Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3fs1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 7.A N SER 4.A OG no hydrogen 3.206 N/A LEU 8.A N SER 4.A O no hydrogen 3.044 N/A LEU 9.A N ILE 5.A O no hydrogen 2.804 N/A GLN 10.A N ASN 6.A O no hydrogen 3.018 N/A ALA 11.A N ALA 7.A O no hydrogen 3.060 N/A GLU 12.A N LEU 8.A O no hydrogen 3.008 N/A VAL 13.A N LEU 9.A O no hydrogen 3.116 N/A LEU 14.A N GLN 10.A O no hydrogen 2.812 N/A SER 15.A N ALA 11.A O no hydrogen 2.837 N/A SER 15.A OG ALA 11.A O no hydrogen 2.988 N/A SER 15.A OG GLU 12.A O no hydrogen 2.744 N/A ARG 16.A N GLU 12.A O no hydrogen 3.388 N/A ARG 16.A NH1 GLU 12.A OE2 no hydrogen 3.476 N/A SER 23.A OG ASP 101.A OD2 no hydrogen 3.008 N/A ARG 30.A N ASP 28.A OD2 no hydrogen 3.158 N/A ARG 30.A NE ASP 28.A OD2 no hydrogen 3.041 N/A ARG 30.A NH2 ASP 28.A OD1 no hydrogen 3.024 N/A ALA 31.A N ASP 28.A O no hydrogen 3.049 N/A LYS 32.A N ILE 29.A O no hydrogen 3.100 N/A LYS 32.A NZ GLY 24.A O no hydrogen 2.611 N/A LYS 32.A NZ GLY 27.A O no hydrogen 3.522 N/A LYS 32.A NZ ASP 101.A OD1 no hydrogen 3.071 N/A LYS 32.A NZ ASP 101.A OD2 no hydrogen 2.988 N/A ALA 35.A N ILE 103.A O no hydrogen 2.943 N/A SER 36.A N ASP 39.A OD2 no hydrogen 2.979 N/A SER 36.A OG ASP 39.A OD2 no hydrogen 2.787 N/A ASP 39.A N SER 36.A OG no hydrogen 3.139 N/A VAL 40.A N SER 36.A O no hydrogen 3.045 N/A CYS 41.A N ILE 37.A O no hydrogen 3.092 N/A CYS 41.A SG ILE 37.A O no hydrogen 3.401 N/A GLU 42.A N ALA 38.A O no hydrogen 2.977 N/A SER 43.A N ASP 39.A O no hydrogen 2.951 N/A MET 44.A N VAL 40.A O no hydrogen 2.868 N/A LYS 45.A N CYS 41.A O no hydrogen 3.019 N/A LYS 45.A NZ ASP 220.A OD1 no hydrogen 3.215 N/A LYS 45.A NZ ASP 220.A OD2 no hydrogen 3.323 N/A GLU 46.A N GLU 42.A O no hydrogen 3.215 N/A GLN 47.A N SER 43.A O no hydrogen 3.064 N/A LEU 48.A N MET 44.A O no hydrogen 2.970 N/A LEU 49.A N LYS 45.A O no hydrogen 3.038 N/A VAL 50.A N GLU 46.A O no hydrogen 3.010 N/A LEU 51.A N GLN 47.A O no hydrogen 2.995 N/A VAL 52.A N LEU 48.A O no hydrogen 3.196 N/A GLU 53.A N LEU 49.A O no hydrogen 2.997 N/A TRP 54.A N VAL 50.A O no hydrogen 2.829 N/A ALA 55.A N LEU 51.A O no hydrogen 3.079 N/A LYS 56.A N VAL 52.A O no hydrogen 3.188 N/A TYR 57.A N GLU 53.A O no hydrogen 3.183 N/A TYR 57.A N TRP 54.A O no hydrogen 3.050 N/A ILE 58.A N ALA 55.A O no hydrogen 2.992 N/A PHE 61.A N ILE 58.A O no hydrogen 3.000 N/A CYS 62.A N ILE 58.A O no hydrogen 3.226 N/A CYS 62.A SG LYS 56.A O no hydrogen 2.941 N/A CYS 62.A SG ILE 58.A O no hydrogen 3.648 N/A GLU 63.A N PRO 59.A O no hydrogen 2.981 N/A LEU 64.A N PHE 61.A O no hydrogen 3.226 N/A GLN 69.A N PRO 65.A O no hydrogen 2.965 N/A GLN 69.A NE2 PHE 61.A O no hydrogen 3.428 N/A GLN 69.A NE2 LEU 64.A O no hydrogen 2.835 N/A VAL 70.A N LEU 66.A O no hydrogen 3.058 N/A ALA 71.A N ASP 67.A O no hydrogen 3.009 N/A LEU 72.A N ASP 68.A O no hydrogen 3.090 N/A LEU 73.A N GLN 69.A O no hydrogen 3.143 N/A ARG 74.A N VAL 70.A O no hydrogen 2.921 N/A ALA 75.A N LEU 72.A O no hydrogen 3.400 N/A HIS 76.A NE2 ASP 149.A OD2 no hydrogen 2.691 N/A GLU 79.A N GLU 79.A OE1 no hydrogen 2.731 N/A HIS 80.A N HIS 76.A O no hydrogen 3.313 N/A LEU 81.A N ALA 77.A O no hydrogen 3.074 N/A LEU 82.A N GLY 78.A O no hydrogen 3.017 N/A LEU 83.A N GLU 79.A O no hydrogen 2.855 N/A GLY 84.A N HIS 80.A O no hydrogen 2.877 N/A ALA 85.A N LEU 81.A O no hydrogen 2.974 N/A THR 86.A N LEU 82.A O no hydrogen 2.994 N/A THR 86.A OG1 LEU 82.A O no hydrogen 2.723 N/A LYS 87.A N LEU 83.A O no hydrogen 2.975 N/A LYS 87.A NZ ASP 136.A OD2 no hydrogen 2.923 N/A ARG 88.A N GLY 84.A O no hydrogen 3.150 N/A ARG 88.A NE LEU 97.A O no hydrogen 3.167 N/A ARG 88.A NH2 LEU 97.A O no hydrogen 2.892 N/A SER 89.A N ALA 85.A O no hydrogen 2.942 N/A SER 89.A OG ALA 85.A O no hydrogen 2.703 N/A PHE 92.A N SER 89.A O no hydrogen 3.026 N/A LEU 96.A N VAL 104.A O no hydrogen 2.985 N/A LEU 97.A N SER 89.A OG no hydrogen 2.828 N/A LEU 98.A N TYR 102.A O no hydrogen 2.910 N/A ASN 100.A ND2 ASP 39.A O no hydrogen 3.051 N/A ASP 101.A N LEU 98.A O no hydrogen 3.059 N/A ILE 103.A N LYS 33.A O no hydrogen 2.906 N/A VAL 104.A N LEU 96.A O no hydrogen 2.856 N/A ARG 106.A N ASP 94.A O no hydrogen 2.934 N/A ARG 106.A NH1 ASP 123.A OD1 no hydrogen 2.835 N/A ARG 106.A NH2 ASP 123.A OD2 no hydrogen 3.098 N/A LEU 111.A N CYS 108.A O no hydrogen 3.096 N/A ALA 112.A N PRO 109.A O no hydrogen 2.718 N/A MET 114.A N LEU 111.A O no hydrogen 3.076 N/A SER 115.A N ALA 112.A O no hydrogen 2.971 N/A SER 115.A OG ALA 112.A O no hydrogen 2.956 N/A VAL 117.A N MET 114.A O no hydrogen 3.155 N/A SER 118.A OG SER 115.A O no hydrogen 3.076 N/A ILE 119.A N SER 115.A O no hydrogen 3.025 N/A ARG 120.A N ARG 116.A O no hydrogen 3.181 N/A ARG 120.A NE GLN 203.A OE1 no hydrogen 3.193 N/A ARG 120.A NH1 GLU 124.A OE1 no hydrogen 2.991 N/A ARG 120.A NH1 GLU 124.A OE2 no hydrogen 3.470 N/A ARG 120.A NH1 SER 199.A OG no hydrogen 3.316 N/A ARG 120.A NH2 SER 199.A OG no hydrogen 2.920 N/A ARG 120.A NH2 GLN 203.A OE1 no hydrogen 2.541 N/A ILE 121.A N VAL 117.A O no hydrogen 3.024 N/A LEU 122.A N SER 118.A O no hydrogen 2.936 N/A ASP 123.A N ILE 119.A O no hydrogen 2.967 N/A GLU 124.A N ARG 120.A O no hydrogen 2.840 N/A LEU 125.A N ILE 121.A O no hydrogen 2.994 N/A VAL 126.A N ILE 121.A O no hydrogen 2.859 N/A LEU 127.A N LEU 122.A O no hydrogen 3.052 N/A PHE 129.A N LEU 125.A O no hydrogen 2.973 N/A GLN 130.A N VAL 126.A O no hydrogen 2.917 N/A GLN 130.A NE2 MET 90.A O no hydrogen 2.899 N/A GLU 131.A N LEU 127.A O no hydrogen 2.918 N/A LEU 132.A N PRO 128.A O no hydrogen 2.979 N/A GLN 133.A N GLN 130.A O no hydrogen 3.367 N/A GLN 133.A NE2 GLN 130.A O no hydrogen 2.572 N/A ILE 134.A N PHE 129.A O no hydrogen 3.323 N/A ASP 135.A N GLU 138.A OE2 no hydrogen 2.904 N/A ASN 137.A ND2 TYR 175.A OH no hydrogen 2.824 N/A GLU 138.A N ASP 135.A OD2 no hydrogen 2.859 N/A TYR 139.A N ASP 135.A O no hydrogen 3.028 N/A ALA 140.A N ASP 136.A O no hydrogen 3.028 N/A TYR 141.A N ASN 137.A O no hydrogen 2.962 N/A LEU 142.A N GLU 138.A O no hydrogen 2.978 N/A LYS 143.A N TYR 139.A O no hydrogen 2.997 N/A LYS 143.A NZ HIS 80.A ND1 no hydrogen 3.108 N/A ALA 144.A N ALA 140.A O no hydrogen 3.066 N/A ILE 145.A N TYR 141.A O no hydrogen 2.926 N/A ILE 146.A N LEU 142.A O no hydrogen 3.064 N/A PHE 147.A N LYS 143.A O no hydrogen 3.050 N/A PHE 148.A N ALA 144.A O no hydrogen 3.105 N/A ASP 149.A N PHE 147.A O no hydrogen 2.969 N/A ASP 151.A N ASP 149.A OD1 no hydrogen 2.897 N/A ALA 152.A N ASP 149.A O no hydrogen 3.175 N/A LEU 155.A N ALA 152.A O no hydrogen 3.466 N/A SER 156.A N ASP 68.A OD1 no hydrogen 3.000 N/A SER 156.A OG ASP 68.A OD1 no hydrogen 3.260 N/A SER 156.A OG ASP 68.A OD2 no hydrogen 2.698 N/A LYS 160.A N ASP 157.A OD1 no hydrogen 3.420 N/A LYS 162.A N PRO 158.A O no hydrogen 2.914 N/A ARG 163.A N GLY 159.A O no hydrogen 3.047 N/A LEU 164.A N LYS 160.A O no hydrogen 3.144 N/A ARG 165.A N ILE 161.A O no hydrogen 2.879 N/A SER 166.A N LYS 162.A O no hydrogen 2.971 N/A SER 166.A OG LYS 162.A O no hydrogen 3.134 N/A GLN 167.A N ARG 163.A O no hydrogen 2.965 N/A VAL 168.A N LEU 164.A O no hydrogen 2.994 N/A GLN 169.A N ARG 165.A O no hydrogen 2.862 N/A VAL 170.A N SER 166.A O no hydrogen 3.226 N/A SER 171.A N GLN 167.A O no hydrogen 3.021 N/A SER 171.A OG GLN 167.A O no hydrogen 2.986 N/A LEU 172.A N VAL 168.A O no hydrogen 3.112 N/A LEU 172.A N GLN 169.A O no hydrogen 3.235 N/A GLU 173.A N GLN 169.A O no hydrogen 3.112 N/A ASP 174.A N VAL 170.A O no hydrogen 2.898 N/A TYR 175.A N SER 171.A O no hydrogen 2.925 N/A TYR 175.A OH ASP 135.A OD1 no hydrogen 2.598 N/A ILE 176.A N LEU 172.A O no hydrogen 3.016 N/A ASN 177.A N GLU 173.A O no hydrogen 3.040 N/A ASP 178.A N ASP 174.A O no hydrogen 3.107 N/A ASP 178.A N TYR 175.A O no hydrogen 3.218 N/A ARG 179.A N ILE 176.A O no hydrogen 3.229 N/A ARG 179.A NH2 ASP 135.A OD1 no hydrogen 3.309 N/A SER 183.A OG ILE 176.A O no hydrogen 2.843 N/A ARG 186.A N SER 183.A O no hydrogen 3.239 N/A ARG 186.A NE GLU 138.A OE1 no hydrogen 2.603 N/A ARG 186.A NH1 LEU 132.A O no hydrogen 2.909 N/A ARG 186.A NH2 LEU 132.A O no hydrogen 2.996 N/A ARG 186.A NH2 GLN 133.A O no hydrogen 3.177 N/A ARG 186.A NH2 GLU 138.A OE1 no hydrogen 3.219 N/A ARG 186.A NH2 GLU 138.A OE2 no hydrogen 2.850 N/A GLU 189.A N GLY 185.A O no hydrogen 3.211 N/A LEU 190.A N ARG 186.A O no hydrogen 3.004 N/A LEU 191.A N PHE 187.A O no hydrogen 3.112 N/A LEU 192.A N GLY 188.A O no hydrogen 2.992 N/A LEU 193.A N LEU 190.A O no hydrogen 3.205 N/A LEU 194.A N LEU 191.A O no hydrogen 3.161 N/A LEU 197.A N LEU 193.A O no hydrogen 2.948 N/A GLN 198.A N LEU 194.A O no hydrogen 2.977 N/A SER 199.A N PRO 195.A O no hydrogen 2.947 N/A ILE 200.A N THR 196.A O no hydrogen 3.049 N/A THR 201.A N LEU 197.A O no hydrogen 3.023 N/A THR 201.A OG1 LEU 197.A O no hydrogen 2.702 N/A TRP 202.A N GLN 198.A O no hydrogen 2.970 N/A GLN 203.A N SER 199.A O no hydrogen 3.264 N/A MET 204.A N ILE 200.A O no hydrogen 2.916 N/A ILE 205.A N THR 201.A O no hydrogen 2.938 N/A GLU 206.A N TRP 202.A O no hydrogen 3.082 N/A GLN 207.A N GLN 203.A O no hydrogen 3.127 N/A GLN 207.A NE2 GLU 113.A O no hydrogen 2.788 N/A ILE 208.A N MET 204.A O no hydrogen 3.030 N/A GLN 209.A N ILE 205.A O no hydrogen 2.880 N/A PHE 210.A N GLU 206.A O no hydrogen 3.020 N/A ILE 211.A N GLN 207.A O no hydrogen 2.995 N/A LYS 212.A N ILE 208.A O no hydrogen 3.017 N/A LEU 213.A N GLN 209.A O no hydrogen 2.999 N/A PHE 214.A N PHE 210.A O no hydrogen 3.106 N/A GLY 215.A N LYS 212.A O no hydrogen 3.309 N/A MET 216.A N ILE 211.A O no hydrogen 3.079 N/A LEU 222.A N ASP 220.A OD2 no hydrogen 2.925 N/A GLN 224.A N ASP 220.A O no hydrogen 3.050 N/A GLN 224.A NE2 GLY 230.A OXT no hydrogen 2.657 N/A GLU 225.A N ASN 221.A O no hydrogen 2.931 N/A MET 226.A N LEU 222.A O no hydrogen 3.062 N/A LEU 227.A N LEU 223.A O no hydrogen 2.759 N/A LEU 228.A N LEU 223.A O no hydrogen 3.291 N/A LEU 228.A N GLN 224.A O no hydrogen 3.018 N/A GLY 230.A N GLN 224.A O no hydrogen 3.246 N/A