Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3umk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 5.A ND1 ASP 1.A O no hydrogen 2.802 N/A HIS 5.A NE2 HIS 124.A NE2 no hydrogen 2.927 N/A GLN 9.A N HIS 5.A O no hydrogen 3.220 N/A LYS 10.A N ALA 6.A O no hydrogen 3.422 N/A ALA 11.A N HIS 7.A O no hydrogen 3.493 N/A LYS 12.A N PHE 8.A O no hydrogen 2.834 N/A LYS 12.A NZ GLN 9.A OE1 no hydrogen 2.829 N/A GLU 13.A N GLN 9.A O no hydrogen 2.868 N/A ARG 14.A N LYS 10.A O no hydrogen 2.904 N/A LEU 15.A N ALA 11.A O no hydrogen 3.097 N/A GLU 16.A N LYS 12.A O no hydrogen 3.153 N/A ALA 17.A N GLU 13.A O no hydrogen 2.794 N/A LYS 18.A N ARG 14.A O no hydrogen 2.690 N/A HIS 19.A N LEU 15.A O no hydrogen 2.903 N/A ARG 20.A N GLU 16.A O no hydrogen 2.766 N/A GLU 21.A N ALA 17.A O no hydrogen 2.943 N/A ARG 22.A N LYS 18.A O no hydrogen 3.047 N/A ARG 22.A NH2 GLU 62.A OE1 no hydrogen 2.926 N/A MET 23.A N HIS 19.A O no hydrogen 2.812 N/A SER 24.A N ARG 20.A O no hydrogen 3.124 N/A SER 24.A N GLU 21.A O no hydrogen 3.136 N/A SER 24.A OG ARG 20.A O no hydrogen 2.780 N/A GLN 25.A N GLU 21.A O no hydrogen 3.327 N/A VAL 26.A N ARG 22.A O no hydrogen 3.274 N/A MET 27.A N MET 23.A O no hydrogen 3.393 N/A ARG 28.A N SER 24.A O no hydrogen 2.997 N/A GLU 29.A N GLN 25.A O no hydrogen 2.907 N/A TRP 30.A N VAL 26.A O no hydrogen 2.793 N/A GLU 31.A N MET 27.A O no hydrogen 3.129 N/A GLU 32.A N ARG 28.A O no hydrogen 3.366 N/A ALA 33.A N GLU 29.A O no hydrogen 2.978 N/A GLU 34.A N TRP 30.A O no hydrogen 2.893 N/A ARG 35.A N GLU 31.A O no hydrogen 2.804 N/A ARG 35.A NH1 ARG 35.A O no hydrogen 3.203 N/A GLN 36.A N GLU 32.A O no hydrogen 2.761 N/A ALA 37.A N ALA 33.A O no hydrogen 2.906 N/A LYS 38.A N ARG 35.A O no hydrogen 3.059 N/A LEU 40.A N ALA 37.A O no hydrogen 3.140 N/A LYS 45.A N LYS 42.A O no hydrogen 2.628 N/A LYS 45.A NZ ALA 37.A O no hydrogen 3.081 N/A LYS 45.A NZ LYS 38.A O no hydrogen 3.384 N/A LYS 45.A NZ LEU 40.A O no hydrogen 2.522 N/A LYS 46.A N LYS 42.A O no hydrogen 2.609 N/A ALA 47.A N ALA 43.A O no hydrogen 3.162 N/A VAL 48.A N LYS 45.A O no hydrogen 3.091 N/A ILE 49.A N LYS 45.A O no hydrogen 3.360 N/A GLN 50.A NE2 LYS 46.A O no hydrogen 3.523 N/A HIS 51.A N ALA 47.A O no hydrogen 3.013 N/A PHE 52.A N VAL 48.A O no hydrogen 3.330 N/A GLN 53.A N ILE 49.A O no hydrogen 2.969 N/A GLU 54.A N GLN 50.A O no hydrogen 2.926 N/A LYS 55.A N HIS 51.A O no hydrogen 2.999 N/A LYS 55.A NZ GLU 29.A OE2 no hydrogen 2.835 N/A VAL 56.A N PHE 52.A O no hydrogen 2.912 N/A GLU 57.A N GLN 53.A O no hydrogen 2.978 N/A SER 58.A N GLU 54.A O no hydrogen 2.998 N/A LEU 59.A N LYS 55.A O no hydrogen 3.074 N/A GLU 60.A N VAL 56.A O no hydrogen 2.955 N/A GLN 61.A N GLU 57.A O no hydrogen 3.105 N/A GLU 62.A N SER 58.A O no hydrogen 3.060 N/A ALA 63.A N LEU 59.A O no hydrogen 3.004 N/A ALA 64.A N GLU 60.A O no hydrogen 2.967 N/A ASN 65.A N GLN 61.A O no hydrogen 2.918 N/A GLU 66.A N GLU 62.A O no hydrogen 2.818 N/A ARG 67.A N ALA 63.A O no hydrogen 2.967 N/A GLN 68.A N ALA 64.A O no hydrogen 3.102 N/A GLN 69.A N ASN 65.A O no hydrogen 2.967 N/A LEU 70.A N GLU 66.A O no hydrogen 2.858 N/A VAL 71.A N ARG 67.A O no hydrogen 2.891 N/A GLU 72.A N GLN 68.A O no hydrogen 2.861 N/A THR 73.A N GLN 69.A O no hydrogen 3.052 N/A HIS 74.A N LEU 70.A O no hydrogen 2.984 N/A MET 75.A N VAL 71.A O no hydrogen 2.843 N/A ALA 76.A N GLU 72.A O no hydrogen 3.017 N/A ARG 77.A N THR 73.A O no hydrogen 2.979 N/A VAL 78.A N HIS 74.A O no hydrogen 3.075 N/A GLU 79.A N MET 75.A O no hydrogen 3.073 N/A ALA 80.A N ALA 76.A O no hydrogen 3.149 N/A MET 81.A N ARG 77.A O no hydrogen 2.907 N/A LEU 82.A N VAL 78.A O no hydrogen 2.767 N/A ASN 83.A N GLU 79.A O no hydrogen 3.199 N/A ASN 83.A ND2 GLU 79.A OE1 no hydrogen 3.310 N/A ASP 84.A N ALA 80.A O no hydrogen 3.057 N/A ARG 85.A N MET 81.A O no hydrogen 2.847 N/A ARG 86.A N LEU 82.A O no hydrogen 2.822 N/A ARG 86.A NH2 ASN 83.A OD1 no hydrogen 2.977 N/A ARG 87.A N ASN 83.A O no hydrogen 2.869 N/A LEU 88.A N ASP 84.A O no hydrogen 3.241 N/A ALA 89.A N ARG 85.A O no hydrogen 3.201 N/A LEU 90.A N ARG 86.A O no hydrogen 2.700 N/A GLU 91.A N ARG 87.A O no hydrogen 2.913 N/A ASN 92.A N LEU 88.A O no hydrogen 3.163 N/A TYR 93.A N ALA 89.A O no hydrogen 3.093 N/A TYR 93.A OH SER 161.A O no hydrogen 2.784 N/A ILE 94.A N LEU 90.A O no hydrogen 2.950 N/A THR 95.A N GLU 91.A O no hydrogen 2.840 N/A THR 95.A OG1 GLU 91.A O no hydrogen 2.982 N/A ALA 96.A N ASN 92.A O no hydrogen 2.977 N/A LEU 97.A N TYR 93.A O no hydrogen 2.986 N/A GLN 98.A N ILE 94.A O no hydrogen 3.183 N/A GLN 98.A N THR 95.A O no hydrogen 3.274 N/A ALA 99.A N ALA 96.A O no hydrogen 3.110 N/A VAL 107.A N ARG 103.A O no hydrogen 2.769 N/A PHE 108.A N PRO 104.A O no hydrogen 2.856 N/A ASN 109.A N ARG 105.A O no hydrogen 2.949 N/A MET 110.A N HIS 106.A O no hydrogen 3.119 N/A LEU 111.A N VAL 107.A O no hydrogen 2.782 N/A LYS 112.A N PHE 108.A O no hydrogen 2.579 N/A LYS 113.A N ASN 109.A O no hydrogen 3.047 N/A TYR 114.A N MET 110.A O no hydrogen 3.155 N/A TYR 114.A OH ARG 157.A O no hydrogen 2.985 N/A VAL 115.A N LEU 111.A O no hydrogen 2.928 N/A ARG 116.A N LYS 112.A O no hydrogen 2.952 N/A ALA 117.A N LYS 113.A O no hydrogen 3.123 N/A GLU 118.A N TYR 114.A O no hydrogen 3.044 N/A GLN 119.A N VAL 115.A O no hydrogen 2.741 N/A LYS 120.A N ARG 116.A O no hydrogen 2.733 N/A LYS 120.A NZ GLU 2.A OE1 no hydrogen 3.204 N/A ASP 121.A N ALA 117.A O no hydrogen 3.057 N/A ARG 122.A N GLU 118.A O no hydrogen 3.004 N/A GLN 123.A N GLN 119.A O no hydrogen 2.886 N/A HIS 124.A N LYS 120.A O no hydrogen 2.909 N/A HIS 124.A NE2 HIS 5.A NE2 no hydrogen 2.927 N/A THR 125.A N ASP 121.A O no hydrogen 2.940 N/A THR 125.A OG1 ASP 121.A O no hydrogen 3.274 N/A THR 125.A OG1 ASP 121.A OD2 no hydrogen 3.487 N/A LEU 126.A N ARG 122.A O no hydrogen 2.820 N/A LYS 127.A N GLN 123.A O no hydrogen 2.816 N/A HIS 128.A N HIS 124.A O no hydrogen 3.238 N/A HIS 128.A NE2 HIS 124.A NE2 no hydrogen 2.674 N/A PHE 129.A N THR 125.A O no hydrogen 3.101 N/A GLU 130.A N LEU 126.A O no hydrogen 2.829 N/A HIS 131.A N LYS 127.A O no hydrogen 2.949 N/A HIS 131.A N HIS 128.A O no hydrogen 3.266 N/A VAL 132.A N HIS 128.A O no hydrogen 3.340 N/A ARG 133.A N PHE 129.A O no hydrogen 2.981 N/A MET 134.A N GLU 130.A O no hydrogen 3.007 N/A VAL 135.A N HIS 131.A O no hydrogen 2.979 N/A ASP 136.A N VAL 132.A O no hydrogen 2.562 N/A LYS 139.A N ASP 136.A O no hydrogen 3.148 N/A LYS 139.A N ASP 136.A OD1 no hydrogen 2.885 N/A ALA 140.A N ASP 136.A O no hydrogen 3.032 N/A ALA 141.A N PRO 137.A O no hydrogen 3.303 N/A GLN 142.A N LYS 139.A O no hydrogen 2.731 N/A VAL 147.A N ILE 143.A O no hydrogen 2.858 N/A VAL 147.A N ARG 144.A O no hydrogen 3.262 N/A MET 148.A N ARG 144.A O no hydrogen 2.968 N/A THR 149.A N SER 145.A O no hydrogen 3.097 N/A THR 149.A OG1 SER 145.A O no hydrogen 3.357 N/A THR 149.A OG1 GLN 146.A O no hydrogen 3.416 N/A LEU 151.A N VAL 147.A O no hydrogen 3.190 N/A ARG 152.A N MET 148.A O no hydrogen 2.805 N/A ARG 152.A NH2 GLU 156.A OE1 no hydrogen 2.914 N/A VAL 153.A N THR 149.A O no hydrogen 2.969 N/A ILE 154.A N HIS 150.A O no hydrogen 3.144 N/A TYR 155.A N LEU 151.A O no hydrogen 3.010 N/A GLU 156.A N ARG 152.A O no hydrogen 3.078 N/A ARG 157.A N VAL 153.A O no hydrogen 2.791 N/A ARG 157.A NE GLU 118.A OE1 no hydrogen 3.344 N/A ARG 157.A NE GLU 118.A OE2 no hydrogen 2.704 N/A ARG 157.A NH2 GLU 118.A OE1 no hydrogen 2.786 N/A MET 158.A N ILE 154.A O no hydrogen 2.995 N/A ASN 159.A N TYR 155.A O no hydrogen 3.041 N/A ASN 159.A ND2 TYR 155.A O no hydrogen 2.618 N/A GLN 160.A N GLU 156.A O no hydrogen 2.959 N/A SER 161.A N ARG 157.A O no hydrogen 3.114 N/A SER 161.A OG TYR 114.A OH no hydrogen 2.797 N/A SER 161.A OG ARG 157.A O no hydrogen 2.701 N/A LEU 162.A N MET 158.A O no hydrogen 2.733 N/A SER 163.A N ASN 159.A O no hydrogen 2.960 N/A SER 163.A OG ASN 159.A O no hydrogen 3.206 N/A SER 163.A OG GLN 160.A O no hydrogen 2.913 N/A LEU 164.A N SER 161.A O no hydrogen 3.294 N/A LEU 165.A N LEU 162.A O no hydrogen 2.900 N/A TYR 166.A N SER 163.A O no hydrogen 2.962 N/A ASN 167.A N LEU 164.A O no hydrogen 3.141 N/A VAL 171.A N VAL 168.A O no hydrogen 2.855 N/A ALA 172.A N VAL 168.A O no hydrogen 3.036 N/A GLU 173.A N PRO 169.A O no hydrogen 2.805 N/A GLU 174.A N ALA 170.A O no hydrogen 3.287 N/A ILE 175.A N VAL 171.A O no hydrogen 3.177 N/A GLN 176.A N GLU 173.A O no hydrogen 3.143 N/A VAL 179.A N ILE 175.A O no hydrogen 2.982 N/A ASP 180.A N GLN 176.A O no hydrogen 3.057 N/A GLU 181.A N ASP 177.A O no hydrogen 3.204 N/A LEU 182.A N GLU 178.A O no hydrogen 3.278 N/A LEU 183.A N VAL 179.A O no hydrogen 2.990 N/A GLN 184.A N GLU 181.A O no hydrogen 3.129 N/A