Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3cei_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 2.A N ASN 39.A OD1 no hydrogen 2.726 N/A ARG 5.A NE GLU 6.A O no hydrogen 3.172 N/A ARG 5.A NH1 ASP 78.A OD2 no hydrogen 2.545 N/A ARG 5.A NH2 ASP 78.A OD1 no hydrogen 3.037 N/A LYS 11.A NZ ASP 24.A OD1 no hydrogen 2.869 N/A SER 13.A N ALA 10.A O no hydrogen 3.000 N/A SER 13.A OG ALA 10.A O no hydrogen 2.611 N/A PHE 17.A N MET 14.A O no hydrogen 2.994 N/A LEU 18.A N MET 14.A O no hydrogen 3.399 N/A SER 19.A N ASP 165.A OD2 no hydrogen 3.045 N/A SER 19.A OG ASP 165.A OD1 no hydrogen 2.758 N/A ALA 22.A N SER 19.A OG no hydrogen 3.249 N/A PHE 23.A N SER 19.A O no hydrogen 3.162 N/A ASP 24.A N PRO 20.A O no hydrogen 2.868 N/A PHE 25.A N VAL 21.A O no hydrogen 2.959 N/A HIS 26.A N ALA 22.A O no hydrogen 2.779 N/A HIS 26.A NE2 HIS 73.A NE2 no hydrogen 2.849 N/A HIS 27.A N PHE 23.A O no hydrogen 2.946 N/A HIS 27.A NE2 ARG 5.A O no hydrogen 2.785 N/A GLY 28.A N PHE 23.A O no hydrogen 3.233 N/A LYS 29.A N PHE 25.A O no hydrogen 3.031 N/A HIS 30.A N PHE 25.A O no hydrogen 2.897 N/A HIS 31.A N HIS 26.A O no hydrogen 2.909 N/A GLN 32.A N HIS 27.A O no hydrogen 3.140 N/A GLN 32.A NE2 GLN 32.A O no hydrogen 3.225 N/A GLN 32.A NE2 ASN 36.A OD1 no hydrogen 2.951 N/A THR 33.A N LYS 29.A O no hydrogen 2.795 N/A THR 33.A OG1 LYS 29.A O no hydrogen 2.633 N/A TYR 34.A N HIS 30.A O no hydrogen 3.155 N/A VAL 35.A N HIS 31.A O no hydrogen 3.232 N/A ASN 36.A N GLN 32.A O no hydrogen 3.050 N/A ASN 37.A N THR 33.A O no hydrogen 2.802 N/A ASN 37.A ND2 ASN 66.A OD1 no hydrogen 3.195 N/A LEU 38.A N TYR 34.A O no hydrogen 2.929 N/A ASN 39.A N VAL 35.A O no hydrogen 2.952 N/A ASN 39.A ND2 PHE 2.A O no hydrogen 2.830 N/A ASN 40.A N ASN 36.A O no hydrogen 3.007 N/A LEU 41.A N ASN 37.A O no hydrogen 2.875 N/A ILE 42.A N LEU 38.A O no hydrogen 2.973 N/A LYS 43.A N ASN 39.A O no hydrogen 3.304 N/A LYS 43.A NZ GLU 48.A OE2 no hydrogen 3.375 N/A GLY 44.A N GLU 48.A OE1 no hydrogen 2.947 N/A THR 45.A N ILE 42.A O no hydrogen 2.851 N/A THR 45.A OG1 ILE 42.A O no hydrogen 2.538 N/A GLU 48.A N THR 45.A O no hydrogen 2.912 N/A SER 50.A N PHE 47.A O no hydrogen 3.004 N/A SER 50.A OG ASP 46.A O no hydrogen 3.259 N/A ALA 54.A N SER 51.A OG no hydrogen 3.029 N/A ILE 55.A N SER 51.A O no hydrogen 2.896 N/A LEU 56.A N LEU 52.A O no hydrogen 2.625 N/A THR 57.A N PHE 53.A O no hydrogen 2.985 N/A THR 57.A OG1 PHE 53.A O no hydrogen 2.693 N/A THR 57.A OG1 ALA 54.A O no hydrogen 3.103 N/A LYS 58.A N ILE 55.A O no hydrogen 3.398 N/A SER 59.A N ILE 55.A O no hydrogen 2.839 N/A SER 59.A OG ILE 55.A O no hydrogen 2.626 N/A PHE 64.A N SER 60.A O no hydrogen 3.202 N/A ASN 65.A N GLY 61.A O no hydrogen 2.944 N/A ASN 66.A N GLY 62.A O no hydrogen 2.951 N/A ASN 66.A ND2 GLY 62.A O no hydrogen 2.958 N/A ALA 67.A N VAL 63.A O no hydrogen 2.890 N/A ALA 68.A N PHE 64.A O no hydrogen 2.737 N/A GLN 69.A N ASN 65.A O no hydrogen 2.924 N/A GLN 69.A NE2 TYR 34.A OH no hydrogen 3.029 N/A ILE 70.A N ASN 66.A O no hydrogen 2.924 N/A TYR 71.A N ALA 67.A O no hydrogen 3.156 N/A ASN 72.A N ALA 68.A O no hydrogen 2.745 N/A ASN 72.A ND2 GLN 69.A OE1 no hydrogen 3.052 N/A ASN 72.A ND2 ALA 141.A O no hydrogen 3.023 N/A HIS 73.A N GLN 69.A O no hydrogen 3.110 N/A HIS 73.A ND1 GLN 69.A O no hydrogen 2.720 N/A HIS 73.A NE2 HIS 26.A NE2 no hydrogen 2.849 N/A ASP 74.A N ILE 70.A O no hydrogen 3.035 N/A PHE 75.A N TYR 71.A O no hydrogen 2.839 N/A TYR 76.A N ASN 72.A O no hydrogen 2.889 N/A TYR 76.A OH TYR 173.A OH no hydrogen 2.780 N/A TRP 77.A N HIS 73.A O no hydrogen 2.828 N/A TRP 77.A NE1 HIS 31.A ND1 no hydrogen 2.990 N/A ASP 78.A N ASP 74.A O no hydrogen 3.301 N/A CYS 79.A N PHE 75.A O no hydrogen 3.120 N/A CYS 79.A N TYR 76.A O no hydrogen 2.888 N/A CYS 79.A SG PHE 75.A O no hydrogen 3.260 N/A CYS 79.A SG VAL 154.A O no hydrogen 4.018 N/A LEU 80.A N TRP 77.A O no hydrogen 3.099 N/A SER 81.A N HIS 180.A O no hydrogen 2.821 N/A SER 81.A OG LYS 83.A O no hydrogen 2.558 N/A THR 85.A OG1 ASN 182.A OD1 no hydrogen 2.680 N/A SER 88.A N SER 187.A OG no hydrogen 2.930 N/A SER 88.A OG SER 187.A OG no hydrogen 3.387 N/A LEU 91.A N SER 88.A OG no hydrogen 3.052 N/A LYS 92.A N SER 88.A O no hydrogen 2.925 N/A GLY 93.A N ASP 89.A O no hydrogen 2.800 N/A ALA 94.A N GLU 90.A O no hydrogen 2.746 N/A LEU 95.A N LEU 91.A O no hydrogen 2.827 N/A GLU 96.A N LYS 92.A O no hydrogen 2.897 N/A LYS 97.A N GLY 93.A O no hydrogen 2.900 N/A LYS 97.A NZ ASP 98.A OD1 no hydrogen 2.659 N/A ASP 98.A N ALA 94.A O no hydrogen 2.925 N/A PHE 99.A N LEU 95.A O no hydrogen 2.810 N/A GLY 100.A N GLU 96.A O no hydrogen 2.569 N/A SER 101.A OG GLU 103.A OE2 no hydrogen 3.016 N/A LYS 104.A N SER 101.A OG no hydrogen 3.159 N/A PHE 105.A N SER 101.A O no hydrogen 2.985 N/A LYS 106.A N LEU 102.A O no hydrogen 2.911 N/A LYS 106.A NZ GLU 175.A OE1 no hydrogen 2.953 N/A GLU 107.A N GLU 103.A O no hydrogen 3.044 N/A ASP 108.A N LYS 104.A O no hydrogen 2.800 N/A PHE 109.A N PHE 105.A O no hydrogen 2.683 N/A ILE 110.A N LYS 106.A O no hydrogen 2.815 N/A LYS 111.A N GLU 107.A O no hydrogen 3.034 N/A SER 112.A N ASP 108.A O no hydrogen 3.030 N/A SER 112.A OG ASN 122.A OD1 no hydrogen 2.889 N/A ALA 113.A N PHE 109.A O no hydrogen 3.011 N/A THR 114.A N ILE 110.A O no hydrogen 2.842 N/A THR 114.A OG1 ILE 110.A O no hydrogen 2.727 N/A THR 115.A N LYS 111.A O no hydrogen 3.108 N/A THR 115.A OG1 LYS 111.A O no hydrogen 3.435 N/A LEU 116.A N SER 112.A O no hydrogen 3.286 N/A TRP 121.A N THR 138.A O no hydrogen 2.804 N/A TRP 121.A NE1 GLN 69.A OE1 no hydrogen 3.128 N/A ASN 122.A N VAL 155.A O no hydrogen 3.006 N/A TRP 123.A N ILE 136.A O no hydrogen 2.691 N/A TRP 123.A NE1 THR 138.A OG1 no hydrogen 2.991 N/A ALA 124.A N LEU 153.A O no hydrogen 2.881 N/A ALA 125.A N GLU 134.A O no hydrogen 2.775 N/A TYR 126.A N VAL 150.A O no hydrogen 2.768 N/A ASN 127.A N LYS 132.A O no hydrogen 2.811 N/A ASN 127.A ND2 GLU 134.A OE1 no hydrogen 3.527 N/A ASN 127.A ND2 GLU 134.A OE2 no hydrogen 3.205 N/A THR 130.A N ASN 127.A OD1 no hydrogen 2.855 N/A LYS 132.A NZ ASP 98.A OD1 no hydrogen 3.026 N/A ILE 133.A N ASP 98.A OD2 no hydrogen 2.925 N/A GLU 134.A N ALA 125.A O no hydrogen 2.807 N/A ILE 136.A N TRP 123.A O no hydrogen 2.875 N/A THR 138.A N TRP 121.A O no hydrogen 2.901 N/A THR 138.A OG1 GLN 142.A O no hydrogen 2.740 N/A ASN 140.A N SER 119.A O no hydrogen 2.713 N/A ASN 140.A ND2 SER 119.A O no hydrogen 3.192 N/A GLN 142.A N SER 139.A O no hydrogen 3.036 N/A THR 146.A N THR 143.A O no hydrogen 3.082 N/A THR 146.A OG1 THR 143.A O no hydrogen 3.262 N/A ASP 147.A N PRO 144.A O no hydrogen 2.627 N/A LYS 148.A N VAL 145.A O no hydrogen 3.071 N/A LYS 149.A N PRO 144.A O no hydrogen 3.245 N/A LYS 149.A NZ GLU 134.A OE1 no hydrogen 2.642 N/A VAL 150.A N TYR 126.A O no hydrogen 3.099 N/A LEU 152.A N ALA 124.A O no hydrogen 2.664 N/A LEU 153.A N ALA 124.A O no hydrogen 3.159 N/A VAL 155.A N ASN 122.A O no hydrogen 3.083 N/A VAL 157.A N GLY 120.A O no hydrogen 2.938 N/A TRP 158.A N ASP 156.A OD1 no hydrogen 3.098 N/A TRP 158.A NE1 ASN 140.A O no hydrogen 2.990 N/A HIS 160.A NE2 HIS 26.A NE2 no hydrogen 2.982 N/A ALA 161.A N TRP 158.A O no hydrogen 2.992 N/A TYR 162.A N GLU 159.A O no hydrogen 2.980 N/A TYR 163.A N GLU 159.A O no hydrogen 2.951 N/A HIS 166.A N TYR 162.A O no hydrogen 2.772 N/A HIS 166.A NE2 PHE 17.A O no hydrogen 2.758 N/A LYS 167.A N TYR 163.A O no hydrogen 2.777 N/A ALA 169.A N HIS 166.A O no hydrogen 2.956 N/A ARG 170.A N ASN 168.A O no hydrogen 2.905 N/A ARG 170.A NE TYR 162.A OH no hydrogen 3.146 N/A ARG 170.A NH1 ALA 113.A O no hydrogen 2.742 N/A ARG 170.A NH1 LEU 116.A O no hydrogen 2.792 N/A ARG 170.A NH2 LEU 116.A O no hydrogen 3.196 N/A TYR 173.A N ALA 169.A O no hydrogen 3.191 N/A TYR 173.A OH TYR 76.A OH no hydrogen 2.780 N/A TYR 173.A OH ASP 156.A O no hydrogen 2.703 N/A LEU 174.A N ARG 170.A O no hydrogen 2.750 N/A GLU 175.A N PRO 171.A O no hydrogen 2.991 N/A LYS 176.A N VAL 172.A O no hydrogen 3.014 N/A PHE 177.A N TYR 173.A O no hydrogen 2.859 N/A TYR 178.A N LEU 174.A O no hydrogen 2.979 N/A GLY 179.A N GLU 175.A O no hydrogen 3.395 N/A HIS 180.A N PHE 177.A O no hydrogen 2.608 N/A HIS 180.A ND1 SER 81.A O no hydrogen 2.754 N/A ILE 181.A N TYR 178.A O no hydrogen 3.239 N/A ASN 182.A N CYS 79.A O no hydrogen 2.759 N/A ASN 182.A ND2 ASP 78.A O no hydrogen 3.021 N/A HIS 184.A N THR 85.A OG1 no hydrogen 2.887 N/A PHE 185.A N ASN 182.A OD1 no hydrogen 3.392 N/A VAL 186.A N ASN 182.A O no hydrogen 2.984 N/A SER 187.A N TRP 183.A O no hydrogen 2.696 N/A SER 187.A OG SER 88.A OG no hydrogen 3.387 N/A SER 187.A OG TRP 183.A O no hydrogen 2.929 N/A GLN 188.A N HIS 184.A O no hydrogen 3.155 N/A CYS 189.A N PHE 185.A O no hydrogen 3.018 N/A CYS 189.A SG PHE 185.A O no hydrogen 3.468 N/A TYR 190.A N VAL 186.A O no hydrogen 3.114 N/A GLU 191.A N SER 187.A O no hydrogen 2.937 N/A TRP 192.A N GLN 188.A O no hydrogen 2.974 N/A ALA 193.A N CYS 189.A O no hydrogen 2.870 N/A ALA 193.A N TYR 190.A O no hydrogen 2.919 N/A LYS 194.A N TYR 190.A O no hydrogen 3.058 N/A LYS 194.A NZ GLU 90.A OE1 no hydrogen 2.999 N/A LYS 195.A N GLU 191.A O no hydrogen 3.082 N/A LYS 195.A NZ GLU 191.A OE1 no hydrogen 3.133 N/A GLU 196.A N TRP 192.A O no hydrogen 2.813 N/A GLY 199.A N GLU 196.A O no hydrogen 2.913 N/A SER 200.A N GLY 197.A O no hydrogen 2.889 N/A SER 200.A OG GLY 197.A O no hydrogen 2.626 N/A VAL 201.A N LEU 198.A O no hydrogen 3.301 N/A TYR 203.A N GLY 199.A O no hydrogen 3.021 N/A TYR 204.A N SER 200.A O no hydrogen 2.825 N/A TYR 204.A OH ASP 78.A OD2 no hydrogen 2.431 N/A ILE 205.A N VAL 201.A O no hydrogen 2.943 N/A ASN 206.A N ASP 202.A O no hydrogen 2.939 N/A ASN 206.A ND2 ASP 202.A OD1 no hydrogen 2.586 N/A GLU 207.A N TYR 203.A O no hydrogen 2.730 N/A HIS 210.A N ILE 205.A O no hydrogen 2.844 N/A HIS 210.A NE2 ASP 74.A OD2 no hydrogen 2.664 N/A LYS 212.A NZ MET 1.A O no hydrogen 3.507 N/A