Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3cm3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 5.A N SER 1.A O no hydrogen 2.950 N/A TYR 5.A OH ASP 143.A OD2 no hydrogen 2.592 N/A LEU 6.A N LEU 2.A O no hydrogen 3.008 N/A LEU 7.A N TYR 3.A O no hydrogen 3.134 N/A LEU 8.A N LYS 4.A O no hydrogen 3.071 N/A ARG 9.A N TYR 5.A O no hydrogen 3.008 N/A ARG 9.A NE ASP 143.A OD1 no hydrogen 3.284 N/A ARG 9.A NE ASP 143.A OD2 no hydrogen 3.116 N/A ARG 9.A NH1 ASP 13.A O no hydrogen 2.877 N/A ARG 9.A NH2 ASP 143.A OD2 no hydrogen 3.007 N/A SER 10.A N LEU 6.A O no hydrogen 2.897 N/A SER 10.A OG LEU 6.A O no hydrogen 2.724 N/A THR 11.A N LEU 8.A O no hydrogen 3.121 N/A THR 11.A OG1 LEU 7.A O no hydrogen 2.876 N/A THR 11.A OG1 LEU 8.A O no hydrogen 3.369 N/A ASP 13.A N LEU 8.A O no hydrogen 3.139 N/A HIS 15.A ND1 LYS 16.A O no hydrogen 2.751 N/A LYS 18.A N GLY 146.A O no hydrogen 2.967 N/A LYS 18.A NZ ARG 145.A O no hydrogen 3.358 N/A THR 24.A N LEU 32.A O no hydrogen 2.908 N/A ARG 25.A NE THR 27.A O no hydrogen 3.283 N/A ARG 25.A NE ASN 28.A O no hydrogen 2.993 N/A ARG 25.A NH2 ASN 28.A O no hydrogen 2.773 N/A VAL 26.A N VAL 30.A O no hydrogen 2.826 N/A THR 27.A N VAL 30.A O no hydrogen 3.186 N/A THR 27.A OG1 ASP 96.A OD1 no hydrogen 2.668 N/A THR 27.A OG1 ASP 96.A OD2 no hydrogen 3.223 N/A ASN 29.A N ASP 96.A OD2 no hydrogen 2.909 N/A ASN 29.A ND2 ASP 96.A OD2 no hydrogen 3.311 N/A ASN 29.A ND2 ASN 99.A OD1 no hydrogen 2.848 N/A VAL 30.A N THR 27.A OG1 no hydrogen 3.089 N/A TYR 31.A N VAL 102.A O no hydrogen 2.905 N/A LEU 32.A N THR 24.A O no hydrogen 2.810 N/A GLY 33.A N VAL 104.A O no hydrogen 2.995 N/A ASN 34.A ND2 PRO 20.A O no hydrogen 3.557 N/A TYR 35.A N ALA 107.A O no hydrogen 3.069 N/A LYS 36.A NZ ASP 40.A OD2 no hydrogen 3.116 N/A ASN 37.A N ASN 34.A OD1 no hydrogen 2.869 N/A ALA 38.A N ASN 34.A O no hydrogen 3.121 N/A MET 39.A N TYR 35.A O no hydrogen 2.982 N/A ASP 40.A N LYS 36.A O no hydrogen 2.940 N/A ALA 41.A N ALA 38.A O no hydrogen 3.090 N/A SER 43.A N ASP 40.A O no hydrogen 3.132 N/A SER 44.A N ALA 41.A O no hydrogen 2.994 N/A SER 44.A OG VAL 46.A O no hydrogen 3.542 N/A VAL 46.A N SER 44.A OG no hydrogen 2.863 N/A PHE 48.A N VAL 46.A O no hydrogen 3.204 N/A LYS 49.A N PRO 101.A O no hydrogen 2.897 N/A LYS 49.A NZ GLU 100.A OE2 no hydrogen 2.931 N/A TYR 50.A N PRO 101.A O no hydrogen 3.230 N/A VAL 51.A N ASN 67.A O no hydrogen 3.010 N/A LEU 52.A N LEU 103.A O no hydrogen 2.765 N/A ASN 53.A N ILE 69.A O no hydrogen 2.846 N/A ASN 53.A ND2 ASP 57.A O.A no hydrogen 2.799 N/A ASN 53.A ND2 ASP 57.A O.B no hydrogen 2.973 N/A LEU 54.A N HIS 105.A O no hydrogen 3.113 N/A THR 55.A N ASN 53.A OD1 no hydrogen 2.936 N/A THR 55.A OG1 ASN 53.A OD1 no hydrogen 2.679 N/A THR 55.A OG1 ASP 57.A O.A no hydrogen 3.459 N/A THR 55.A OG1 ASP 57.A O.B no hydrogen 3.523 N/A LYS 58.A NZ HIS 70.A ND1 no hydrogen 2.882 N/A TYR 59.A N ASP 57.A O.B no hydrogen 3.043 N/A TYR 59.A OH HIS 105.A NE2 no hydrogen 2.656 N/A SER 64.A N LEU 61.A O no hydrogen 2.997 N/A ILE 66.A N SER 64.A OG no hydrogen 3.124 N/A ASN 67.A N LYS 49.A O no hydrogen 2.964 N/A ILE 69.A N VAL 51.A O no hydrogen 2.813 N/A HIS 70.A NE2 THR 55.A O no hydrogen 2.751 N/A ILE 71.A N ASN 53.A O no hydrogen 2.980 N/A LEU 73.A N LEU 54.A O no hydrogen 3.169 N/A THR 78.A N ASP 76.A OD1 no hydrogen 2.937 N/A THR 79.A N ASP 76.A OD1 no hydrogen 2.716 N/A THR 79.A OG1 ASP 76.A OD1 no hydrogen 3.234 N/A ILE 81.A N GLN 157.A OE1 no hydrogen 2.871 N/A SER 82.A N ASP 80.A OD1.B no hydrogen 3.068 N/A SER 82.A N GLN 157.A OE1 no hydrogen 2.992 N/A SER 82.A OG ASP 80.A OD1.B no hydrogen 2.516 N/A SER 82.A OG ASP 80.A OD2.A no hydrogen 2.553 N/A LYS 83.A N ASP 80.A OD1.A no hydrogen 2.873 N/A LYS 83.A NZ ASP 80.A OD1.A no hydrogen 3.139 N/A LYS 83.A NZ ASP 80.A OD2.B no hydrogen 3.464 N/A TYR 84.A N ILE 81.A O no hydrogen 3.121 N/A PHE 85.A N SER 82.A O no hydrogen 3.073 N/A VAL 88.A N TYR 84.A O no hydrogen 2.937 N/A THR 89.A N PHE 85.A O no hydrogen 2.920 N/A THR 89.A OG1 PHE 85.A O no hydrogen 2.902 N/A THR 89.A OG1 ASP 86.A O no hydrogen 3.219 N/A ALA 90.A N ASP 86.A O no hydrogen 3.049 N/A PHE 91.A N ASP 87.A O no hydrogen 3.036 N/A LEU 92.A N VAL 88.A O no hydrogen 2.872 N/A SER 93.A N.A THR 89.A O no hydrogen 2.927 N/A SER 93.A N.B THR 89.A O no hydrogen 2.920 N/A SER 93.A OG.A THR 89.A O no hydrogen 3.153 N/A LYS 94.A N ALA 90.A O no hydrogen 3.060 N/A CYS 95.A N PHE 91.A O no hydrogen 2.978 N/A CYS 95.A SG PHE 91.A O no hydrogen 3.451 N/A ASP 96.A N LEU 92.A O no hydrogen 3.047 N/A GLN 97.A N SER 93.A O.A no hydrogen 2.958 N/A GLN 97.A N SER 93.A O.B no hydrogen 2.913 N/A GLN 97.A NE2 SER 93.A O.A no hydrogen 3.016 N/A GLN 97.A NE2 SER 93.A OG.B no hydrogen 3.013 N/A ARG 98.A N LYS 94.A O no hydrogen 2.903 N/A ARG 98.A NE GLU 100.A OE1 no hydrogen 3.262 N/A ARG 98.A NE GLU 100.A OE2 no hydrogen 2.935 N/A ARG 98.A NH2 GLU 100.A OE2 no hydrogen 3.244 N/A GLU 100.A N CYS 95.A O no hydrogen 2.949 N/A VAL 102.A N ASN 29.A O no hydrogen 2.840 N/A LEU 103.A N TYR 50.A O no hydrogen 3.124 N/A VAL 104.A N TYR 31.A O no hydrogen 2.822 N/A HIS 105.A N LEU 52.A O no hydrogen 3.030 N/A HIS 105.A ND1 SER 106.A O no hydrogen 2.920 N/A HIS 105.A NE2 TYR 59.A OH no hydrogen 2.656 N/A SER 106.A N GLY 33.A O no hydrogen 3.433 N/A SER 106.A OG SER 113.A OG no hydrogen 2.712 N/A GLY 109.A N SER 106.A OG no hydrogen 3.050 N/A ASN 111.A ND2 ASP 75.A OD2 no hydrogen 2.768 N/A ARG 112.A NH1 LEU 73.A O no hydrogen 2.819 N/A SER 113.A OG SER 106.A OG no hydrogen 2.712 N/A ALA 115.A N ASN 111.A O no hydrogen 2.851 N/A MET 116.A N ARG 112.A O no hydrogen 3.267 N/A ILE 117.A N SER 113.A O no hydrogen 2.963 N/A LEU 118.A N GLY 114.A O no hydrogen 2.836 N/A ALA 119.A N ALA 115.A O no hydrogen 2.882 N/A TYR 120.A N MET 116.A O no hydrogen 2.927 N/A TYR 120.A OH ASP 96.A OD1 no hydrogen 2.523 N/A LEU 121.A N ILE 117.A O no hydrogen 2.911 N/A MET 122.A N LEU 118.A O no hydrogen 2.876 N/A SER 123.A N ALA 119.A O no hydrogen 2.836 N/A SER 123.A OG TYR 120.A O no hydrogen 2.644 N/A LYS 124.A N TYR 120.A O no hydrogen 3.016 N/A LYS 124.A N LEU 121.A O no hydrogen 3.215 N/A LYS 124.A NZ SER 93.A OG.B no hydrogen 2.713 N/A ASN 125.A N LEU 121.A O no hydrogen 3.172 N/A ASN 125.A N MET 122.A O no hydrogen 3.165 N/A ASN 125.A ND2 SER 128.A O no hydrogen 2.914 N/A GLU 127.A N ASN 125.A OD1 no hydrogen 3.158 N/A SER 128.A N ASN 125.A OD1 no hydrogen 2.838 N/A TYR 133.A N LEU 129.A O no hydrogen 2.918 N/A PHE 134.A N PRO 130.A O no hydrogen 2.821 N/A LEU 135.A N MET 131.A O no hydrogen 3.170 N/A TYR 136.A N LEU 132.A O no hydrogen 2.947 N/A VAL 137.A N TYR 133.A O no hydrogen 2.824 N/A TYR 138.A N PHE 134.A O no hydrogen 2.893 N/A TYR 138.A OH PHE 148.A O no hydrogen 2.816 N/A HIS 139.A N LEU 135.A O no hydrogen 2.991 N/A SER 140.A N TYR 136.A O no hydrogen 2.919 N/A SER 140.A OG TYR 136.A O no hydrogen 2.729 N/A SER 140.A OG VAL 137.A O no hydrogen 3.366 N/A MET 141.A N VAL 137.A O no hydrogen 2.958 N/A ARG 142.A N TYR 138.A O no hydrogen 2.980 N/A ARG 142.A NE GLU 150.A OE2 no hydrogen 2.871 N/A ARG 142.A NH1 HIS 15.A O no hydrogen 2.746 N/A ARG 142.A NH2 HIS 15.A O no hydrogen 3.303 N/A ARG 142.A NH2 GLU 150.A OE1 no hydrogen 3.180 N/A ASP 143.A N HIS 139.A O no hydrogen 2.922 N/A LEU 144.A N SER 140.A O no hydrogen 3.172 N/A ARG 145.A N MET 141.A O no hydrogen 2.839 N/A ARG 145.A NH1 ILE 22.A O no hydrogen 2.873 N/A ARG 145.A NH1 THR 24.A OG1 no hydrogen 2.826 N/A ARG 145.A NH2 GLY 109.A O no hydrogen 2.950 N/A GLY 146.A N ARG 142.A O no hydrogen 2.762 N/A PHE 148.A N GLU 150.A OE2 no hydrogen 2.854 N/A VAL 149.A N VAL 110.A O no hydrogen 2.896 N/A ASN 151.A N ASN 111.A OD1 no hydrogen 2.964 N/A ASN 151.A ND2 ASP 75.A OD1 no hydrogen 2.852 N/A ASN 151.A ND2 ASP 76.A O no hydrogen 3.181 N/A SER 153.A N ASN 151.A OD1 no hydrogen 2.858 N/A SER 153.A OG.A THR 77.A O no hydrogen 3.434 N/A SER 153.A OG.B THR 77.A O no hydrogen 3.088 N/A PHE 154.A N ASN 151.A OD1 no hydrogen 3.167 N/A LYS 155.A N ASN 151.A O no hydrogen 3.158 N/A LYS 155.A NZ TYR 138.A OH no hydrogen 3.303 N/A LYS 155.A NZ VAL 149.A O no hydrogen 3.272 N/A ARG 156.A N PRO 152.A O no hydrogen 2.920 N/A ARG 156.A NE GLU 160.A OE2 no hydrogen 3.083 N/A GLN 157.A N SER 153.A O no hydrogen 3.061 N/A GLN 157.A NE2 THR 79.A O no hydrogen 3.057 N/A GLN 157.A NE2 SER 153.A O no hydrogen 3.362 N/A GLN 157.A NE2 SER 153.A OG.A no hydrogen 3.143 N/A ILE 158.A N PHE 154.A O no hydrogen 3.053 N/A ILE 159.A N LYS 155.A O no hydrogen 2.923 N/A GLU 160.A N ARG 156.A O no hydrogen 2.883 N/A LYS 161.A N GLN 157.A O no hydrogen 3.062 N/A LYS 161.A NZ ASP 86.A OD1 no hydrogen 2.744 N/A LYS 161.A NZ ASP 86.A OD2 no hydrogen 3.366 N/A TYR 162.A N ILE 158.A O no hydrogen 2.949 N/A VAL 163.A N ILE 159.A O no hydrogen 2.965 N/A ILE 164.A N.A ILE 159.A O no hydrogen 2.907 N/A ILE 164.A N.B ILE 159.A O no hydrogen 2.913 N/A