Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4f1k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 1.A N GLU 1.A OE2 no hydrogen 2.940 N/A CYS 3.A N GLN 38.A O no hydrogen 3.166 N/A CYS 3.A SG MET 191.A O no hydrogen 3.344 N/A GLU 6.A N ASP 5.A OD2 no hydrogen 2.727 N/A ASP 8.A N ASN 114.A O no hydrogen 2.857 N/A LEU 9.A N HIS 47.A O no hydrogen 2.924 N/A TYR 10.A N LEU 116.A O no hydrogen 2.834 N/A TYR 10.A OH GLN 115.A OE1 no hydrogen 2.752 N/A LEU 11.A N TYR 49.A O no hydrogen 2.800 N/A LEU 12.A N VAL 118.A O no hydrogen 2.847 N/A MET 13.A N ASN 51.A O no hydrogen 2.874 N/A ASP 14.A N LEU 120.A O no hydrogen 3.063 N/A CYS 15.A N PHE 53.A O no hydrogen 2.847 N/A CYS 15.A SG SER 54.A OG no hydrogen 3.584 N/A SER 16.A N ASP 14.A OD1 no hydrogen 2.890 N/A SER 16.A OG ASP 14.A OD1 no hydrogen 2.617 N/A SER 16.A OG SER 18.A OG no hydrogen 3.120 N/A GLY 17.A N GLY 89.A O no hydrogen 3.031 N/A SER 18.A OG SER 16.A OG no hydrogen 3.120 N/A SER 18.A OG ASP 122.A OD2 no hydrogen 2.686 N/A ILE 19.A N SER 16.A O no hydrogen 3.244 N/A ARG 20.A N GLY 17.A O no hydrogen 3.374 N/A ARG 21.A NH1 LEU 82.A O no hydrogen 3.025 N/A ARG 21.A NH1 LEU 86.A O no hydrogen 2.852 N/A ARG 21.A NH2 LEU 82.A O no hydrogen 2.696 N/A ASN 23.A ND2 ILE 19.A O no hydrogen 3.169 N/A TRP 24.A N ARG 20.A O no hydrogen 3.065 N/A TRP 24.A NE1 LEU 81.A O no hydrogen 3.329 N/A VAL 25.A N ARG 21.A O no hydrogen 2.941 N/A LYS 26.A N HIS 22.A O no hydrogen 2.859 N/A HIS 27.A N ASN 23.A O no hydrogen 2.764 N/A ALA 28.A N ASN 23.A O no hydrogen 2.761 N/A VAL 29.A N TRP 24.A O no hydrogen 3.005 N/A LEU 31.A N HIS 27.A O no hydrogen 2.796 N/A ALA 32.A N ALA 28.A O no hydrogen 3.041 N/A MET 33.A N VAL 29.A O no hydrogen 3.087 N/A LYS 34.A N PRO 30.A O no hydrogen 2.945 N/A LYS 34.A NZ LYS 184.A O no hydrogen 2.749 N/A LEU 35.A N LEU 31.A O no hydrogen 2.827 N/A ILE 36.A N ALA 32.A O no hydrogen 3.056 N/A GLN 37.A N MET 33.A O no hydrogen 3.047 N/A GLN 38.A N LEU 35.A O no hydrogen 2.835 N/A GLN 38.A NE2 LYS 34.A O no hydrogen 2.904 N/A LEU 39.A N ILE 36.A O no hydrogen 3.008 N/A ASN 40.A N CYS 3.A O no hydrogen 2.861 N/A ASN 40.A ND2 ASN 4.A OD1 no hydrogen 2.708 N/A ASN 42.A N ILE 46.A O no hydrogen 3.117 N/A ASN 44.A N ASN 42.A OD1 no hydrogen 2.799 N/A ALA 45.A N ASN 42.A O no hydrogen 3.021 N/A ILE 46.A N ASN 40.A O no hydrogen 3.076 N/A HIS 47.A N VAL 7.A O no hydrogen 2.987 N/A HIS 47.A NE2 GLU 43.A O no hydrogen 2.672 N/A LEU 48.A N SER 68.A O no hydrogen 2.860 N/A TYR 49.A N LEU 9.A O no hydrogen 2.809 N/A ALA 50.A N ILE 61.A O no hydrogen 3.115 N/A ASN 51.A N LEU 11.A O no hydrogen 2.957 N/A ASN 51.A ND2 TYR 49.A OH no hydrogen 3.079 N/A ASN 51.A ND2 ALA 96.A O no hydrogen 3.545 N/A ILE 52.A N LYS 58.A O no hydrogen 3.052 N/A PHE 53.A N MET 13.A O no hydrogen 2.993 N/A SER 54.A N ASN 56.A O no hydrogen 3.114 N/A SER 54.A OG TYR 88.A O no hydrogen 2.692 N/A ASN 55.A N SER 54.A OG no hydrogen 2.818 N/A ALA 57.A N ASP 95.A OD2 no hydrogen 2.747 N/A LYS 58.A N ILE 52.A O no hydrogen 2.726 N/A ILE 60.A N ALA 50.A O no hydrogen 2.766 N/A ILE 61.A N ALA 50.A O no hydrogen 3.083 N/A HIS 64.A N SER 68.A OG no hydrogen 2.865 N/A SER 65.A N ARG 62.A O no hydrogen 3.140 N/A SER 65.A OG ARG 62.A O no hydrogen 2.675 N/A SER 68.A N SER 65.A OG no hydrogen 3.250 N/A SER 68.A OG LEU 48.A O no hydrogen 2.647 N/A LYS 69.A N ASP 66.A O no hydrogen 3.192 N/A LYS 69.A NZ GLU 43.A OE2 no hydrogen 3.087 N/A LYS 69.A NZ HIS 64.A O no hydrogen 2.952 N/A LYS 71.A NZ GLU 1.A OE1 no hydrogen 2.726 N/A LYS 71.A NZ GLN 37.A O no hydrogen 3.141 N/A LYS 73.A N ASN 70.A OD1 no hydrogen 3.037 N/A LYS 73.A NZ.B ASP 66.A OD2 no hydrogen 3.483 N/A ALA 74.A N ASN 70.A O no hydrogen 2.997 N/A LEU 75.A N LYS 71.A O no hydrogen 2.931 N/A ILE 76.A N GLU 72.A O no hydrogen 3.223 N/A ILE 77.A N LYS 73.A O no hydrogen 3.494 N/A ILE 78.A N ALA 74.A O no hydrogen 3.046 N/A LYS 79.A N LEU 75.A O no hydrogen 2.870 N/A SER 80.A N ILE 76.A O no hydrogen 2.940 N/A SER 80.A OG ILE 77.A O no hydrogen 2.644 N/A LEU 81.A N ILE 78.A O no hydrogen 2.927 N/A LEU 82.A N LYS 79.A O no hydrogen 3.100 N/A THR 84.A OG1 LEU 81.A O no hydrogen 2.705 N/A LEU 86.A N THR 84.A OG1 no hydrogen 3.109 N/A TYR 88.A N CYS 15.A O no hydrogen 2.910 N/A ARG 90.A N ASN 55.A OD1 no hydrogen 2.987 N/A ARG 90.A NH1 ASP 126.A OD2 no hydrogen 2.742 N/A THR 91.A N ASP 126.A OD1 no hydrogen 3.077 N/A ASN 92.A N SER 54.A O no hydrogen 2.742 N/A ASN 92.A ND2 ASN 55.A O no hydrogen 2.944 N/A LEU 93.A N THR 91.A O no hydrogen 2.986 N/A SER 94.A OG ASN 92.A OD1 no hydrogen 3.138 N/A ASP 95.A N ASN 92.A OD1 no hydrogen 3.220 N/A ALA 96.A N ASN 92.A O no hydrogen 3.424 N/A LEU 97.A N LEU 93.A O no hydrogen 2.949 N/A LEU 98.A N SER 94.A O no hydrogen 2.845 N/A GLN 99.A N ASP 95.A O no hydrogen 3.145 N/A GLN 99.A NE2 ASP 95.A O no hydrogen 2.901 N/A ARG 101.A N LEU 97.A O no hydrogen 3.097 N/A ARG 101.A NE GLU 134.A OE1 no hydrogen 2.681 N/A ARG 101.A NH2 GLU 134.A OE1 no hydrogen 3.538 N/A ARG 101.A NH2 GLU 134.A OE2 no hydrogen 2.906 N/A LYS 102.A N LEU 98.A O no hydrogen 2.896 N/A HIS 103.A N GLN 99.A O no hydrogen 3.270 N/A HIS 103.A ND1 GLN 99.A O no hydrogen 2.692 N/A LEU 104.A N VAL 100.A O no hydrogen 3.227 N/A ASN 105.A N ARG 101.A O no hydrogen 2.818 N/A ASN 105.A ND2 ASP 106.A OD1 no hydrogen 2.944 N/A ASP 106.A N LYS 102.A O no hydrogen 2.931 N/A ARG 107.A N LEU 104.A O no hydrogen 2.992 N/A ARG 107.A NH1 GLU 111.A OE1 no hydrogen 2.963 N/A ILE 108.A N HIS 103.A O no hydrogen 2.793 N/A ASN 109.A ND2 ARG 110.A O no hydrogen 3.360 N/A ARG 110.A N ASP 8.A OD2 no hydrogen 2.704 N/A ARG 110.A NE ASP 8.A OD1 no hydrogen 2.812 N/A ARG 110.A NH1 ALA 45.A O no hydrogen 3.047 N/A ARG 110.A NH2 ASP 8.A OD1 no hydrogen 2.938 N/A ARG 110.A NH2 ALA 45.A O no hydrogen 2.894 N/A ASN 112.A ND2 GLU 6.A OE1 no hydrogen 2.704 N/A ASN 112.A ND2 GLU 6.A OE2 no hydrogen 3.137 N/A ALA 113.A N ARG 110.A O no hydrogen 3.004 N/A ASN 114.A N GLU 6.A O no hydrogen 2.984 N/A GLN 115.A NE2 ASP 8.A OD2 no hydrogen 3.039 N/A GLN 115.A NE2 ALA 113.A O no hydrogen 3.069 N/A LEU 116.A N ASP 8.A O no hydrogen 3.084 N/A VAL 117.A N LYS 144.A O no hydrogen 2.764 N/A VAL 118.A N TYR 10.A O no hydrogen 2.844 N/A ILE 119.A N ALA 146.A O no hydrogen 2.926 N/A LEU 120.A N LEU 12.A O no hydrogen 3.027 N/A THR 121.A N PHE 148.A O no hydrogen 3.098 N/A THR 121.A OG1 ASP 14.A OD2 no hydrogen 2.715 N/A THR 121.A OG1 GLY 123.A O no hydrogen 3.548 N/A ASP 122.A N ASP 14.A OD2 no hydrogen 3.280 N/A ASP 126.A N THR 91.A O no hydrogen 2.979 N/A ASP 130.A N SER 127.A OG no hydrogen 2.822 N/A SER 131.A N SER 127.A O no hydrogen 2.979 N/A SER 131.A OG SER 127.A O no hydrogen 2.984 N/A LEU 132.A N ILE 128.A O no hydrogen 2.922 N/A LYS 133.A N GLN 129.A O no hydrogen 3.079 N/A GLU 134.A N ASP 130.A O no hydrogen 3.005 N/A SER 135.A N SER 131.A O no hydrogen 2.830 N/A SER 135.A OG SER 131.A O no hydrogen 3.380 N/A SER 135.A OG LEU 132.A O no hydrogen 2.696 N/A ARG 136.A N LEU 132.A O no hydrogen 3.061 N/A LYS 137.A N LYS 133.A O no hydrogen 3.122 N/A LEU 138.A N GLU 134.A O no hydrogen 2.915 N/A ASN 139.A N SER 135.A O no hydrogen 2.803 N/A ASN 139.A ND2 VAL 143.A O no hydrogen 3.007 N/A ASP 140.A N ARG 136.A O no hydrogen 2.875 N/A ARG 141.A N LEU 138.A O no hydrogen 2.879 N/A GLY 142.A N ASN 139.A O no hydrogen 2.957 N/A VAL 143.A N LEU 138.A O no hydrogen 3.025 N/A LYS 144.A N GLN 115.A O no hydrogen 2.942 N/A LYS 144.A NZ GLU 197.A O no hydrogen 3.045 N/A ALA 146.A N VAL 117.A O no hydrogen 2.816 N/A VAL 147.A N LEU 174.A O no hydrogen 2.917 N/A PHE 148.A N ILE 119.A O no hydrogen 2.815 N/A GLY 149.A N ALA 176.A O no hydrogen 2.862 N/A ILE 150.A N THR 121.A O no hydrogen 2.950 N/A GLY 151.A N SER 178.A O no hydrogen 2.832 N/A PHE 158.A N ASN 155.A OD1 no hydrogen 2.900 N/A ASN 159.A N ASN 155.A O no hydrogen 3.103 N/A ASN 159.A ND2 TYR 175.A OH no hydrogen 3.277 N/A ARG 160.A N VAL 156.A O no hydrogen 2.904 N/A ARG 160.A NE HIS 166.A O no hydrogen 2.761 N/A ARG 160.A NH2 HIS 166.A O no hydrogen 3.063 N/A ARG 160.A NH2 GLY 170.A O no hydrogen 2.861 N/A PHE 161.A N ALA 157.A O no hydrogen 2.822 N/A LEU 162.A N PHE 158.A O no hydrogen 2.862 N/A VAL 163.A N ASN 159.A O no hydrogen 3.227 N/A GLY 164.A N PHE 161.A O no hydrogen 3.092 N/A CYS 165.A N ARG 160.A O no hydrogen 2.917 N/A SER 168.A N HIS 166.A ND1 no hydrogen 3.181 N/A SER 168.A OG ASP 169.A OD1 no hydrogen 2.876 N/A ASP 169.A N HIS 166.A ND1 no hydrogen 3.060 N/A ASN 173.A ND2 GLU 197.A OE2 no hydrogen 2.335 N/A TYR 175.A N CYS 172.A O no hydrogen 3.172 N/A TYR 175.A OH ASP 177.A OD2 no hydrogen 2.694 N/A ALA 176.A N VAL 147.A O no hydrogen 3.172 N/A SER 178.A N GLY 149.A O no hydrogen 2.888 N/A SER 178.A OG ALA 179.A O no hydrogen 2.802 N/A GLU 181.A N GLU 181.A OE1 no hydrogen 2.765 N/A ASN 182.A N ALA 179.A O no hydrogen 3.083 N/A VAL 183.A N TRP 180.A O no hydrogen 3.376 N/A ASN 185.A N ASN 182.A O no hydrogen 2.983 N/A VAL 186.A N VAL 183.A O no hydrogen 3.127 N/A ILE 187.A N VAL 183.A O no hydrogen 3.191 N/A PHE 190.A N VAL 186.A O no hydrogen 3.101 N/A MET 191.A N ILE 187.A O no hydrogen 2.973 N/A LYS 192.A N GLY 188.A O no hydrogen 3.038 N/A ALA 193.A N PRO 189.A O no hydrogen 3.025 N/A VAL 194.A N PHE 190.A O no hydrogen 2.838 N/A CYS 195.A N MET 191.A O no hydrogen 2.922 N/A CYS 195.A SG MET 191.A O no hydrogen 3.427 N/A VAL 196.A N LYS 192.A O no hydrogen 2.999 N/A GLU 197.A N ALA 193.A O no hydrogen 3.105 N/A VAL 198.A N VAL 194.A O no hydrogen 2.943 N/A GLU 199.A N CYS 195.A O no hydrogen 3.118 N/A LYS 200.A N VAL 196.A O no hydrogen 3.096 N/A