Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3mxi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 6.A ND1 ASP 204.A OD2 no hydrogen 2.867 N/A MET 7.A N ASP 204.A OD1 no hydrogen 3.112 N/A GLN 8.A N PRO 110.A O no hydrogen 3.117 N/A GLN 8.A NE2 HIS 6.A O no hydrogen 2.688 N/A THR 9.A N PRO 110.A O no hydrogen 3.518 N/A LEU 10.A N VAL 35.A O no hydrogen 2.774 N/A ILE 11.A N CYS 112.A O no hydrogen 2.901 N/A PHE 12.A N LEU 33.A O no hydrogen 3.142 N/A LEU 13.A N VAL 114.A O no hydrogen 3.039 N/A ASN 14.A N CYS 31.A O no hydrogen 3.050 N/A ASN 14.A ND2 ALA 181.A O no hydrogen 2.947 N/A LEU 15.A N ASP 122.A OD2 no hydrogen 3.247 N/A GLU 16.A N GLU 29.A O no hydrogen 2.801 N/A THR 18.A N GLU 26.A O no hydrogen 2.919 N/A THR 18.A OG1 GLU 26.A O no hydrogen 3.469 N/A SER 23.A N LEU 20.A O no hydrogen 2.826 N/A SER 23.A OG LEU 20.A O no hydrogen 2.724 N/A ARG 24.A N PRO 21.A O no hydrogen 3.051 N/A GLU 26.A N THR 18.A OG1 no hydrogen 2.677 N/A VAL 27.A N GLU 129.A OE2 no hydrogen 2.799 N/A THR 28.A N GLU 16.A O no hydrogen 2.845 N/A GLU 29.A N GLU 16.A O no hydrogen 3.277 N/A LEU 30.A N LEU 61.A O no hydrogen 2.988 N/A CYS 31.A N ASN 14.A O no hydrogen 2.850 N/A CYS 31.A SG LEU 32.A O no hydrogen 3.781 N/A CYS 31.A SG LEU 59.A O no hydrogen 3.534 N/A LEU 32.A N LEU 59.A O no hydrogen 2.690 N/A LEU 33.A N PHE 12.A O no hydrogen 2.986 N/A ALA 34.A N ASP 57.A O no hydrogen 2.562 N/A VAL 35.A N LEU 10.A O no hydrogen 2.769 N/A ARG 37.A N GLN 8.A O no hydrogen 2.867 N/A ARG 37.A NH1 MET 7.A O no hydrogen 2.751 N/A ARG 37.A NH1 ASP 204.A OD1 no hydrogen 3.312 N/A ARG 37.A NH1 ASP 204.A OD2 no hydrogen 3.083 N/A ARG 37.A NH2 ASP 204.A OD2 no hydrogen 2.863 N/A ARG 38.A N HIS 36.A ND1 no hydrogen 3.249 N/A ALA 39.A N HIS 36.A O no hydrogen 2.985 N/A LEU 40.A N ARG 37.A O no hydrogen 2.874 N/A GLU 41.A N ARG 37.A O no hydrogen 3.024 N/A GLU 41.A N ARG 38.A O no hydrogen 3.099 N/A ARG 54.A NH1 ARG 54.A O no hydrogen 2.839 N/A ASP 57.A N ALA 34.A O no hydrogen 3.051 N/A LYS 58.A NZ GLU 182.A OE2 no hydrogen 2.858 N/A LEU 59.A N LEU 32.A O no hydrogen 2.729 N/A LEU 61.A N LEU 30.A O no hydrogen 2.820 N/A CYS 62.A SG GLU 29.A OE2 no hydrogen 3.650 N/A ILE 63.A N THR 28.A O no hydrogen 2.712 N/A ALA 64.A N GLN 90.A O no hydrogen 3.130 N/A GLY 66.A N GLU 26.A OE1 no hydrogen 2.789 N/A LYS 67.A NZ SER 23.A O no hydrogen 2.892 N/A LYS 67.A NZ ARG 24.A O no hydrogen 2.912 N/A SER 70.A N THR 18.A O no hydrogen 2.663 N/A SER 70.A OG THR 18.A O no hydrogen 2.938 N/A ALA 73.A N SER 70.A OG no hydrogen 3.034 N/A SER 74.A N SER 70.A O no hydrogen 3.075 N/A SER 74.A OG LEU 79.A O no hydrogen 2.709 N/A GLU 75.A N PRO 71.A O no hydrogen 3.035 N/A ILE 76.A N GLY 72.A O no hydrogen 3.151 N/A THR 77.A N ALA 73.A O no hydrogen 2.908 N/A THR 77.A OG1 ALA 73.A O no hydrogen 2.914 N/A GLY 78.A N SER 74.A O no hydrogen 2.933 N/A LEU 79.A N THR 77.A OG1 no hydrogen 3.210 N/A LYS 81.A NZ PRO 65.A O no hydrogen 3.524 N/A GLU 83.A N SER 80.A OG no hydrogen 3.099 N/A LEU 84.A N SER 80.A O no hydrogen 3.046 N/A GLU 85.A N LYS 81.A O no hydrogen 3.161 N/A VAL 86.A N ALA 82.A O no hydrogen 2.994 N/A GLN 87.A N GLU 83.A O no hydrogen 2.881 N/A GLN 87.A NE2 GLU 83.A OE2 no hydrogen 2.876 N/A GLY 88.A N GLU 85.A O no hydrogen 3.036 N/A ARG 89.A N LEU 84.A O no hydrogen 2.675 N/A ARG 89.A NE GLN 87.A O no hydrogen 3.047 N/A ARG 89.A NH2 GLN 87.A O no hydrogen 3.116 N/A LEU 96.A N ASP 93.A OD1 no hydrogen 3.070 N/A ALA 97.A N ASP 93.A O no hydrogen 3.188 N/A ALA 97.A N ASP 94.A O no hydrogen 3.093 N/A ILE 98.A N ASP 94.A O no hydrogen 3.106 N/A LEU 99.A N ASN 95.A O no hydrogen 3.031 N/A LEU 100.A N LEU 96.A O no hydrogen 3.020 N/A ARG 101.A N ALA 97.A O no hydrogen 2.656 N/A ALA 102.A N ILE 98.A O no hydrogen 2.689 N/A PHE 103.A N LEU 99.A O no hydrogen 2.763 N/A LEU 104.A N LEU 100.A O no hydrogen 2.750 N/A GLN 105.A N ARG 101.A O no hydrogen 2.895 N/A ARG 106.A N PHE 103.A O no hydrogen 3.191 N/A GLN 107.A N LEU 104.A O no hydrogen 3.060 N/A GLN 107.A NE2 ASP 57.A OD2 no hydrogen 2.841 N/A GLN 107.A NE2 PHE 103.A O no hydrogen 3.251 N/A GLN 109.A NE2 LEU 104.A O no hydrogen 3.609 N/A CYS 111.A SG GLN 109.A OE1 no hydrogen 3.108 N/A CYS 112.A N THR 9.A O no hydrogen 3.038 N/A CYS 112.A SG LEU 113.A O no hydrogen 3.891 N/A LEU 113.A N PHE 143.A O no hydrogen 2.472 N/A VAL 114.A N ILE 11.A O no hydrogen 2.822 N/A ALA 115.A N VAL 145.A O no hydrogen 3.278 N/A HIS 116.A ND1 SER 147.A OG no hydrogen 2.924 N/A HIS 116.A NE2 TYR 161.A O no hydrogen 2.682 N/A ASN 117.A N ASP 146.A OD1 no hydrogen 2.967 N/A GLY 118.A N ALA 115.A O no hydrogen 3.186 N/A ASP 119.A N ASP 146.A OD2 no hydrogen 3.203 N/A ARG 120.A N ASN 117.A O no hydrogen 2.919 N/A TYR 121.A N ASN 117.A O no hydrogen 2.807 N/A TYR 121.A N GLY 118.A O no hydrogen 3.322 N/A TYR 121.A OH GLY 19.A O no hydrogen 2.692 N/A PHE 123.A N GLY 118.A O no hydrogen 2.998 N/A LEU 125.A N TYR 121.A O no hydrogen 2.969 N/A LEU 126.A N ASP 122.A O no hydrogen 2.805 N/A GLN 127.A N PHE 123.A O no hydrogen 2.744 N/A GLN 127.A NE2 PHE 210.A O no hydrogen 3.254 N/A GLN 127.A NE2 VAL 213.A O no hydrogen 2.810 N/A THR 128.A N PRO 124.A O no hydrogen 2.987 N/A THR 128.A OG1 PRO 124.A O no hydrogen 3.464 N/A THR 128.A OG1 TYR 217.A O no hydrogen 3.025 N/A GLU 129.A N LEU 125.A O no hydrogen 2.874 N/A LEU 130.A N LEU 126.A O no hydrogen 2.876 N/A ALA 131.A N GLN 127.A O no hydrogen 3.054 N/A ALA 131.A N THR 128.A O no hydrogen 3.167 N/A ARG 132.A N GLU 129.A O no hydrogen 2.928 N/A LEU 133.A N LEU 130.A O no hydrogen 3.219 N/A SER 134.A N ASP 94.A OD1 no hydrogen 3.245 N/A THR 135.A N ASP 94.A OD1 no hydrogen 3.392 N/A THR 135.A OG1 ASP 94.A OD1 no hydrogen 3.086 N/A LEU 139.A N SER 137.A OG no hydrogen 2.986 N/A ASP 140.A N SER 137.A OG no hydrogen 3.214 N/A THR 142.A N LEU 139.A O no hydrogen 2.780 N/A THR 142.A OG1 LEU 139.A O no hydrogen 2.892 N/A PHE 143.A N CYS 111.A O no hydrogen 2.896 N/A CYS 144.A N ARG 208.A O no hydrogen 2.862 N/A CYS 144.A SG ARG 208.A O no hydrogen 3.853 N/A VAL 145.A N LEU 113.A O no hydrogen 2.898 N/A SER 147.A N ALA 115.A O no hydrogen 3.167 N/A SER 147.A OG HIS 116.A ND1 no hydrogen 2.924 N/A ILE 148.A N ASP 146.A OD1 no hydrogen 2.809 N/A ALA 150.A N ASP 146.A O no hydrogen 3.397 N/A LEU 151.A N SER 147.A O no hydrogen 3.102 N/A LYS 152.A N ILE 148.A O no hydrogen 2.997 N/A ALA 153.A N ALA 149.A O no hydrogen 3.068 N/A LEU 154.A N ALA 150.A O no hydrogen 2.795 N/A GLU 155.A N LEU 151.A O no hydrogen 2.818 N/A GLN 156.A N LYS 152.A O no hydrogen 2.890 N/A ALA 157.A N ALA 153.A O no hydrogen 3.309 N/A SER 158.A N GLU 155.A O no hydrogen 3.050 N/A SER 158.A OG LEU 154.A O no hydrogen 3.355 N/A LYS 159.A NZ TYR 161.A OH no hydrogen 3.177 N/A SER 160.A OG SER 165.A OG no hydrogen 3.073 N/A TYR 161.A OH GLU 155.A OE1 no hydrogen 2.648 N/A SER 162.A N SER 160.A OG no hydrogen 3.383 N/A SER 162.A OG SER 165.A OG no hydrogen 2.708 N/A SER 165.A OG SER 160.A OG no hydrogen 3.073 N/A SER 165.A OG SER 162.A OG no hydrogen 2.708 N/A ILE 166.A N SER 162.A O no hydrogen 3.289 N/A TYR 167.A N LEU 163.A O no hydrogen 3.169 N/A THR 168.A N GLY 164.A O no hydrogen 2.830 N/A THR 168.A N SER 165.A O no hydrogen 3.167 N/A THR 168.A OG1 GLY 164.A O no hydrogen 3.091 N/A THR 168.A OG1 GLN 173.A O no hydrogen 2.854 N/A ARG 169.A N SER 165.A O no hydrogen 2.780 N/A ARG 169.A NE GLU 155.A OE2 no hydrogen 2.404 N/A ARG 169.A NH1 SER 160.A O no hydrogen 2.944 N/A ARG 169.A NH2 GLU 155.A OE1 no hydrogen 3.099 N/A ARG 169.A NH2 SER 160.A O no hydrogen 2.866 N/A LEU 170.A N ILE 166.A O no hydrogen 2.786 N/A TYR 171.A N TYR 167.A O no hydrogen 3.145 N/A TYR 171.A OH SER 190.A O no hydrogen 2.853 N/A TRP 172.A N THR 168.A O no hydrogen 2.799 N/A THR 176.A OG1 ASP 177.A OD2 no hydrogen 3.275 N/A HIS 179.A N ASP 184.A OD1 no hydrogen 2.985 N/A HIS 179.A N ASP 184.A OD2 no hydrogen 3.224 N/A THR 180.A OG1 ASP 177.A O no hydrogen 3.231 N/A ALA 181.A N GLU 29.A OE1 no hydrogen 2.698 N/A GLY 183.A N THR 180.A OG1 no hydrogen 3.131 N/A ASP 184.A N THR 180.A O no hydrogen 2.950 N/A VAL 185.A N ALA 181.A O no hydrogen 3.251 N/A VAL 185.A N GLU 182.A O no hydrogen 2.829 N/A LEU 186.A N GLU 182.A O no hydrogen 2.999 N/A THR 187.A N GLY 183.A O no hydrogen 3.468 N/A THR 187.A OG1 GLY 183.A O no hydrogen 3.460 N/A LEU 188.A N ASP 184.A O no hydrogen 3.174 N/A LEU 189.A N VAL 185.A O no hydrogen 2.885 N/A SER 190.A N LEU 186.A O no hydrogen 2.857 N/A SER 190.A OG LEU 186.A O no hydrogen 3.071 N/A ILE 191.A N THR 187.A O no hydrogen 3.068 N/A CYS 192.A N LEU 188.A O no hydrogen 3.058 N/A CYS 192.A SG LEU 188.A O no hydrogen 3.337 N/A GLN 193.A N LEU 189.A O no hydrogen 2.940 N/A GLN 193.A N SER 190.A O no hydrogen 3.187 N/A GLN 193.A NE2 ARG 51.A O no hydrogen 2.914 N/A TRP 194.A N ILE 191.A O no hydrogen 3.080 N/A LYS 195.A NZ SER 158.A OG no hydrogen 2.436 N/A ALA 198.A N LYS 195.A O no hydrogen 3.050 N/A LEU 199.A N LYS 195.A O no hydrogen 2.837 N/A LEU 200.A N PRO 196.A O no hydrogen 2.677 N/A GLN 201.A N GLN 197.A O no hydrogen 3.273 N/A GLN 201.A NE2 GLU 205.A OE2 no hydrogen 3.070 N/A TRP 202.A N ALA 198.A O no hydrogen 2.898 N/A VAL 203.A N LEU 199.A O no hydrogen 2.712 N/A ASP 204.A N LEU 200.A O no hydrogen 3.180 N/A GLU 205.A N GLN 201.A O no hydrogen 3.005 N/A HIS 206.A N TRP 202.A O no hydrogen 3.032 N/A HIS 206.A N VAL 203.A O no hydrogen 2.923 N/A HIS 206.A ND1 TRP 202.A O no hydrogen 2.781 N/A ALA 207.A N VAL 203.A O no hydrogen 2.703 N/A ARG 208.A N CYS 144.A O no hydrogen 3.248 N/A ARG 208.A NE THR 212.A OG1 no hydrogen 3.418 N/A ARG 208.A NH1 ASP 119.A OD1 no hydrogen 3.218 N/A PHE 210.A N THR 142.A O no hydrogen 2.907 N/A THR 212.A N PRO 209.A O no hydrogen 3.045 N/A THR 212.A OG1 PRO 209.A O no hydrogen 3.048 N/A VAL 213.A N PHE 210.A O no hydrogen 2.986 N/A MET 216.A N PRO 124.A O no hydrogen 3.104 N/A TYR 217.A N THR 128.A OG1 no hydrogen 3.243 N/A TYR 217.A OH PRO 25.A O no hydrogen 2.593 N/A