Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4nnw_I.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A OG ASP 2.A OD1 no hydrogen 3.341 N/A SER 4.A OG ASP 2.A OD2 no hydrogen 3.180 N/A SER 5.A N ASP 2.A O no hydrogen 2.875 N/A SER 5.A OG ASP 2.A OD2 no hydrogen 3.411 N/A ASN 7.A ND2 GLY 29.A O no hydrogen 2.901 N/A ILE 10.A N ASP 25.A OD1 no hydrogen 2.848 N/A VAL 11.A N SER 138.A O no hydrogen 2.930 N/A VAL 12.A N ALA 23.A O no hydrogen 2.991 N/A ALA 13.A N ILE 136.A O no hydrogen 2.956 N/A MET 14.A N ALA 21.A O no hydrogen 2.776 N/A THR 15.A N ASP 134.A O no hydrogen 3.245 N/A THR 15.A OG1 LYS 133.A O no hydrogen 2.344 N/A THR 15.A OG1 TYR 153.A OH no hydrogen 3.250 N/A GLY 16.A N CYS 19.A O no hydrogen 2.862 N/A LYS 17.A N LEU 157.A O no hydrogen 2.840 N/A CYS 19.A SG LYS 17.A O no hydrogen 3.418 N/A CYS 19.A SG LEU 157.A O no hydrogen 3.957 N/A VAL 20.A N ILE 189.A O no hydrogen 2.918 N/A ALA 21.A N MET 14.A O no hydrogen 2.735 N/A ILE 22.A N TYR 187.A O no hydrogen 3.049 N/A ALA 23.A N VAL 12.A O no hydrogen 2.759 N/A CYS 24.A N VAL 185.A O no hydrogen 3.008 N/A CYS 24.A SG ASP 25.A O no hydrogen 3.328 N/A ASP 25.A N ILE 10.A O no hydrogen 3.411 N/A LEU 26.A N GLY 181.A O no hydrogen 3.277 N/A LEU 26.A N GLY 183.A O no hydrogen 3.042 N/A ARG 27.A NH1 LEU 179.A O no hydrogen 3.047 N/A ARG 27.A NH2 GLN 31.A O no hydrogen 3.359 N/A LEU 28.A N SER 36.A O no hydrogen 3.099 N/A GLY 29.A N ASN 7.A O no hydrogen 2.864 N/A SER 30.A N LEU 33.A O no hydrogen 2.699 N/A GLN 31.A N ILE 6.A O no hydrogen 2.788 N/A LEU 33.A N SER 30.A O no hydrogen 3.141 N/A VAL 35.A N LEU 28.A O no hydrogen 2.999 N/A SER 36.A N LEU 28.A O no hydrogen 3.108 N/A LYS 38.A N SER 36.A OG no hydrogen 3.244 N/A PHE 39.A N LEU 26.A O no hydrogen 2.928 N/A LYS 41.A NZ ASP 25.A O no hydrogen 3.226 N/A LYS 41.A NZ ASP 25.A OD1 no hydrogen 3.118 N/A LYS 41.A NZ ARG 27.A O no hydrogen 2.620 N/A LYS 41.A NZ PHE 39.A O no hydrogen 3.312 N/A PHE 43.A N LEU 50.A O no hydrogen 2.759 N/A TYR 45.A N VAL 48.A O no hydrogen 2.786 N/A TYR 45.A OH ASN 63.A O no hydrogen 3.376 N/A TYR 45.A OH ASN 63.A OD1 no hydrogen 2.659 N/A HIS 47.A NE2 GLU 82.A OE1 no hydrogen 2.748 N/A VAL 48.A N TYR 45.A O no hydrogen 3.094 N/A PHE 49.A N ALA 109.A O no hydrogen 2.763 N/A LEU 50.A N PHE 43.A O no hydrogen 2.745 N/A GLY 51.A N VAL 107.A O no hydrogen 2.786 N/A ILE 52.A N LYS 41.A O no hydrogen 2.933 N/A THR 53.A N GLY 105.A O no hydrogen 3.305 N/A THR 53.A OG1 GLY 105.A O no hydrogen 3.333 N/A THR 53.A OG1 SER 138.A OG no hydrogen 2.518 N/A LEU 55.A N PHE 103.A O no hydrogen 2.840 N/A ALA 56.A N ASN 7.A OD1 no hydrogen 2.804 N/A VAL 59.A N LEU 55.A O no hydrogen 2.954 N/A THR 60.A N ALA 56.A O no hydrogen 2.953 N/A THR 60.A OG1 ALA 56.A O no hydrogen 3.124 N/A THR 61.A N THR 57.A O no hydrogen 2.976 N/A THR 61.A OG1 THR 57.A O no hydrogen 3.123 N/A LEU 62.A N ASP 58.A O no hydrogen 2.832 N/A ASN 63.A N VAL 59.A O no hydrogen 3.188 N/A GLU 64.A N THR 60.A O no hydrogen 3.107 N/A MET 65.A N THR 61.A O no hydrogen 2.895 N/A PHE 66.A N LEU 62.A O no hydrogen 2.777 N/A ARG 67.A N ASN 63.A O no hydrogen 2.887 N/A TYR 68.A N GLU 64.A O no hydrogen 3.098 N/A LYS 69.A N MET 65.A O no hydrogen 2.959 N/A LYS 69.A NZ SER 93.A OG no hydrogen 2.900 N/A THR 70.A N PHE 66.A O no hydrogen 3.008 N/A THR 70.A OG1 PHE 66.A O no hydrogen 2.628 N/A THR 70.A OG1 ARG 67.A O no hydrogen 3.238 N/A ASN 71.A N ARG 67.A O no hydrogen 2.968 N/A LEU 72.A N TYR 68.A O no hydrogen 3.304 N/A TYR 73.A N LYS 69.A O no hydrogen 2.963 N/A LYS 74.A N THR 70.A O no hydrogen 3.045 N/A LEU 75.A N ASN 71.A O no hydrogen 3.067 N/A LYS 76.A N LEU 72.A O no hydrogen 3.021 N/A GLU 77.A N TYR 73.A O no hydrogen 2.795 N/A GLU 78.A N LYS 74.A O no hydrogen 2.772 N/A GLU 84.A N GLU 84.A OE1 no hydrogen 2.653 N/A PHE 86.A N GLU 82.A O no hydrogen 2.907 N/A THR 87.A N PRO 83.A O no hydrogen 2.943 N/A THR 87.A OG1 PRO 83.A O no hydrogen 2.801 N/A GLN 88.A N GLU 84.A O no hydrogen 3.332 N/A LEU 89.A N THR 85.A O no hydrogen 3.000 N/A VAL 90.A N PHE 86.A O no hydrogen 2.848 N/A SER 91.A N THR 87.A O no hydrogen 3.014 N/A SER 91.A OG GLY 127.A O no hydrogen 2.715 N/A SER 92.A N GLN 88.A O no hydrogen 3.085 N/A SER 92.A OG GLN 88.A O no hydrogen 3.003 N/A SER 92.A OG LEU 89.A O no hydrogen 3.389 N/A SER 93.A N LEU 89.A O no hydrogen 3.106 N/A SER 93.A OG LEU 89.A O no hydrogen 2.921 N/A LEU 94.A N VAL 90.A O no hydrogen 2.927 N/A TYR 95.A N SER 91.A O no hydrogen 2.978 N/A GLU 96.A N SER 92.A O no hydrogen 3.070 N/A ARG 97.A N LEU 94.A O no hydrogen 3.061 N/A ARG 98.A N TYR 95.A O no hydrogen 2.995 N/A ARG 98.A NH2 ARG 98.A O no hydrogen 3.033 N/A GLY 100.A N ARG 97.A O no hydrogen 3.106 N/A PHE 103.A N ASP 58.A OD2 no hydrogen 2.819 N/A GLY 105.A N THR 53.A O no hydrogen 2.823 N/A VAL 107.A N GLY 51.A O no hydrogen 2.713 N/A VAL 108.A N ALA 121.A O no hydrogen 2.731 N/A ALA 109.A N PHE 49.A O no hydrogen 2.839 N/A GLY 110.A N PHE 119.A O no hydrogen 3.036 N/A ASN 112.A N LYS 117.A O no hydrogen 2.915 N/A ASN 112.A ND2 GLU 84.A OE1 no hydrogen 3.004 N/A SER 113.A N GLU 82.A OE1 no hydrogen 2.979 N/A SER 113.A OG GLU 82.A OE2 no hydrogen 2.796 N/A LYS 114.A N ASN 112.A OD1 no hydrogen 3.153 N/A SER 115.A N ASN 112.A OD1 no hydrogen 2.894 N/A SER 115.A OG ASN 112.A OD1 no hydrogen 2.995 N/A GLY 116.A N ASN 112.A O no hydrogen 2.743 N/A LYS 117.A N SER 115.A OG no hydrogen 3.356 N/A PHE 119.A N GLY 110.A O no hydrogen 2.806 N/A ALA 121.A N VAL 108.A O no hydrogen 2.999 N/A GLY 122.A N ASP 130.A O no hydrogen 2.871 N/A PHE 123.A N PRO 106.A O no hydrogen 3.241 N/A ASP 124.A N CYS 128.A O no hydrogen 3.364 N/A GLY 127.A N ASP 124.A O no hydrogen 2.883 N/A CYS 128.A N ASP 124.A OD1 no hydrogen 2.677 N/A CYS 128.A SG ILE 129.A O no hydrogen 3.713 N/A ASP 130.A N GLY 122.A O no hydrogen 2.633 N/A PHE 135.A N ASP 134.A OD1 no hydrogen 2.756 N/A ILE 136.A N ALA 13.A O no hydrogen 3.029 N/A SER 138.A N VAL 11.A O no hydrogen 2.961 N/A SER 138.A OG THR 53.A OG1 no hydrogen 2.518 N/A SER 138.A OG GLY 105.A O no hydrogen 2.861 N/A THR 140.A N GLY 9.A O no hydrogen 3.077 N/A THR 140.A OG1 GLY 9.A O no hydrogen 3.446 N/A THR 140.A OG1 ASP 177.A OD2 no hydrogen 2.712 N/A THR 140.A OG1 SER 180.A OG no hydrogen 3.130 N/A SER 142.A N GLY 139.A O no hydrogen 3.130 N/A GLN 144.A N GLN 144.A OE1 no hydrogen 2.687 N/A GLN 144.A NE2 ARG 176.A O no hydrogen 3.011 N/A LEU 145.A N ALA 141.A O no hydrogen 2.826 N/A PHE 146.A N SER 142.A O no hydrogen 2.916 N/A GLY 147.A N ASP 143.A O no hydrogen 3.102 N/A MET 148.A N GLN 144.A O no hydrogen 2.940 N/A CYS 149.A N LEU 145.A O no hydrogen 2.900 N/A CYS 149.A SG LEU 145.A O no hydrogen 3.183 N/A GLU 150.A N PHE 146.A O no hydrogen 3.071 N/A SER 151.A N GLY 147.A O no hydrogen 3.390 N/A SER 151.A OG GLY 147.A O no hydrogen 2.679 N/A SER 151.A OG MET 148.A O no hydrogen 3.399 N/A LEU 152.A N MET 148.A O no hydrogen 2.815 N/A TYR 153.A N CYS 149.A O no hydrogen 2.923 N/A TYR 153.A OH THR 15.A O no hydrogen 3.320 N/A TYR 153.A OH THR 15.A OG1 no hydrogen 3.250 N/A GLU 160.A N GLU 160.A OE1 no hydrogen 2.764 N/A ASP 161.A N GLU 158.A O no hydrogen 2.816 N/A LEU 162.A N GLU 158.A O no hydrogen 2.781 N/A PHE 163.A N PRO 159.A O no hydrogen 3.046 N/A THR 165.A N ASP 161.A O no hydrogen 3.105 N/A ILE 166.A N LEU 162.A O no hydrogen 2.860 N/A SER 167.A N PHE 163.A O no hydrogen 3.129 N/A SER 167.A OG PHE 163.A O no hydrogen 2.768 N/A GLN 168.A N GLU 164.A O no hydrogen 3.001 N/A ALA 169.A N THR 165.A O no hydrogen 2.926 N/A LEU 170.A N ILE 166.A O no hydrogen 2.980 N/A LEU 171.A N SER 167.A O no hydrogen 2.853 N/A ASN 172.A N GLN 168.A O no hydrogen 3.281 N/A ASN 172.A ND2 GLN 168.A O no hydrogen 2.858 N/A ASN 172.A ND2 GLN 168.A OE1 no hydrogen 3.170 N/A ALA 173.A N ALA 169.A O no hydrogen 3.183 N/A ALA 174.A N LEU 170.A O no hydrogen 2.928 N/A ASP 175.A N LEU 171.A O no hydrogen 3.183 N/A ARG 176.A N ALA 173.A O no hydrogen 3.060 N/A ASP 177.A N ALA 174.A O no hydrogen 3.171 N/A LEU 179.A N ASP 177.A OD1 no hydrogen 3.007 N/A SER 180.A OG THR 140.A OG1 no hydrogen 3.130 N/A SER 180.A OG ASP 177.A OD2 no hydrogen 2.617 N/A GLY 181.A N ASP 25.A OD2 no hydrogen 2.775 N/A VAL 185.A N CYS 24.A O no hydrogen 2.831 N/A VAL 186.A N ARG 197.A O no hydrogen 2.827 N/A TYR 187.A N ILE 22.A O no hydrogen 2.827 N/A ILE 188.A N VAL 195.A O no hydrogen 2.800 N/A ILE 189.A N VAL 20.A O no hydrogen 2.826 N/A LYS 190.A N GLU 193.A O no hydrogen 3.070 N/A LYS 191.A NZ SER 113.A O no hydrogen 3.007 N/A VAL 195.A N ILE 188.A O no hydrogen 2.937 N/A LYS 196.A NZ GLU 40.A OE1 no hydrogen 3.482 N/A LYS 196.A NZ GLU 40.A OE2 no hydrogen 3.095 N/A LYS 196.A NZ TYR 187.A OH no hydrogen 3.119 N/A LYS 196.A NZ TYR 198.A OH no hydrogen 3.351 N/A ARG 197.A N VAL 186.A O no hydrogen 2.875 N/A TYR 198.A OH GLU 40.A OE1 no hydrogen 2.675 N/A LEU 199.A N ALA 184.A O no hydrogen 2.946 N/A ARG 202.A NE ASP 204.A OD1 no hydrogen 3.005 N/A ARG 202.A NH2 ASP 204.A OD2 no hydrogen 2.864 N/A GLN 203.A NE2 MET 201.A O no hydrogen 3.076 N/A