Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4iy1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG HIS 25.A ND1 no hydrogen 3.046 N/A THR 2.A N ASP 73.A OD1 no hydrogen 2.908 N/A THR 2.A OG1 HIS 71.A O no hydrogen 2.128 N/A ALA 3.A N THR 26.A O no hydrogen 2.818 N/A ILE 4.A N ILE 74.A O no hydrogen 2.869 N/A VAL 5.A N ALA 28.A O no hydrogen 3.010 N/A THR 6.A N VAL 76.A O no hydrogen 3.221 N/A THR 6.A OG1 VAL 76.A O no hydrogen 3.562 N/A ASN 7.A N HIS 30.A ND1 no hydrogen 2.946 N/A ASN 7.A ND2 ASN 78.A O no hydrogen 2.819 N/A VAL 8.A N HIS 30.A O no hydrogen 2.792 N/A LYS 9.A N ASP 31.A OD1 no hydrogen 3.145 N/A LYS 9.A NZ SER 33.A OG no hydrogen 2.427 N/A HIS 10.A N ASN 7.A O no hydrogen 3.061 N/A HIS 10.A ND1 SER 182.A OG no hydrogen 2.616 N/A GLY 12.A N ASN 78.A OD1 no hydrogen 3.180 N/A GLY 13.A N HIS 10.A O no hydrogen 2.708 N/A GLY 15.A N GLN 213.A OE1 no hydrogen 2.798 N/A SER 16.A N GLY 12.A O no hydrogen 3.227 N/A SER 16.A OG GLY 12.A O no hydrogen 2.728 N/A ALA 17.A N GLY 13.A O no hydrogen 3.116 N/A LEU 18.A N MET 14.A O no hydrogen 3.016 N/A ARG 19.A N GLY 15.A O no hydrogen 3.103 N/A LEU 20.A N SER 16.A O no hydrogen 2.930 N/A SER 21.A N ALA 17.A O no hydrogen 2.976 N/A GLU 22.A N LEU 18.A O no hydrogen 2.913 N/A ALA 23.A N LEU 20.A O no hydrogen 3.010 N/A GLY 24.A N SER 21.A O no hydrogen 2.790 N/A HIS 25.A N LEU 20.A O no hydrogen 3.273 N/A HIS 25.A ND1 SER 1.A OG no hydrogen 3.046 N/A THR 26.A N SER 1.A O no hydrogen 2.874 N/A ALA 28.A N ALA 3.A O no hydrogen 2.799 N/A CYS 29.A N ILE 51.A O no hydrogen 3.180 N/A HIS 30.A N VAL 5.A O no hydrogen 2.862 N/A SER 33.A N ASP 31.A OD2 no hydrogen 3.091 N/A SER 33.A OG ASP 31.A OD2 no hydrogen 2.884 N/A PHE 34.A N ASP 31.A O no hydrogen 3.252 N/A LYS 35.A N GLU 32.A O no hydrogen 3.100 N/A HIS 36.A N SER 33.A O no hydrogen 2.733 N/A LEU 40.A N HIS 36.A O no hydrogen 2.777 N/A GLU 41.A N GLN 37.A O no hydrogen 2.792 N/A ALA 42.A N ASP 38.A O no hydrogen 3.078 N/A PHE 43.A N GLU 39.A O no hydrogen 3.222 N/A ALA 44.A N LEU 40.A O no hydrogen 2.879 N/A GLU 45.A N GLU 41.A O no hydrogen 2.704 N/A THR 46.A N ALA 42.A O no hydrogen 2.857 N/A THR 46.A OG1 ALA 42.A O no hydrogen 2.714 N/A TYR 47.A N ALA 44.A O no hydrogen 3.062 N/A GLN 49.A N GLN 49.A OE1 no hydrogen 2.792 N/A LEU 50.A N TYR 47.A O no hydrogen 3.266 N/A ILE 51.A N VAL 27.A O no hydrogen 2.973 N/A MET 53.A N CYS 29.A O no hydrogen 2.824 N/A SER 54.A N GLU 55.A OE2 no hydrogen 3.213 N/A SER 54.A OG GLU 55.A OE2 no hydrogen 3.451 N/A GLU 55.A N GLU 55.A OE2 no hydrogen 2.435 N/A GLN 56.A N GLU 60.A OE1 no hydrogen 2.873 N/A GLN 56.A NE2 ASP 31.A O no hydrogen 2.924 N/A GLN 56.A NE2 SER 54.A O no hydrogen 2.766 N/A GLU 57.A N GLU 60.A OE1 no hydrogen 3.077 N/A LEU 61.A N GLU 57.A O no hydrogen 2.714 N/A ILE 62.A N PRO 58.A O no hydrogen 2.928 N/A GLU 63.A N VAL 59.A O no hydrogen 3.002 N/A ALA 64.A N GLU 60.A O no hydrogen 2.802 N/A VAL 65.A N LEU 61.A O no hydrogen 3.035 N/A THR 66.A N ILE 62.A O no hydrogen 2.872 N/A THR 66.A OG1 ILE 62.A O no hydrogen 2.698 N/A SER 67.A N GLU 63.A O no hydrogen 2.935 N/A SER 67.A OG GLU 63.A O no hydrogen 3.152 N/A ALA 68.A N ALA 64.A O no hydrogen 2.981 N/A LEU 69.A N VAL 65.A O no hydrogen 2.885 N/A GLY 70.A N THR 66.A O no hydrogen 2.729 N/A VAL 72.A N GLN 117.A OE1 no hydrogen 2.580 N/A ASP 73.A N THR 2.A O no hydrogen 2.980 N/A ILE 74.A N THR 2.A O no hydrogen 3.033 N/A LEU 75.A N HIS 125.A O no hydrogen 2.976 N/A VAL 76.A N ILE 4.A O no hydrogen 2.942 N/A SER 77.A N ILE 127.A O no hydrogen 2.827 N/A SER 77.A OG ASP 79.A OD1 no hydrogen 3.373 N/A SER 77.A OG ASP 79.A OD2 no hydrogen 2.890 N/A ASN 78.A N THR 6.A OG1 no hydrogen 2.798 N/A ASN 78.A ND2 THR 6.A O no hydrogen 3.236 N/A ASN 78.A ND2 ASN 7.A O no hydrogen 2.931 N/A ASN 78.A ND2 HIS 10.A O no hydrogen 3.075 N/A ALA 81.A N TYR 185.A OH no hydrogen 2.917 N/A ARG 86.A N TYR 91.A OH no hydrogen 3.386 N/A ARG 86.A NE LYS 90.A O no hydrogen 3.180 N/A ARG 86.A NH1 GLU 84.A OE1 no hydrogen 3.484 N/A ARG 86.A NH2 LYS 90.A O no hydrogen 2.949 N/A ASP 89.A N ASP 89.A OD1 no hydrogen 2.461 N/A LYS 90.A N PRO 87.A O no hydrogen 2.769 N/A TYR 91.A N ILE 88.A O no hydrogen 3.390 N/A TYR 91.A OH GLU 84.A O no hydrogen 2.609 N/A ALA 92.A N ASP 95.A OD2 no hydrogen 2.861 N/A ASP 95.A N ALA 92.A O no hydrogen 2.821 N/A TYR 96.A OH SER 146.A OG no hydrogen 2.635 N/A ARG 97.A N VAL 93.A O no hydrogen 2.974 N/A ARG 97.A NH1 GLU 94.A OE1 no hydrogen 3.113 N/A ASP 98.A N GLU 94.A O no hydrogen 2.923 N/A MET 99.A N ASP 95.A O no hydrogen 3.151 N/A VAL 100.A N TYR 96.A O no hydrogen 2.846 N/A GLU 101.A N ARG 97.A O no hydrogen 2.869 N/A ALA 102.A N ASP 98.A O no hydrogen 2.985 N/A LEU 103.A N MET 99.A O no hydrogen 2.919 N/A GLN 104.A N VAL 100.A O no hydrogen 2.977 N/A ILE 105.A N VAL 100.A O no hydrogen 3.016 N/A LYS 106.A N GLU 101.A O no hydrogen 3.146 N/A PHE 108.A N GLN 104.A O no hydrogen 3.371 N/A ALA 109.A N ILE 105.A O no hydrogen 2.890 N/A LEU 110.A N LYS 106.A O no hydrogen 2.950 N/A ALA 111.A N PRO 107.A O no hydrogen 2.819 N/A ASN 112.A N PHE 108.A O no hydrogen 2.770 N/A ALA 113.A N ALA 109.A O no hydrogen 3.000 N/A ALA 113.A N LEU 110.A O no hydrogen 2.979 N/A VAL 114.A N LEU 110.A O no hydrogen 3.109 N/A VAL 114.A N ALA 111.A O no hydrogen 3.337 N/A MET 118.A N VAL 114.A O no hydrogen 3.230 N/A LYS 119.A N ALA 115.A O no hydrogen 2.808 N/A ARG 120.A N SER 116.A O no hydrogen 2.945 N/A ARG 121.A N GLN 117.A O no hydrogen 3.466 N/A ARG 121.A NH1 VAL 72.A O no hydrogen 3.451 N/A ARG 121.A NH1 GLN 117.A OE1 no hydrogen 3.250 N/A ARG 121.A NH2 VAL 72.A O no hydrogen 3.100 N/A ARG 121.A NH2 SER 123.A O no hydrogen 2.907 N/A LYS 122.A N LYS 119.A O no hydrogen 3.086 N/A LYS 122.A NZ LYS 119.A O no hydrogen 3.287 N/A LYS 122.A NZ HIS 165.A ND1 no hydrogen 2.895 N/A SER 123.A N MET 118.A O no hydrogen 3.045 N/A HIS 125.A N ASP 73.A O no hydrogen 2.876 N/A HIS 125.A NE2 ASP 229.A OD1 no hydrogen 2.969 N/A ILE 126.A N PRO 168.A O no hydrogen 2.966 N/A ILE 127.A N LEU 75.A O no hydrogen 2.704 N/A PHE 128.A N PHE 170.A O no hydrogen 2.944 N/A ILE 129.A N SER 77.A O no hydrogen 3.008 N/A THR 130.A N ILE 172.A O no hydrogen 2.668 N/A THR 130.A OG1 SER 152.A OG no hydrogen 2.921 N/A THR 130.A OG1 ILE 172.A O no hydrogen 3.556 N/A SER 131.A N THR 130.A OG1 no hydrogen 2.721 N/A ALA 132.A N PRO 174.A O no hydrogen 2.731 N/A ALA 133.A N SER 131.A OG no hydrogen 2.737 N/A SER 134.A N SER 131.A O no hydrogen 3.207 N/A SER 134.A OG SER 131.A O no hydrogen 3.128 N/A GLY 136.A N ALA 133.A O no hydrogen 2.886 N/A ALA 145.A N LEU 141.A O no hydrogen 2.917 N/A SER 146.A N SER 142.A O no hydrogen 3.190 N/A SER 146.A OG TYR 96.A OH no hydrogen 2.635 N/A SER 146.A OG SER 142.A O no hydrogen 3.134 N/A SER 146.A OG THR 143.A O no hydrogen 3.449 N/A ALA 147.A N THR 143.A O no hydrogen 3.224 N/A ARG 148.A N TYR 144.A O no hydrogen 2.985 N/A ARG 148.A NE TYR 144.A OH no hydrogen 3.113 N/A ARG 148.A NH1 ASP 79.A O no hydrogen 2.997 N/A ARG 148.A NH2 ASP 79.A O no hydrogen 2.973 N/A ARG 148.A NH2 TYR 144.A OH no hydrogen 3.010 N/A ALA 149.A N ALA 145.A O no hydrogen 3.179 N/A GLY 150.A N SER 146.A O no hydrogen 3.044 N/A ALA 151.A N ALA 147.A O no hydrogen 3.080 N/A SER 152.A N ARG 148.A O no hydrogen 3.039 N/A SER 152.A OG ARG 148.A O no hydrogen 3.322 N/A ALA 153.A N ALA 149.A O no hydrogen 2.840 N/A LEU 154.A N GLY 150.A O no hydrogen 2.893 N/A ALA 155.A N ALA 151.A O no hydrogen 2.949 N/A ASN 156.A N SER 152.A O no hydrogen 3.143 N/A ASN 156.A ND2 GLY 233.A O no hydrogen 3.060 N/A ALA 157.A N ALA 153.A O no hydrogen 2.897 N/A LEU 158.A N LEU 154.A O no hydrogen 2.904 N/A SER 159.A N ALA 155.A O no hydrogen 2.960 N/A SER 159.A OG ASN 156.A O no hydrogen 2.590 N/A LYS 160.A N ASN 156.A O no hydrogen 3.387 N/A LYS 160.A N ALA 157.A O no hydrogen 3.072 N/A GLU 161.A N ALA 157.A O no hydrogen 3.373 N/A LEU 162.A N LEU 158.A O no hydrogen 2.885 N/A HIS 165.A N LEU 162.A O no hydrogen 3.015 N/A ASN 166.A N GLY 163.A O no hydrogen 2.810 N/A ASN 166.A ND2 LYS 122.A O no hydrogen 3.129 N/A ILE 167.A N LEU 162.A O no hydrogen 2.991 N/A VAL 169.A N THR 232.A OG1 no hydrogen 3.144 N/A PHE 170.A N ILE 126.A O no hydrogen 2.949 N/A ALA 171.A N GLN 234.A O no hydrogen 3.171 N/A ILE 172.A N PHE 128.A O no hydrogen 2.815 N/A ALA 173.A N PHE 236.A O no hydrogen 2.560 N/A ASN 175.A N LEU 238.A O no hydrogen 2.918 N/A ASN 175.A ND2 TYR 186.A OH no hydrogen 3.096 N/A ASP 178.A N GLY 211.A O no hydrogen 2.562 N/A SER 179.A N TYR 186.A O no hydrogen 3.024 N/A SER 179.A OG SER 182.A O no hydrogen 2.848 N/A GLY 180.A N ASP 178.A OD1 no hydrogen 2.702 N/A SER 182.A N SER 179.A O no hydrogen 3.002 N/A SER 182.A OG HIS 10.A ND1 no hydrogen 2.616 N/A TYR 184.A N SER 182.A OG no hydrogen 3.259 N/A TYR 185.A OH ALA 81.A O no hydrogen 2.880 N/A TYR 186.A N SER 179.A OG no hydrogen 3.112 N/A SER 188.A N GLY 180.A O no hydrogen 2.903 N/A SER 188.A OG ASP 178.A OD1 no hydrogen 2.923 N/A SER 188.A OG ASP 178.A OD2 no hydrogen 3.247 N/A TRP 191.A N PRO 187.A O no hydrogen 3.425 N/A LYS 192.A N SER 188.A O no hydrogen 2.763 N/A THR 193.A N PRO 190.A O no hydrogen 3.253 N/A SER 194.A N PRO 190.A O no hydrogen 2.822 N/A SER 194.A OG HIS 197.A ND1 no hydrogen 2.767 N/A HIS 197.A ND1 SER 194.A OG no hydrogen 2.767 N/A VAL 198.A N SER 194.A O no hydrogen 3.018 N/A ALA 199.A N PRO 195.A O no hydrogen 2.861 N/A TRP 200.A N GLU 196.A O no hydrogen 2.718 N/A VAL 201.A N HIS 197.A O no hydrogen 3.008 N/A ARG 202.A N VAL 198.A O no hydrogen 3.138 N/A LYS 203.A N ALA 199.A O no hydrogen 2.792 N/A LYS 203.A NZ GLU 246.A OE2 no hydrogen 3.042 N/A TYR 204.A N TRP 200.A O no hydrogen 3.006 N/A THR 205.A N VAL 201.A O no hydrogen 3.085 N/A THR 205.A OG1 VAL 201.A O no hydrogen 2.868 N/A ALA 206.A N GLY 240.A O no hydrogen 2.773 N/A LEU 207.A N GLY 240.A O no hydrogen 3.062 N/A GLN 208.A N THR 205.A OG1 no hydrogen 3.023 N/A GLN 208.A NE2 ARG 202.A O no hydrogen 2.677 N/A ARG 209.A NH1 LEU 210.A O no hydrogen 3.181 N/A ARG 209.A NH1 GLU 215.A OE1 no hydrogen 3.413 N/A ARG 209.A NH1 GLU 215.A OE2 no hydrogen 2.970 N/A ARG 209.A NH2 GLU 215.A OE1 no hydrogen 2.771 N/A GLY 211.A N GLY 176.A O no hydrogen 2.602 N/A THR 212.A N GLU 215.A OE2 no hydrogen 2.945 N/A THR 212.A OG1 GLU 215.A OE2 no hydrogen 3.198 N/A GLN 213.A NE2 PHE 11.A O no hydrogen 2.954 N/A GLN 213.A NE2 ASP 178.A O no hydrogen 3.120 N/A GLU 215.A N THR 212.A OG1 no hydrogen 3.201 N/A LEU 216.A N THR 212.A O no hydrogen 3.153 N/A GLY 217.A N GLN 213.A O no hydrogen 2.773 N/A GLU 218.A N LYS 214.A O no hydrogen 2.753 N/A LEU 219.A N GLU 215.A O no hydrogen 3.174 N/A VAL 220.A N LEU 216.A O no hydrogen 2.977 N/A THR 221.A N GLY 217.A O no hydrogen 2.907 N/A THR 221.A OG1 GLY 217.A O no hydrogen 2.941 N/A PHE 222.A N GLU 218.A O no hydrogen 2.954 N/A LEU 223.A N LEU 219.A O no hydrogen 2.952 N/A ALA 224.A N VAL 220.A O no hydrogen 2.936 N/A SER 225.A N PHE 222.A O no hydrogen 3.178 N/A SER 225.A OG PHE 222.A O no hydrogen 2.725 N/A SER 225.A OG SER 227.A OG no hydrogen 2.834 N/A SER 227.A N SER 225.A OG no hydrogen 2.882 N/A SER 227.A OG SER 225.A OG no hydrogen 2.834 N/A LEU 231.A N CYS 228.A O no hydrogen 3.074 N/A THR 232.A N ASP 229.A O no hydrogen 2.974 N/A GLY 233.A N VAL 169.A O no hydrogen 2.753 N/A GLN 234.A N LEU 231.A O no hydrogen 3.017 N/A GLN 234.A NE2 VAL 235.A O no hydrogen 3.017 N/A PHE 236.A N ALA 171.A O no hydrogen 2.774 N/A LEU 238.A N ALA 173.A O no hydrogen 3.117 N/A PHE 242.A N ALA 239.A O no hydrogen 2.827 N/A VAL 244.A N TYR 204.A O no hydrogen 2.970 N/A