Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4y8f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A NE ASP 231.A OD1 no hydrogen 2.853 N/A ARG 5.A NH1 ASP 206.A O no hydrogen 2.904 N/A ILE 8.A N ASP 231.A O no hydrogen 2.953 N/A ILE 9.A N GLU 39.A O no hydrogen 2.911 N/A ALA 10.A N ALA 233.A O no hydrogen 2.908 N/A GLY 11.A N VAL 41.A O no hydrogen 2.737 N/A ASN 12.A N VAL 235.A O no hydrogen 2.753 N/A TRP 13.A N CYS 43.A O no hydrogen 3.251 N/A LYS 14.A N ASN 12.A OD1 no hydrogen 3.119 N/A LYS 14.A NZ GLU 99.A OE2 no hydrogen 2.776 N/A HIS 16.A N LYS 14.A O no hydrogen 3.001 N/A TYR 17.A OH LEU 240.A O no hydrogen 2.588 N/A THR 18.A N GLU 21.A OE1 no hydrogen 2.976 N/A GLU 21.A N THR 18.A OG1 no hydrogen 3.299 N/A ALA 22.A N THR 18.A O no hydrogen 2.818 N/A VAL 23.A N ILE 19.A O no hydrogen 2.919 N/A LYS 24.A N ASP 20.A O no hydrogen 2.992 N/A LYS 24.A NZ GLU 28.A OE2 no hydrogen 3.106 N/A LEU 25.A N GLU 21.A O no hydrogen 3.038 N/A VAL 26.A N ALA 22.A O no hydrogen 3.107 N/A GLU 27.A N VAL 23.A O no hydrogen 2.950 N/A GLU 28.A N LYS 24.A O no hydrogen 3.069 N/A LEU 29.A N LEU 25.A O no hydrogen 2.977 N/A LYS 30.A N VAL 26.A O no hydrogen 3.072 N/A LYS 30.A NZ GLU 27.A OE1.A no hydrogen 2.948 N/A LYS 30.A NZ GLU 27.A OE2.A no hydrogen 3.258 N/A LYS 30.A NZ ALA 55.A O no hydrogen 2.734 N/A LEU 32.A N LEU 29.A O no hydrogen 2.879 N/A VAL 33.A N LYS 30.A O no hydrogen 3.419 N/A LYS 34.A NZ.B ASP 35.A OD2 no hydrogen 3.122 N/A ALA 36.A N VAL 33.A O no hydrogen 3.119 N/A CYS 38.A SG GLU 39.A O no hydrogen 3.628 N/A CYS 38.A SG VAL 249.A O no hydrogen 3.754 N/A GLU 39.A N PRO 7.A O no hydrogen 2.858 N/A VAL 41.A N ILE 9.A O no hydrogen 3.030 N/A VAL 42.A N LYS 62.A O no hydrogen 2.948 N/A CYS 43.A N GLY 11.A O no hydrogen 2.821 N/A CYS 48.A N THR 45.A O no hydrogen 2.900 N/A CYS 48.A SG TYR 17.A O no hydrogen 3.435 N/A CYS 48.A SG THR 45.A OG1 no hydrogen 3.584 N/A LEU 49.A N PHE 46.A O no hydrogen 3.231 N/A VAL 52.A N CYS 48.A O no hydrogen 2.991 N/A LYS 53.A N LEU 49.A O no hydrogen 2.897 N/A LYS 53.A NZ ASP 91.A OD1 no hydrogen 3.520 N/A LYS 53.A NZ ASP 91.A OD2 no hydrogen 2.889 N/A LYS 54.A N ASP 50.A O no hydrogen 3.005 N/A LYS 54.A NZ ASP 50.A OD1 no hydrogen 3.345 N/A LYS 54.A NZ ASP 50.A OD2 no hydrogen 2.764 N/A ALA 55.A N ALA 51.A O no hydrogen 2.945 N/A VAL 56.A N VAL 52.A O no hydrogen 3.046 N/A GLU 57.A N LYS 54.A O no hydrogen 3.418 N/A THR 59.A N VAL 56.A O no hydrogen 3.052 N/A THR 59.A OG1 VAL 56.A O no hydrogen 2.787 N/A ASN 60.A ND2 VAL 33.A O no hydrogen 2.947 N/A ILE 61.A N THR 59.A OG1 no hydrogen 3.118 N/A LYS 62.A N VAL 40.A O no hydrogen 2.869 N/A LYS 62.A NZ GLU 39.A OE2 no hydrogen 2.704 N/A VAL 63.A N ASP 91.A OD2 no hydrogen 2.926 N/A GLY 64.A N VAL 42.A O no hydrogen 2.828 N/A ALA 65.A N TYR 92.A O no hydrogen 2.909 N/A GLN 66.A NE2 LYS 14.A O no hydrogen 2.953 N/A GLN 66.A NE2 CYS 43.A O no hydrogen 2.844 N/A HIS 69.A N ILE 80.A O no hydrogen 2.824 N/A GLU 71.A N HIS 69.A ND1 no hydrogen 3.043 N/A PHE 76.A N GLY 74.A O no hydrogen 2.911 N/A GLU 79.A N PHE 76.A O no hydrogen 3.002 N/A MET 84.A N ALA 81.A O no hydrogen 2.871 N/A GLU 86.A N PRO 82.A O no hydrogen 2.956 N/A ALA 87.A N ARG 83.A O no hydrogen 2.984 N/A MET 88.A N LEU 85.A O no hydrogen 3.024 N/A ASN 89.A N GLU 86.A O no hydrogen 2.947 N/A ILE 90.A N LEU 85.A O no hydrogen 3.207 N/A ASP 91.A N VAL 63.A O no hydrogen 2.885 N/A TYR 92.A N VAL 63.A O no hydrogen 3.073 N/A TYR 92.A OH GLU 39.A OE2 no hydrogen 2.507 N/A VAL 93.A N THR 124.A O no hydrogen 2.995 N/A ILE 94.A N ALA 65.A O no hydrogen 2.861 N/A ILE 95.A N ILE 126.A O no hydrogen 2.850 N/A SER 98.A N GLU 169.A OE2 no hydrogen 2.857 N/A SER 98.A OG GLU 169.A OE1 no hydrogen 2.697 N/A GLU 99.A N HIS 97.A ND1 no hydrogen 3.038 N/A ARG 100.A N HIS 97.A O no hydrogen 2.903 N/A ARG 101.A N HIS 97.A O no hydrogen 3.017 N/A ARG 101.A NE GLY 96.A O no hydrogen 2.816 N/A ARG 101.A NH1 ASP 108.A OD1 no hydrogen 2.911 N/A ARG 101.A NH2 CYS 128.A O no hydrogen 2.929 N/A ARG 101.A NH2 ASP 152.A OD2 no hydrogen 2.863 N/A GLU 102.A N SER 98.A O no hydrogen 2.808 N/A TYR 103.A N GLU 99.A O no hydrogen 3.028 N/A PHE 104.A N ARG 100.A O no hydrogen 2.992 N/A GLU 106.A N ARG 100.A O no hydrogen 3.287 N/A THR 107.A N THR 110.A OG1 no hydrogen 3.111 N/A THR 107.A OG1 THR 110.A OG1 no hydrogen 3.343 N/A THR 110.A N THR 107.A OG1 no hydrogen 3.145 N/A THR 110.A OG1 GLU 106.A OE2 no hydrogen 2.585 N/A THR 110.A OG1 THR 107.A O no hydrogen 3.127 N/A THR 110.A OG1 THR 107.A OG1 no hydrogen 3.343 N/A CYS 111.A N THR 107.A O no hydrogen 2.933 N/A CYS 111.A SG THR 107.A O no hydrogen 3.341 N/A ASN 112.A N ASP 108.A O no hydrogen 2.922 N/A ASN 112.A ND2 ASP 152.A O no hydrogen 2.955 N/A ASN 112.A ND2 GLU 154.A O no hydrogen 2.918 N/A LYS 113.A N GLU 109.A O no hydrogen 3.126 N/A LYS 114.A N THR 110.A O no hydrogen 2.925 N/A LYS 114.A NZ ASN 67.A OD1 no hydrogen 2.980 N/A LYS 114.A NZ MET 68.A O no hydrogen 2.876 N/A LYS 114.A NZ GLU 106.A OE1 no hydrogen 2.859 N/A LYS 114.A NZ GLU 106.A OE2 no hydrogen 3.290 N/A VAL 115.A N CYS 111.A O no hydrogen 2.884 N/A LYS 116.A N ASN 112.A O no hydrogen 3.098 N/A LYS 116.A NZ ASN 112.A OD1 no hydrogen 2.858 N/A LYS 116.A NZ GLU 154.A OE1 no hydrogen 2.980 N/A ALA 117.A N LYS 113.A O no hydrogen 3.023 N/A ALA 118.A N LYS 114.A O no hydrogen 2.864 N/A PHE 119.A N VAL 115.A O no hydrogen 3.346 N/A ALA 120.A N LYS 116.A O no hydrogen 3.192 N/A HIS 121.A N ALA 118.A O no hydrogen 2.959 N/A HIS 121.A ND1 GLU 86.A OE1 no hydrogen 2.820 N/A HIS 121.A NE2 GLU 72.A OE2 no hydrogen 2.624 N/A ASN 122.A ND2.B GLU 86.A OE2 no hydrogen 2.730 N/A LEU 123.A N ALA 118.A O no hydrogen 3.041 N/A THR 124.A N ASP 91.A O no hydrogen 2.947 N/A ILE 126.A N VAL 93.A O no hydrogen 2.831 N/A LEU 127.A N VAL 165.A O no hydrogen 2.788 N/A CYS 128.A N ILE 95.A O no hydrogen 2.869 N/A CYS 129.A N ALA 167.A O no hydrogen 2.988 N/A CYS 129.A SG ALA 167.A O no hydrogen 3.954 N/A GLY 130.A N GLN 148.A OE1 no hydrogen 2.888 N/A GLU 131.A N GLU 131.A OE1 no hydrogen 2.840 N/A THR 132.A N GLN 135.A OE1 no hydrogen 2.906 N/A GLN 135.A N THR 132.A OG1 no hydrogen 3.143 N/A ARG 136.A N THR 132.A O no hydrogen 3.015 N/A ARG 136.A NE GLU 131.A OE2 no hydrogen 2.513 N/A ARG 136.A NH2 GLU 131.A OE2 no hydrogen 2.960 N/A ARG 136.A NH2 THR 188.A OG1 no hydrogen 3.049 N/A GLU 137.A N LEU 133.A O no hydrogen 2.933 N/A ASN 138.A N GLU 134.A O no hydrogen 3.000 N/A GLY 139.A N ARG 136.A O no hydrogen 2.983 N/A THR 140.A N GLN 135.A O no hydrogen 2.920 N/A THR 140.A OG1 GLN 135.A O no hydrogen 2.959 N/A THR 141.A OG1 GLU 131.A OE2 no hydrogen 2.856 N/A VAL 144.A N THR 140.A O no hydrogen 2.873 N/A ILE 145.A N THR 141.A O no hydrogen 2.960 N/A LYS 146.A N ASN 142.A O no hydrogen 2.860 N/A ALA 147.A N ASP 143.A O no hydrogen 3.008 N/A GLN 148.A N VAL 144.A O no hydrogen 3.133 N/A ILE 149.A N ILE 145.A O no hydrogen 2.839 N/A THR 150.A N LYS 146.A O no hydrogen 2.888 N/A THR 150.A OG1.A LYS 146.A O no hydrogen 2.769 N/A THR 150.A OG1.B LYS 146.A O no hydrogen 2.931 N/A THR 150.A OG1.B ALA 147.A O no hydrogen 3.313 N/A ALA 151.A N ALA 147.A O no hydrogen 3.117 N/A ASP 152.A N GLN 148.A O no hydrogen 2.730 N/A LEU 153.A N ILE 149.A O no hydrogen 2.960 N/A GLU 154.A N ALA 151.A O no hydrogen 3.461 N/A LEU 156.A N LEU 153.A O no hydrogen 3.404 N/A THR 157.A N GLN 160.A OE1 no hydrogen 3.009 N/A GLN 160.A N THR 157.A OG1 no hydrogen 3.045 N/A ALA 161.A N THR 157.A O no hydrogen 2.871 N/A GLU 162.A N LYS 158.A O no hydrogen 3.088 N/A LYS 163.A N GLN 160.A O no hydrogen 2.953 N/A VAL 164.A N ALA 161.A O no hydrogen 3.170 N/A VAL 165.A N PRO 125.A O no hydrogen 3.004 N/A ILE 166.A N ARG 209.A O no hydrogen 3.007 N/A ALA 167.A N LEU 127.A O no hydrogen 2.816 N/A TYR 168.A N GLN 211.A O no hydrogen 2.898 N/A TYR 168.A OH GLU 131.A OE1 no hydrogen 2.584 N/A TYR 168.A OH GLU 131.A OE2 no hydrogen 3.338 N/A GLU 169.A N CYS 129.A O no hydrogen 2.774 N/A ILE 171.A N GLU 169.A O no hydrogen 2.885 N/A TRP 172.A N GLU 131.A O no hydrogen 3.150 N/A TRP 172.A NE1 TYR 168.A OH no hydrogen 3.032 N/A ALA 173.A N PRO 170.A O no hydrogen 2.888 N/A ILE 174.A N ILE 171.A O no hydrogen 2.908 N/A THR 176.A OG1 ALA 173.A O no hydrogen 3.241 N/A LYS 178.A N THR 176.A OG1 no hydrogen 3.283 N/A THR 181.A N GLN 184.A OE1 no hydrogen 2.858 N/A SER 182.A OG GLU 223.A OE2 no hydrogen 2.581 N/A GLN 184.A N THR 181.A OG1 no hydrogen 2.992 N/A ALA 185.A N THR 181.A O no hydrogen 2.924 N/A ASN 186.A N SER 182.A O no hydrogen 2.893 N/A ASN 186.A ND2 SER 228.A OG no hydrogen 2.958 N/A GLU 187.A N ASP 183.A O no hydrogen 2.909 N/A THR 188.A N GLN 184.A O no hydrogen 3.193 N/A THR 188.A OG1 GLN 184.A O no hydrogen 3.461 N/A ILE 189.A N ALA 185.A O no hydrogen 2.925 N/A ALA 190.A N ASN 186.A O no hydrogen 2.800 N/A ALA 191.A N GLU 187.A O no hydrogen 3.081 N/A ILE 192.A N THR 188.A O no hydrogen 2.972 N/A ARG 193.A N ILE 189.A O no hydrogen 3.009 N/A ARG 193.A NE ASP 229.A OD1 no hydrogen 2.942 N/A ARG 193.A NH1 ALA 205.A O no hydrogen 2.806 N/A ARG 193.A NH1 VAL 208.A O no hydrogen 2.822 N/A ARG 193.A NH2 ASP 229.A O no hydrogen 2.918 N/A ARG 193.A NH2 ASP 231.A OD2 no hydrogen 2.811 N/A ALA 194.A N ALA 190.A O no hydrogen 3.018 N/A MET 195.A N ALA 191.A O no hydrogen 2.917 N/A VAL 196.A N ILE 192.A O no hydrogen 2.906 N/A ALA 197.A N ARG 193.A O no hydrogen 2.924 N/A GLU 198.A N ALA 194.A O no hydrogen 3.016 N/A MET 199.A N MET 195.A O no hydrogen 3.199 N/A MET 199.A N VAL 196.A O no hydrogen 3.107 N/A PHE 200.A N VAL 196.A O no hydrogen 2.793 N/A GLY 201.A N ALA 197.A O no hydrogen 2.795 N/A GLN 202.A NE2 ASP 206.A OD1 no hydrogen 2.921 N/A ALA 205.A N GLY 201.A O no hydrogen 3.133 N/A ASP 206.A N GLN 202.A O no hydrogen 2.934 N/A LYS 207.A N VAL 204.A O no hydrogen 3.051 N/A VAL 208.A N VAL 204.A O no hydrogen 3.033 N/A ARG 209.A NH1 THR 6.A O no hydrogen 2.801 N/A ARG 209.A NH1 GLU 39.A OE1 no hydrogen 3.047 N/A ARG 209.A NH2 GLU 39.A OE1 no hydrogen 3.277 N/A ARG 209.A NH2 TYR 92.A OH no hydrogen 3.291 N/A ILE 210.A N ASP 231.A OD2 no hydrogen 2.938 N/A GLN 211.A N ILE 166.A O no hydrogen 2.698 N/A GLN 211.A NE2 ILE 8.A O no hydrogen 3.007 N/A TYR 212.A N GLY 232.A O no hydrogen 2.949 N/A GLY 213.A N TYR 168.A O no hydrogen 2.734 N/A LYS 217.A N THR 220.A OG1 no hydrogen 3.027 N/A THR 220.A N LYS 217.A O no hydrogen 3.001 N/A THR 220.A OG1 LYS 217.A O no hydrogen 3.176 N/A THR 220.A OG1 GLN 224.A OE1.A no hydrogen 2.792 N/A ILE 221.A N LYS 217.A O no hydrogen 3.282 N/A GLN 224.A N THR 220.A O no hydrogen 3.176 N/A GLN 224.A NE2.A SER 215.A O no hydrogen 3.159 N/A GLN 224.A NE2.B GLY 232.A O no hydrogen 2.931 N/A MET 225.A N ILE 221.A O no hydrogen 2.810 N/A ALA 226.A N ALA 222.A O no hydrogen 3.135 N/A ALA 226.A N GLU 223.A O no hydrogen 3.294 N/A LYS 227.A N GLN 224.A O no hydrogen 3.257 N/A LYS 227.A NZ ASP 183.A OD1 no hydrogen 3.554 N/A SER 228.A OG ASP 229.A OD2 no hydrogen 2.685 N/A ASP 229.A N ASN 186.A OD1 no hydrogen 2.904 N/A ILE 230.A N LYS 227.A O no hydrogen 3.498 N/A ASP 231.A N ILE 210.A O no hydrogen 2.857 N/A ALA 233.A N ILE 8.A O no hydrogen 3.149 N/A LEU 234.A N TYR 212.A O no hydrogen 2.966 N/A VAL 235.A N ALA 10.A O no hydrogen 2.808 N/A SER 239.A N GLY 236.A O no hydrogen 2.841 N/A SER 239.A OG GLY 236.A O no hydrogen 2.662 N/A LEU 240.A N GLY 237.A O no hydrogen 3.047 N/A VAL 241.A N ALA 238.A O no hydrogen 3.500 N/A PHE 245.A N VAL 241.A O no hydrogen 2.872 N/A ALA 246.A N ALA 242.A O no hydrogen 2.863 N/A GLN 247.A N ALA 243.A O no hydrogen 3.066 N/A ILE 248.A N ASP 244.A O no hydrogen 3.220 N/A VAL 249.A N PHE 245.A O no hydrogen 2.924 N/A ASN 250.A N ALA 246.A O no hydrogen 2.915 N/A