Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1e3a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 4.A N SER 1.A O no hydrogen 3.155 N/A LYS 6.A N TYR 18.A O no hydrogen 2.912 N/A VAL 8.A N HIS 16.A O no hydrogen 2.946 N/A ARG 9.A NH1 GLY 13.A O no hydrogen 2.852 N/A ARG 9.A NH1 ASP 36.A OD2 no hydrogen 2.926 N/A ARG 9.A NH2 VAL 32.A O no hydrogen 3.509 N/A ARG 9.A NH2 GLN 35.A OE1 no hydrogen 2.875 N/A ARG 9.A NH2 ASP 36.A OD2 no hydrogen 3.383 N/A ASP 10.A N MET 14.A O no hydrogen 3.011 N/A TYR 12.A N ASP 10.A OD1 no hydrogen 2.933 N/A GLY 13.A N ASP 10.A O no hydrogen 2.954 N/A MET 14.A N ASP 10.A OD1 no hydrogen 2.898 N/A HIS 16.A N VAL 8.A O no hydrogen 2.791 N/A TYR 18.A N LYS 6.A O no hydrogen 2.814 N/A THR 22.A OG1 GLU 86.A OE1 no hydrogen 2.769 N/A TRP 23.A NE1 ASP 96.A OD2 no hydrogen 2.786 N/A HIS 24.A N ASP 21.A OD1 no hydrogen 2.906 N/A HIS 24.A ND1 ASP 21.A OD1 no hydrogen 2.713 N/A LEU 25.A N ASP 21.A O no hydrogen 2.995 N/A PHE 26.A N THR 22.A O no hydrogen 3.036 N/A TYR 27.A N TRP 23.A O no hydrogen 2.883 N/A GLY 28.A N HIS 24.A O no hydrogen 3.034 N/A TYR 29.A N LEU 25.A O no hydrogen 3.127 N/A GLY 30.A N PHE 26.A O no hydrogen 2.886 N/A TYR 31.A N TYR 27.A O no hydrogen 3.003 N/A VAL 32.A N GLY 28.A O no hydrogen 3.005 N/A VAL 33.A N TYR 29.A O no hydrogen 2.970 N/A ALA 34.A N GLY 30.A O no hydrogen 2.942 N/A GLN 35.A N TYR 31.A O no hydrogen 2.989 N/A ASP 36.A N VAL 32.A O no hydrogen 2.921 N/A ARG 37.A N VAL 33.A O no hydrogen 2.713 N/A ARG 37.A NH1 GLN 40.A OE1 no hydrogen 2.924 N/A MET 41.A N ARG 37.A O no hydrogen 2.810 N/A GLU 42.A N LEU 38.A O no hydrogen 2.860 N/A MET 43.A N PHE 39.A O no hydrogen 2.921 N/A ALA 44.A N GLN 40.A O no hydrogen 2.859 N/A ARG 45.A N MET 41.A O no hydrogen 2.778 N/A ARG 45.A NH1 ARG 126.A O no hydrogen 2.882 N/A ARG 45.A NH1 ASP 131.A OD2 no hydrogen 3.268 N/A ARG 45.A NH2 GLU 42.A OE1 no hydrogen 2.680 N/A ARG 45.A NH2 LYS 125.A O no hydrogen 3.078 N/A ARG 46.A N GLU 42.A O no hydrogen 2.946 N/A ARG 46.A NE GLU 42.A OE2 no hydrogen 2.729 N/A ARG 46.A NH1 THR 51.A O no hydrogen 2.945 N/A ARG 46.A NH1 GLU 54.A OE1.A no hydrogen 3.062 N/A ARG 46.A NH1 GLU 54.A OE1.B no hydrogen 2.602 N/A SER 47.A N MET 43.A O no hydrogen 2.812 N/A SER 47.A OG MET 43.A O no hydrogen 2.669 N/A THR 48.A N ALA 44.A O no hydrogen 2.831 N/A THR 48.A OG1 ALA 44.A O no hydrogen 2.957 N/A THR 48.A OG1 ARG 45.A O no hydrogen 3.006 N/A GLN 49.A N ARG 45.A O no hydrogen 3.081 N/A GLN 49.A NE2 ASP 131.A OD1 no hydrogen 2.925 N/A THR 51.A N ARG 46.A O no hydrogen 2.949 N/A VAL 52.A N ASP 64.A OD1 no hydrogen 2.897 N/A ALA 53.A N ASP 64.A OD2 no hydrogen 2.662 N/A VAL 55.A N VAL 52.A O no hydrogen 3.067 N/A LEU 56.A N VAL 52.A O no hydrogen 2.863 N/A GLY 57.A N ALA 53.A O no hydrogen 2.854 N/A LYS 58.A NZ ASP 59.A OD1 no hydrogen 3.333 N/A PHE 60.A N GLY 57.A O no hydrogen 3.093 N/A VAL 61.A N LYS 58.A O no hydrogen 3.270 N/A ASP 64.A N PHE 60.A O no hydrogen 2.924 N/A LYS 65.A N VAL 61.A O no hydrogen 2.991 N/A ASP 66.A N LYS 62.A O no hydrogen 2.897 N/A ILE 67.A N PHE 63.A O no hydrogen 2.996 N/A ARG 68.A N ASP 64.A O no hydrogen 3.027 N/A ARG 68.A NE GLY 50.A O no hydrogen 2.993 N/A ARG 68.A NH2 GLY 50.A O no hydrogen 2.853 N/A ARG 69.A N LYS 65.A O no hydrogen 2.850 N/A ASN 70.A N ILE 67.A O no hydrogen 3.042 N/A ASN 70.A ND2 ASP 146.A OD2 no hydrogen 3.065 N/A TYR 71.A N ARG 68.A O no hydrogen 3.518 N/A ALA 75.A N TRP 72.A O no hydrogen 2.968 N/A ILE 76.A N TRP 72.A O no hydrogen 3.471 N/A ARG 77.A N PRO 73.A O no hydrogen 2.902 N/A ALA 78.A N ASP 74.A O no hydrogen 2.951 N/A GLN 79.A N ALA 75.A O no hydrogen 3.047 N/A GLN 79.A NE2 ALA 75.A O no hydrogen 3.539 N/A ILE 80.A N ILE 76.A O no hydrogen 3.036 N/A ALA 81.A N ARG 77.A O no hydrogen 2.825 N/A ALA 82.A N ALA 78.A O no hydrogen 3.167 N/A ALA 82.A N GLN 79.A O no hydrogen 3.236 N/A LEU 83.A N ILE 80.A O no hydrogen 3.150 N/A ASP 87.A N SER 84.A OG no hydrogen 3.140 N/A MET 88.A N SER 84.A O no hydrogen 2.897 N/A SER 89.A N PRO 85.A O no hydrogen 3.047 N/A SER 89.A OG PRO 85.A O no hydrogen 2.838 N/A ILE 90.A N ASP 87.A O no hydrogen 3.142 N/A GLN 92.A N MET 88.A O no hydrogen 2.865 N/A GLN 92.A NE2 GLN 92.A O no hydrogen 3.690 N/A GLN 92.A NE2 ASP 96.A OD1 no hydrogen 2.941 N/A GLN 92.A NE2 ASP 96.A OD2 no hydrogen 3.483 N/A GLY 93.A N SER 89.A O no hydrogen 2.966 N/A TYR 94.A N ILE 90.A O no hydrogen 3.044 N/A ALA 95.A N LEU 91.A O no hydrogen 3.030 N/A ASP 96.A N GLN 92.A O no hydrogen 2.753 N/A GLY 97.A N GLY 93.A O no hydrogen 2.823 N/A MET 98.A N TYR 94.A O no hydrogen 3.080 N/A ASN 99.A N ALA 95.A O no hydrogen 2.907 N/A ASN 99.A ND2 TRP 127.A O no hydrogen 2.867 N/A ALA 100.A N ASP 96.A O no hydrogen 3.054 N/A TRP 101.A N GLY 97.A O no hydrogen 3.353 N/A ILE 102.A N MET 98.A O no hydrogen 2.792 N/A ASP 103.A N ASN 99.A O no hydrogen 2.795 N/A LYS 104.A N ALA 100.A O no hydrogen 3.233 N/A LYS 104.A NZ TYR 31.A OH no hydrogen 2.899 N/A VAL 105.A N TRP 101.A O no hydrogen 2.887 N/A ASN 106.A N ILE 102.A O no hydrogen 2.996 N/A ASN 106.A ND2 PRO 124.A O no hydrogen 2.977 N/A THR 107.A N LYS 104.A O no hydrogen 3.237 N/A THR 107.A OG1 ASP 103.A O no hydrogen 2.699 N/A ASN 108.A N LYS 104.A O no hydrogen 3.075 N/A ASN 108.A ND2 GLU 110.A OE2 no hydrogen 2.763 N/A GLU 110.A N GLU 110.A OE1 no hydrogen 2.765 N/A THR 111.A N ASN 108.A O no hydrogen 3.427 N/A LEU 112.A N ASN 108.A O no hydrogen 3.045 N/A LEU 113.A N PRO 109.A O no hydrogen 3.185 N/A GLN 116.A N GLN 116.A OE1 no hydrogen 2.771 N/A PHE 117.A N PRO 114.A O no hydrogen 2.982 N/A THR 119.A N LYS 115.A O no hydrogen 3.075 N/A THR 119.A OG1 LYS 115.A O no hydrogen 3.372 N/A PHE 120.A N GLN 116.A O no hydrogen 2.829 N/A GLY 121.A N ASN 118.A O no hydrogen 3.131 N/A PHE 122.A N PHE 117.A O no hydrogen 3.109 N/A ARG 126.A NE ASP 103.A OD1 no hydrogen 2.806 N/A ARG 126.A NH2 ASP 103.A OD1 no hydrogen 3.163 N/A TRP 127.A N ASN 99.A OD1 no hydrogen 2.715 N/A GLU 128.A N ASP 131.A OD2 no hydrogen 2.805 N/A VAL 132.A N GLU 128.A O no hydrogen 3.244 N/A ALA 133.A N PRO 129.A O no hydrogen 2.933 N/A MET 134.A N PHE 130.A O no hydrogen 2.784 N/A ILE 135.A N ASP 131.A O no hydrogen 3.132 N/A ILE 135.A N VAL 132.A O no hydrogen 3.194 N/A VAL 137.A N ALA 133.A O no hydrogen 2.871 N/A GLY 138.A N MET 134.A O no hydrogen 2.722 N/A THR 139.A N ILE 135.A O no hydrogen 3.239 N/A THR 139.A N PHE 136.A O no hydrogen 3.112 N/A THR 139.A OG1 ILE 135.A O no hydrogen 2.531 N/A THR 139.A OG1 PHE 136.A O no hydrogen 3.350 N/A MET 140.A N THR 139.A OG1 no hydrogen 2.877 N/A ALA 141.A N VAL 137.A O no hydrogen 3.222 N/A ASN 142.A N VAL 137.A O no hydrogen 2.820 N/A ARG 143.A N THR 139.A O no hydrogen 3.227 N/A PHE 144.A N THR 139.A O no hydrogen 2.966 N/A SER 145.A N ALA 141.A O no hydrogen 3.196 N/A SER 149.A OG ASN 153.A OD1 no hydrogen 2.768 N/A ASN 153.A N SER 149.A O no hydrogen 2.745 N/A LEU 154.A N GLU 150.A O no hydrogen 2.893 N/A ALA 155.A N ILE 151.A O no hydrogen 2.895 N/A LEU 156.A N ASP 152.A O no hydrogen 2.854 N/A LEU 157.A N ASN 153.A O no hydrogen 2.801 N/A THR 158.A N LEU 154.A O no hydrogen 2.848 N/A THR 158.A OG1 LEU 154.A O no hydrogen 2.754 N/A ALA 159.A N ALA 155.A O no hydrogen 3.115 N/A LEU 160.A N LEU 156.A O no hydrogen 2.844 N/A LYS 161.A N LEU 157.A O no hydrogen 2.873 N/A ASP 162.A N THR 158.A O no hydrogen 2.926 N/A LYS 163.A N ALA 159.A O no hydrogen 3.016 N/A TYR 164.A N LEU 160.A O no hydrogen 2.814 N/A GLY 165.A N LYS 161.A O no hydrogen 2.772 N/A GLY 169.A N GLY 165.A O no hydrogen 2.861 N/A MET 170.A N VAL 166.A O no hydrogen 3.160 N/A ALA 171.A N SER 167.A O no hydrogen 2.931 N/A VAL 172.A N GLN 168.A O no hydrogen 2.798 N/A PHE 173.A N GLY 169.A O no hydrogen 2.890 N/A ASN 174.A N MET 170.A O no hydrogen 3.030 N/A GLN 175.A N ALA 171.A O no hydrogen 3.116 N/A LEU 176.A N VAL 172.A O no hydrogen 3.009 N/A LYS 177.A N PHE 173.A O no hydrogen 2.790 N/A SER 183.A N ASN 181.A OD1 no hydrogen 3.031 N/A SER 183.A OG ASN 181.A OD1 no hydrogen 2.790 N/A ALA 184.A N ASN 181.A O no hydrogen 3.072 N/A THR 186.A OG1 ILE 188.A O no hydrogen 2.824 N/A GLN 191.A N GLN 191.A OE1 no hydrogen 2.833 N/A GLU 192.A N ALA 189.A O no hydrogen 2.942 N/A ASN 194.A ND2 TYR 195.A O no hydrogen 3.585 N/A LYS 198.A NZ TYR 195.A O no hydrogen 2.653 N/A GLN 202.A NE2 ASN 203.A OD1 no hydrogen 3.553 N/A SER 204.A OG ASN 200.A O no hydrogen 3.523 N/A SER 204.A OG GLN 201.A O no hydrogen 3.458 N/A LEU 209.A N THR 206.A O no hydrogen 2.964 N/A ARG 212.A NE ASP 214.A OD1 no hydrogen 3.360 N/A ARG 212.A NE ASP 214.A OD2 no hydrogen 2.928 N/A ARG 212.A NH1 ASP 162.A OD1 no hydrogen 2.901 N/A ARG 212.A NH2 ASP 162.A OD1 no hydrogen 3.539 N/A ARG 212.A NH2 ASP 162.A OD2 no hydrogen 2.720 N/A ARG 212.A NH2 ASP 214.A OD1 no hydrogen 2.822 N/A TYR 213.A N THR 158.A OG1 no hydrogen 2.942 N/A MET 219.A N ASP 152.A OD1 no hydrogen 2.778 N/A LEU 220.A N ALA 217.A O no hydrogen 3.181 N/A ASP 221.A N PRO 218.A O no hydrogen 2.967 N/A ARG 222.A N MET 219.A O no hydrogen 3.443 N/A ARG 222.A NE MET 219.A O no hydrogen 2.802 N/A ARG 222.A NH1 ALA 256.A O no hydrogen 2.912 N/A ARG 222.A NH1 GLY 257.A O no hydrogen 3.201 N/A ARG 222.A NH2 MET 219.A O no hydrogen 3.517 N/A ARG 222.A NH2 ALA 256.A O no hydrogen 2.748 N/A ALA 224.A N ASN 239.A OD1 no hydrogen 2.875 N/A GLY 226.A N ALA 230.A O no hydrogen 2.997 N/A GLY 229.A N GLY 226.A O no hydrogen 2.972 N/A LEU 232.A N ALA 224.A O no hydrogen 2.926 N/A ASN 239.A N ALA 235.A O no hydrogen 2.933 N/A ASN 239.A ND2 LEU 220.A O no hydrogen 3.228 N/A ASN 239.A ND2 ARG 222.A O no hydrogen 2.754 N/A ARG 240.A N ALA 236.A O no hydrogen 3.193 N/A GLU 241.A N GLY 237.A O no hydrogen 3.262 N/A THR 242.A N LYS 238.A O no hydrogen 2.920 N/A THR 242.A OG1 LYS 238.A O no hydrogen 2.792 N/A ILE 243.A N ASN 239.A O no hydrogen 2.906 N/A ALA 244.A N ARG 240.A O no hydrogen 3.062 N/A ALA 245.A N GLU 241.A O no hydrogen 3.087 N/A GLN 246.A N THR 242.A O no hydrogen 2.863 N/A GLN 246.A NE2 LYS 225.A O no hydrogen 2.862 N/A PHE 247.A N ILE 243.A O no hydrogen 2.742 N/A ALA 248.A N ALA 244.A O no hydrogen 2.886 N/A GLN 249.A N ALA 245.A O no hydrogen 3.133 N/A GLY 250.A N GLN 246.A O no hydrogen 2.853 N/A GLY 251.A N PHE 247.A O no hydrogen 2.768 N/A GLY 254.A N GLY 251.A O no hydrogen 3.042 N/A GLY 257.A N GLY 254.A O no hydrogen 3.017 N/A TYR 258.A N ALA 252.A O no hydrogen 2.943 N/A