Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3jxz_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 67.A OE1 no hydrogen 3.401 N/A HIS 2.A N GLU 67.A OE1 no hydrogen 3.068 N/A LYS 6.A N HIS 2.A O no hydrogen 3.030 N/A ALA 7.A N PRO 3.A O no hydrogen 2.950 N/A LEU 8.A N PHE 4.A O no hydrogen 3.012 N/A GLN 9.A N VAL 5.A O no hydrogen 2.821 N/A GLU 10.A N LYS 6.A O no hydrogen 2.976 N/A HIS 11.A N ALA 7.A O no hydrogen 2.919 N/A HIS 11.A NE2 ASP 48.A OD1 no hydrogen 3.028 N/A PHE 12.A N LEU 8.A O no hydrogen 2.882 N/A THR 13.A N GLN 9.A O no hydrogen 3.062 N/A THR 13.A OG1 GLN 9.A O no hydrogen 2.709 N/A ALA 14.A N GLU 10.A O no hydrogen 3.073 N/A HIS 15.A N PHE 12.A O no hydrogen 2.991 N/A GLN 16.A N THR 13.A O no hydrogen 3.212 N/A ASN 17.A N LEU 35.A O no hydrogen 2.822 N/A GLU 19.A N ASN 17.A OD1 no hydrogen 3.124 N/A LYS 20.A N ASN 17.A O no hydrogen 2.957 N/A LYS 20.A NZ GLU 41.A OE1 no hydrogen 3.540 N/A ALA 21.A N ASN 17.A O no hydrogen 3.093 N/A MET 24.A N LYS 20.A O no hydrogen 3.299 N/A ALA 25.A N ALA 21.A O no hydrogen 2.912 N/A ARG 26.A N GLU 22.A O no hydrogen 2.999 N/A TYR 27.A N PRO 23.A O no hydrogen 3.006 N/A MET 28.A N ALA 25.A O no hydrogen 3.249 N/A LYS 29.A N ARG 26.A O no hydrogen 2.805 N/A ASN 30.A N ALA 25.A O no hydrogen 2.882 N/A HIS 31.A N MET 28.A O no hydrogen 3.254 N/A LEU 35.A N GLU 75.A OE1 no hydrogen 2.841 N/A GLY 36.A N GLU 75.A OE2 no hydrogen 2.741 N/A ILE 37.A N GLU 75.A OE2 no hydrogen 2.839 N/A GLN 38.A N GLU 41.A OE1 no hydrogen 3.183 N/A ARG 42.A N GLN 38.A O no hydrogen 2.845 N/A ARG 42.A NE ASP 82.A OD2 no hydrogen 3.116 N/A ARG 42.A NH2 ASP 82.A OD1 no hydrogen 3.268 N/A ARG 42.A NH2 ASP 82.A OD2 no hydrogen 2.902 N/A ARG 43.A N THR 39.A O no hydrogen 2.939 N/A ARG 43.A NE ASP 82.A OD1 no hydrogen 3.448 N/A GLN 44.A N PRO 40.A O no hydrogen 3.053 N/A LEU 45.A N GLU 41.A O no hydrogen 2.789 N/A LEU 46.A N ARG 42.A O no hydrogen 3.019 N/A LYS 47.A N ARG 43.A O no hydrogen 2.770 N/A ASP 48.A N GLN 44.A O no hydrogen 2.778 N/A ILE 49.A N LEU 45.A O no hydrogen 3.242 N/A ILE 50.A N LEU 46.A O no hydrogen 2.977 N/A GLN 51.A N LYS 47.A O no hydrogen 2.876 N/A ILE 52.A N ASP 48.A O no hydrogen 3.219 N/A ILE 52.A N ILE 49.A O no hydrogen 3.298 N/A HIS 53.A N ILE 49.A O no hydrogen 2.898 N/A THR 54.A N ILE 50.A O no hydrogen 2.661 N/A THR 54.A OG1 HIS 53.A O no hydrogen 2.496 N/A LYS 59.A N ASP 57.A OD1 no hydrogen 3.043 N/A ASP 60.A N ASP 57.A O no hydrogen 2.781 N/A PHE 61.A N GLN 58.A O no hydrogen 3.405 N/A ILE 64.A N ASP 60.A O no hydrogen 3.216 N/A ILE 65.A N PHE 61.A O no hydrogen 2.995 N/A ARG 66.A N GLN 62.A O no hydrogen 2.914 N/A ARG 66.A NH1 GLU 101.A OE1 no hydrogen 2.593 N/A ARG 66.A NH2 GLU 101.A OE1 no hydrogen 2.996 N/A ARG 66.A NH2 GLU 101.A OE2 no hydrogen 3.055 N/A GLU 67.A N ILE 63.A O no hydrogen 2.964 N/A LEU 68.A N ILE 64.A O no hydrogen 3.055 N/A TRP 69.A N ILE 65.A O no hydrogen 2.927 N/A TRP 69.A NE1 THR 105.A O no hydrogen 2.987 N/A ASP 70.A N ARG 66.A O no hydrogen 3.157 N/A ASP 70.A N GLU 67.A O no hydrogen 3.305 N/A LEU 71.A N LEU 68.A O no hydrogen 3.265 N/A GLU 73.A N GLU 73.A OE1 no hydrogen 2.856 N/A ARG 74.A N LEU 33.A O no hydrogen 2.927 N/A ARG 74.A NE ASP 110.A OD2 no hydrogen 2.949 N/A ARG 74.A NH1 GLN 77.A OE1 no hydrogen 3.180 N/A ARG 74.A NH1 LYS 106.A O no hydrogen 2.952 N/A ARG 74.A NH2 LYS 106.A O no hydrogen 3.373 N/A ARG 74.A NH2 ASP 110.A OD1 no hydrogen 2.660 N/A ARG 74.A NH2 ASP 110.A OD2 no hydrogen 3.447 N/A ARG 74.A NH2 SER 111.A OG no hydrogen 3.073 N/A GLU 75.A N GLU 75.A OE1 no hydrogen 2.852 N/A PHE 76.A N GLU 73.A O no hydrogen 3.084 N/A GLN 77.A N ARG 74.A O no hydrogen 2.898 N/A GLN 77.A NE2 LEU 68.A O no hydrogen 3.116 N/A GLN 77.A NE2 LEU 71.A O no hydrogen 2.879 N/A ALA 78.A N ARG 74.A O no hydrogen 3.087 N/A ALA 79.A N GLU 75.A O no hydrogen 2.725 N/A ALA 80.A N PHE 76.A O no hydrogen 2.901 N/A LEU 81.A N GLN 77.A O no hydrogen 3.088 N/A ASP 82.A N ALA 78.A O no hydrogen 3.083 N/A ILE 83.A N ALA 79.A O no hydrogen 2.936 N/A MET 84.A N ALA 80.A O no hydrogen 2.874 N/A GLN 85.A N LEU 81.A O no hydrogen 3.048 N/A LYS 86.A N ASP 82.A O no hydrogen 3.284 N/A TYR 87.A N ILE 83.A O no hydrogen 3.239 N/A TYR 87.A N MET 84.A O no hydrogen 3.048 N/A TYR 87.A OH PRO 56.A O no hydrogen 2.607 N/A LYS 88.A N GLN 85.A O no hydrogen 3.121 N/A HIS 90.A N TYR 87.A O no hydrogen 2.757 N/A ILE 91.A N LYS 88.A O no hydrogen 3.146 N/A GLU 93.A N GLU 93.A OE1 no hydrogen 2.761 N/A THR 94.A N ASN 92.A OD1 no hydrogen 2.898 N/A THR 94.A OG1 ASN 92.A OD1 no hydrogen 2.647 N/A HIS 95.A N ASN 92.A O no hydrogen 2.962 N/A ILE 96.A N GLU 93.A O no hydrogen 3.286 N/A LEU 99.A N HIS 95.A O no hydrogen 2.929 N/A GLU 100.A N ILE 96.A O no hydrogen 2.788 N/A GLU 101.A N PRO 97.A O no hydrogen 3.042 N/A LEU 102.A N PHE 98.A O no hydrogen 3.117 N/A ILE 103.A N LEU 99.A O no hydrogen 2.978 N/A VAL 104.A N GLU 100.A O no hydrogen 3.101 N/A VAL 104.A N GLU 101.A O no hydrogen 3.268 N/A THR 105.A OG1 GLU 101.A O no hydrogen 2.932 N/A LYS 106.A NZ TRP 69.A O no hydrogen 2.996 N/A SER 107.A OG ILE 103.A O no hydrogen 2.772 N/A SER 111.A OG TRP 108.A O no hydrogen 3.378 N/A VAL 112.A N TRP 108.A O no hydrogen 3.166 N/A ASP 113.A N TRP 109.A O no hydrogen 2.928 N/A SER 114.A N SER 111.A O no hydrogen 3.016 N/A SER 114.A OG ASP 110.A O no hydrogen 2.865 N/A ILE 115.A N VAL 112.A O no hydrogen 3.099 N/A VAL 116.A N VAL 112.A O no hydrogen 3.021 N/A PHE 119.A N ILE 115.A O no hydrogen 3.195 N/A LEU 120.A N ILE 115.A O no hydrogen 3.433 N/A GLY 121.A N VAL 116.A O no hydrogen 2.989 N/A ASP 122.A N THR 118.A O no hydrogen 3.031 N/A ILE 123.A N PHE 119.A O no hydrogen 3.068 N/A PHE 124.A N LEU 120.A O no hydrogen 2.994 N/A LEU 125.A N GLY 121.A O no hydrogen 3.313 N/A LYS 126.A N ASP 122.A O no hydrogen 3.132 N/A HIS 127.A N ILE 123.A O no hydrogen 2.835 N/A GLU 129.A N GLU 129.A OE1 no hydrogen 2.717 N/A LEU 130.A N HIS 127.A O no hydrogen 2.944 N/A ILE 131.A N PRO 128.A O no hydrogen 3.341 N/A ALA 133.A N LEU 130.A O no hydrogen 2.899 N/A TYR 134.A N ILE 131.A O no hydrogen 3.209 N/A ILE 135.A N ILE 131.A O no hydrogen 2.864 N/A LYS 137.A NZ GLU 100.A OE2 no hydrogen 2.875 N/A TRP 138.A N TYR 134.A O no hydrogen 2.825 N/A TRP 138.A NE1 GLU 100.A OE2 no hydrogen 2.620 N/A ILE 139.A N ILE 135.A O no hydrogen 2.935 N/A ALA 140.A N PRO 136.A O no hydrogen 3.068 N/A SER 141.A N TRP 138.A O no hydrogen 3.257 N/A SER 141.A OG TRP 138.A O no hydrogen 2.798 N/A ASN 143.A N SER 141.A OG no hydrogen 3.023 N/A TRP 145.A N ASN 143.A OD1 no hydrogen 2.890 N/A LEU 146.A N ASN 143.A OD1 no hydrogen 3.198 N/A GLN 147.A N ASN 143.A O no hydrogen 2.994 N/A GLN 147.A NE2 ILE 139.A O no hydrogen 2.943 N/A ARG 148.A N ILE 144.A O no hydrogen 2.889 N/A ARG 148.A NE ASP 113.A OD1 no hydrogen 2.923 N/A ARG 148.A NH1 PHE 180.A O no hydrogen 2.854 N/A ARG 148.A NH2 ASP 113.A OD1 no hydrogen 3.222 N/A ARG 148.A NH2 ASP 113.A OD2 no hydrogen 2.785 N/A ALA 149.A N TRP 145.A O no hydrogen 2.932 N/A ALA 150.A N LEU 146.A O no hydrogen 3.003 N/A ILE 151.A N GLN 147.A O no hydrogen 3.262 N/A LEU 152.A N ARG 148.A O no hydrogen 2.997 N/A PHE 153.A N ALA 149.A O no hydrogen 3.158 N/A LEU 155.A N LEU 152.A O no hydrogen 2.929 N/A TYR 157.A N GLN 154.A O no hydrogen 2.933 N/A TYR 157.A OH GLY 121.A O no hydrogen 2.667 N/A GLN 159.A N GLN 159.A OE1.B no hydrogen 2.802 N/A LYS 160.A N TYR 157.A O no hydrogen 2.817 N/A MET 161.A N LYS 158.A O no hydrogen 3.083 N/A ASP 162.A N GLN 154.A OE1 no hydrogen 3.210 N/A LEU 165.A N ASP 162.A OD1 no hydrogen 3.323 N/A LEU 166.A N ASP 162.A O no hydrogen 2.858 N/A PHE 167.A N GLU 163.A O no hydrogen 2.874 N/A TRP 168.A N GLU 164.A O no hydrogen 3.001 N/A ILE 169.A N LEU 165.A O no hydrogen 2.974 N/A ILE 170.A N LEU 166.A O no hydrogen 3.020 N/A GLY 171.A N PHE 167.A O no hydrogen 2.886 N/A GLN 172.A N TRP 168.A O no hydrogen 3.077 N/A GLN 172.A N ILE 169.A O no hydrogen 3.129 N/A LEU 173.A N ILE 170.A O no hydrogen 2.909 N/A SER 176.A N LEU 173.A O no hydrogen 3.014 N/A GLU 178.A N SER 176.A OG no hydrogen 3.130 N/A ILE 181.A N GLU 178.A O no hydrogen 3.105 N/A GLN 182.A N GLU 178.A O no hydrogen 3.050 N/A GLN 182.A NE2 SER 176.A O no hydrogen 3.016 N/A LYS 183.A N PHE 179.A O no hydrogen 2.901 N/A LYS 183.A NZ GLU 216.A OE2 no hydrogen 2.962 N/A ALA 184.A N PHE 180.A O no hydrogen 3.135 N/A ILE 185.A N ILE 181.A O no hydrogen 2.939 N/A GLY 186.A N GLN 182.A O no hydrogen 3.086 N/A TRP 187.A N LYS 183.A O no hydrogen 2.837 N/A VAL 188.A N ALA 184.A O no hydrogen 3.035 N/A LEU 189.A N ILE 185.A O no hydrogen 3.231 N/A ARG 190.A N GLY 186.A O no hydrogen 2.886 N/A ARG 190.A NH1 GLU 216.A O no hydrogen 2.966 N/A ARG 190.A NH1 GLU 216.A OE1 no hydrogen 2.780 N/A GLU 191.A N TRP 187.A O no hydrogen 2.721 N/A TYR 192.A N VAL 188.A O no hydrogen 2.758 N/A TYR 192.A OH GLU 163.A OE2 no hydrogen 2.495 N/A ALA 193.A N LEU 189.A O no hydrogen 2.988 N/A LYS 194.A N GLU 191.A O no hydrogen 3.142 N/A LYS 194.A NZ GLU 191.A OE1 no hydrogen 2.789 N/A THR 195.A N TYR 192.A O no hydrogen 2.895 N/A ASN 196.A N TYR 192.A O no hydrogen 2.911 N/A TRP 201.A N PRO 197.A O no hydrogen 2.922 N/A GLU 202.A N ASP 198.A O no hydrogen 3.022 N/A TYR 203.A N VAL 199.A O no hydrogen 2.976 N/A VAL 204.A N VAL 200.A O no hydrogen 2.902 N/A GLN 205.A N TRP 201.A O no hydrogen 3.019 N/A ASN 206.A N GLU 202.A O no hydrogen 2.998 N/A ASN 206.A N TYR 203.A O no hydrogen 3.310 N/A ASN 207.A ND2 TYR 203.A O no hydrogen 2.937 N/A SER 213.A OG GLN 182.A O no hydrogen 2.769 N/A LYS 214.A N ALA 210.A O no hydrogen 3.070 N/A LYS 214.A NZ VAL 204.A O no hydrogen 2.831 N/A LYS 214.A NZ ASN 207.A O no hydrogen 2.790 N/A ARG 215.A N PRO 211.A O no hydrogen 2.917 N/A GLU 216.A N LEU 212.A O no hydrogen 3.027 N/A ALA 217.A N SER 213.A O no hydrogen 2.893 N/A ILE 218.A N LYS 214.A O no hydrogen 3.276 N/A ILE 221.A N ILE 218.A O no hydrogen 3.098 N/A LYS 222.A N ILE 218.A O no hydrogen 2.957 N/A ASN 224.A N ILE 221.A O no hydrogen 2.737 N/A TYR 225.A N LYS 222.A O no hydrogen 3.192 N/A TYR 225.A OH ASP 198.A OD1 no hydrogen 2.702 N/A