Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4y5i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 4.A N GLY 1.A O no hydrogen 3.084 N/A MET 6.A N MET 3.A O no hydrogen 3.041 N/A ARG 8.A NH1 GLU 45.A OE2 no hydrogen 2.924 N/A ARG 8.A NH2 GLU 45.A OE1 no hydrogen 2.852 N/A LEU 11.A N GLU 7.A O no hydrogen 2.993 N/A ILE 12.A N ARG 8.A O no hydrogen 3.077 N/A GLN 13.A N ALA 9.A O no hydrogen 2.956 N/A LYS 14.A N SER 10.A O no hydrogen 2.893 N/A ALA 15.A N LEU 11.A O no hydrogen 2.902 N/A LYS 16.A N ILE 12.A O no hydrogen 3.095 N/A LYS 16.A NZ GLU 44.A OE2 no hydrogen 3.310 N/A LEU 17.A N GLN 13.A O no hydrogen 3.070 N/A ALA 18.A N LYS 14.A O no hydrogen 2.837 N/A GLU 19.A N ALA 15.A O no hydrogen 2.986 N/A GLN 20.A N LYS 16.A O no hydrogen 3.163 N/A ALA 21.A N LEU 17.A O no hydrogen 2.992 N/A GLU 22.A N GLU 19.A O no hydrogen 2.988 N/A ARG 23.A N ALA 18.A O no hydrogen 2.809 N/A ARG 23.A NE ASP 26.A OD2 no hydrogen 3.001 N/A ARG 23.A NH2 ASP 26.A OD2 no hydrogen 2.886 N/A MET 27.A N ARG 23.A O no hydrogen 2.948 N/A ALA 28.A N TYR 24.A O no hydrogen 2.862 N/A ALA 29.A N GLU 25.A O no hydrogen 3.089 N/A PHE 30.A N ASP 26.A O no hydrogen 2.939 N/A MET 31.A N MET 27.A O no hydrogen 2.974 N/A LYS 32.A N ALA 28.A O no hydrogen 2.839 N/A LYS 32.A NZ GLU 36.A OE2 no hydrogen 2.741 N/A GLY 33.A N ALA 29.A O no hydrogen 3.084 N/A ALA 34.A N PHE 30.A O no hydrogen 2.953 N/A VAL 35.A N MET 31.A O no hydrogen 2.876 N/A GLU 36.A N LYS 32.A O no hydrogen 2.996 N/A LYS 37.A N ALA 34.A O no hydrogen 3.072 N/A LYS 37.A NZ MET 3.A O no hydrogen 3.444 N/A LYS 37.A NZ MET 6.A O no hydrogen 2.713 N/A GLY 38.A N VAL 35.A O no hydrogen 3.037 N/A SER 42.A N GLU 45.A OE1 no hydrogen 2.870 N/A GLU 45.A N SER 42.A OG no hydrogen 3.138 N/A ARG 46.A N SER 42.A O no hydrogen 2.853 N/A ASN 47.A N CYS 43.A O no hydrogen 3.182 N/A LEU 48.A N GLU 44.A O no hydrogen 3.089 N/A LEU 49.A N GLU 45.A O no hydrogen 2.989 N/A SER 50.A N ARG 46.A O no hydrogen 2.972 N/A SER 50.A OG.B ARG 46.A O no hydrogen 3.306 N/A SER 50.A OG.B ASN 47.A O no hydrogen 3.057 N/A VAL 51.A N.A ASN 47.A O no hydrogen 2.965 N/A VAL 51.A N.B ASN 47.A O no hydrogen 2.925 N/A ALA 52.A N LEU 48.A O no hydrogen 3.144 N/A TYR 53.A N LEU 49.A O no hydrogen 3.275 N/A LYS 54.A N SER 50.A O no hydrogen 2.855 N/A ASN 55.A N VAL 51.A O.A no hydrogen 3.193 N/A ASN 55.A N VAL 51.A O.B no hydrogen 3.063 N/A ASN 55.A ND2 VAL 51.A O.A no hydrogen 2.850 N/A ASN 55.A ND2 VAL 51.A O.B no hydrogen 3.007 N/A VAL 56.A N ALA 52.A O no hydrogen 3.126 N/A VAL 57.A N TYR 53.A O no hydrogen 2.869 N/A GLY 58.A N LYS 54.A O no hydrogen 2.829 N/A GLY 59.A N ASN 55.A O no hydrogen 3.127 N/A GLN 60.A N VAL 56.A O no hydrogen 3.290 N/A GLN 60.A NE2.A GLU 89.A OE2.B no hydrogen 2.850 N/A GLN 60.A NE2.B GLU 89.A OE2.B no hydrogen 3.003 N/A ARG 61.A N VAL 57.A O no hydrogen 2.793 N/A ARG 61.A NE GLU 129.A OE1 no hydrogen 3.001 N/A ARG 61.A NH2 GLU 129.A OE1 no hydrogen 3.439 N/A ARG 61.A NH2 GLU 129.A OE2 no hydrogen 3.001 N/A ALA 62.A N GLY 58.A O no hydrogen 3.026 N/A ALA 63.A N GLY 59.A O no hydrogen 3.041 N/A TRP 64.A N GLN 60.A O no hydrogen 2.832 N/A TRP 64.A NE1 GLU 87.A OE1 no hydrogen 2.912 N/A ARG 65.A N ARG 61.A O no hydrogen 2.935 N/A VAL 66.A N ALA 62.A O no hydrogen 3.115 N/A LEU 67.A N ALA 63.A O no hydrogen 2.992 N/A SER 68.A N TRP 64.A O no hydrogen 2.821 N/A SER 68.A OG.B TRP 64.A O no hydrogen 3.005 N/A SER 69.A N ARG 65.A O no hydrogen 3.036 N/A ILE 70.A N VAL 66.A O no hydrogen 3.116 N/A GLU 71.A N LEU 67.A O no hydrogen 2.899 N/A GLN 72.A N SER 68.A O no hydrogen 2.920 N/A LYS 73.A N SER 69.A O no hydrogen 3.103 N/A SER 74.A N ILE 70.A O no hydrogen 3.026 N/A SER 74.A OG GLU 71.A O no hydrogen 2.662 N/A ASN 75.A N GLU 71.A O no hydrogen 2.968 N/A GLU 78.A N GLU 78.A OE1 no hydrogen 2.848 N/A ARG 80.A NH1 GLU 84.A OE2 no hydrogen 3.236 N/A GLU 81.A N PRO 77.A O no hydrogen 2.884 N/A TYR 82.A N GLU 78.A O no hydrogen 2.949 N/A ARG 83.A N VAL 79.A O no hydrogen 2.928 N/A ARG 83.A NE GLU 71.A OE1 no hydrogen 2.735 N/A ARG 83.A NH1 GLU 87.A OE1 no hydrogen 2.978 N/A ARG 83.A NH2 GLU 71.A OE1 no hydrogen 3.446 N/A ARG 83.A NH2 GLU 71.A OE2 no hydrogen 2.944 N/A GLU 84.A N ARG 80.A O no hydrogen 2.829 N/A LYS 85.A N GLU 81.A O no hydrogen 2.954 N/A LYS 85.A NZ.A GLU 89.A OE1.A no hydrogen 2.942 N/A VAL 86.A N TYR 82.A O no hydrogen 3.010 N/A GLU 87.A N ARG 83.A O no hydrogen 2.844 N/A THR 88.A N GLU 84.A O no hydrogen 2.876 N/A THR 88.A OG1.A GLU 84.A O no hydrogen 2.908 N/A THR 88.A OG1.B GLU 84.A O no hydrogen 3.008 N/A THR 88.A OG1.B LYS 85.A O no hydrogen 2.594 N/A GLU 89.A N LYS 85.A O no hydrogen 3.106 N/A LEU 90.A N VAL 86.A O no hydrogen 2.921 N/A GLN 91.A N GLU 87.A O no hydrogen 2.899 N/A GLY 92.A N THR 88.A O no hydrogen 2.963 N/A VAL 93.A N GLU 89.A O no hydrogen 3.071 N/A CYS 94.A N LEU 90.A O no hydrogen 3.034 N/A CYS 94.A SG LEU 90.A O no hydrogen 3.527 N/A CYS 94.A SG TYR 123.A O no hydrogen 3.933 N/A ASP 95.A N GLN 91.A O no hydrogen 2.846 N/A THR 96.A N GLY 92.A O no hydrogen 2.974 N/A THR 96.A OG1 GLY 92.A O no hydrogen 3.078 N/A VAL 97.A N VAL 93.A O no hydrogen 2.972 N/A LEU 98.A N CYS 94.A O no hydrogen 2.884 N/A GLY 99.A N ASP 95.A O no hydrogen 2.889 N/A LEU 100.A N THR 96.A O no hydrogen 2.960 N/A LEU 101.A N VAL 97.A O no hydrogen 2.947 N/A ASP 102.A N LEU 98.A O no hydrogen 2.911 N/A SER 103.A N GLY 99.A O no hydrogen 2.837 N/A SER 103.A OG GLY 99.A O no hydrogen 3.164 N/A HIS 104.A N LEU 100.A O no hydrogen 2.952 N/A LEU 105.A N LEU 100.A O no hydrogen 3.221 N/A LEU 105.A N LEU 101.A O no hydrogen 3.188 N/A ILE 106.A N LEU 101.A O no hydrogen 2.810 N/A GLU 111.A N GLU 111.A OE1 no hydrogen 2.807 N/A SER 112.A OG.A ASP 109.A O no hydrogen 3.050 N/A ARG 113.A N ASP 109.A O no hydrogen 2.990 N/A VAL 114.A N ALA 110.A O no hydrogen 2.893 N/A PHE 115.A N GLU 111.A O no hydrogen 3.146 N/A TYR 116.A N SER 112.A O no hydrogen 2.989 N/A LEU 117.A N ARG 113.A O no hydrogen 3.028 N/A LYS 118.A N VAL 114.A O no hydrogen 2.877 N/A LYS 118.A NZ ASP 122.A OD2 no hydrogen 2.847 N/A MET 119.A N PHE 115.A O no hydrogen 3.035 N/A LYS 120.A N TYR 116.A O no hydrogen 2.907 N/A LYS 120.A NZ ASP 102.A OD1.A no hydrogen 3.111 N/A GLY 121.A N LEU 117.A O no hydrogen 2.980 N/A ASP 122.A N LYS 118.A O no hydrogen 2.849 N/A TYR 123.A N MET 119.A O no hydrogen 2.944 N/A TYR 124.A N LYS 120.A O no hydrogen 3.047 N/A ARG 125.A N GLY 121.A O no hydrogen 2.841 N/A ARG 125.A NE TYR 147.A OH no hydrogen 2.922 N/A ARG 125.A NH2 ASP 122.A OD1 no hydrogen 3.167 N/A ARG 125.A NH2 TYR 147.A OH no hydrogen 3.498 N/A TYR 126.A N ASP 122.A O no hydrogen 2.909 N/A LEU 127.A N TYR 123.A O no hydrogen 3.088 N/A ALA 128.A N TYR 124.A O no hydrogen 2.816 N/A GLU 129.A N ARG 125.A O no hydrogen 3.006 N/A VAL 130.A N LEU 127.A O no hydrogen 3.245 N/A ALA 131.A N ALA 128.A O no hydrogen 3.252 N/A LYS 136.A N GLY 133.A O no hydrogen 3.027 N/A ARG 138.A N ASP 134.A O no hydrogen 3.131 N/A ILE 139.A N ASP 135.A O no hydrogen 3.028 N/A ILE 140.A N LYS 136.A O no hydrogen 2.856 N/A ASP 141.A N LYS 137.A O no hydrogen 3.050 N/A SER 142.A N ARG 138.A O no hydrogen 2.981 N/A SER 142.A OG ARG 138.A O no hydrogen 3.305 N/A ALA 143.A N ILE 139.A O no hydrogen 2.952 N/A ARG 144.A N ILE 140.A O no hydrogen 2.924 N/A SER 145.A N ASP 141.A O no hydrogen 2.916 N/A SER 145.A OG.B ASP 141.A O no hydrogen 2.969 N/A ALA 146.A N SER 142.A O no hydrogen 3.126 N/A TYR 147.A N ALA 143.A O no hydrogen 2.973 N/A TYR 147.A OH ASP 122.A OD1 no hydrogen 2.624 N/A GLN 148.A N ARG 144.A O no hydrogen 2.821 N/A GLN 148.A NE2 GLN 148.A O no hydrogen 3.421 N/A GLN 148.A NE2 ASP 152.A OD1 no hydrogen 3.078 N/A GLU 149.A N SER 145.A O no hydrogen 3.047 N/A ALA 150.A N ALA 146.A O no hydrogen 3.055 N/A MET 151.A N TYR 147.A O no hydrogen 2.833 N/A ASP 152.A N GLN 148.A O no hydrogen 2.958 N/A ILE 153.A N GLU 149.A O no hydrogen 3.166 N/A SER 154.A N ALA 150.A O no hydrogen 2.894 N/A SER 154.A OG.A ALA 150.A O no hydrogen 3.455 N/A SER 154.A OG.A MET 151.A O no hydrogen 2.942 N/A SER 154.A OG.B ALA 150.A O no hydrogen 2.772 N/A LYS 155.A N MET 151.A O no hydrogen 2.957 N/A LYS 156.A N ASP 152.A O no hydrogen 3.314 N/A LYS 156.A N ILE 153.A O no hydrogen 3.124 N/A GLU 157.A N ILE 153.A O no hydrogen 2.874 N/A MET 158.A N SER 154.A O no hydrogen 3.028 N/A ASN 162.A N PRO 159.A O no hydrogen 3.023 N/A ARG 165.A N ASN 162.A OD1 no hydrogen 3.129 N/A ARG 165.A NH1 MET 158.A O no hydrogen 2.783 N/A LEU 166.A N ASN 162.A O no hydrogen 2.885 N/A GLY 167.A N PRO 163.A O no hydrogen 2.958 N/A LEU 168.A N ILE 164.A O no hydrogen 2.960 N/A ALA 169.A N ARG 165.A O no hydrogen 3.012 N/A LEU 170.A N LEU 166.A O no hydrogen 2.953 N/A ASN 171.A N GLY 167.A O no hydrogen 3.033 N/A ASN 171.A ND2 ASP 122.A OD1 no hydrogen 2.937 N/A ASN 171.A ND2 ASP 122.A OD2 no hydrogen 3.389 N/A PHE 172.A N LEU 168.A O no hydrogen 2.852 N/A SER 173.A N ALA 169.A O no hydrogen 2.898 N/A SER 173.A OG.A ALA 186.A O no hydrogen 2.810 N/A SER 173.A OG.B ALA 169.A O no hydrogen 3.264 N/A SER 173.A OG.B LEU 170.A O no hydrogen 2.733 N/A VAL 174.A N LEU 170.A O no hydrogen 2.998 N/A PHE 175.A N ASN 171.A O no hydrogen 2.857 N/A HIS 176.A N PHE 172.A O no hydrogen 2.949 N/A TYR 177.A N SER 173.A O no hydrogen 3.004 N/A GLU 178.A N VAL 174.A O no hydrogen 2.772 N/A ILE 179.A N PHE 175.A O no hydrogen 2.962 N/A ALA 180.A N PHE 175.A O no hydrogen 3.001 N/A SER 182.A N HIS 176.A O no hydrogen 2.822 N/A SER 182.A OG.A ALA 180.A O no hydrogen 3.056 N/A SER 182.A OG.B ALA 180.A O no hydrogen 3.056 N/A ALA 186.A N SER 182.A O no hydrogen 3.030 N/A ILE 187.A N PRO 183.A O no hydrogen 2.920 N/A SER 188.A N GLU 184.A O no hydrogen 2.981 N/A SER 188.A OG.B GLU 184.A O no hydrogen 3.072 N/A LEU 189.A N GLU 185.A O no hydrogen 2.950 N/A ALA 190.A N ALA 186.A O no hydrogen 3.036 N/A LYS 191.A N ILE 187.A O no hydrogen 2.957 N/A THR 192.A N SER 188.A O no hydrogen 2.964 N/A THR 192.A OG1 SER 188.A O no hydrogen 3.014 N/A THR 192.A OG1 LEU 189.A O no hydrogen 3.341 N/A THR 193.A N LEU 189.A O no hydrogen 3.018 N/A THR 193.A OG1 LEU 189.A O no hydrogen 2.688 N/A PHE 194.A N ALA 190.A O no hydrogen 2.977 N/A ASP 195.A N LYS 191.A O no hydrogen 2.936 N/A GLU 196.A N THR 192.A O no hydrogen 2.958 N/A ALA 197.A N THR 193.A O no hydrogen 3.028 N/A MET 198.A N PHE 194.A O no hydrogen 2.902 N/A ALA 199.A N ASP 195.A O no hydrogen 3.222 N/A ASP 200.A N ALA 197.A O no hydrogen 2.952 N/A LEU 201.A N MET 198.A O no hydrogen 3.336 N/A THR 203.A N ASP 200.A O no hydrogen 3.140 N/A THR 203.A OG1 ASP 200.A O no hydrogen 2.749 N/A LEU 204.A N LEU 201.A O no hydrogen 3.002 N/A SER 205.A OG SER 208.A OG no hydrogen 3.270 N/A SER 208.A N SER 205.A OG no hydrogen 3.167 N/A SER 208.A OG SER 205.A OG no hydrogen 3.270 N/A TYR 209.A N SER 205.A O no hydrogen 2.789 N/A LYS 210.A N GLU 206.A O no hydrogen 3.106 N/A ASP 211.A N ASP 207.A O no hydrogen 3.072 N/A SER 212.A N SER 208.A O no hydrogen 2.961 N/A SER 212.A OG THR 161.A O no hydrogen 2.651 N/A SER 212.A OG SER 208.A O no hydrogen 3.335 N/A THR 213.A N TYR 209.A O no hydrogen 2.859 N/A THR 213.A OG1 TYR 209.A O no hydrogen 2.746 N/A THR 213.A OG1 LYS 210.A O no hydrogen 3.367 N/A LEU 214.A N LYS 210.A O no hydrogen 3.045 N/A MET 216.A N SER 212.A O no hydrogen 3.007 N/A GLN 217.A N THR 213.A O no hydrogen 2.834 N/A LEU 218.A N LEU 214.A O no hydrogen 3.291 N/A LEU 219.A N ILE 215.A O no hydrogen 3.045 N/A ARG 220.A N MET 216.A O no hydrogen 2.928 N/A ASP 221.A N GLN 217.A O no hydrogen 2.918 N/A ASN 222.A N LEU 218.A O no hydrogen 3.060 N/A LEU 223.A N LEU 219.A O no hydrogen 2.948 N/A THR 224.A N ARG 220.A O no hydrogen 2.891 N/A THR 224.A OG1.A ARG 220.A O no hydrogen 3.211 N/A THR 224.A OG1.B ARG 220.A O no hydrogen 3.420 N/A THR 224.A OG1.B ASP 221.A O no hydrogen 2.773 N/A LEU 225.A N ASP 221.A O no hydrogen 2.992 N/A TRP 226.A N ASN 222.A O no hydrogen 2.879 N/A THR 227.A N LEU 223.A O no hydrogen 2.986 N/A THR 227.A OG1 LEU 223.A O no hydrogen 2.642 N/A