Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6e5a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 6.A N GLU 3.A O no hydrogen 3.240 N/A ARG 8.A N SER 4.A O no hydrogen 2.912 N/A ARG 8.A NH1 GLN 202.A OE1 no hydrogen 2.930 N/A ARG 8.A NH2 GLN 202.A OE1 no hydrogen 3.311 N/A ALA 9.A N ALA 5.A O no hydrogen 3.000 N/A LEU 10.A N ASP 6.A O no hydrogen 2.953 N/A ALA 11.A N LEU 7.A O no hydrogen 2.896 N/A LYS 12.A N ARG 8.A O no hydrogen 2.985 N/A HIS 13.A N ALA 9.A O no hydrogen 2.912 N/A HIS 13.A NE2 SER 84.A O no hydrogen 2.826 N/A LEU 14.A N LEU 10.A O no hydrogen 3.005 N/A TYR 15.A N ALA 11.A O no hydrogen 2.951 N/A ASP 16.A N LYS 12.A O no hydrogen 2.874 N/A SER 17.A N HIS 13.A O no hydrogen 3.032 N/A SER 17.A OG.A HIS 13.A O no hydrogen 2.856 N/A SER 17.A OG.A LEU 14.A O no hydrogen 3.161 N/A SER 17.A OG.A SER 84.A OG no hydrogen 3.304 N/A SER 17.A OG.B SER 84.A OG no hydrogen 2.672 N/A TYR 18.A N LEU 14.A O no hydrogen 2.815 N/A TYR 18.A OH ASP 163.A OD1 no hydrogen 3.114 N/A ILE 19.A N TYR 15.A O no hydrogen 3.068 N/A LYS 20.A N ASP 16.A O no hydrogen 3.237 N/A LYS 20.A NZ ASP 16.A OD1 no hydrogen 3.385 N/A LYS 20.A NZ ASP 16.A OD2 no hydrogen 2.809 N/A SER 21.A N TYR 18.A O no hydrogen 3.066 N/A SER 21.A OG SER 17.A O no hydrogen 2.738 N/A PHE 22.A N TYR 18.A O no hydrogen 3.045 N/A LYS 26.A N ASP 163.A OD1 no hydrogen 2.729 N/A LYS 26.A NZ LEU 161.A O no hydrogen 2.575 N/A ALA 27.A N ASP 163.A OD2 no hydrogen 3.073 N/A LYS 28.A N THR 25.A OG1 no hydrogen 3.361 N/A ALA 29.A N THR 25.A O no hydrogen 3.117 N/A ARG 30.A N LYS 26.A O no hydrogen 2.843 N/A ARG 30.A NH1.A MET 116.A O no hydrogen 2.792 N/A ARG 30.A NH2.A MET 116.A O no hydrogen 2.766 N/A ALA 31.A N ALA 27.A O no hydrogen 3.061 N/A ILE 32.A N LYS 28.A O no hydrogen 3.064 N/A ILE 32.A N ALA 29.A O no hydrogen 3.206 N/A LEU 33.A N ALA 29.A O no hydrogen 2.873 N/A THR 34.A N ARG 30.A O no hydrogen 3.084 N/A THR 34.A OG1 ARG 30.A O no hydrogen 2.663 N/A LYS 36.A N ALA 31.A O no hydrogen 3.313 N/A LYS 40.A NZ.A ASP 39.A OD2 no hydrogen 3.325 N/A PHE 43.A N GLN 127.A O no hydrogen 2.948 N/A ILE 45.A N PHE 129.A O no hydrogen 2.797 N/A TYR 46.A N SER 50.A OG no hydrogen 2.791 N/A ASP 47.A N SER 50.A OG no hydrogen 2.858 N/A SER 50.A N ASP 47.A OD1 no hydrogen 2.917 N/A SER 50.A OG ASP 47.A O no hydrogen 3.104 N/A SER 50.A OG ASP 47.A OD1 no hydrogen 2.666 N/A LEU 51.A N ASP 47.A O no hydrogen 3.107 N/A MET 52.A N MET 48.A O no hydrogen 3.017 N/A MET 53.A N ASN 49.A O no hydrogen 2.934 N/A GLY 54.A N SER 50.A O no hydrogen 2.984 N/A ALA 61.A N GLU 59.A OE1 no hydrogen 3.123 N/A ARG 63.A N GLU 59.A O no hydrogen 3.031 N/A ARG 63.A NH2 GLU 55.A OE2 no hydrogen 2.359 N/A ILE 64.A N VAL 60.A O no hydrogen 2.965 N/A PHE 65.A N ALA 61.A O no hydrogen 3.036 N/A GLN 66.A N ILE 62.A O no hydrogen 2.860 N/A GLY 67.A N ARG 63.A O no hydrogen 2.977 N/A PHE 69.A N GLN 66.A O no hydrogen 3.083 N/A ARG 70.A N GLY 67.A O no hydrogen 3.187 N/A ARG 70.A NH1 GLU 73.A OE1 no hydrogen 3.451 N/A ARG 70.A NH1 GLU 77.A OE2 no hydrogen 3.152 N/A ARG 70.A NH2 GLU 77.A OE1 no hydrogen 3.277 N/A VAL 72.A N GLN 68.A O no hydrogen 2.743 N/A GLU 73.A N PHE 69.A O no hydrogen 2.976 N/A ALA 74.A N ARG 70.A O no hydrogen 2.884 N/A VAL 75.A N SER 71.A O no hydrogen 2.879 N/A GLN 76.A N VAL 72.A O no hydrogen 3.034 N/A GLU 77.A N GLU 73.A O no hydrogen 2.969 N/A ILE 78.A N ALA 74.A O no hydrogen 2.804 N/A THR 79.A N VAL 75.A O no hydrogen 2.869 N/A THR 79.A OG1 VAL 75.A O no hydrogen 2.692 N/A GLU 80.A N GLN 76.A O no hydrogen 2.904 N/A TYR 81.A N GLU 77.A O no hydrogen 2.860 N/A TYR 81.A OH ALA 167.A O no hydrogen 2.429 N/A ALA 82.A N ILE 78.A O no hydrogen 2.744 N/A LYS 83.A N THR 79.A O no hydrogen 3.020 N/A SER 84.A N TYR 81.A O no hydrogen 3.113 N/A SER 84.A OG SER 17.A OG.A no hydrogen 3.304 N/A SER 84.A OG SER 17.A OG.B no hydrogen 2.672 N/A SER 84.A OG TYR 81.A O no hydrogen 2.555 N/A ILE 85.A N ALA 82.A O no hydrogen 2.988 N/A PHE 88.A N ILE 85.A O no hydrogen 2.999 N/A ASN 90.A N GLY 87.A O no hydrogen 3.226 N/A LEU 91.A N PHE 88.A O no hydrogen 3.207 N/A ASN 94.A N ASP 92.A OD1 no hydrogen 2.861 N/A GLN 96.A N ASP 92.A O no hydrogen 2.987 N/A GLN 96.A NE2 LEU 91.A O no hydrogen 3.102 N/A VAL 97.A N LEU 93.A O no hydrogen 3.108 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 2.969 N/A LEU 99.A N ASP 95.A O no hydrogen 2.856 N/A LEU 100.A N GLN 96.A O no hydrogen 3.093 N/A LYS 101.A N VAL 97.A O no hydrogen 2.824 N/A LYS 101.A NZ GLU 253.A O no hydrogen 3.540 N/A LYS 101.A NZ ILE 254.A O no hydrogen 2.640 N/A LYS 101.A NZ LYS 256.A O no hydrogen 2.655 N/A TYR 102.A N THR 98.A O no hydrogen 3.100 N/A GLY 103.A N LEU 99.A O no hydrogen 2.901 N/A VAL 104.A N LEU 100.A O no hydrogen 2.997 N/A ILE 107.A N GLY 103.A O no hydrogen 3.139 N/A ILE 108.A N VAL 104.A O no hydrogen 3.004 N/A TYR 109.A N HIS 105.A O no hydrogen 2.985 N/A THR 110.A N GLU 106.A O no hydrogen 3.011 N/A THR 110.A OG1 GLU 106.A O no hydrogen 2.672 N/A MET 111.A N ILE 107.A O no hydrogen 2.803 N/A LEU 112.A N ILE 108.A O no hydrogen 2.812 N/A ALA 113.A N TYR 109.A O no hydrogen 3.120 N/A SER 114.A N MET 111.A O no hydrogen 2.969 N/A LEU 115.A N LEU 112.A O no hydrogen 3.038 N/A MET 116.A N ALA 113.A O no hydrogen 3.152 N/A ASN 117.A N GLY 120.A O no hydrogen 3.016 N/A LYS 118.A NZ ASP 119.A OD2 no hydrogen 3.494 N/A ASP 119.A N ASN 117.A OD1 no hydrogen 2.689 N/A GLY 120.A N ASN 117.A OD1 no hydrogen 2.804 N/A VAL 121.A N MET 130.A O no hydrogen 2.932 N/A LEU 122.A N LEU 115.A O no hydrogen 2.779 N/A ILE 123.A N GLY 128.A O no hydrogen 2.970 N/A SER 124.A OG GLN 127.A OE1 no hydrogen 3.282 N/A GLY 126.A N ILE 123.A O no hydrogen 3.069 N/A GLN 127.A N SER 124.A O no hydrogen 2.982 N/A GLY 128.A N ILE 123.A O no hydrogen 2.955 N/A PHE 129.A N PHE 43.A O no hydrogen 2.850 N/A MET 130.A N VAL 121.A O no hydrogen 2.944 N/A THR 131.A N ILE 45.A O no hydrogen 2.955 N/A THR 131.A OG1 ILE 45.A O no hydrogen 3.428 N/A ARG 132.A N ASP 119.A O no hydrogen 2.633 N/A ARG 132.A NE GLU 147.A OE1 no hydrogen 2.743 N/A ARG 132.A NE GLU 147.A OE2 no hydrogen 3.253 N/A ARG 132.A NH1 LYS 118.A O no hydrogen 3.543 N/A ARG 132.A NH2 GLU 147.A OE2 no hydrogen 3.001 N/A PHE 134.A N THR 131.A OG1 no hydrogen 3.256 N/A LEU 135.A N THR 131.A O no hydrogen 3.211 N/A LYS 136.A N ARG 132.A O no hydrogen 2.966 N/A LYS 136.A NZ LYS 136.A O no hydrogen 3.270 N/A SER 137.A N GLU 133.A O no hydrogen 2.860 N/A SER 137.A N PHE 134.A O no hydrogen 3.113 N/A SER 137.A OG GLU 133.A O no hydrogen 3.414 N/A SER 137.A OG PHE 134.A O no hydrogen 2.515 N/A LEU 138.A N LEU 135.A O no hydrogen 3.445 N/A ARG 139.A NH1 GLU 59.A OE2 no hydrogen 2.901 N/A GLY 143.A N ARG 139.A O no hydrogen 3.261 N/A PHE 145.A N PHE 142.A O no hydrogen 3.283 N/A LYS 149.A NZ PHE 145.A O no hydrogen 2.786 N/A LYS 149.A NZ HIS 231.A ND1 no hydrogen 2.910 N/A PHE 150.A N MET 146.A O no hydrogen 2.988 N/A GLU 151.A N GLU 147.A O no hydrogen 2.921 N/A PHE 152.A N PRO 148.A O no hydrogen 3.011 N/A ALA 153.A N LYS 149.A O no hydrogen 2.923 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 3.205 N/A PHE 156.A N PHE 152.A O no hydrogen 2.764 N/A ASN 157.A N ALA 153.A O no hydrogen 2.869 N/A ASN 157.A ND2 ALA 113.A O no hydrogen 2.964 N/A LEU 159.A N PHE 156.A O no hydrogen 3.104 N/A GLU 160.A N ASN 157.A O no hydrogen 3.049 N/A ASP 162.A N ASP 165.A OD2 no hydrogen 3.131 N/A SER 164.A OG ASP 162.A OD1 no hydrogen 2.518 N/A ASP 165.A N ASP 162.A OD1 no hydrogen 3.066 N/A LEU 166.A N ASP 162.A O no hydrogen 3.113 N/A ALA 167.A N ASP 163.A O no hydrogen 2.927 N/A PHE 169.A N ASP 165.A O no hydrogen 3.031 N/A ILE 170.A N LEU 166.A O no hydrogen 2.879 N/A ALA 171.A N ALA 167.A O no hydrogen 3.168 N/A VAL 172.A N ILE 168.A O no hydrogen 2.904 N/A ILE 173.A N PHE 169.A O no hydrogen 3.034 N/A ILE 174.A N ILE 170.A O no hydrogen 3.055 N/A LEU 175.A N ALA 171.A O no hydrogen 3.234 N/A SER 176.A OG ILE 173.A O no hydrogen 2.928 N/A ASP 178.A N ASP 178.A OD1.A no hydrogen 2.530 N/A ARG 179.A NH1 GLU 106.A OE2 no hydrogen 3.178 N/A ARG 179.A NH2 GLU 106.A OE1 no hydrogen 2.950 N/A ARG 179.A NH2 ILE 173.A O no hydrogen 3.010 N/A LEU 183.A N ASP 95.A OD1 no hydrogen 2.698 N/A ASN 184.A N ASP 95.A OD2 no hydrogen 3.046 N/A LYS 186.A NZ ASP 190.A OD1 no hydrogen 3.032 N/A LYS 186.A NZ ASP 190.A OD2 no hydrogen 3.016 N/A GLU 189.A N VAL 185.A O no hydrogen 2.933 N/A ASP 190.A N LYS 186.A O no hydrogen 2.993 N/A ILE 191.A N PRO 187.A O no hydrogen 3.035 N/A GLN 192.A N ILE 188.A O no hydrogen 3.051 N/A ASP 193.A N GLU 189.A O no hydrogen 2.827 N/A ASN 194.A N ASP 190.A O no hydrogen 3.056 N/A LEU 195.A N ILE 191.A O no hydrogen 2.839 N/A LEU 196.A N GLN 192.A O no hydrogen 2.581 N/A GLN 197.A N ASP 193.A O no hydrogen 3.172 N/A ALA 198.A N ASN 194.A O no hydrogen 2.921 N/A LEU 199.A N LEU 195.A O no hydrogen 2.848 N/A GLU 200.A N LEU 196.A O no hydrogen 2.913 N/A LEU 201.A N GLN 197.A O no hydrogen 3.038 N/A GLN 202.A N ALA 198.A O no hydrogen 2.938 N/A GLN 202.A NE2 ASP 165.A OD1 no hydrogen 2.813 N/A LEU 203.A N LEU 199.A O no hydrogen 2.889 N/A LYS 204.A N GLU 200.A O no hydrogen 3.004 N/A LYS 204.A NZ GLU 200.A OE1 no hydrogen 3.409 N/A LEU 205.A N LEU 201.A O no hydrogen 2.970 N/A ASN 206.A N GLN 202.A O no hydrogen 2.922 N/A ASN 206.A ND2 ASP 162.A OD2 no hydrogen 2.603 N/A ASN 206.A ND2 ASP 165.A OD1 no hydrogen 3.180 N/A ASN 206.A ND2 ASP 165.A OD2 no hydrogen 3.297 N/A HIS 207.A N LEU 203.A O no hydrogen 3.070 N/A HIS 207.A NE2 ASP 165.A OD2 no hydrogen 2.765 N/A SER 210.A N HIS 207.A O no hydrogen 3.092 N/A LYS 216.A N GLN 212.A O no hydrogen 3.126 N/A LYS 216.A NZ SER 211.A O no hydrogen 2.691 N/A LEU 217.A N LEU 213.A O no hydrogen 2.877 N/A LEU 218.A N PHE 214.A O no hydrogen 2.963 N/A GLN 219.A N ALA 215.A O no hydrogen 2.904 N/A LYS 220.A N LYS 216.A O no hydrogen 3.166 N/A LYS 220.A N LEU 217.A O no hydrogen 3.098 N/A MET 221.A N LEU 218.A O no hydrogen 3.236 N/A THR 222.A N GLN 219.A O no hydrogen 3.175 N/A THR 222.A OG1 GLN 219.A O no hydrogen 3.210 N/A LEU 224.A N LYS 220.A O no hydrogen 3.155 N/A ARG 225.A N MET 221.A O no hydrogen 3.108 N/A ARG 225.A NH1 GLU 106.A OE2 no hydrogen 3.308 N/A ARG 225.A NH2 ASP 178.A OD2.A no hydrogen 3.073 N/A GLN 226.A N THR 222.A O no hydrogen 3.094 N/A ILE 227.A N ASP 223.A O no hydrogen 2.892 N/A VAL 228.A N LEU 224.A O no hydrogen 2.927 N/A THR 229.A N ARG 225.A O no hydrogen 2.943 N/A THR 229.A OG1 ARG 225.A O no hydrogen 3.221 N/A GLU 230.A N GLN 226.A O no hydrogen 3.035 N/A HIS 231.A N ILE 227.A O no hydrogen 3.052 N/A VAL 232.A N VAL 228.A O no hydrogen 3.030 N/A GLN 233.A N THR 229.A O no hydrogen 3.135 N/A LEU 234.A N GLU 230.A O no hydrogen 2.946 N/A LEU 235.A N HIS 231.A O no hydrogen 2.899 N/A GLN 236.A N VAL 232.A O no hydrogen 3.068 N/A VAL 237.A N GLN 233.A O no hydrogen 3.066 N/A VAL 237.A N LEU 234.A O no hydrogen 2.988 N/A ILE 238.A N LEU 234.A O no hydrogen 3.013 N/A LYS 239.A N LEU 235.A O no hydrogen 2.920 N/A LYS 240.A N VAL 237.A O no hydrogen 3.056 N/A THR 241.A N VAL 237.A O no hydrogen 3.000 N/A THR 241.A OG1 VAL 237.A O no hydrogen 3.056 N/A THR 241.A OG1 ILE 238.A O no hydrogen 3.401 N/A GLU 242.A N ILE 238.A O no hydrogen 2.940 N/A HIS 248.A N GLN 68.A OE1 no hydrogen 3.366 N/A LEU 250.A N HIS 248.A ND1 no hydrogen 3.042 N/A GLN 252.A N HIS 248.A O no hydrogen 2.680 N/A GLN 252.A NE2 LEU 247.A O no hydrogen 3.321 N/A GLU 253.A N PRO 249.A O no hydrogen 2.861 N/A ILE 254.A N LEU 250.A O no hydrogen 3.128 N/A TYR 255.A N LEU 251.A O no hydrogen 3.166 N/A