Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3zwd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 193.A O no hydrogen 2.955 N/A ILE 2.A N PHE 196.A O no hydrogen 3.144 N/A VAL 3.A N PRO 34.A O no hydrogen 2.924 N/A PHE 4.A N VAL 198.A O no hydrogen 2.801 N/A THR 5.A N VAL 36.A O no hydrogen 3.032 N/A ASP 6.A N LEU 200.A O no hydrogen 3.011 N/A GLY 9.A N ASP 202.A OD2 no hydrogen 2.632 N/A THR 10.A N ASP 202.A OD2 no hydrogen 2.625 N/A LEU 11.A N LEU 7.A O no hydrogen 3.180 N/A LEU 12.A N LEU 7.A O no hydrogen 3.030 N/A ASP 13.A N ASP 8.A O no hydrogen 2.764 N/A ARG 15.A N ASP 13.A O no hydrogen 2.881 N/A GLY 16.A N GLU 14.A O no hydrogen 2.632 N/A ALA 21.A N LEU 18.A O no hydrogen 2.668 N/A ARG 22.A N LEU 18.A O no hydrogen 3.467 N/A GLU 23.A N GLY 19.A O no hydrogen 3.107 N/A ALA 24.A N PRO 20.A O no hydrogen 3.064 N/A LEU 25.A N ALA 21.A O no hydrogen 2.783 N/A GLU 26.A N ARG 22.A O no hydrogen 2.787 N/A ARG 27.A N GLU 23.A O no hydrogen 3.075 N/A LEU 28.A N ALA 24.A O no hydrogen 3.101 N/A ARG 29.A N LEU 25.A O no hydrogen 2.942 N/A ALA 30.A N GLU 26.A O no hydrogen 2.705 N/A LEU 31.A N ARG 27.A O no hydrogen 3.172 N/A LEU 31.A N LEU 28.A O no hydrogen 3.109 N/A GLY 32.A N ARG 29.A O no hydrogen 2.979 N/A VAL 33.A N LEU 28.A O no hydrogen 3.024 N/A VAL 36.A N VAL 3.A O no hydrogen 2.701 N/A VAL 38.A N THR 5.A O no hydrogen 2.801 N/A THR 39.A N ILE 56.A O no hydrogen 2.987 N/A LYS 41.A N THR 39.A OG1 no hydrogen 2.894 N/A THR 42.A N GLU 45.A OE1 no hydrogen 2.906 N/A THR 42.A OG1 ARG 131.A O no hydrogen 2.772 N/A ARG 43.A NH1 GLU 47.A OE2 no hydrogen 2.820 N/A GLU 45.A N THR 42.A OG1 no hydrogen 3.120 N/A VAL 46.A N THR 42.A O no hydrogen 3.047 N/A GLU 47.A N ARG 43.A O no hydrogen 2.940 N/A ALA 48.A N LYS 44.A O no hydrogen 3.167 N/A LEU 49.A N GLU 45.A O no hydrogen 3.076 N/A GLY 50.A N GLU 47.A O no hydrogen 2.773 N/A LEU 51.A N VAL 46.A O no hydrogen 3.169 N/A PHE 55.A N TYR 64.A O no hydrogen 3.107 N/A ILE 56.A N PRO 37.A O no hydrogen 2.827 N/A VAL 57.A N GLY 62.A O no hydrogen 2.965 N/A GLU 58.A N LYS 41.A O no hydrogen 2.903 N/A ASN 59.A N THR 39.A O no hydrogen 2.812 N/A ASN 59.A ND2 ASP 138.A OD2 no hydrogen 3.365 N/A GLY 60.A N VAL 57.A O no hydrogen 3.034 N/A GLY 61.A N GLU 58.A O no hydrogen 2.991 N/A GLY 62.A N VAL 57.A O no hydrogen 3.411 N/A LEU 63.A N VAL 83.A O no hydrogen 2.852 N/A TYR 64.A N PHE 55.A O no hydrogen 2.975 N/A TYR 64.A OH GLU 136.A OE1 no hydrogen 2.497 N/A LEU 65.A N ARG 81.A O no hydrogen 2.833 N/A ARG 67.A N GLY 79.A O no hydrogen 2.996 N/A ARG 67.A NH1 GLY 78.A O no hydrogen 2.889 N/A TRP 69.A N PRO 66.A O no hydrogen 3.036 N/A TRP 69.A NE1 LEU 187.A O no hydrogen 2.958 N/A ARG 75.A N VAL 82.A O no hydrogen 2.783 N/A LYS 77.A N TYR 80.A O no hydrogen 2.862 N/A LYS 77.A NZ TYR 64.A OH no hydrogen 2.772 N/A TYR 80.A N LYS 77.A O no hydrogen 2.791 N/A TYR 80.A OH GLU 47.A OE2 no hydrogen 2.566 N/A ARG 81.A N LEU 65.A O no hydrogen 2.803 N/A ARG 81.A NE ALA 73.A O no hydrogen 2.783 N/A ARG 81.A NH1 ARG 67.A O no hydrogen 3.451 N/A ARG 81.A NH2 GLY 74.A O no hydrogen 3.370 N/A VAL 82.A N ARG 75.A O no hydrogen 2.758 N/A VAL 83.A N LEU 63.A O no hydrogen 2.785 N/A SER 84.A OG TYR 137.A OH no hydrogen 2.599 N/A LEU 85.A N GLY 61.A O no hydrogen 2.836 N/A TRP 87.A N LYS 173.A O no hydrogen 2.805 N/A TYR 89.A N GLU 136.A O no hydrogen 2.772 N/A TYR 89.A OH GLU 139.A OE1 no hydrogen 2.723 N/A TYR 89.A OH GLU 139.A OE2 no hydrogen 3.125 N/A LYS 91.A N PRO 88.A O no hydrogen 3.047 N/A VAL 92.A N PRO 88.A O no hydrogen 3.124 N/A ARG 93.A N TYR 89.A O no hydrogen 2.753 N/A ARG 93.A NH1 ASP 112.A OD2 no hydrogen 3.362 N/A ARG 93.A NH2 ASP 112.A OD1 no hydrogen 2.731 N/A ALA 94.A N ARG 90.A O no hydrogen 3.036 N/A ARG 95.A N LYS 91.A O no hydrogen 3.048 N/A ARG 95.A NH1 VAL 158.A O no hydrogen 2.833 N/A LEU 96.A N VAL 92.A O no hydrogen 2.926 N/A ARG 97.A N ARG 93.A O no hydrogen 3.273 N/A ARG 97.A N ALA 94.A O no hydrogen 3.093 N/A GLU 98.A N ALA 94.A O no hydrogen 3.419 N/A ALA 99.A N ARG 95.A O no hydrogen 2.902 N/A GLU 100.A N LEU 96.A O no hydrogen 2.960 N/A ALA 101.A N ARG 97.A O no hydrogen 3.399 N/A LEU 102.A N GLU 98.A O no hydrogen 3.194 N/A ALA 103.A N ALA 99.A O no hydrogen 2.821 N/A GLY 104.A N ALA 101.A O no hydrogen 3.293 N/A ARG 105.A N GLU 100.A O no hydrogen 3.283 N/A ILE 107.A N GLU 100.A OE2 no hydrogen 2.761 N/A GLY 109.A N ASP 112.A OD2 no hydrogen 3.066 N/A TYR 110.A N THR 140.A O no hydrogen 2.940 N/A GLY 111.A N GLU 139.A OE2 no hydrogen 2.844 N/A ASP 112.A N GLY 109.A O no hydrogen 2.913 N/A LEU 113.A N TYR 110.A O no hydrogen 3.049 N/A ALA 117.A N THR 114.A OG1 no hydrogen 3.037 N/A VAL 118.A N THR 114.A O no hydrogen 3.072 N/A ALA 119.A N ALA 115.A O no hydrogen 2.832 N/A ARG 120.A N GLU 116.A O no hydrogen 2.937 N/A LEU 121.A N ALA 117.A O no hydrogen 2.950 N/A THR 122.A N VAL 118.A O no hydrogen 2.944 N/A THR 122.A OG1 VAL 118.A O no hydrogen 2.792 N/A THR 122.A OG1 ALA 119.A O no hydrogen 3.409 N/A GLY 123.A N ALA 119.A O no hydrogen 2.811 N/A LEU 124.A N THR 122.A OG1 no hydrogen 3.026 N/A SER 125.A OG GLU 127.A OE1 no hydrogen 3.398 N/A ARG 126.A NE GLU 127.A OE2 no hydrogen 3.402 N/A ARG 126.A NH2 GLU 127.A OE2 no hydrogen 3.546 N/A ALA 128.A N SER 125.A OG no hydrogen 3.075 N/A ALA 129.A N SER 125.A O no hydrogen 2.826 N/A ARG 130.A N ARG 126.A O no hydrogen 2.935 N/A ARG 131.A N GLU 127.A O no hydrogen 3.283 N/A ALA 132.A N ALA 128.A O no hydrogen 2.839 N/A LYS 133.A N ALA 129.A O no hydrogen 2.935 N/A LYS 133.A N ARG 130.A O no hydrogen 3.216 N/A LYS 133.A NZ TYR 110.A O no hydrogen 2.648 N/A LYS 133.A NZ LEU 113.A O no hydrogen 2.821 N/A ALA 134.A N ARG 131.A O no hydrogen 3.106 N/A ARG 135.A N LYS 133.A O no hydrogen 2.873 N/A ARG 135.A NE ASP 138.A O no hydrogen 2.783 N/A ARG 135.A NH1 ALA 132.A O no hydrogen 2.885 N/A ARG 135.A NH2 ALA 40.A O no hydrogen 2.918 N/A ARG 135.A NH2 ASP 138.A OD1 no hydrogen 3.034 N/A GLU 136.A N GLU 58.A OE1 no hydrogen 3.211 N/A GLU 136.A N GLU 58.A OE2 no hydrogen 2.737 N/A TYR 137.A N GLU 58.A OE1 no hydrogen 2.782 N/A TYR 137.A OH SER 84.A OG no hydrogen 2.599 N/A ASP 138.A N GLU 58.A OE1 no hydrogen 2.857 N/A GLU 139.A N ALA 171.A O no hydrogen 2.905 N/A LEU 141.A N TYR 169.A O no hydrogen 2.793 N/A VAL 142.A N LEU 108.A O no hydrogen 2.817 N/A GLU 146.A N GLU 146.A OE1 no hydrogen 2.930 N/A GLU 147.A N CYS 144.A O no hydrogen 2.651 N/A VAL 151.A N GLU 147.A O no hydrogen 3.112 N/A LEU 152.A N VAL 148.A O no hydrogen 2.860 N/A GLU 153.A N GLU 149.A O no hydrogen 3.052 N/A ALA 154.A N ALA 150.A O no hydrogen 3.210 N/A LEU 155.A N VAL 151.A O no hydrogen 2.879 N/A GLU 156.A N LEU 152.A O no hydrogen 3.139 N/A ALA 157.A N GLU 153.A O no hydrogen 3.020 N/A VAL 158.A N ALA 154.A O no hydrogen 3.235 N/A VAL 158.A N LEU 155.A O no hydrogen 3.275 N/A GLY 159.A N GLU 156.A O no hydrogen 2.898 N/A LEU 160.A N LEU 155.A O no hydrogen 2.900 N/A GLU 161.A N ALA 172.A O no hydrogen 2.682 N/A TRP 162.A NE1 GLU 156.A OE2 no hydrogen 2.709 N/A THR 163.A N HIS 170.A O no hydrogen 3.119 N/A GLY 165.A N PHE 168.A O no hydrogen 3.026 N/A GLY 166.A N HIS 164.A ND1 no hydrogen 3.170 N/A ARG 167.A NH1 THR 122.A O no hydrogen 3.425 N/A ARG 167.A NH2 THR 122.A O no hydrogen 2.624 N/A HIS 170.A N THR 163.A O no hydrogen 2.827 N/A HIS 170.A ND1 ASP 138.A OD1 no hydrogen 2.719 N/A ALA 171.A N GLU 139.A O no hydrogen 2.908 N/A ALA 172.A N GLU 161.A O no hydrogen 2.921 N/A GLY 174.A N GLU 161.A OE1 no hydrogen 2.975 N/A LYS 177.A NZ VAL 38.A O no hydrogen 3.477 N/A ARG 179.A N ASP 176.A OD1 no hydrogen 2.900 N/A ARG 179.A NH1 LEU 85.A O no hydrogen 2.582 N/A ARG 179.A NH1 GLY 174.A O no hydrogen 2.823 N/A ALA 180.A N ASP 176.A O no hydrogen 3.097 N/A VAL 181.A N LYS 177.A O no hydrogen 2.917 N/A ALA 182.A N GLY 178.A O no hydrogen 2.892 N/A ARG 183.A N ARG 179.A O no hydrogen 2.921 N/A LEU 184.A N ALA 180.A O no hydrogen 2.977 N/A ARG 185.A N VAL 181.A O no hydrogen 2.973 N/A ARG 185.A NE ALA 194.A O no hydrogen 3.054 N/A ARG 185.A NH1 ALA 212.A O no hydrogen 2.956 N/A ARG 185.A NH2 ALA 194.A O no hydrogen 2.985 N/A ARG 185.A NH2 ASP 214.A OD2 no hydrogen 2.748 N/A ALA 186.A N ALA 182.A O no hydrogen 3.032 N/A LEU 187.A N ARG 183.A O no hydrogen 2.968 N/A LEU 187.A N LEU 184.A O no hydrogen 3.085 N/A TRP 188.A N ARG 185.A O no hydrogen 3.215 N/A TRP 188.A NE1 GLU 193.A OE1 no hydrogen 2.742 N/A GLU 192.A N ASP 190.A OD1 no hydrogen 3.339 N/A GLU 193.A N ASP 190.A O no hydrogen 3.067 N/A ARG 195.A N GLU 192.A O no hydrogen 3.332 N/A ARG 195.A NE GLU 192.A OE1 no hydrogen 3.085 N/A ARG 195.A NE GLU 192.A OE2 no hydrogen 3.222 N/A ARG 195.A NH2 GLU 192.A OE2 no hydrogen 2.771 N/A ALA 197.A N ASP 214.A OD2 no hydrogen 2.930 N/A VAL 198.A N ILE 2.A O no hydrogen 2.827 N/A GLY 199.A N LEU 215.A O no hydrogen 2.856 N/A LEU 200.A N PHE 4.A O no hydrogen 2.871 N/A GLY 201.A N VAL 217.A O no hydrogen 2.988 N/A ASN 205.A N SER 203.A OG no hydrogen 2.779 N/A ASP 206.A N SER 203.A O no hydrogen 3.022 N/A PHE 210.A N ASP 206.A O no hydrogen 2.936 N/A ARG 211.A N LEU 207.A O no hydrogen 2.686 N/A ALA 212.A N PRO 208.A O no hydrogen 3.285 N/A ALA 212.A N LEU 209.A O no hydrogen 3.169 N/A ASP 214.A N ALA 197.A O no hydrogen 2.869 N/A LEU 215.A N ALA 197.A O no hydrogen 3.090 N/A VAL 217.A N GLY 199.A O no hydrogen 2.787 N/A TYR 218.A N LEU 229.A O no hydrogen 2.903 N/A TYR 218.A OH ARG 221.A O no hydrogen 2.633 N/A VAL 219.A N GLY 201.A O no hydrogen 2.812 N/A VAL 228.A N PRO 225.A O no hydrogen 3.124 N/A LEU 229.A N ALA 216.A O no hydrogen 2.941 N/A THR 231.A OG1 ALA 233.A O no hydrogen 2.714 N/A PHE 239.A N GLY 235.A O no hydrogen 2.885 N/A ARG 240.A N PRO 236.A O no hydrogen 2.844 N/A ARG 240.A NE GLU 237.A OE1 no hydrogen 3.396 N/A ARG 240.A NH2 GLU 237.A OE1 no hydrogen 3.086 N/A TYR 241.A N GLU 237.A O no hydrogen 2.809 N/A ALA 242.A N GLY 238.A O no hydrogen 3.044 N/A VAL 243.A N PHE 239.A O no hydrogen 2.881 N/A GLU 244.A N ARG 240.A O no hydrogen 2.813 N/A ARG 245.A N TYR 241.A O no hydrogen 2.839 N/A ARG 245.A NH1 TYR 241.A OH no hydrogen 2.620 N/A TYR 246.A N ALA 242.A O no hydrogen 2.865 N/A TYR 246.A OH ALA 230.A O no hydrogen 3.070 N/A LEU 247.A N VAL 243.A O no hydrogen 3.128 N/A LEU 248.A N VAL 243.A O no hydrogen 3.044 N/A ARG 250.A N LEU 247.A O no hydrogen 2.701 N/A LEU 251.A N LEU 248.A O no hydrogen 3.020 N/A