Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3zfy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N ARG 16.A O no hydrogen 3.002 N/A GLU 5.A N ARG 14.A O no hydrogen 2.747 N/A CYS 13.A N ILE 27.A O no hydrogen 2.835 N/A ARG 14.A N GLU 6.A O no hydrogen 2.953 N/A GLY 15.A N VAL 25.A O no hydrogen 3.093 N/A ARG 16.A N LYS 3.A O no hydrogen 2.831 N/A LEU 17.A N VAL 23.A O no hydrogen 2.833 N/A LYS 18.A N CYS 1.A O no hydrogen 3.103 N/A VAL 23.A N LEU 17.A O no hydrogen 3.062 N/A VAL 25.A N GLY 15.A O no hydrogen 2.960 N/A ALA 26.A N THR 74.A O no hydrogen 2.948 N/A ILE 27.A N CYS 13.A O no hydrogen 2.982 N/A LYS 28.A N ILE 72.A O no hydrogen 3.125 N/A LYS 28.A NZ PHE 140.A O no hydrogen 2.844 N/A LYS 31.A N PHE 9.A O no hydrogen 3.248 N/A ARG 39.A N THR 35.A O no hydrogen 2.746 N/A ARG 40.A N GLU 36.A O no hydrogen 2.817 N/A ASP 41.A N ARG 37.A O no hydrogen 3.210 N/A PHE 42.A N GLN 38.A O no hydrogen 3.389 N/A LEU 43.A N ARG 39.A O no hydrogen 3.349 N/A SER 44.A N ARG 40.A O no hydrogen 3.384 N/A SER 44.A OG ARG 40.A O no hydrogen 2.952 N/A SER 44.A OG ASP 41.A O no hydrogen 3.031 N/A GLU 45.A N ASP 41.A O no hydrogen 3.305 N/A SER 47.A N LEU 43.A O no hydrogen 2.904 N/A SER 47.A OG LEU 43.A O no hydrogen 3.530 N/A ILE 48.A N SER 44.A O no hydrogen 2.914 N/A MET 49.A N GLU 45.A O no hydrogen 3.042 N/A GLY 50.A N ALA 46.A O no hydrogen 2.767 N/A PHE 52.A N MET 49.A O no hydrogen 3.448 N/A ASP 53.A N TYR 111.A OH no hydrogen 2.977 N/A ASN 56.A N HIS 54.A ND1 no hydrogen 3.130 N/A ASN 56.A ND2 CYS 135.A O no hydrogen 3.103 N/A ILE 57.A N HIS 54.A O no hydrogen 2.959 N/A ILE 58.A N VAL 137.A O no hydrogen 3.086 N/A ARG 59.A N GLU 75.A OE2 no hydrogen 2.699 N/A ARG 59.A NE GLU 61.A OE2 no hydrogen 3.052 N/A GLY 62.A N LEU 73.A O no hydrogen 3.149 N/A VAL 64.A N MET 71.A O no hydrogen 3.292 N/A MET 71.A N VAL 64.A O no hydrogen 3.165 N/A ILE 72.A N LYS 28.A O no hydrogen 3.043 N/A LEU 73.A N GLY 62.A O no hydrogen 2.805 N/A THR 74.A N ALA 26.A O no hydrogen 2.937 N/A THR 74.A OG1 ALA 26.A O no hydrogen 3.354 N/A GLU 75.A N ARG 59.A O no hydrogen 3.037 N/A GLU 78.A N GLU 78.A OE1 no hydrogen 2.835 N/A ASN 79.A N VAL 129.A O no hydrogen 2.872 N/A ASN 79.A ND2 ASN 130.A O no hydrogen 2.596 N/A CYS 80.A N MET 77.A O no hydrogen 3.132 N/A CYS 80.A SG GLU 78.A O no hydrogen 3.894 N/A LEU 82.A N ILE 127.A O no hydrogen 2.779 N/A SER 84.A N ASP 83.A OD1 no hydrogen 2.928 N/A SER 84.A OG ALA 81.A O no hydrogen 3.095 N/A PHE 85.A N ALA 81.A O no hydrogen 3.111 N/A LEU 86.A N LEU 82.A O no hydrogen 2.877 N/A ARG 87.A N ASP 83.A O no hydrogen 3.179 N/A ARG 87.A NH1 GLY 190.A O no hydrogen 2.916 N/A ARG 87.A NH2 ASP 83.A OD2 no hydrogen 3.285 N/A LEU 88.A N SER 84.A O no hydrogen 2.947 N/A ASN 89.A N LEU 86.A O no hydrogen 3.209 N/A ASN 89.A ND2 PHE 85.A O no hydrogen 2.673 N/A GLN 92.A N ASN 89.A O no hydrogen 3.086 N/A PHE 93.A N TYR 189.A OH no hydrogen 3.169 N/A THR 94.A N GLN 97.A OE1 no hydrogen 2.728 N/A GLN 97.A N THR 94.A OG1 no hydrogen 3.104 N/A LEU 98.A N THR 94.A O no hydrogen 3.065 N/A VAL 99.A N VAL 95.A O no hydrogen 2.961 N/A GLY 100.A N ILE 96.A O no hydrogen 2.860 N/A MET 101.A N GLN 97.A O no hydrogen 2.968 N/A LEU 102.A N LEU 98.A O no hydrogen 3.031 N/A ARG 103.A N VAL 99.A O no hydrogen 2.740 N/A ARG 103.A NE ASP 248.A OD1 no hydrogen 2.862 N/A ARG 103.A NH2 ASP 248.A OD2 no hydrogen 3.029 N/A GLY 104.A N GLY 100.A O no hydrogen 3.118 N/A ILE 105.A N MET 101.A O no hydrogen 3.168 N/A ALA 106.A N LEU 102.A O no hydrogen 2.829 N/A ALA 107.A N ARG 103.A O no hydrogen 2.809 N/A GLY 108.A N GLY 104.A O no hydrogen 2.970 N/A MET 109.A N ILE 105.A O no hydrogen 2.976 N/A LYS 110.A N ALA 106.A O no hydrogen 2.981 N/A LYS 110.A NZ GLU 114.A OE2 no hydrogen 3.019 N/A TYR 111.A N ALA 107.A O no hydrogen 3.127 N/A LEU 112.A N GLY 108.A O no hydrogen 2.995 N/A SER 113.A N MET 109.A O no hydrogen 2.967 N/A SER 113.A OG SER 172.A OG no hydrogen 2.736 N/A GLU 114.A N LYS 110.A O no hydrogen 2.986 N/A MET 115.A N TYR 111.A O no hydrogen 3.014 N/A ASN 116.A N SER 113.A O no hydrogen 3.040 N/A TYR 117.A N LEU 112.A O no hydrogen 2.857 N/A HIS 119.A N ASP 175.A OD2 no hydrogen 2.847 N/A HIS 119.A NE2 SER 138.A O no hydrogen 2.875 N/A ARG 120.A N ASP 175.A OD1 no hydrogen 3.114 N/A ASP 121.A N HIS 119.A ND1 no hydrogen 3.269 N/A ALA 124.A N GLU 185.A OE1 no hydrogen 2.913 N/A ARG 125.A NE TYR 150.A OH no hydrogen 2.662 N/A ARG 125.A NH2 ASP 121.A OD1 no hydrogen 2.628 N/A ARG 125.A NH2 TYR 150.A OH no hydrogen 3.011 N/A ASN 126.A N ALA 123.A O no hydrogen 2.858 N/A ASN 126.A ND2 ASP 121.A O no hydrogen 2.615 N/A ILE 127.A N ALA 124.A O no hydrogen 3.046 N/A LEU 128.A N LYS 136.A O no hydrogen 2.806 N/A VAL 129.A N CYS 80.A O no hydrogen 2.896 N/A ASN 130.A N VAL 134.A O no hydrogen 3.123 N/A SER 131.A N GLU 78.A OE1 no hydrogen 2.991 N/A SER 131.A OG GLU 78.A OE1 no hydrogen 3.148 N/A SER 131.A OG GLU 78.A OE2 no hydrogen 3.158 N/A ASN 132.A N ASN 130.A OD1 no hydrogen 3.199 N/A LEU 133.A N ASN 130.A O no hydrogen 2.911 N/A VAL 134.A N ASN 130.A OD1 no hydrogen 2.823 N/A CYS 135.A SG LEU 133.A O no hydrogen 3.998 N/A LYS 136.A N LEU 128.A O no hydrogen 2.736 N/A LYS 136.A NZ GLU 75.A OE1 no hydrogen 2.543 N/A LYS 136.A NZ GLU 75.A OE2 no hydrogen 3.049 N/A VAL 137.A N ASN 56.A O no hydrogen 2.745 N/A SER 138.A N ASN 126.A O no hydrogen 2.841 N/A SER 138.A OG ASP 139.A O no hydrogen 3.334 N/A PHE 140.A N ASP 139.A OD1 no hydrogen 2.546 N/A SER 146.A N ASP 144.A OD1 no hydrogen 2.930 N/A SER 146.A OG ASP 144.A OD1 no hydrogen 3.132 N/A SER 146.A OG ASP 144.A OD2 no hydrogen 2.980 N/A ASP 147.A N ASP 144.A O no hydrogen 2.882 N/A THR 149.A N GLU 142.A OE1 no hydrogen 3.150 N/A THR 149.A N GLU 142.A OE2 no hydrogen 3.349 N/A THR 149.A OG1 GLU 142.A OE1 no hydrogen 2.699 N/A TYR 150.A OH ASP 121.A OD1 no hydrogen 3.106 N/A TYR 150.A OH ASP 121.A OD2 no hydrogen 2.550 N/A THR 151.A N ILE 155.A O no hydrogen 2.831 N/A ILE 155.A N THR 151.A O no hydrogen 2.986 N/A ARG 158.A NE ASN 199.A OD1 no hydrogen 3.154 N/A ARG 158.A NH1 PRO 193.A O no hydrogen 3.096 N/A ARG 158.A NH1 MET 197.A O no hydrogen 3.129 N/A ARG 158.A NH2 MET 197.A O no hydrogen 2.571 N/A ARG 158.A NH2 ASN 199.A OD1 no hydrogen 3.013 N/A TRP 159.A N PRO 156.A O no hydrogen 3.096 N/A TRP 159.A NE1 GLU 185.A OE1 no hydrogen 2.935 N/A THR 160.A N ILE 157.A O no hydrogen 3.082 N/A THR 160.A OG1 PRO 156.A O no hydrogen 2.696 N/A GLU 163.A N GLU 163.A OE1 no hydrogen 2.738 N/A ALA 164.A N ALA 161.A O no hydrogen 2.949 N/A ILE 165.A N ALA 161.A O no hydrogen 3.038 N/A ALA 166.A N PRO 162.A O no hydrogen 2.945 N/A TYR 167.A N GLU 163.A O no hydrogen 2.997 N/A LYS 169.A N GLU 163.A O no hydrogen 3.223 N/A PHE 170.A N ARG 168.A O no hydrogen 2.946 N/A THR 171.A N SER 174.A OG no hydrogen 2.891 N/A SER 172.A OG SER 113.A OG no hydrogen 2.736 N/A SER 174.A N THR 171.A OG1 no hydrogen 3.259 N/A SER 174.A OG THR 171.A O no hydrogen 2.707 N/A ASP 175.A N THR 171.A O no hydrogen 2.965 N/A VAL 176.A N SER 172.A O no hydrogen 2.862 N/A TRP 177.A N ALA 173.A O no hydrogen 3.271 N/A SER 178.A N SER 174.A O no hydrogen 3.150 N/A SER 178.A OG TRP 159.A O no hydrogen 2.712 N/A SER 178.A OG SER 174.A O no hydrogen 3.291 N/A TYR 179.A N ASP 175.A O no hydrogen 2.804 N/A TYR 179.A OH LEU 102.A O no hydrogen 2.809 N/A GLY 180.A N VAL 176.A O no hydrogen 2.992 N/A ILE 181.A N TRP 177.A O no hydrogen 3.285 N/A VAL 182.A N SER 178.A O no hydrogen 2.906 N/A MET 183.A N TYR 179.A O no hydrogen 2.738 N/A TRP 184.A N GLY 180.A O no hydrogen 3.136 N/A TRP 184.A N ILE 181.A O no hydrogen 2.882 N/A TRP 184.A NE1 PRO 213.A O no hydrogen 2.775 N/A GLU 185.A N ILE 181.A O no hydrogen 2.974 N/A VAL 186.A N VAL 182.A O no hydrogen 3.025 N/A MET 187.A N MET 183.A O no hydrogen 2.940 N/A SER 188.A N TRP 184.A O no hydrogen 3.110 N/A SER 188.A N GLU 185.A O no hydrogen 3.313 N/A SER 188.A OG TRP 184.A O no hydrogen 2.766 N/A SER 188.A OG GLU 185.A O no hydrogen 3.142 N/A TYR 189.A N VAL 186.A O no hydrogen 2.992 N/A GLY 190.A N GLU 185.A O no hydrogen 2.818 N/A GLU 191.A N SER 188.A OG no hydrogen 3.251 N/A ARG 192.A NE TRP 195.A O no hydrogen 2.926 N/A ARG 192.A NH2 ASP 147.A O no hydrogen 3.098 N/A TRP 195.A N ARG 192.A O no hydrogen 2.988 N/A TRP 195.A NE1 GLU 191.A OE1 no hydrogen 2.926 N/A MET 197.A N TYR 194.A O no hydrogen 2.997 N/A SER 198.A N ASP 201.A OD2 no hydrogen 2.957 N/A ASN 199.A N ASP 147.A OD1 no hydrogen 3.206 N/A ASN 199.A ND2 PRO 148.A O no hydrogen 3.008 N/A GLN 200.A NE2 GLN 200.A O no hydrogen 3.176 N/A GLN 200.A NE2 ASN 204.A OD1 no hydrogen 2.853 N/A ASP 201.A N SER 198.A OG no hydrogen 2.735 N/A VAL 202.A N SER 198.A O no hydrogen 3.089 N/A ILE 203.A N ASN 199.A O no hydrogen 3.384 N/A ASN 204.A N GLN 200.A O no hydrogen 2.962 N/A ALA 205.A N ASP 201.A O no hydrogen 2.676 N/A VAL 206.A N VAL 202.A O no hydrogen 3.047 N/A GLU 207.A N ILE 203.A O no hydrogen 3.037 N/A GLN 208.A N ASN 204.A O no hydrogen 3.162 N/A GLN 208.A N ALA 205.A O no hydrogen 2.928 N/A ASP 209.A N VAL 206.A O no hydrogen 2.976 N/A TYR 210.A N ALA 205.A O no hydrogen 3.089 N/A ARG 211.A NE TRP 230.A O no hydrogen 2.852 N/A ARG 211.A NH1 VAL 206.A O no hydrogen 3.087 N/A ARG 211.A NH1 TYR 210.A O no hydrogen 2.945 N/A ARG 211.A NH2 TRP 230.A O no hydrogen 2.864 N/A CYS 218.A N PRO 215.A O no hydrogen 2.972 N/A CYS 218.A SG PRO 219.A O no hydrogen 3.545 N/A THR 220.A N VAL 259.A O no hydrogen 3.011 N/A LEU 222.A N PRO 219.A O no hydrogen 2.990 N/A HIS 223.A N PRO 219.A O no hydrogen 3.236 N/A HIS 223.A NE2 LEU 212.A O no hydrogen 2.990 N/A GLN 224.A N THR 220.A O no hydrogen 2.858 N/A GLN 224.A NE2 ASP 228.A OD1 no hydrogen 2.953 N/A LEU 225.A N ALA 221.A O no hydrogen 3.177 N/A MET 226.A N LEU 222.A O no hydrogen 3.068 N/A LEU 227.A N HIS 223.A O no hydrogen 2.897 N/A ASP 228.A N GLN 224.A O no hydrogen 2.946 N/A CYS 229.A N LEU 225.A O no hydrogen 3.078 N/A CYS 229.A SG LEU 225.A O no hydrogen 3.363 N/A TRP 230.A N MET 226.A O no hydrogen 2.999 N/A TRP 230.A N LEU 227.A O no hydrogen 3.133 N/A VAL 231.A N ASP 228.A O no hydrogen 3.305 N/A ASN 235.A N ASP 233.A OD1 no hydrogen 2.945 N/A ASN 235.A ND2 ASP 233.A OD1 no hydrogen 3.046 N/A LEU 236.A N ASP 233.A O no hydrogen 3.131 N/A ARG 237.A N ARG 234.A O no hydrogen 3.437 N/A ARG 237.A NE VAL 231.A O no hydrogen 2.720 N/A ARG 237.A NH1 GLU 163.A OE2 no hydrogen 2.861 N/A ARG 237.A NH1 ALA 173.A O no hydrogen 3.036 N/A ARG 237.A NH2 GLU 163.A OE1 no hydrogen 3.045 N/A ARG 237.A NH2 VAL 231.A O no hydrogen 3.002 N/A LYS 239.A N GLN 242.A OE1 no hydrogen 2.768 N/A ILE 243.A N LYS 239.A O no hydrogen 3.092 N/A VAL 244.A N PHE 240.A O no hydrogen 2.928 N/A ASN 245.A N SER 241.A O no hydrogen 2.902 N/A THR 246.A N GLN 242.A O no hydrogen 2.827 N/A THR 246.A OG1 GLN 242.A O no hydrogen 2.977 N/A LEU 247.A N ILE 243.A O no hydrogen 2.948 N/A ASP 248.A N VAL 244.A O no hydrogen 2.923 N/A LYS 249.A N ASN 245.A O no hydrogen 2.975 N/A LEU 250.A N THR 246.A O no hydrogen 3.057 N/A ILE 251.A N LEU 247.A O no hydrogen 3.006 N/A ARG 252.A N ASP 248.A O no hydrogen 2.918 N/A ASN 253.A N LEU 250.A O no hydrogen 3.164 N/A ASN 253.A ND2 LYS 249.A O no hydrogen 2.886 N/A SER 256.A N ASN 253.A O no hydrogen 2.943 N/A SER 256.A OG ASN 253.A O no hydrogen 2.586 N/A LEU 257.A N PRO 254.A O no hydrogen 2.876 N/A LYS 258.A N ALA 255.A O no hydrogen 2.955 N/A