Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5buo_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 4.A ND1 HIS 73.A NE2 no hydrogen 3.099 N/A ALA 5.A N ASN 2.A O no hydrogen 2.988 N/A HIS 6.A N ASN 2.A O no hydrogen 3.213 N/A HIS 6.A NE2 GLU 1.A O no hydrogen 2.869 N/A PHE 7.A N GLU 3.A O no hydrogen 3.303 N/A GLN 8.A N HIS 4.A O no hydrogen 3.206 N/A ALA 10.A N HIS 6.A O no hydrogen 3.307 N/A LYS 11.A N PHE 7.A O no hydrogen 2.944 N/A GLU 12.A N GLN 8.A O no hydrogen 3.083 N/A ARG 13.A N LYS 9.A O no hydrogen 2.846 N/A LEU 14.A N ALA 10.A O no hydrogen 3.001 N/A GLU 15.A N LYS 11.A O no hydrogen 3.118 N/A ALA 16.A N GLU 12.A O no hydrogen 3.018 N/A LYS 17.A N ARG 13.A O no hydrogen 2.941 N/A LYS 17.A NZ GLU 65.A OE1 no hydrogen 3.539 N/A LYS 17.A NZ GLU 65.A OE2 no hydrogen 2.937 N/A HIS 18.A N LEU 14.A O no hydrogen 3.035 N/A HIS 18.A NE2 GLU 59.A OE2 no hydrogen 3.091 N/A ARG 19.A N GLU 15.A O no hydrogen 3.116 N/A GLU 20.A N ALA 16.A O no hydrogen 2.892 N/A ARG 21.A N LYS 17.A O no hydrogen 2.924 N/A ARG 21.A NH1 GLU 61.A OE1 no hydrogen 3.473 N/A ARG 21.A NH1 GLU 61.A OE2 no hydrogen 2.963 N/A ARG 21.A NH2 GLU 61.A OE2 no hydrogen 2.761 N/A MET 22.A N HIS 18.A O no hydrogen 2.891 N/A SER 23.A N ARG 19.A O no hydrogen 3.104 N/A SER 23.A OG ARG 19.A O no hydrogen 3.196 N/A SER 23.A OG GLU 20.A O no hydrogen 2.918 N/A GLN 24.A N GLU 20.A O no hydrogen 3.106 N/A VAL 25.A N ARG 21.A O no hydrogen 3.149 N/A MET 26.A N MET 22.A O no hydrogen 2.990 N/A ARG 27.A N SER 23.A O no hydrogen 2.996 N/A GLU 28.A N GLN 24.A O no hydrogen 2.982 N/A TRP 29.A N VAL 25.A O no hydrogen 2.865 N/A GLU 30.A N MET 26.A O no hydrogen 3.102 N/A GLU 31.A N ARG 27.A O no hydrogen 3.128 N/A ALA 32.A N GLU 28.A O no hydrogen 2.943 N/A GLU 33.A N TRP 29.A O no hydrogen 2.905 N/A ARG 34.A N GLU 30.A O no hydrogen 3.122 N/A GLN 35.A N GLU 31.A O no hydrogen 3.019 N/A ALA 36.A N ALA 32.A O no hydrogen 2.695 N/A LYS 37.A N ARG 34.A O no hydrogen 3.115 N/A LEU 39.A N ALA 36.A O no hydrogen 3.046 N/A ASP 43.A N PRO 40.A O no hydrogen 2.911 N/A LYS 44.A N PRO 40.A O no hydrogen 3.231 N/A LYS 44.A NZ LEU 39.A O no hydrogen 2.888 N/A LYS 45.A N LYS 41.A O no hydrogen 2.878 N/A ALA 46.A N ALA 42.A O no hydrogen 3.135 N/A VAL 47.A N ASP 43.A O no hydrogen 3.038 N/A ILE 48.A N LYS 44.A O no hydrogen 3.320 N/A GLN 49.A N LYS 45.A O no hydrogen 2.968 N/A GLN 49.A NE2 GLU 53.A OE2 no hydrogen 3.104 N/A HIS 50.A N ALA 46.A O no hydrogen 2.731 N/A PHE 51.A N VAL 47.A O no hydrogen 3.026 N/A GLN 52.A N ILE 48.A O no hydrogen 3.011 N/A GLU 53.A N GLN 49.A O no hydrogen 3.137 N/A LYS 54.A N HIS 50.A O no hydrogen 3.003 N/A VAL 55.A N PHE 51.A O no hydrogen 2.986 N/A GLU 56.A N GLN 52.A O no hydrogen 2.984 N/A SER 57.A N GLU 53.A O no hydrogen 2.854 N/A LEU 58.A N LYS 54.A O no hydrogen 3.066 N/A GLU 59.A N VAL 55.A O no hydrogen 2.937 N/A GLN 60.A N GLU 56.A O no hydrogen 3.016 N/A GLU 61.A N SER 57.A O no hydrogen 2.914 N/A ALA 62.A N LEU 58.A O no hydrogen 3.050 N/A ALA 63.A N GLU 59.A O no hydrogen 3.045 N/A ASN 64.A N GLN 60.A O no hydrogen 3.048 N/A GLU 65.A N GLU 61.A O no hydrogen 2.972 N/A ARG 66.A N ALA 62.A O no hydrogen 2.936 N/A ARG 66.A NE GLU 15.A OE2 no hydrogen 2.727 N/A ARG 66.A NH2 GLU 15.A OE2 no hydrogen 2.962 N/A GLN 67.A N ALA 63.A O no hydrogen 3.043 N/A GLN 67.A NE2 GLU 71.A OE2 no hydrogen 3.566 N/A GLN 68.A N ASN 64.A O no hydrogen 3.096 N/A LEU 69.A N GLU 65.A O no hydrogen 2.872 N/A VAL 70.A N ARG 66.A O no hydrogen 2.839 N/A GLU 71.A N GLN 67.A O no hydrogen 2.981 N/A THR 72.A N GLN 68.A O no hydrogen 3.066 N/A THR 72.A OG1 GLN 68.A O no hydrogen 3.023 N/A HIS 73.A N LEU 69.A O no hydrogen 3.177 N/A HIS 73.A NE2 HIS 4.A ND1 no hydrogen 3.099 N/A MET 74.A N VAL 70.A O no hydrogen 2.884 N/A ALA 75.A N GLU 71.A O no hydrogen 3.148 N/A ARG 76.A N THR 72.A O no hydrogen 3.103 N/A VAL 77.A N HIS 73.A O no hydrogen 2.916 N/A GLU 78.A N MET 74.A O no hydrogen 2.937 N/A ALA 79.A N ALA 75.A O no hydrogen 3.132 N/A MET 80.A N ARG 76.A O no hydrogen 3.104 N/A LEU 81.A N VAL 77.A O no hydrogen 2.821 N/A ASN 82.A N GLU 78.A O no hydrogen 2.902 N/A ASP 83.A N ALA 79.A O no hydrogen 3.039 N/A ARG 84.A N MET 80.A O no hydrogen 3.087 N/A ARG 85.A N LEU 81.A O no hydrogen 3.202 N/A ARG 85.A NH1.B GLU 117.A OE2 no hydrogen 2.830 N/A ARG 85.A NH1.B ASP 120.A OD2 no hydrogen 2.603 N/A ARG 85.A NH2.A ASN 82.A OD1 no hydrogen 3.037 N/A ARG 85.A NH2.B ASN 82.A OD1 no hydrogen 2.294 N/A ARG 85.A NH2.B ASP 120.A OD2 no hydrogen 3.120 N/A ARG 86.A N ASN 82.A O no hydrogen 2.820 N/A ARG 86.A NH2 ASP 83.A OD1 no hydrogen 2.831 N/A LEU 87.A N ASP 83.A O no hydrogen 3.114 N/A ALA 88.A N ARG 84.A O no hydrogen 2.876 N/A LEU 89.A N ARG 85.A O no hydrogen 2.987 N/A GLU 90.A N ARG 86.A O no hydrogen 3.022 N/A ASN 91.A N LEU 87.A O no hydrogen 3.030 N/A TYR 92.A N ALA 88.A O no hydrogen 3.249 N/A TYR 92.A OH SER 160.A O no hydrogen 2.792 N/A ILE 93.A N LEU 89.A O no hydrogen 2.939 N/A THR 94.A N GLU 90.A O no hydrogen 2.980 N/A THR 94.A OG1 GLU 90.A O no hydrogen 3.078 N/A ALA 95.A N ASN 91.A O no hydrogen 2.800 N/A LEU 96.A N TYR 92.A O no hydrogen 3.195 N/A GLN 97.A N THR 94.A O no hydrogen 3.067 N/A ALA 98.A N ALA 95.A O no hydrogen 3.426 N/A VAL 106.A N ARG 102.A O no hydrogen 3.068 N/A PHE 107.A N PRO 103.A O no hydrogen 3.039 N/A ASN 108.A N ARG 104.A O no hydrogen 3.128 N/A MET 109.A N HIS 105.A O no hydrogen 3.023 N/A LEU 110.A N VAL 106.A O no hydrogen 2.807 N/A LYS 111.A N PHE 107.A O no hydrogen 2.874 N/A LYS 112.A N ASN 108.A O no hydrogen 3.445 N/A TYR 113.A OH ARG 156.A O no hydrogen 3.315 N/A VAL 114.A N LEU 110.A O no hydrogen 2.733 N/A ARG 115.A N LYS 111.A O no hydrogen 2.964 N/A ALA 116.A N LYS 112.A O no hydrogen 3.347 N/A GLU 117.A N TYR 113.A O no hydrogen 3.180 N/A GLU 117.A N VAL 114.A O no hydrogen 2.957 N/A GLN 118.A N VAL 114.A O no hydrogen 2.841 N/A LYS 119.A N ARG 115.A O no hydrogen 2.855 N/A ARG 121.A N GLU 117.A O no hydrogen 2.972 N/A GLN 122.A N GLN 118.A O no hydrogen 2.793 N/A HIS 123.A N LYS 119.A O no hydrogen 2.881 N/A HIS 123.A NE2 HIS 73.A NE2 no hydrogen 3.198 N/A THR 124.A N ASP 120.A O no hydrogen 3.040 N/A THR 124.A OG1 ASP 120.A O no hydrogen 2.588 N/A LEU 125.A N ARG 121.A O no hydrogen 3.041 N/A LYS 126.A N GLN 122.A O no hydrogen 2.928 N/A HIS 127.A N HIS 123.A O no hydrogen 3.094 N/A PHE 128.A N THR 124.A O no hydrogen 3.049 N/A GLU 129.A N LEU 125.A O no hydrogen 2.900 N/A HIS 130.A N LYS 126.A O no hydrogen 3.167 N/A VAL 131.A N HIS 127.A O no hydrogen 3.238 N/A ARG 132.A N PHE 128.A O no hydrogen 2.979 N/A ARG 132.A NH1 GLU 129.A OE1 no hydrogen 2.875 N/A MET 133.A N GLU 129.A O no hydrogen 3.084 N/A MET 133.A N HIS 130.A O no hydrogen 3.050 N/A VAL 134.A N HIS 130.A O no hydrogen 2.980 N/A ASP 135.A N VAL 131.A O no hydrogen 2.701 N/A LYS 138.A N ASP 135.A OD1 no hydrogen 3.283 N/A ALA 139.A N ASP 135.A O no hydrogen 3.059 N/A ALA 140.A N PRO 136.A O no hydrogen 2.972 N/A GLN 141.A N LYS 137.A O no hydrogen 3.298 N/A ILE 142.A N LYS 138.A O no hydrogen 2.987 N/A ARG 143.A N ALA 139.A O no hydrogen 2.850 N/A VAL 146.A N ILE 142.A O no hydrogen 3.018 N/A MET 147.A N ARG 143.A O no hydrogen 2.956 N/A THR 148.A N SER 144.A O no hydrogen 2.946 N/A THR 148.A OG1 SER 144.A O no hydrogen 2.882 N/A HIS 149.A N GLN 145.A O no hydrogen 2.845 N/A LEU 150.A N VAL 146.A O no hydrogen 2.905 N/A ARG 151.A N MET 147.A O no hydrogen 2.904 N/A ARG 151.A NE GLU 155.A OE1 no hydrogen 3.442 N/A ARG 151.A NE GLU 155.A OE2 no hydrogen 3.528 N/A VAL 152.A N THR 148.A O no hydrogen 2.968 N/A ILE 153.A N HIS 149.A O no hydrogen 3.059 N/A TYR 154.A N LEU 150.A O no hydrogen 3.031 N/A GLU 155.A N ARG 151.A O no hydrogen 2.951 N/A ARG 156.A N VAL 152.A O no hydrogen 2.961 N/A ARG 156.A NE GLU 117.A OE1 no hydrogen 3.030 N/A ARG 156.A NE GLU 117.A OE2 no hydrogen 3.231 N/A ARG 156.A NH2 GLU 117.A OE2 no hydrogen 2.524 N/A MET 157.A N ILE 153.A O no hydrogen 2.965 N/A ASN 158.A N TYR 154.A O no hydrogen 2.998 N/A GLN 159.A N GLU 155.A O no hydrogen 2.901 N/A SER 160.A N ARG 156.A O no hydrogen 3.113 N/A SER 160.A OG TYR 113.A OH no hydrogen 2.941 N/A SER 160.A OG ARG 156.A O no hydrogen 2.990 N/A LEU 161.A N MET 157.A O no hydrogen 3.004 N/A SER 162.A N ASN 158.A O no hydrogen 3.125 N/A SER 162.A OG GLN 159.A O no hydrogen 2.710 N/A LEU 163.A N SER 160.A O no hydrogen 3.235 N/A LEU 164.A N LEU 161.A O no hydrogen 3.227 N/A ASN 166.A N SER 162.A O no hydrogen 3.169 N/A ASN 166.A N LEU 163.A O no hydrogen 3.233 N/A VAL 167.A N LEU 164.A O no hydrogen 3.327 N/A ALA 171.A N VAL 167.A O no hydrogen 3.137 N/A GLU 172.A N PRO 168.A O no hydrogen 3.020 N/A GLU 173.A N VAL 170.A O no hydrogen 3.286 N/A ILE 174.A N VAL 170.A O no hydrogen 3.169 N/A ILE 174.A N ALA 171.A O no hydrogen 3.186 N/A VAL 178.A N ILE 174.A O no hydrogen 3.052 N/A ASP 179.A N GLN 175.A O no hydrogen 3.429 N/A GLU 180.A N ASP 176.A O no hydrogen 3.269 N/A LEU 181.A N VAL 178.A O no hydrogen 3.113 N/A LEU 182.A N VAL 178.A O no hydrogen 2.780 N/A GLN 183.A N ASP 179.A O no hydrogen 3.245 N/A GLN 183.A NE2 GLU 180.A O no hydrogen 2.839 N/A GLU 185.A N LEU 182.A O no hydrogen 3.231 N/A