Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5wr1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 6.A N SER 2.A O no hydrogen 2.851 N/A ARG 6.A NH1 GLN 202.A OE1 no hydrogen 3.397 N/A ARG 6.A NH2 GLN 202.A OE1 no hydrogen 2.664 N/A ALA 7.A N ALA 3.A O no hydrogen 3.037 N/A LEU 8.A N ASP 4.A O no hydrogen 3.196 N/A ALA 9.A N LEU 5.A O no hydrogen 2.954 N/A LYS 10.A N ARG 6.A O no hydrogen 2.790 N/A HIS 11.A N ALA 7.A O no hydrogen 2.905 N/A HIS 11.A NE2 SER 84.A O no hydrogen 2.807 N/A LEU 12.A N LEU 8.A O no hydrogen 3.028 N/A TYR 13.A N ALA 9.A O no hydrogen 3.049 N/A ASP 14.A N LYS 10.A O no hydrogen 3.170 N/A SER 15.A N HIS 11.A O no hydrogen 3.121 N/A SER 15.A OG SER 84.A OG no hydrogen 2.603 N/A TYR 16.A N LEU 12.A O no hydrogen 2.814 N/A TYR 16.A OH ASP 163.A OD1 no hydrogen 2.727 N/A ILE 17.A N TYR 13.A O no hydrogen 2.865 N/A LYS 18.A N ASP 14.A O no hydrogen 3.056 N/A LYS 18.A NZ ASP 14.A OD2 no hydrogen 2.676 N/A SER 19.A N SER 15.A O no hydrogen 2.995 N/A SER 19.A N TYR 16.A O no hydrogen 3.168 N/A SER 19.A OG SER 15.A O no hydrogen 2.695 N/A PHE 20.A N TYR 16.A O no hydrogen 3.116 N/A LYS 24.A N ASP 163.A OD1 no hydrogen 2.901 N/A LYS 24.A NZ LEU 161.A O no hydrogen 2.750 N/A ALA 25.A N ASP 163.A OD2 no hydrogen 3.057 N/A LYS 26.A N THR 23.A OG1 no hydrogen 3.124 N/A ALA 27.A N THR 23.A O no hydrogen 2.970 N/A ARG 28.A N LYS 24.A O no hydrogen 2.904 N/A ARG 28.A NH1 MET 116.A O no hydrogen 3.470 N/A ARG 28.A NH2 MET 116.A O no hydrogen 2.806 N/A ALA 29.A N ALA 25.A O no hydrogen 3.090 N/A ILE 30.A N LYS 26.A O no hydrogen 3.042 N/A LEU 31.A N ALA 27.A O no hydrogen 2.996 N/A THR 32.A N ARG 28.A O no hydrogen 2.772 N/A GLY 33.A N ALA 29.A O no hydrogen 3.267 N/A LYS 34.A N ALA 29.A O no hydrogen 3.266 N/A LYS 37.A NZ ASP 36.A OD2 no hydrogen 3.169 N/A PHE 40.A N GLN 127.A O no hydrogen 3.043 N/A ILE 42.A N PHE 129.A O no hydrogen 2.680 N/A SER 47.A N ASP 44.A OD1 no hydrogen 2.729 N/A SER 47.A OG ASP 44.A OD1 no hydrogen 2.583 N/A LEU 48.A N ASP 44.A O no hydrogen 3.185 N/A MET 49.A N MET 45.A O no hydrogen 3.161 N/A MET 50.A N ASN 46.A O no hydrogen 2.988 N/A GLY 51.A N SER 47.A O no hydrogen 2.694 N/A LYS 54.A N GLY 51.A O no hydrogen 3.154 N/A ILE 55.A N GLY 51.A O no hydrogen 2.735 N/A ARG 62.A N GLU 58.A O no hydrogen 2.738 N/A ILE 63.A N VAL 59.A O no hydrogen 2.937 N/A PHE 64.A N ALA 60.A O no hydrogen 2.864 N/A GLN 65.A N ILE 61.A O no hydrogen 2.822 N/A GLN 65.A NE2 SER 246.A O no hydrogen 3.144 N/A GLY 66.A N ARG 62.A O no hydrogen 3.039 N/A CYS 67.A N ILE 63.A O no hydrogen 3.016 N/A GLN 68.A N PHE 64.A O no hydrogen 3.139 N/A PHE 69.A N GLN 65.A O no hydrogen 3.072 N/A ARG 70.A N GLY 66.A O no hydrogen 3.083 N/A ARG 70.A NH1 GLU 73.A OE1 no hydrogen 3.359 N/A ARG 70.A NH1 GLU 77.A OE1 no hydrogen 3.441 N/A SER 71.A N CYS 67.A O no hydrogen 2.665 N/A SER 71.A OG CYS 67.A O no hydrogen 3.015 N/A VAL 72.A N GLN 68.A O no hydrogen 3.090 N/A GLU 73.A N PHE 69.A O no hydrogen 3.308 N/A ALA 74.A N ARG 70.A O no hydrogen 3.159 N/A VAL 75.A N SER 71.A O no hydrogen 2.856 N/A GLN 76.A N VAL 72.A O no hydrogen 3.049 N/A GLU 77.A N GLU 73.A O no hydrogen 3.003 N/A ILE 78.A N ALA 74.A O no hydrogen 2.818 N/A THR 79.A N VAL 75.A O no hydrogen 2.800 N/A THR 79.A OG1 VAL 75.A O no hydrogen 2.795 N/A GLU 80.A N GLN 76.A O no hydrogen 3.067 N/A TYR 81.A N GLU 77.A O no hydrogen 2.825 N/A TYR 81.A OH ALA 167.A O no hydrogen 2.611 N/A ALA 82.A N ILE 78.A O no hydrogen 2.939 N/A LYS 83.A N THR 79.A O no hydrogen 3.377 N/A SER 84.A N TYR 81.A O no hydrogen 2.954 N/A SER 84.A OG SER 15.A OG no hydrogen 2.603 N/A SER 84.A OG TYR 81.A O no hydrogen 2.537 N/A ILE 85.A N ALA 82.A O no hydrogen 2.878 N/A PHE 88.A N ILE 85.A O no hydrogen 2.980 N/A ASN 90.A N GLY 87.A O no hydrogen 3.123 N/A LEU 91.A N PHE 88.A O no hydrogen 3.320 N/A ASN 94.A N ASP 92.A OD2 no hydrogen 3.018 N/A ASN 94.A ND2 ASP 92.A OD2 no hydrogen 3.390 N/A GLN 96.A N ASP 92.A O no hydrogen 3.186 N/A VAL 97.A N LEU 93.A O no hydrogen 3.233 N/A THR 98.A N ASN 94.A O no hydrogen 2.938 N/A THR 98.A OG1 ASN 94.A O no hydrogen 3.425 N/A LEU 99.A N ASP 95.A O no hydrogen 2.650 N/A LEU 100.A N GLN 96.A O no hydrogen 3.121 N/A LYS 101.A N VAL 97.A O no hydrogen 2.961 N/A LYS 101.A NZ ILE 254.A O no hydrogen 3.186 N/A TYR 102.A N THR 98.A O no hydrogen 3.248 N/A TYR 102.A OH ASP 257.A OD2 no hydrogen 3.294 N/A GLY 103.A N LEU 99.A O no hydrogen 2.851 N/A VAL 104.A N LEU 100.A O no hydrogen 3.027 N/A ILE 107.A N GLY 103.A O no hydrogen 3.178 N/A ILE 108.A N VAL 104.A O no hydrogen 3.059 N/A TYR 109.A N HIS 105.A O no hydrogen 3.121 N/A THR 110.A N GLU 106.A O no hydrogen 3.162 N/A THR 110.A OG1 GLU 106.A O no hydrogen 2.828 N/A MET 111.A N ILE 107.A O no hydrogen 2.985 N/A LEU 112.A N ILE 108.A O no hydrogen 2.848 N/A ALA 113.A N TYR 109.A O no hydrogen 3.435 N/A LEU 115.A N LEU 112.A O no hydrogen 3.007 N/A MET 116.A N ALA 113.A O no hydrogen 2.800 N/A ASN 117.A N GLY 120.A O no hydrogen 3.063 N/A ASP 119.A N ASN 117.A OD1 no hydrogen 3.031 N/A GLY 120.A N ASN 117.A O no hydrogen 3.155 N/A VAL 121.A N MET 130.A O no hydrogen 2.988 N/A LEU 122.A N LEU 115.A O no hydrogen 2.855 N/A ILE 123.A N GLY 128.A O no hydrogen 3.197 N/A GLN 127.A N SER 124.A O no hydrogen 2.987 N/A GLY 128.A N ILE 123.A O no hydrogen 3.130 N/A PHE 129.A N PHE 40.A O no hydrogen 2.901 N/A MET 130.A N VAL 121.A O no hydrogen 2.964 N/A THR 131.A N ILE 42.A O no hydrogen 2.841 N/A THR 131.A OG1 ILE 42.A O no hydrogen 3.450 N/A ARG 132.A N ASP 119.A O no hydrogen 2.862 N/A ARG 132.A NE GLU 147.A OE1 no hydrogen 3.266 N/A ARG 132.A NE GLU 147.A OE2 no hydrogen 3.075 N/A ARG 132.A NH1 LYS 118.A O no hydrogen 2.975 N/A ARG 132.A NH2 GLU 147.A OE2 no hydrogen 2.508 N/A PHE 134.A N THR 131.A OG1 no hydrogen 3.099 N/A LEU 135.A N THR 131.A O no hydrogen 3.306 N/A LYS 136.A N ARG 132.A O no hydrogen 3.118 N/A LYS 136.A NZ GLU 133.A OE2 no hydrogen 3.010 N/A SER 137.A N GLU 133.A O no hydrogen 3.063 N/A LEU 138.A N LEU 135.A O no hydrogen 3.391 N/A ARG 139.A NE GLU 58.A OE2 no hydrogen 2.991 N/A ARG 139.A NH1 LYS 140.A O no hydrogen 3.473 N/A ARG 139.A NH1 GLU 242.A OE2 no hydrogen 3.207 N/A ARG 139.A NH2 GLU 58.A OE1 no hydrogen 3.050 N/A ARG 139.A NH2 GLU 242.A OE1 no hydrogen 3.219 N/A PHE 145.A N PHE 142.A O no hydrogen 3.401 N/A LYS 149.A NZ PHE 145.A O no hydrogen 2.966 N/A LYS 149.A NZ HIS 231.A ND1 no hydrogen 3.343 N/A PHE 150.A N MET 146.A O no hydrogen 3.149 N/A GLU 151.A N GLU 147.A O no hydrogen 3.082 N/A PHE 152.A N PRO 148.A O no hydrogen 3.027 N/A ALA 153.A N LYS 149.A O no hydrogen 2.872 N/A VAL 154.A N PHE 150.A O no hydrogen 2.963 N/A LYS 155.A N GLU 151.A O no hydrogen 3.481 N/A LYS 155.A NZ ASP 223.A OD1 no hydrogen 3.173 N/A PHE 156.A N PHE 152.A O no hydrogen 2.680 N/A ASN 157.A N ALA 153.A O no hydrogen 2.694 N/A ASN 157.A ND2 ALA 113.A O no hydrogen 3.274 N/A ALA 158.A N LYS 155.A O no hydrogen 3.108 N/A LEU 159.A N PHE 156.A O no hydrogen 2.894 N/A GLU 160.A N ASN 157.A O no hydrogen 3.207 N/A ASP 162.A N ASP 165.A OD2 no hydrogen 3.019 N/A SER 164.A OG ASP 162.A OD1 no hydrogen 2.752 N/A ASP 165.A N ASP 162.A O no hydrogen 2.970 N/A ASP 165.A N ASP 162.A OD1 no hydrogen 3.470 N/A LEU 166.A N ASP 162.A O no hydrogen 3.109 N/A ALA 167.A N ASP 163.A O no hydrogen 3.006 N/A ILE 168.A N ASP 165.A O no hydrogen 3.274 N/A PHE 169.A N ASP 165.A O no hydrogen 3.179 N/A ILE 170.A N LEU 166.A O no hydrogen 2.756 N/A ALA 171.A N ALA 167.A O no hydrogen 3.408 N/A VAL 172.A N ILE 168.A O no hydrogen 3.073 N/A ILE 173.A N PHE 169.A O no hydrogen 3.129 N/A ILE 174.A N ILE 170.A O no hydrogen 3.065 N/A LEU 175.A N ALA 171.A O no hydrogen 3.162 N/A SER 176.A OG ILE 173.A O no hydrogen 2.696 N/A ARG 179.A NH1 GLU 106.A OE1 no hydrogen 3.082 N/A ARG 179.A NH2 GLU 106.A OE2 no hydrogen 3.078 N/A ARG 179.A NH2 ILE 173.A O no hydrogen 3.215 N/A LEU 183.A N ASP 95.A OD1 no hydrogen 2.863 N/A ASN 184.A N ASP 95.A OD2 no hydrogen 3.123 N/A LYS 186.A NZ ASP 190.A OD1 no hydrogen 3.407 N/A GLU 189.A N VAL 185.A O no hydrogen 3.130 N/A ASP 190.A N LYS 186.A O no hydrogen 3.122 N/A ILE 191.A N PRO 187.A O no hydrogen 3.389 N/A GLN 192.A N ILE 188.A O no hydrogen 3.050 N/A ASP 193.A N GLU 189.A O no hydrogen 2.856 N/A ASN 194.A N ASP 190.A O no hydrogen 3.404 N/A LEU 195.A N ILE 191.A O no hydrogen 2.988 N/A LEU 196.A N GLN 192.A O no hydrogen 2.689 N/A GLN 197.A N ASP 193.A O no hydrogen 2.938 N/A ALA 198.A N ASN 194.A O no hydrogen 2.890 N/A LEU 199.A N LEU 195.A O no hydrogen 2.737 N/A GLU 200.A N LEU 196.A O no hydrogen 2.914 N/A LEU 201.A N GLN 197.A O no hydrogen 3.231 N/A GLN 202.A N ALA 198.A O no hydrogen 2.892 N/A GLN 202.A NE2 ASP 165.A OD1 no hydrogen 3.035 N/A LEU 203.A N LEU 199.A O no hydrogen 2.777 N/A LYS 204.A N GLU 200.A O no hydrogen 3.171 N/A LYS 204.A NZ PRO 208.A O no hydrogen 3.197 N/A LEU 205.A N LEU 201.A O no hydrogen 2.972 N/A ASN 206.A N GLN 202.A O no hydrogen 2.906 N/A ASN 206.A ND2 ASP 162.A OD2 no hydrogen 3.005 N/A ASN 206.A ND2 ASP 165.A OD1 no hydrogen 3.177 N/A ASN 206.A ND2 ASP 165.A OD2 no hydrogen 3.253 N/A HIS 207.A N LEU 203.A O no hydrogen 2.650 N/A HIS 207.A NE2 ASP 165.A OD2 no hydrogen 2.749 N/A SER 210.A N HIS 207.A O no hydrogen 2.778 N/A SER 211.A N GLU 209.A O no hydrogen 3.054 N/A LEU 213.A N SER 210.A O no hydrogen 3.323 N/A LYS 216.A N GLN 212.A O no hydrogen 2.782 N/A LEU 217.A N LEU 213.A O no hydrogen 2.717 N/A LEU 218.A N PHE 214.A O no hydrogen 3.046 N/A GLN 219.A N ALA 215.A O no hydrogen 3.019 N/A LYS 220.A N LEU 217.A O no hydrogen 2.945 N/A MET 221.A N LEU 218.A O no hydrogen 3.196 N/A THR 222.A N GLN 219.A O no hydrogen 3.028 N/A ASP 223.A N LYS 220.A O no hydrogen 2.743 N/A LEU 224.A N LYS 220.A O no hydrogen 3.083 N/A ARG 225.A N MET 221.A O no hydrogen 3.061 N/A ARG 225.A NE GLU 106.A OE1 no hydrogen 3.104 N/A ARG 225.A NH2 GLU 106.A OE1 no hydrogen 3.541 N/A GLN 226.A N THR 222.A O no hydrogen 3.157 N/A GLN 226.A NE2 GLU 230.A OE2 no hydrogen 3.328 N/A ILE 227.A N ASP 223.A O no hydrogen 2.993 N/A VAL 228.A N LEU 224.A O no hydrogen 3.089 N/A THR 229.A N ARG 225.A O no hydrogen 3.331 N/A THR 229.A OG1 ARG 225.A O no hydrogen 3.192 N/A GLU 230.A N GLN 226.A O no hydrogen 3.234 N/A HIS 231.A N ILE 227.A O no hydrogen 3.027 N/A VAL 232.A N VAL 228.A O no hydrogen 2.985 N/A GLN 233.A N THR 229.A O no hydrogen 3.207 N/A LEU 234.A N GLU 230.A O no hydrogen 3.036 N/A LEU 235.A N HIS 231.A O no hydrogen 2.795 N/A GLN 236.A N VAL 232.A O no hydrogen 2.914 N/A VAL 237.A N GLN 233.A O no hydrogen 3.401 N/A ILE 238.A N LEU 234.A O no hydrogen 3.092 N/A LYS 239.A N LEU 235.A O no hydrogen 3.167 N/A LYS 240.A N VAL 237.A O no hydrogen 3.083 N/A THR 241.A N VAL 237.A O no hydrogen 2.939 N/A THR 241.A OG1 VAL 237.A O no hydrogen 2.916 N/A THR 241.A OG1 ILE 238.A O no hydrogen 3.354 N/A GLU 242.A N ILE 238.A O no hydrogen 2.613 N/A MET 245.A N GLU 242.A O no hydrogen 2.923 N/A LEU 250.A N HIS 248.A ND1 no hydrogen 3.140 N/A GLN 252.A N HIS 248.A O no hydrogen 2.836 N/A GLU 253.A N PRO 249.A O no hydrogen 2.663 N/A ILE 254.A N LEU 250.A O no hydrogen 3.173 N/A TYR 255.A N LEU 251.A O no hydrogen 3.085 N/A