Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1m4d_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A N HIS 2.A ND1 no hydrogen 2.948 N/A GLN 4.A NE2 HIS 2.A O no hydrogen 3.252 N/A HIS 6.A NE2 HIS 54.A ND1 no hydrogen 2.756 N/A THR 7.A N GLN 4.A O no hydrogen 3.031 N/A ARG 9.A N LEU 51.A O no hydrogen 2.777 N/A VAL 11.A N HIS 49.A O no hydrogen 2.851 N/A THR 13.A N GLY 47.A O no hydrogen 2.983 N/A THR 13.A OG1 GLY 47.A O no hydrogen 3.420 N/A THR 13.A OG1 HIS 49.A NE2 no hydrogen 2.681 N/A ALA 14.A N HIS 12.A ND1 no hydrogen 3.001 N/A ASP 15.A N HIS 12.A O no hydrogen 2.841 N/A LEU 16.A N THR 13.A O no hydrogen 3.038 N/A SER 18.A OG GLN 22.A OE1 no hydrogen 3.181 N/A GLU 19.A N GLU 19.A OE1 no hydrogen 2.696 N/A THR 20.A N ASP 17.A OD1 no hydrogen 2.939 N/A THR 20.A OG1 ASP 17.A OD1 no hydrogen 3.169 N/A THR 20.A OG1 ASP 17.A OD2 no hydrogen 3.177 N/A ARG 21.A N ASP 17.A O no hydrogen 2.989 N/A GLN 22.A N SER 18.A O no hydrogen 2.980 N/A ASP 23.A N GLU 19.A O no hydrogen 2.892 N/A ILE 24.A N THR 20.A O no hydrogen 2.876 N/A ARG 25.A N ARG 21.A O no hydrogen 2.967 N/A GLN 26.A N GLN 22.A O no hydrogen 2.959 N/A GLN 26.A NE2 ASP 23.A O no hydrogen 3.262 N/A GLN 26.A NE2 ASP 23.A OD1 no hydrogen 2.853 N/A MET 27.A N ASP 23.A O no hydrogen 2.906 N/A VAL 28.A N ILE 24.A O no hydrogen 2.864 N/A THR 29.A N ARG 25.A O no hydrogen 2.985 N/A THR 29.A OG1 ARG 25.A O no hydrogen 2.585 N/A GLY 30.A N GLN 26.A O no hydrogen 2.940 N/A ALA 31.A N MET 27.A O no hydrogen 2.735 N/A PHE 32.A N VAL 28.A O no hydrogen 3.354 N/A ALA 33.A N GLY 30.A O no hydrogen 3.458 N/A ASP 35.A N PHE 32.A O no hydrogen 3.167 N/A THR 37.A N ASP 40.A OD2 no hydrogen 2.868 N/A THR 37.A OG1 ASP 40.A OD2 no hydrogen 3.240 N/A ASP 40.A N THR 37.A OG1 no hydrogen 2.998 N/A TRP 41.A N THR 37.A O no hydrogen 2.919 N/A GLU 42.A N GLU 38.A O no hydrogen 2.993 N/A HIS 43.A N THR 39.A O no hydrogen 2.996 N/A HIS 43.A NE2 ALA 177.A O no hydrogen 2.834 N/A THR 44.A N TRP 41.A O no hydrogen 2.813 N/A THR 44.A OG1 TRP 41.A O no hydrogen 2.881 N/A LEU 45.A N GLU 42.A O no hydrogen 3.091 N/A GLY 46.A N THR 13.A OG1 no hydrogen 2.836 N/A MET 48.A N VAL 64.A O no hydrogen 3.039 N/A HIS 49.A N VAL 11.A O no hydrogen 2.871 N/A HIS 49.A ND1 HIS 61.A NE2 no hydrogen 2.990 N/A HIS 49.A NE2 THR 13.A OG1 no hydrogen 2.681 N/A ALA 50.A N ALA 62.A O no hydrogen 2.671 N/A LEU 51.A N ARG 9.A O no hydrogen 2.814 N/A ILE 52.A N ALA 60.A O no hydrogen 3.001 N/A HIS 54.A N ALA 57.A O no hydrogen 2.911 N/A HIS 54.A ND1 HIS 6.A NE2 no hydrogen 2.756 N/A ALA 57.A N HIS 54.A O no hydrogen 2.909 N/A ILE 58.A N ASP 23.A OD2 no hydrogen 2.778 N/A ILE 59.A N ILE 52.A O no hydrogen 2.854 N/A HIS 61.A N ALA 85.A O no hydrogen 2.851 N/A HIS 61.A ND1 GLY 83.A O no hydrogen 2.841 N/A HIS 61.A NE2 HIS 49.A ND1 no hydrogen 2.990 N/A ALA 62.A N ALA 50.A O no hydrogen 3.112 N/A ALA 63.A N GLU 82.A O no hydrogen 2.846 N/A VAL 64.A N MET 48.A O no hydrogen 2.799 N/A ILE 65.A N TYR 80.A O no hydrogen 2.863 N/A ARG 67.A N CYS 78.A O no hydrogen 2.953 N/A ARG 67.A NE ASP 174.A OD1 no hydrogen 2.771 N/A ARG 67.A NH1 VAL 180.A O no hydrogen 2.950 N/A ARG 67.A NH2 ASP 174.A O no hydrogen 2.872 N/A ARG 67.A NH2 ASP 174.A OD1 no hydrogen 3.175 N/A ARG 67.A NH2 VAL 180.A O no hydrogen 2.789 N/A ARG 68.A N ASP 174.A OD2 no hydrogen 2.822 N/A ARG 68.A NH1 ALA 75.A O no hydrogen 2.873 N/A LEU 69.A N LEU 76.A O no hydrogen 3.193 N/A ILE 70.A N MET 172.A O no hydrogen 2.692 N/A TYR 71.A N ASN 74.A O no hydrogen 2.980 N/A ASN 74.A N TYR 71.A O no hydrogen 2.784 N/A LEU 76.A N LEU 69.A O no hydrogen 2.864 N/A ARG 77.A N GLN 112.A OE1 no hydrogen 2.726 N/A ARG 77.A NE ALA 110.A O no hydrogen 2.939 N/A ARG 77.A NH2 ALA 110.A O no hydrogen 3.067 N/A CYS 78.A N ARG 67.A O no hydrogen 2.872 N/A CYS 78.A SG LEU 113.A O no hydrogen 3.895 N/A GLY 79.A N LEU 113.A O no hydrogen 3.006 N/A TYR 80.A N ILE 65.A O no hydrogen 2.762 N/A TYR 80.A OH TRP 181.A OXT no hydrogen 2.635 N/A VAL 81.A N ALA 115.A O no hydrogen 2.882 N/A GLU 82.A N ALA 63.A O no hydrogen 2.790 N/A ALA 85.A N HIS 61.A O no hydrogen 2.947 N/A ARG 87.A N ILE 59.A O no hydrogen 2.713 N/A ARG 87.A NE ASP 89.A OD1 no hydrogen 2.753 N/A ARG 87.A NH2 ASP 89.A OD2 no hydrogen 2.881 N/A TRP 90.A N ARG 87.A O no hydrogen 2.879 N/A ARG 91.A N ALA 88.A O no hydrogen 3.483 N/A ARG 91.A NE VAL 86.A O no hydrogen 2.891 N/A ARG 91.A NH2 ALA 31.A O no hydrogen 3.085 N/A ARG 91.A NH2 VAL 86.A O no hydrogen 3.126 N/A SER 97.A N ARG 94.A O no hydrogen 2.873 N/A LEU 99.A N LEU 95.A O no hydrogen 3.011 N/A LEU 100.A N VAL 96.A O no hydrogen 2.875 N/A ASP 101.A N SER 97.A O no hydrogen 2.902 N/A ALA 102.A N ALA 98.A O no hydrogen 3.422 N/A VAL 103.A N LEU 99.A O no hydrogen 2.920 N/A GLU 104.A N LEU 100.A O no hydrogen 2.791 N/A GLN 105.A N ASP 101.A O no hydrogen 3.084 N/A VAL 106.A N ALA 102.A O no hydrogen 3.038 N/A MET 107.A N VAL 103.A O no hydrogen 2.985 N/A ARG 108.A N GLU 104.A O no hydrogen 2.818 N/A GLY 109.A N GLN 105.A O no hydrogen 2.949 N/A ALA 110.A N MET 107.A O no hydrogen 3.323 N/A TYR 111.A N MET 107.A O no hydrogen 3.061 N/A GLN 112.A N ARG 77.A O no hydrogen 2.830 N/A GLY 114.A N LEU 159.A O no hydrogen 2.851 N/A ALA 115.A N GLY 79.A O no hydrogen 3.019 N/A LEU 116.A N PHE 157.A O no hydrogen 3.146 N/A SER 117.A OG THR 155.A OG1 no hydrogen 2.876 N/A SER 118.A N THR 155.A O no hydrogen 2.817 N/A SER 118.A OG SER 119.A O no hydrogen 2.915 N/A ARG 123.A N SER 119.A O no hydrogen 3.285 N/A ARG 123.A NE GLY 154.A O no hydrogen 3.475 N/A ARG 123.A NH2 GLY 154.A O no hydrogen 3.525 N/A TYR 126.A N ALA 122.A O no hydrogen 3.251 N/A ALA 127.A N ARG 123.A O no hydrogen 2.997 N/A SER 128.A N ARG 124.A O no hydrogen 2.932 N/A SER 128.A OG ARG 124.A O no hydrogen 2.518 N/A ARG 129.A N TYR 126.A O no hydrogen 3.104 N/A ARG 129.A NE GLU 104.A OE1 no hydrogen 3.427 N/A ARG 129.A NE GLU 104.A OE2 no hydrogen 2.796 N/A ARG 129.A NH2 ASP 101.A OD1 no hydrogen 2.821 N/A ARG 129.A NH2 GLU 104.A OE1 no hydrogen 2.877 N/A GLY 130.A N ALA 127.A O no hydrogen 2.943 N/A TRP 131.A N TYR 126.A O no hydrogen 3.150 N/A TRP 131.A NE1 GLU 104.A OE2 no hydrogen 2.810 N/A LEU 132.A N VAL 158.A O no hydrogen 2.799 N/A TRP 134.A N VAL 156.A O no hydrogen 2.771 N/A TRP 134.A NE1 ALA 169.A O no hydrogen 2.731 N/A HIS 135.A N THR 167.A O no hydrogen 2.884 N/A GLY 136.A N THR 167.A O no hydrogen 2.981 N/A THR 138.A N ASP 153.A OD1 no hydrogen 2.831 N/A THR 138.A OG1 THR 149.A OG1 no hydrogen 2.741 N/A THR 138.A OG1 ASP 153.A OD1 no hydrogen 2.842 N/A SER 139.A N LEU 171.A O no hydrogen 3.040 N/A VAL 140.A N VAL 147.A O no hydrogen 2.813 N/A LEU 141.A N CYS 173.A O no hydrogen 2.858 N/A ALA 142.A N GLY 145.A O no hydrogen 3.253 N/A GLY 145.A N ALA 142.A O no hydrogen 2.769 N/A VAL 147.A N VAL 140.A O no hydrogen 2.874 N/A ARG 148.A NH1 THR 138.A O no hydrogen 2.817 N/A ARG 148.A NH1 ASP 153.A OD1 no hydrogen 3.195 N/A ARG 148.A NH1 ASP 153.A OD2 no hydrogen 2.990 N/A ARG 148.A NH2 ASP 153.A OD2 no hydrogen 3.018 N/A THR 149.A N THR 138.A O no hydrogen 3.007 N/A THR 149.A OG1 THR 138.A OG1 no hydrogen 2.741 N/A ASP 152.A N THR 149.A O no hydrogen 2.862 N/A ASP 153.A N PRO 150.A O no hydrogen 3.015 N/A THR 155.A N ASP 152.A O no hydrogen 3.232 N/A THR 155.A OG1 SER 117.A OG no hydrogen 2.876 N/A THR 155.A OG1 ASP 152.A O no hydrogen 2.769 N/A PHE 157.A N LEU 116.A O no hydrogen 2.909 N/A VAL 158.A N LEU 132.A O no hydrogen 2.810 N/A LEU 159.A N GLY 114.A O no hydrogen 2.810 N/A ILE 161.A N GLN 112.A O no hydrogen 2.795 N/A ASP 166.A N TYR 71.A OH no hydrogen 2.874 N/A SER 168.A N ASP 166.A OD1 no hydrogen 2.925 N/A SER 168.A OG ASP 166.A OD1 no hydrogen 2.527 N/A SER 168.A OG ASP 166.A OD2 no hydrogen 3.342 N/A ALA 169.A N ASP 166.A O no hydrogen 3.101 N/A GLU 170.A N GLU 170.A OE1 no hydrogen 2.845 N/A LEU 171.A N PRO 137.A O no hydrogen 3.203 N/A MET 172.A N ILE 70.A O no hydrogen 3.009 N/A CYS 173.A N SER 139.A O no hydrogen 3.047 N/A CYS 173.A SG SER 139.A O no hydrogen 3.733 N/A CYS 173.A SG ASP 174.A O no hydrogen 3.667 N/A CYS 173.A SG VAL 180.A O no hydrogen 3.715 N/A ASP 174.A N ARG 68.A O no hydrogen 3.321 N/A ARG 176.A NE ASP 179.A O no hydrogen 2.929 N/A ARG 176.A NH1 GLU 82.A OE2 no hydrogen 2.964 N/A ARG 176.A NH2 GLU 82.A OE2 no hydrogen 2.823 N/A ARG 176.A NH2 ASP 179.A O no hydrogen 3.209 N/A TRP 181.A NE1 THR 149.A OG1 no hydrogen 2.926 N/A