 128.A O no hydrogen 2.911 N/A LYS 99.A NZ VAL 97.A O no hydrogen 2.895 N/A LYS 99.A NZ SER 128.A OG no hydrogen 3.358 N/A THR 100.A N GLU 105.A O no hydrogen 2.791 N/A THR 100.A OG1 ASP 102.A OD1 no hydrogen 3.084 N/A THR 100.A OG1 GLU 105.A O no hydrogen 3.439 N/A MET 101.A N SER 133.A OG no hydrogen 2.887 N/A ARG 103.A NH1 GLU 105.A OE2.A no hydrogen 3.518 N/A GLY 104.A N THR 100.A O no hydrogen 2.839 N/A SER 107.A N ILE 98.A O no hydrogen 2.816 N/A SER 107.A OG PRO 108.A O no hydrogen 2.739 N/A ARG 110.A N TYR 113.A OH no hydrogen 2.986 N/A ARG 110.A NH1 VAL 109.A O no hydrogen 2.924 N/A TYR 113.A N VAL 82.A O no hydrogen 2.776 N/A ALA 114.A N ASP 130.A OD1 no hydrogen 2.771 N/A VAL 116.A N LEU 129.A O no hydrogen 3.076 N/A ILE 117.A N TYR 78.A O no hydrogen 2.934 N/A PHE 118.A N TYR 78.A O no hydrogen 3.323 N/A SER 119.A N GLN 56.A OE1 no hydrogen 2.830 N/A SER 119.A OG GLU 127.A OE1 no hydrogen 2.958 N/A GLN 120.A N VAL 76.A O no hydrogen 2.936 N/A SER 122.A OG SER 74.A O no hydrogen 2.719 N/A VAL 123.A N GLN 120.A O no hydrogen 2.923 N/A SER 124.A N ASP 121.A O no hydrogen 3.189 N/A SER 124.A OG ASP 121.A O no hydrogen 3.304 N/A LEU 126.A N VAL 123.A O no hydrogen 3.022 N/A GLU 127.A N SER 124.A O no hydrogen 3.027 N/A SER 128.A N VAL 116.A O no hydrogen 2.952 N/A SER 128.A OG GLU 127.A O no hydrogen 2.607 N/A LEU 129.A N LEU 126.A O no hydrogen 2.920 N/A ASP 130.A N LYS 99.A O no hydrogen 2.778 N/A MET 131.A N ALA 114.A O no hydrogen 2.900 N/A MET 132.A N ASP 130.A OD1 no hydrogen 2.888 N/A SER 133.A N ASP 130.A O no hydrogen 2.959 N/A SER 133.A OG ASP 130.A O no hydrogen 2.667 N/A GLU 136.A N GLU 136.A OE1 no hydrogen 2.812 N/A ARG 138.A N GLY 134.A O no hydrogen 2.819 N/A ARG 138.A NE GLU 135.A OE1 no hydrogen 3.369 N/A ARG 138.A NE GLU 135.A OE2 no hydrogen 2.939 N/A ARG 138.A NH2 GLU 135.A OE1 no hydrogen 3.093 N/A GLU 139.A N GLU 135.A O no hydrogen 3.047 N/A ASN 140.A N GLU 136.A O no hydrogen 3.090 N/A ASN 140.A ND2 VAL 151.A O no hydrogen 3.093 N/A ASN 140.A ND2 VAL 167.A O no hydrogen 3.091 N/A ASN 140.A ND2 THR 169.A OG1 no hydrogen 3.024 N/A ILE 141.A N ASP 137.A O no hydrogen 2.876 N/A LEU 142.A N ARG 138.A O no hydrogen 3.091 N/A ARG 143.A N GLU 139.A O no hydrogen 3.020 N/A ARG 143.A NH2 LEU 152.A O no hydrogen 2.961 N/A ARG 143.A NH2 ASP 255.A OD2 no hydrogen 2.795 N/A ALA 144.A N ASN 140.A O no hydrogen 2.853 N/A ARG 145.A N ILE 141.A O no hydrogen 3.024 N/A ARG 145.A NH1 GLU 112.A OE1 no hydrogen 2.846 N/A ARG 145.A NH1 TYR 193.A OH no hydrogen 2.895 N/A ARG 145.A NH2 GLU 112.A OE2 no hydrogen 2.911 N/A GLU 146.A N LEU 142.A O no hydrogen 3.008 N/A THR 147.A N ARG 143.A O no hydrogen 3.034 N/A THR 147.A OG1 ARG 143.A O no hydrogen 2.647 N/A GLY 148.A N ALA 144.A O no hydrogen 2.997 N/A VAL 151.A N THR 169.A O no hydrogen 2.969 N/A LEU 152.A N ASP 255.A OD2 no hydrogen 2.964 N/A THR 153.A N VAL 167.A O no hydrogen 3.072 N/A THR 153.A OG1 SER 154.A O no hydrogen 2.776 N/A PHE 156.A N GLY 165.A O no hydrogen 2.946 N/A ARG 157.A NH1 HIS 162.A O no hydrogen 2.808 N/A ARG 157.A NH1 GLU 201.A OE1 no hydrogen 2.907 N/A LEU 158.A N HIS 163.A O no hydrogen 2.970 N/A THR 161.A N LEU 159.A O no hydrogen 2.811 N/A HIS 162.A N LEU 158.A O no hydrogen 2.959 N/A HIS 163.A N THR 161.A OG1 no hydrogen 3.127 N/A HIS 163.A ND1 ASP 199.A OD2 no hydrogen 2.733 N/A LEU 164.A N GLU 201.A OE1 no hydrogen 2.842 N/A GLY 165.A N PHE 156.A O no hydrogen 2.931 N/A VAL 166.A N PHE 198.A O no hydrogen 3.048 N/A VAL 167.A N THR 153.A OG1 no hydrogen 2.908 N/A LEU 168.A N GLY 196.A O no hydrogen 2.860 N/A THR 169.A N VAL 151.A O no hydrogen 3.056 N/A PHE 170.A N LEU 194.A O no hydrogen 2.797 N/A VAL 172.A N GLY 192.A O no hydrogen 2.752 N/A TYR 173.A OH ARG 145.A O no hydrogen 2.600 N/A LYS 174.A N ALA 189.A O no hydrogen 2.721 N/A LEU 177.A N LYS 174.A O no hydrogen 3.126 N/A THR 182.A N GLU 185.A OE1 no hydrogen 2.846 N/A GLU 185.A N THR 182.A OG1 no hydrogen 3.005 N/A ARG 186.A N THR 182.A O no hydrogen 2.952 N/A ARG 186.A NH1 TYR 173.A OH no hydrogen 3.408 N/A ILE 187.A N VAL 183.A O no hydrogen 2.994 N/A ALA 188.A N GLU 184.A O no hydrogen 3.215 N/A ALA 189.A N GLU 185.A O no hydrogen 2.958 N/A THR 190.A N ILE 187.A O no hydrogen 3.138 N/A THR 190.A OG1 ARG 186.A O no hydrogen 2.730 N/A THR 190.A OG1 ILE 187.A O no hydrogen 3.396 N/A ALA 191.A N VAL 172.A O no hydrogen 2.821 N/A GLY 192.A N VAL 172.A O no hydrogen 3.204 N/A TYR 193.A N ALA 79.A O no hydrogen 2.852 N/A LEU 194.A N PHE 170.A O no hydrogen 2.784 N/A GLY 195.A N ALA 77.A O no hydrogen 2.896 N/A GLY 196.A N LEU 168.A O no hydrogen 2.885 N/A ALA 197.A N GLY 75.A O no hydrogen 3.135 N/A PHE 198.A N VAL 166.A O no hydrogen 2.822 N/A VAL 200.A N PHE 198.A O no hydrogen 2.935 N/A GLU 201.A N LEU 164.A O no hydrogen 3.019 N/A SER 202.A N ASP 199.A OD1 no hydrogen 3.080 N/A LEU 203.A N ASP 199.A O no hydrogen 2.892 N/A VAL 204.A N VAL 200.A O no hydrogen 2.877 N/A ASN 206.A N SER 202.A O no hydrogen 2.993 N/A LEU 207.A N LEU 203.A O no hydrogen 3.005 N/A LEU 208.A N VAL 204.A O no hydrogen 2.887 N/A GLY 209.A N GLU 205.A O no hydrogen 2.768 N/A GLN 210.A NE2 ASN 206.A O no hydrogen 3.106 N/A LEU 211.A N LEU 208.A O no hydrogen 3.152 N/A ASN 214.A N LEU 211.A O no hydrogen 3.189 N/A ASN 214.A ND2 LEU 211.A O no hydrogen 2.684 N/A GLN 215.A N GLN 215.A OE1 no hydrogen 2.756 N/A ALA 216.A N GLY 213.A O no hydrogen 3.150 N/A ILE 217.A N ASN 214.A O no hydrogen 3.242 N/A VAL 218.A N ARG 265.A O no hydrogen 2.683 N/A HIS 220.A N ILE 263.A O no hydrogen 2.945 N/A VAL 221.A N TYR 234.A O no hydrogen 2.928 N/A TYR 222.A N LYS 261.A O no hydrogen 2.856 N/A ASP 223.A N LEU 231.A O no hydrogen 2.806 N/A ILE 224.A N LYS 259.A O no hydrogen 2.826 N/A THR 225.A N ASP 223.A OD1 no hydrogen 2.988 N/A THR 225.A OG1 ASP 223.A OD1 no hydrogen 2.612 N/A SER 228.A N ASN 226.A OD1 no hydrogen 3.212 N/A SER 228.A OG ASN 226.A OD1 no hydrogen 2.786 N/A ASP 229.A N ASN 226.A O no hydrogen 2.981 N/A LEU 231.A N ASP 223.A O no hydrogen 2.853 N/A MET 233.A N VAL 221.A O no hydrogen 2.862 N/A TYR 234.A N VAL 221.A O no hydrogen 3.105 N/A GLU 239.A N ASN 236.A O no hydrogen 2.877 N/A ASP 242.A N TYR 266.A O no hydrogen 2.684 N/A SER 244.A N ASP 242.A OD1 no hydrogen 3.327 N/A SER 244.A OG ASP 242.A OD1 no hydrogen 3.128 N/A SER 244.A OG ASP 242.A OD2 no hydrogen 3.567 N/A HIS 247.A N CYS 264.A O no hydrogen 3.037 N/A SER 249.A N MET 262.A O no hydrogen 2.845 N/A SER 249.A OG ASP 18.A OD1 no hydrogen 2.741 N/A ASP 252.A N GLN 25.A OE1 no hydrogen 2.930 N/A GLY 254.A N ASP 252.A OD2 no hydrogen 2.932 N/A PHE 257.A N ASP 255.A OD1 no hydrogen 2.871 N/A ARG 258.A N ASP 255.A O no hydrogen 2.899 N/A ARG 258.A NE LEU 152.A O no hydrogen 2.935 N/A LYS 259.A N THR 225.A OG1 no hydrogen 3.140 N/A LYS 259.A NZ.A PRO 256.A O no hydrogen 2.946 N/A LYS 261.A N TYR 222.A O no hydrogen 3.054 N/A MET 262.A N SER 249.A O no hydrogen 3.076 N/A ILE 263.A N HIS 220.A O no hydrogen 2.835 N/A CYS 264.A N HIS 247.A O no hydrogen 2.946 N/A ARG 265.A N VAL 218.A O no hydrogen 3.020 N/A ARG 265.A NH1 ASP 242.A O no hydrogen 3.141 N/A TYR 266.A OH ARG 9.A O no hydrogen 2.476 N/A HIS 267.A N ALA 216.A O no hydrogen 3.176 N/A