Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4jle_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A N GLU 5.A OE1 no hydrogen 3.187 N/A ILE 6.A N THR 2.A O no hydrogen 3.175 N/A ASN 7.A N ALA 3.A O no hydrogen 3.412 N/A GLU 8.A N GLU 4.A O no hydrogen 2.899 N/A MET 9.A N GLU 5.A O no hydrogen 2.976 N/A ILE 10.A N ILE 6.A O no hydrogen 2.941 N/A ASN 11.A N ASN 7.A O no hydrogen 2.960 N/A SER 12.A N MET 9.A O no hydrogen 3.358 N/A ASN 14.A N SER 12.A OG no hydrogen 3.288 N/A ASN 20.A ND2 ASP 21.A OD1 no hydrogen 3.504 N/A ASP 21.A N ASN 18.A OD1 no hydrogen 3.020 N/A MET 22.A N ASN 18.A O no hydrogen 3.087 N/A ASN 23.A N ARG 19.A O no hydrogen 2.855 N/A ILE 24.A N ASN 20.A O no hydrogen 3.152 N/A ILE 25.A N ASP 21.A O no hydrogen 2.807 N/A PHE 26.A N MET 22.A O no hydrogen 3.061 N/A SER 27.A N ASN 23.A O no hydrogen 2.832 N/A SER 27.A OG ASN 23.A O no hydrogen 3.111 N/A TYR 28.A N ILE 24.A O no hydrogen 3.364 N/A VAL 29.A N ILE 25.A O no hydrogen 2.955 N/A HIS 30.A N PHE 26.A O no hydrogen 2.790 N/A GLU 31.A N SER 27.A O no hydrogen 3.025 N/A SER 32.A N TYR 28.A O no hydrogen 2.948 N/A GLU 33.A N VAL 29.A O no hydrogen 2.933 N/A ARG 34.A N HIS 30.A O no hydrogen 3.072 N/A ARG 34.A NH1 HIS 30.A NE2 no hydrogen 3.385 N/A GLU 35.A N GLU 31.A O no hydrogen 3.034 N/A LYS 36.A N SER 32.A O no hydrogen 3.003 N/A PHE 37.A N GLU 33.A O no hydrogen 3.040 N/A LYS 38.A N ARG 34.A O no hydrogen 3.428 N/A LYS 39.A N GLU 35.A O no hydrogen 3.273 N/A VAL 40.A N LYS 36.A O no hydrogen 3.339 N/A GLU 41.A N PHE 37.A O no hydrogen 3.080 N/A GLU 42.A N LYS 38.A O no hydrogen 3.055 N/A ASN 43.A N LYS 39.A O no hydrogen 3.082 N/A ILE 44.A N VAL 40.A O no hydrogen 3.001 N/A PHE 45.A N GLU 41.A O no hydrogen 2.965 N/A LYS 46.A N GLU 42.A O no hydrogen 2.827 N/A PHE 47.A N ASN 43.A O no hydrogen 3.135 N/A ILE 48.A N ILE 44.A O no hydrogen 2.961 N/A GLN 49.A N PHE 45.A O no hydrogen 3.042 N/A GLN 49.A N LYS 46.A O no hydrogen 3.232 N/A GLN 49.A NE2 GLU 53.A OE2 no hydrogen 3.164 N/A SER 50.A N PHE 47.A O no hydrogen 3.135 N/A SER 50.A OG PHE 47.A O no hydrogen 2.560 N/A ILE 51.A N ILE 48.A O no hydrogen 3.060 N/A VAL 52.A N ILE 48.A O no hydrogen 2.941 N/A GLU 53.A N GLN 49.A O no hydrogen 3.004 N/A THR 54.A N SER 50.A O no hydrogen 3.115 N/A THR 54.A OG1 SER 50.A O no hydrogen 2.746 N/A TYR 55.A N ILE 51.A O no hydrogen 3.017 N/A ILE 57.A N VAL 52.A O no hydrogen 2.851 N/A LYS 62.A N PRO 58.A O no hydrogen 3.227 N/A LYS 62.A NZ GLN 49.A OE1 no hydrogen 2.604 N/A MET 63.A N ASP 59.A O no hydrogen 2.804 N/A ARG 64.A N GLU 60.A O no hydrogen 3.226 N/A LYS 65.A N TYR 61.A O no hydrogen 3.061 N/A PHE 66.A N LYS 62.A O no hydrogen 2.892 N/A LYS 67.A N MET 63.A O no hydrogen 2.845 N/A PHE 68.A N ARG 64.A O no hydrogen 3.254 N/A ALA 69.A N LYS 65.A O no hydrogen 3.036 N/A HIS 70.A N PHE 66.A O no hydrogen 2.919 N/A HIS 70.A ND1 GLU 41.A OE1 no hydrogen 2.674 N/A HIS 70.A ND1 GLU 41.A OE2 no hydrogen 3.158 N/A PHE 71.A N LYS 67.A O no hydrogen 3.182 N/A GLU 72.A N PHE 68.A O no hydrogen 3.022 N/A MET 73.A N ALA 69.A O no hydrogen 2.914 N/A GLN 74.A N HIS 70.A O no hydrogen 2.851 N/A GLY 75.A N PHE 71.A O no hydrogen 2.860 N/A TYR 76.A N GLU 72.A O no hydrogen 3.128 N/A ALA 77.A N MET 73.A O no hydrogen 2.898 N/A LEU 78.A N GLN 74.A O no hydrogen 2.808 N/A LYS 79.A N GLY 75.A O no hydrogen 3.194 N/A GLN 80.A N TYR 76.A O no hydrogen 2.980 N/A GLU 81.A N ALA 77.A O no hydrogen 2.989 N/A LYS 82.A N LEU 78.A O no hydrogen 2.912 N/A PHE 83.A N LYS 79.A O no hydrogen 3.050 N/A LEU 84.A N GLN 80.A O no hydrogen 3.045 N/A LEU 85.A N GLU 81.A O no hydrogen 2.793 N/A GLU 86.A N LYS 82.A O no hydrogen 3.052 N/A TYR 87.A N PHE 83.A O no hydrogen 2.753 N/A ALA 88.A N LEU 84.A O no hydrogen 3.038 N/A PHE 89.A N LEU 85.A O no hydrogen 2.907 N/A LEU 90.A N GLU 86.A O no hydrogen 3.069 N/A SER 91.A N TYR 87.A O no hydrogen 2.989 N/A SER 91.A OG TYR 87.A O no hydrogen 2.720 N/A LEU 92.A N ALA 88.A O no hydrogen 3.152 N/A ASN 93.A N PHE 89.A O no hydrogen 3.156 N/A CYS 97.A SG GLU 98.A O no hydrogen 3.490 N/A PHE 102.A N GLU 98.A O no hydrogen 3.149 N/A LYS 103.A N ARG 99.A O no hydrogen 2.902 N/A LYS 103.A NZ GLU 107.A OE2 no hydrogen 3.434 N/A GLU 104.A N LYS 100.A O no hydrogen 3.007 N/A VAL 105.A N LYS 101.A O no hydrogen 3.023 N/A LEU 106.A N PHE 102.A O no hydrogen 2.957 N/A GLU 107.A N LYS 103.A O no hydrogen 2.909 N/A TYR 108.A N GLU 104.A O no hydrogen 3.086 N/A VAL 109.A N VAL 105.A O no hydrogen 2.957 N/A LYS 110.A N LEU 106.A O no hydrogen 3.036 N/A ARG 111.A N GLU 107.A O no hydrogen 3.138 N/A GLU 112.A N TYR 108.A O no hydrogen 2.950 N/A TRP 113.A N VAL 109.A O no hydrogen 3.006 N/A ILE 114.A N LYS 110.A O no hydrogen 3.113 N/A GLU 115.A N ARG 111.A O no hydrogen 3.021 N/A PHE 116.A N GLU 112.A O no hydrogen 2.856 N/A ARG 117.A N TRP 113.A O no hydrogen 3.002 N/A LYS 118.A N ILE 114.A O no hydrogen 3.053 N/A SER 119.A N GLU 115.A O no hydrogen 3.190 N/A MET 120.A N.A PHE 116.A O no hydrogen 2.856 N/A MET 120.A N.B PHE 116.A O no hydrogen 2.892 N/A PHE 121.A N ARG 117.A O no hydrogen 3.110 N/A ASP 122.A N LYS 118.A O no hydrogen 3.288 N/A VAL 123.A N SER 119.A O no hydrogen 2.798 N/A TRP 124.A N MET 120.A O.A no hydrogen 3.032 N/A TRP 124.A N MET 120.A O.B no hydrogen 2.997 N/A LYS 125.A N PHE 121.A O no hydrogen 3.043 N/A GLU 126.A N ASP 122.A O no hydrogen 3.076 N/A LYS 127.A N VAL 123.A O no hydrogen 3.015 N/A LEU 128.A N TRP 124.A O no hydrogen 3.151 N/A ALA 129.A N LYS 125.A O no hydrogen 2.765 N/A SER 130.A N GLU 126.A O no hydrogen 3.143 N/A SER 130.A OG GLU 126.A O no hydrogen 2.860 N/A SER 130.A OG LYS 127.A O no hydrogen 2.859 N/A GLU 131.A N LYS 127.A O no hydrogen 3.274 N/A PHE 132.A N LEU 128.A O no hydrogen 2.867 N/A ARG 133.A N ALA 129.A O no hydrogen 2.840 N/A GLU 134.A N SER 130.A O no hydrogen 2.981 N/A HIS 135.A N GLU 131.A O no hydrogen 3.141 N/A GLY 136.A N PHE 132.A O no hydrogen 2.811 N/A GLU 137.A N ARG 133.A O no hydrogen 2.947 N/A MET 138.A N GLU 134.A O no hydrogen 3.066 N/A LEU 139.A N HIS 135.A O no hydrogen 2.995 N/A ASN 140.A N GLY 136.A O no hydrogen 3.013 N/A GLN 141.A N GLU 137.A O no hydrogen 3.137 N/A LYS 142.A N MET 138.A O no hydrogen 2.967 N/A ARG 143.A N LEU 139.A O no hydrogen 2.864 N/A ARG 143.A NH1 ASN 140.A OD1 no hydrogen 3.370 N/A LYS 144.A N ASN 140.A O no hydrogen 2.900 N/A LEU 145.A N GLN 141.A O no hydrogen 3.099 N/A LYS 146.A N LYS 142.A O no hydrogen 3.309 N/A GLN 147.A N ARG 143.A O no hydrogen 3.009 N/A HIS 148.A N LYS 144.A O no hydrogen 2.937 N/A GLU 149.A N LYS 146.A O no hydrogen 3.141 N/A