Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3isr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A N VAL 84.A O no hydrogen 3.342 N/A ASN 3.A N TYR 82.A O no hydrogen 2.953 N/A PHE 6.A N VAL 78.A O no hydrogen 2.808 N/A LYS 7.A N ALA 260.A O no hydrogen 2.892 N/A ILE 8.A N ALA 76.A O no hydrogen 2.783 N/A HIS 9.A N GLU 258.A O no hydrogen 2.943 N/A HIS 9.A NE2 SER 73.A OG no hydrogen 3.082 N/A SER 10.A N TYR 74.A O no hydrogen 2.908 N/A SER 10.A OG TYR 195.A OH no hydrogen 2.937 N/A ASP 11.A N HIS 256.A O no hydrogen 2.932 N/A THR 13.A N ASN 255.A O no hydrogen 3.201 N/A TYR 14.A N PHE 71.A O no hydrogen 2.910 N/A GLN 15.A N SER 252.A O no hydrogen 3.102 N/A VAL 16.A N THR 69.A O no hydrogen 2.730 N/A THR 19.A N ALA 65.A O no hydrogen 2.957 N/A THR 19.A OG1 SER 17.A O no hydrogen 2.651 N/A THR 19.A OG1 ASN 250.A O no hydrogen 3.366 N/A THR 20.A N PHE 248.A O no hydrogen 2.936 N/A PHE 21.A N LEU 63.A O no hydrogen 2.841 N/A ILE 22.A N SER 246.A O no hydrogen 2.810 N/A PHE 23.A N VAL 61.A O no hydrogen 2.741 N/A ASN 24.A N VAL 244.A O no hydrogen 2.920 N/A ALA 27.A N TYR 74.A OH no hydrogen 3.134 N/A LEU 28.A N LYS 232.A O no hydrogen 2.971 N/A ARG 29.A NH2 GLU 38.A OE2 no hydrogen 3.566 N/A THR 30.A N GLN 33.A O no hydrogen 3.120 N/A GLN 33.A N THR 30.A OG1 no hydrogen 2.744 N/A GLN 33.A NE2 LEU 28.A O no hydrogen 2.741 N/A GLN 33.A NE2 LYS 232.A O no hydrogen 2.859 N/A HIS 34.A N ASP 79.A O no hydrogen 2.806 N/A LEU 36.A N THR 77.A O no hydrogen 2.810 N/A ASP 37.A N THR 77.A O no hydrogen 3.435 N/A SER 39.A N THR 75.A O no hydrogen 2.764 N/A ILE 41.A N SER 73.A O no hydrogen 2.853 N/A THR 43.A N SER 72.A O no hydrogen 2.863 N/A GLU 49.A N ARG 62.A O no hydrogen 3.026 N/A PHE 51.A N PHE 60.A O no hydrogen 2.870 N/A SER 52.A OG SER 58.A O no hydrogen 2.708 N/A GLY 56.A N TYR 53.A O no hydrogen 3.034 N/A THR 57.A OG1 THR 235.A O no hydrogen 2.731 N/A ARG 59.A NE GLU 50.A OE2 no hydrogen 2.856 N/A ARG 59.A NH1 ALA 27.A O no hydrogen 2.957 N/A ARG 59.A NH1 GLU 38.A OE1 no hydrogen 3.042 N/A ARG 59.A NH1 GLU 38.A OE2 no hydrogen 3.459 N/A ARG 59.A NH2 GLU 38.A OE2 no hydrogen 2.701 N/A ARG 59.A NH2 GLU 50.A OE1 no hydrogen 2.979 N/A PHE 60.A N PHE 51.A O no hydrogen 2.894 N/A VAL 61.A N PHE 23.A O no hydrogen 2.910 N/A ARG 62.A N GLU 49.A O no hydrogen 2.929 N/A ARG 62.A NE GLU 49.A OE1 no hydrogen 3.281 N/A ARG 62.A NH1 GLU 49.A OE1 no hydrogen 3.136 N/A LEU 63.A N PHE 21.A O no hydrogen 3.125 N/A ALA 65.A N THR 19.A O no hydrogen 2.763 N/A THR 69.A N VAL 16.A O no hydrogen 3.342 N/A THR 69.A OG1 THR 66.A O no hydrogen 3.083 N/A PHE 71.A N TYR 14.A O no hydrogen 3.169 N/A SER 72.A N THR 43.A O no hydrogen 2.687 N/A SER 72.A OG ILE 12.A O no hydrogen 3.394 N/A SER 73.A OG HIS 9.A NE2 no hydrogen 3.082 N/A TYR 74.A N SER 10.A O no hydrogen 2.760 N/A TYR 74.A OH GLU 38.A OE1 no hydrogen 2.701 N/A THR 75.A N SER 39.A O no hydrogen 2.934 N/A ALA 76.A N ILE 8.A O no hydrogen 3.007 N/A THR 77.A N ASP 37.A O no hydrogen 2.902 N/A VAL 78.A N PHE 6.A O no hydrogen 2.844 N/A ASP 79.A N HIS 34.A O no hydrogen 2.821 N/A TYR 82.A N ASN 3.A O no hydrogen 2.835 N/A LYS 83.A N SER 280.A O no hydrogen 2.860 N/A VAL 84.A N GLN 1.A O no hydrogen 2.772 N/A ILE 85.A N GLY 278.A O no hydrogen 2.732 N/A GLN 87.A N LEU 276.A O no hydrogen 2.629 N/A GLN 87.A NE2 ILE 85.A O no hydrogen 3.013 N/A ARG 88.A N ASP 86.A OD1 no hydrogen 2.957 N/A ARG 88.A NE ASP 86.A OD1 no hydrogen 3.153 N/A ARG 88.A NE ASP 86.A OD2 no hydrogen 3.131 N/A ARG 88.A NH2 ASP 86.A OD2 no hydrogen 2.921 N/A GLU 90.A N GLN 87.A O no hydrogen 3.144 N/A LEU 91.A N GLN 89.A O no hydrogen 2.985 N/A ASP 98.A N PRO 95.A O no hydrogen 2.798 N/A LEU 99.A N PRO 95.A O no hydrogen 3.213 N/A ILE 103.A N ASP 100.A O no hydrogen 2.944 N/A ILE 104.A N ASP 100.A O no hydrogen 3.413 N/A PHE 106.A N ILE 103.A O no hydrogen 2.963 N/A LEU 107.A N ILE 104.A O no hydrogen 2.923 N/A PHE 108.A N PRO 105.A O no hydrogen 3.170 N/A SER 110.A N CYS 113.A O no hydrogen 3.072 N/A SER 110.A OG ASP 238.A OD2 no hydrogen 2.675 N/A ARG 111.A NH1 ARG 111.A O no hydrogen 3.015 N/A ARG 111.A NH2 GLN 157.A O no hydrogen 3.058 N/A TYR 112.A N ASP 238.A OD2 no hydrogen 2.809 N/A TYR 112.A OH SER 156.A O no hydrogen 3.162 N/A CYS 113.A N SER 110.A O no hydrogen 3.097 N/A CYS 113.A SG HIS 176.A ND1 no hydrogen 3.784 N/A CYS 113.A SG HIS 176.A O no hydrogen 3.586 N/A GLN 114.A N GLN 114.A OE1 no hydrogen 2.801 N/A GLN 114.A NE2 SER 159.A OG no hydrogen 2.758 N/A SER 115.A N CYS 113.A O no hydrogen 2.827 N/A LYS 117.A N GLN 114.A O no hydrogen 2.902 N/A LEU 118.A N SER 115.A O no hydrogen 3.193 N/A ALA 122.A N LEU 118.A O no hydrogen 2.909 N/A TYR 123.A N GLN 119.A O no hydrogen 3.018 N/A LYS 124.A N LYS 120.A O no hydrogen 2.915 N/A GLU 125.A N LEU 121.A O no hydrogen 2.888 N/A PHE 126.A N ALA 122.A O no hydrogen 2.905 N/A GLY 127.A N TYR 123.A O no hydrogen 2.800 N/A ILE 129.A N PHE 126.A O no hydrogen 3.211 N/A ASN 131.A ND2 GLN 87.A O no hydrogen 2.844 N/A ASN 131.A ND2 ARG 88.A O no hydrogen 3.568 N/A VAL 132.A N GLU 90.A O no hydrogen 2.852 N/A SER 134.A N ASN 131.A OD1 no hydrogen 2.953 N/A LYS 135.A N ASN 131.A O no hydrogen 2.870 N/A VAL 136.A N VAL 132.A O no hydrogen 3.046 N/A LEU 137.A N TYR 133.A O no hydrogen 2.856 N/A ALA 138.A N SER 134.A O no hydrogen 2.862 N/A ILE 139.A N LYS 135.A O no hydrogen 3.009 N/A THR 140.A N VAL 136.A O no hydrogen 2.919 N/A THR 140.A OG1.A LEU 137.A O no hydrogen 2.855 N/A THR 140.A OG1.B VAL 136.A O no hydrogen 2.751 N/A ASP 141.A N LEU 137.A O no hydrogen 2.853 N/A TRP 142.A N ALA 138.A O no hydrogen 2.878 N/A ILE 143.A N ILE 139.A O no hydrogen 2.932 N/A TYR 144.A N THR 140.A O no hydrogen 2.912 N/A ASN 145.A N ASP 141.A O no hydrogen 2.958 N/A ASN 146.A N ILE 143.A O no hydrogen 3.267 N/A VAL 147.A N ILE 143.A O no hydrogen 2.928 N/A GLU 148.A N ARG 167.A O no hydrogen 2.956 N/A ILE 150.A N GLY 169.A O no hydrogen 2.928 N/A SER 153.A N ILE 150.A O no hydrogen 3.325 N/A SER 153.A OG ILE 150.A O no hydrogen 2.699 N/A THR 154.A OG1 ASP 173.A OD2 no hydrogen 2.625 N/A ASN 155.A N THR 158.A OG1 no hydrogen 3.047 N/A GLN 157.A N ASN 155.A OD1 no hydrogen 2.865 N/A THR 158.A N ASN 155.A O no hydrogen 3.127 N/A THR 158.A OG1 ASN 155.A O no hydrogen 3.184 N/A THR 158.A OG1 ASN 155.A OD1 no hydrogen 3.345 N/A SER 159.A N ASP 162.A OD2 no hydrogen 2.895 N/A SER 159.A OG ASP 162.A OD2 no hydrogen 3.069 N/A ALA 160.A N TYR 112.A O no hydrogen 2.882 N/A PHE 161.A N GLN 114.A OE1 no hydrogen 3.242 N/A THR 163.A N SER 159.A O no hydrogen 3.065 N/A THR 163.A OG1 SER 159.A O no hydrogen 3.199 N/A ILE 164.A N ALA 160.A O no hydrogen 3.100 N/A THR 165.A N ASP 162.A O no hydrogen 3.169 N/A THR 165.A OG1 ASP 162.A O no hydrogen 3.103 N/A GLU 166.A N ASP 162.A O no hydrogen 2.872 N/A ARG 167.A N THR 163.A O no hydrogen 2.826 N/A ARG 167.A NE ILE 164.A O no hydrogen 2.943 N/A GLY 169.A N GLU 148.A O no hydrogen 2.973 N/A VAL 170.A N ASP 173.A OD2 no hydrogen 2.882 N/A CYS 171.A N TYR 149.A OH no hydrogen 3.260 N/A CYS 171.A SG HIS 205.A ND1 no hydrogen 3.926 N/A ARG 172.A NH1 THR 158.A O no hydrogen 3.191 N/A ARG 172.A NH2 SER 156.A O no hydrogen 2.945 N/A PHE 174.A N VAL 170.A O no hydrogen 3.017 N/A ALA 175.A N CYS 171.A O no hydrogen 2.827 N/A HIS 176.A N ARG 172.A O no hydrogen 2.994 N/A LEU 177.A N ASP 173.A O no hydrogen 3.005 N/A GLY 178.A N PHE 174.A O no hydrogen 3.086 N/A ILE 179.A N ALA 175.A O no hydrogen 3.016 N/A ALA 180.A N HIS 176.A O no hydrogen 2.956 N/A LEU 181.A N LEU 177.A O no hydrogen 3.060 N/A CYS 182.A N GLY 178.A O no hydrogen 3.052 N/A CYS 182.A SG GLY 178.A O no hydrogen 3.394 N/A ARG 183.A N ILE 179.A O no hydrogen 2.958 N/A ARG 183.A NE PHE 106.A O no hydrogen 2.983 N/A ARG 183.A NE ALA 189.A O no hydrogen 3.256 N/A ARG 183.A NH1 SER 110.A OG no hydrogen 3.017 N/A ARG 183.A NH2 ALA 189.A O no hydrogen 2.899 N/A ARG 183.A NH2 ARG 237.A O no hydrogen 2.788 N/A ALA 184.A N ALA 180.A O no hydrogen 2.906 N/A LEU 185.A N LEU 181.A O no hydrogen 3.284 N/A LEU 185.A N CYS 182.A O no hydrogen 2.925 N/A SER 186.A N ARG 183.A O no hydrogen 2.875 N/A ILE 187.A N CYS 182.A O no hydrogen 2.928 N/A ALA 189.A N PHE 106.A O no hydrogen 3.143 N/A ARG 190.A N GLU 209.A O no hydrogen 2.864 N/A ARG 190.A NE GLU 209.A OE1 no hydrogen 2.638 N/A ARG 190.A NH2 GLU 209.A OE1 no hydrogen 2.902 N/A TYR 191.A N GLY 236.A O no hydrogen 2.836 N/A PHE 192.A N CYS 207.A O no hydrogen 2.953 N/A THR 193.A N ALA 234.A O no hydrogen 2.903 N/A THR 193.A OG1 ALA 234.A O no hydrogen 3.459 N/A GLY 194.A N HIS 205.A O no hydrogen 2.966 N/A TYR 195.A N VAL 231.A O no hydrogen 2.876 N/A TYR 195.A OH SER 10.A OG no hydrogen 2.937 N/A TYR 195.A OH VAL 25.A O no hydrogen 2.609 N/A PHE 197.A N GLY 229.A O no hydrogen 2.881 N/A LEU 199.A N ALA 196.A O no hydrogen 3.471 N/A PHE 204.A N ASP 203.A OD1 no hydrogen 2.693 N/A HIS 205.A N GLY 194.A O no hydrogen 2.890 N/A HIS 205.A NE2 ASP 220.A OD2 no hydrogen 2.745 N/A CYS 207.A N PHE 192.A O no hydrogen 2.857 N/A PHE 208.A N PHE 219.A O no hydrogen 3.191 N/A GLU 209.A N ARG 190.A O no hydrogen 2.939 N/A ALA 210.A N ILE 217.A O no hydrogen 2.910 N/A TYR 211.A N PRO 188.A O no hydrogen 3.003 N/A ILE 212.A N ASN 215.A O no hydrogen 2.901 N/A ASN 215.A N ILE 212.A O no hydrogen 3.164 N/A ILE 217.A N ALA 210.A O no hydrogen 2.799 N/A ILE 218.A N LEU 279.A O no hydrogen 2.989 N/A PHE 219.A N PHE 208.A O no hydrogen 2.837 N/A THR 222.A N ASP 220.A OD1 no hydrogen 3.006 N/A THR 222.A OG1 ASP 220.A OD1 no hydrogen 2.823 N/A THR 222.A OG1 ASP 220.A OD2 no hydrogen 3.216 N/A ARG 223.A N ASP 220.A O no hydrogen 3.138 N/A ARG 223.A NH1 ASP 141.A OD1 no hydrogen 2.917 N/A LEU 224.A N THR 222.A OG1 no hydrogen 3.083 N/A LEU 227.A N PHE 269.A O no hydrogen 2.902 N/A ASN 228.A ND2 THR 267.A O no hydrogen 2.839 N/A GLY 229.A N PRO 226.A O no hydrogen 3.007 N/A VAL 231.A N TYR 195.A O no hydrogen 2.894 N/A LYS 232.A N GLN 33.A OE1 no hydrogen 2.958 N/A ILE 233.A N THR 193.A O no hydrogen 2.808 N/A ALA 234.A N THR 193.A O no hydrogen 3.285 N/A THR 235.A N THR 57.A O no hydrogen 3.092 N/A GLY 236.A N TYR 191.A O no hydrogen 3.075 N/A ARG 237.A N ASP 241.A OD2 no hydrogen 3.015 N/A ARG 237.A NH1 PRO 109.A O no hydrogen 2.901 N/A ALA 240.A N ASP 238.A OD1 no hydrogen 2.980 N/A ASP 241.A N ASP 238.A O no hydrogen 2.972 N/A ALA 242.A N ALA 239.A O no hydrogen 3.044 N/A SER 246.A N ILE 22.A O no hydrogen 2.723 N/A PHE 248.A N THR 20.A O no hydrogen 2.827 N/A ASN 250.A N THR 19.A OG1 no hydrogen 3.000 N/A ASN 250.A ND2 SER 17.A OG no hydrogen 2.741 N/A SER 252.A N GLN 15.A O no hydrogen 3.128 N/A THR 254.A N THR 13.A O no hydrogen 2.956 N/A GLU 258.A N HIS 9.A O no hydrogen 2.847 N/A ALA 260.A N LYS 7.A O no hydrogen 2.924 N/A SER 261.A OG ASP 263.A O no hydrogen 3.164 N/A LEU 262.A N LYS 5.A O no hydrogen 2.952 N/A ASP 263.A N SER 261.A OG no hydrogen 3.283 N/A PHE 269.A N ASN 228.A OD1 no hydrogen 2.922 N/A TYR 271.A OH ILE 218.A O no hydrogen 2.640 N/A ASN 274.A N ASP 272.A OD1 no hydrogen 3.149 N/A GLY 278.A N ILE 85.A O no hydrogen 2.860 N/A LEU 279.A N TYR 271.A OH no hydrogen 2.956 N/A SER 280.A N LYS 83.A O no hydrogen 2.925 N/A SER 280.A OG TRP 216.A O no hydrogen 2.741 N/A GLN 282.A NE2 SER 280.A OG no hydrogen 2.847 N/A