Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4nel_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A NH1 HIS 42.A O.A no hydrogen 3.489 N/A ARG 4.A NH1 HIS 42.A O.B no hydrogen 3.478 N/A ARG 5.A N SER 1.A O no hydrogen 2.927 N/A ARG 5.A NH1 GLU 9.A OE1 no hydrogen 2.454 N/A ARG 5.A NH2 GLU 9.A OE1 no hydrogen 2.557 N/A ARG 6.A N GLU 2.A O no hydrogen 3.213 N/A ILE 7.A N ALA 3.A O no hydrogen 2.980 N/A LEU 8.A N ARG 4.A O no hydrogen 2.934 N/A GLU 9.A N ARG 5.A O no hydrogen 2.971 N/A THR 10.A N ARG 6.A O no hydrogen 2.966 N/A THR 10.A OG1 ARG 6.A O no hydrogen 2.634 N/A ALA 11.A N ILE 7.A O no hydrogen 2.862 N/A TRP 12.A N LEU 8.A O no hydrogen 3.037 N/A TRP 12.A NE1 ASN 57.A OD1 no hydrogen 2.827 N/A ARG 13.A N.A GLU 9.A O no hydrogen 3.035 N/A ARG 13.A N.B GLU 9.A O no hydrogen 3.045 N/A ARG 13.A NH1.B GLU 31.A OE1 no hydrogen 2.739 N/A ARG 13.A NH2.B GLU 31.A OE1 no hydrogen 2.573 N/A LEU 14.A N THR 10.A O no hydrogen 2.944 N/A ILE 15.A N ALA 11.A O no hydrogen 2.816 N/A ALA 16.A N TRP 12.A O no hydrogen 2.894 N/A ARG 17.A N ARG 13.A O.A no hydrogen 2.923 N/A ARG 17.A N ARG 13.A O.B no hydrogen 2.887 N/A ARG 17.A NE ASP 95.A OD1 no hydrogen 3.130 N/A ARG 17.A NE ASP 95.A OD2 no hydrogen 3.224 N/A ARG 17.A NH1 ASP 95.A OD2 no hydrogen 2.951 N/A ARG 18.A N LEU 14.A O no hydrogen 2.744 N/A GLY 19.A N ILE 15.A O no hydrogen 2.859 N/A TYR 20.A N GLN 102.A OE1 no hydrogen 2.825 N/A HIS 21.A NE2 GLU 106.A OE2 no hydrogen 2.740 N/A ASN 22.A N GLY 19.A O no hydrogen 2.877 N/A ASN 22.A ND2 ARG 18.A O no hydrogen 3.010 N/A VAL 23.A N TYR 20.A O no hydrogen 3.085 N/A ARG 24.A N ASP 27.A OD2 no hydrogen 2.594 N/A ASP 27.A N ARG 24.A O no hydrogen 2.954 N/A ILE 28.A N ARG 24.A O no hydrogen 3.161 N/A ALA 29.A N ILE 25.A O no hydrogen 2.858 N/A SER 30.A N HIS 26.A O no hydrogen 2.796 N/A SER 30.A OG HIS 26.A O no hydrogen 2.953 N/A GLU 31.A N ASP 27.A O no hydrogen 3.063 N/A LEU 32.A N ILE 28.A O no hydrogen 3.224 N/A LEU 32.A N ALA 29.A O no hydrogen 3.255 N/A GLY 33.A N SER 30.A O no hydrogen 3.228 N/A THR 34.A N ALA 29.A O no hydrogen 2.753 N/A SER 35.A OG THR 38.A OG1 no hydrogen 2.753 N/A THR 38.A N SER 35.A OG no hydrogen 3.116 N/A THR 38.A OG1 THR 34.A OG1 no hydrogen 3.413 N/A THR 38.A OG1 SER 35.A OG no hydrogen 2.753 N/A ILE 39.A N SER 35.A O no hydrogen 3.465 N/A HIS 40.A N ASN 36.A O no hydrogen 3.066 N/A TYR 41.A N ALA 37.A O no hydrogen 2.946 N/A HIS 42.A N.A ILE 39.A O no hydrogen 3.218 N/A HIS 42.A N.B ILE 39.A O no hydrogen 3.226 N/A HIS 42.A ND1.A THR 38.A O no hydrogen 3.013 N/A PHE 43.A N ILE 39.A O no hydrogen 2.898 N/A SER 45.A OG ASP 48.A OD2 no hydrogen 3.069 N/A LYS 46.A NZ TYR 20.A O no hydrogen 2.818 N/A LYS 46.A NZ VAL 23.A O no hydrogen 2.751 N/A ASP 48.A N SER 45.A O no hydrogen 2.820 N/A ASP 48.A N SER 45.A OG no hydrogen 3.090 N/A ILE 49.A N LYS 46.A O no hydrogen 2.877 N/A LEU 50.A N LYS 46.A O no hydrogen 3.186 N/A LEU 51.A N LYS 47.A O no hydrogen 2.934 N/A GLU 52.A N ASP 48.A O no hydrogen 3.018 N/A ALA 53.A N ILE 49.A O no hydrogen 2.778 N/A LEU 54.A N LEU 50.A O no hydrogen 2.986 N/A ARG 55.A N LEU 51.A O no hydrogen 2.957 N/A ARG 55.A NE GLU 52.A OE2 no hydrogen 2.780 N/A ARG 56.A N GLU 52.A O no hydrogen 2.807 N/A ASN 57.A N ALA 53.A O no hydrogen 3.044 N/A ASN 57.A ND2 GLU 96.A O no hydrogen 2.960 N/A VAL 58.A N LEU 54.A O no hydrogen 2.943 N/A LYS 59.A N ARG 55.A O no hydrogen 2.961 N/A LEU 60.A N ARG 56.A O no hydrogen 2.702 N/A ALA 61.A N ASN 57.A O no hydrogen 3.161 N/A PHE 62.A N VAL 58.A O no hydrogen 3.122 N/A ASP 63.A N LYS 59.A O no hydrogen 3.013 N/A ARG 64.A N LEU 60.A O no hydrogen 3.131 N/A ARG 64.A NH1 GLU 96.A OE1 no hydrogen 2.988 N/A ARG 64.A NH2 GLU 96.A OE1 no hydrogen 3.378 N/A ARG 64.A NH2 GLU 96.A OE2 no hydrogen 2.424 N/A GLN 65.A N ALA 61.A O no hydrogen 3.032 N/A VAL 66.A N PHE 62.A O no hydrogen 2.853 N/A ALA 67.A N ASP 63.A O no hydrogen 3.066 N/A GLU 68.A N ARG 64.A O no hydrogen 3.022 N/A LEU 69.A N GLN 65.A O no hydrogen 2.933 N/A HIS 70.A N VAL 66.A O no hydrogen 3.443 N/A ILE 72.A N LEU 69.A O no hydrogen 2.964 N/A ALA 75.A N GLN 137.A OE1 no hydrogen 3.260 N/A ARG 76.A N ASP 74.A OD1 no hydrogen 3.225 N/A ARG 78.A N ASP 74.A O no hydrogen 2.834 N/A LEU 79.A N ALA 75.A O no hydrogen 2.800 N/A VAL 80.A N ARG 76.A O no hydrogen 3.036 N/A ARG 81.A N GLU 77.A O no hydrogen 3.093 N/A LEU 82.A N ARG 78.A O no hydrogen 2.907 N/A VAL 83.A N LEU 79.A O no hydrogen 3.059 N/A GLU 84.A N VAL 80.A O no hydrogen 2.906 N/A LEU 85.A N ARG 81.A O no hydrogen 2.952 N/A GLN 86.A N VAL 83.A O no hydrogen 2.770 N/A LEU 87.A N GLU 84.A O no hydrogen 3.079 N/A THR 89.A N LEU 87.A O no hydrogen 2.811 N/A ARG 94.A N.A THR 89.A O no hydrogen 2.982 N/A ARG 94.A N.B THR 89.A O no hydrogen 2.985 N/A ASP 95.A N GLY 91.A O no hydrogen 3.032 N/A GLU 96.A N LEU 92.A O no hydrogen 2.801 N/A TRP 97.A N LEU 93.A O no hydrogen 2.987 N/A TRP 97.A NE1 GLN 86.A O no hydrogen 2.771 N/A SER 98.A N ARG 94.A O.A no hydrogen 2.967 N/A SER 98.A N ARG 94.A O.B no hydrogen 3.016 N/A SER 98.A OG ALA 16.A O no hydrogen 2.609 N/A VAL 99.A N ASP 95.A O no hydrogen 3.113 N/A TRP 100.A N GLU 96.A O no hydrogen 2.911 N/A LEU 101.A N TRP 97.A O no hydrogen 2.899 N/A GLN 102.A N SER 98.A O no hydrogen 3.224 N/A GLN 102.A NE2 ILE 15.A O no hydrogen 2.906 N/A GLN 102.A NE2 SER 98.A O no hydrogen 3.113 N/A GLN 102.A NE2 SER 98.A OG no hydrogen 3.057 N/A VAL 103.A N VAL 99.A O no hydrogen 2.911 N/A TRP 104.A N TRP 100.A O no hydrogen 2.847 N/A THR 105.A N LEU 101.A O no hydrogen 3.354 N/A THR 105.A OG1 LEU 101.A O no hydrogen 3.276 N/A GLU 106.A N GLN 102.A O no hydrogen 2.949 N/A SER 107.A N VAL 103.A O no hydrogen 2.784 N/A SER 107.A OG VAL 103.A O no hydrogen 2.866 N/A THR 108.A N TRP 104.A O no hydrogen 3.352 N/A THR 108.A N THR 105.A O no hydrogen 3.150 N/A THR 108.A OG1 THR 105.A O no hydrogen 2.816 N/A LEU 109.A N GLU 106.A O no hydrogen 2.877 N/A ASN 110.A N GLU 106.A O no hydrogen 2.735 N/A ARG 114.A N ASN 110.A O no hydrogen 2.984 N/A ARG 114.A NE SER 107.A O no hydrogen 2.840 N/A ARG 114.A NH2 SER 107.A O no hydrogen 3.136 N/A ASP 115.A N PRO 111.A O no hydrogen 2.805 N/A LEU 116.A N LYS 112.A O no hydrogen 3.123 N/A TYR 117.A N ILE 113.A O no hydrogen 2.657 N/A ASN 118.A N ARG 114.A O no hydrogen 2.772 N/A ASP 119.A N ASP 115.A O no hydrogen 2.862 N/A ALA 120.A N LEU 116.A O no hydrogen 3.095 N/A TYR 121.A N TYR 117.A O no hydrogen 2.942 N/A TYR 121.A OH SER 153.A OG no hydrogen 2.971 N/A ASP 122.A N ASN 118.A O no hydrogen 3.043 N/A ARG 123.A N ASP 119.A O no hydrogen 3.065 N/A TRP 124.A N ALA 120.A O no hydrogen 2.708 N/A TYR 125.A N TYR 121.A O no hydrogen 2.682 N/A TYR 125.A OH ASP 146.A O no hydrogen 2.899 N/A TYR 125.A OH ASP 146.A OD1 no hydrogen 2.851 N/A GLN 126.A N ASP 122.A O no hydrogen 2.774 N/A THR 127.A N ARG 123.A O no hydrogen 3.179 N/A THR 127.A OG1 GLN 65.A OE1 no hydrogen 3.398 N/A THR 127.A OG1 ARG 123.A O no hydrogen 2.915 N/A ILE 128.A N TRP 124.A O no hydrogen 3.227 N/A ALA 129.A N TYR 125.A O no hydrogen 2.949 N/A THR 130.A OG1 THR 127.A O no hydrogen 2.802 N/A ILE 131.A N ILE 128.A O no hydrogen 2.888 N/A ARG 132.A N ALA 129.A O no hydrogen 2.740 N/A ARG 132.A NH2 ASP 146.A OD2 no hydrogen 3.191 N/A GLY 134.A N THR 130.A O no hydrogen 3.012 N/A GLN 135.A N ILE 131.A O no hydrogen 3.098 N/A GLN 135.A NE2 ARG 141.A O no hydrogen 3.068 N/A GLN 135.A NE2 GLN 143.A O no hydrogen 2.869 N/A LYS 136.A N ARG 132.A O no hydrogen 3.000 N/A GLN 137.A N THR 133.A O no hydrogen 2.910 N/A GLN 137.A NE2 ALA 73.A O no hydrogen 3.033 N/A GLY 138.A N GLN 135.A O no hydrogen 2.886 N/A VAL 139.A N GLY 134.A O no hydrogen 2.840 N/A PHE 140.A N GLY 134.A O no hydrogen 3.037 N/A ARG 141.A N ILE 185.A O no hydrogen 2.878 N/A GLN 143.A N ARG 141.A O no hydrogen 3.075 N/A ASP 146.A N ASP 144.A OD1 no hydrogen 2.800 N/A GLU 147.A N ASP 144.A OD1 no hydrogen 3.296 N/A LEU 148.A N ASP 144.A O no hydrogen 2.987 N/A ALA 149.A N ALA 145.A O no hydrogen 2.783 N/A THR 150.A N ASP 146.A O no hydrogen 2.803 N/A THR 150.A OG1 ASP 146.A O no hydrogen 2.897 N/A ARG 151.A N GLU 147.A O no hydrogen 3.006 N/A LEU 152.A N LEU 148.A O no hydrogen 2.895 N/A SER 153.A N ALA 149.A O no hydrogen 2.891 N/A SER 153.A OG TYR 121.A OH no hydrogen 2.971 N/A SER 153.A OG ALA 149.A O no hydrogen 2.797 N/A SER 153.A OG THR 150.A O no hydrogen 3.031 N/A ALA 154.A N THR 150.A O no hydrogen 2.864 N/A LEU 155.A N ARG 151.A O no hydrogen 2.978 N/A ILE 156.A N LEU 152.A O no hydrogen 3.011 N/A ASP 157.A N SER 153.A O no hydrogen 3.084 N/A GLY 158.A N ALA 154.A O no hydrogen 2.925 N/A LEU 159.A N LEU 155.A O no hydrogen 2.945 N/A GLY 160.A N ILE 156.A O no hydrogen 2.937 N/A ILE 161.A N ASP 157.A O no hydrogen 3.096 N/A GLN 162.A N GLY 158.A O no hydrogen 3.378 N/A VAL 163.A N LEU 159.A O no hydrogen 2.996 N/A LEU 164.A N GLY 160.A O no hydrogen 2.895 N/A THR 165.A N ILE 161.A O no hydrogen 2.866 N/A THR 165.A OG1 ILE 161.A O no hydrogen 2.675 N/A GLY 166.A N VAL 163.A O no hydrogen 3.153 N/A LYS 167.A N GLN 162.A O no hydrogen 2.889 N/A SER 170.A OG ASP 172.A OD2 no hydrogen 3.329 N/A SER 170.A OG HIS 173.A ND1 no hydrogen 2.799 N/A HIS 173.A N SER 170.A OG no hydrogen 3.096 N/A ARG 174.A NE GLU 84.A OE1 no hydrogen 2.785 N/A ARG 174.A NH2 GLU 84.A OE1 no hydrogen 3.507 N/A ARG 174.A NH2 GLU 84.A OE2 no hydrogen 3.155 N/A GLN 175.A N ASP 172.A O no hydrogen 3.013 N/A HIS 176.A N HIS 173.A O no hydrogen 2.881 N/A ASN 178.A N ARG 174.A O no hydrogen 2.896 N/A ASP 179.A N GLN 175.A O no hydrogen 2.967 N/A PHE 180.A N HIS 176.A O no hydrogen 2.890 N/A ILE 181.A N LEU 177.A O no hydrogen 2.937 N/A GLU 182.A N ASN 178.A O no hydrogen 2.826 N/A HIS 183.A N ASP 179.A O no hydrogen 2.888 N/A ASN 184.A N PHE 180.A O no hydrogen 2.716 N/A ILE 185.A N ILE 181.A O no hydrogen 2.895 N/A VAL 186.A N ILE 181.A O no hydrogen 2.928 N/A GLU 187.A N VAL 139.A O no hydrogen 3.057 N/A