Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3sp6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 4.A N GLU 1.A O no hydrogen 3.020 N/A THR 5.A N GLU 1.A O no hydrogen 3.158 N/A ALA 6.A N ASP 2.A O no hydrogen 3.049 N/A ASP 7.A N SER 3.A O no hydrogen 3.294 N/A LEU 8.A N GLU 4.A O no hydrogen 2.802 N/A LYS 9.A N THR 5.A O no hydrogen 2.871 N/A SER 10.A N ALA 6.A O no hydrogen 2.952 N/A LEU 11.A N ASP 7.A O no hydrogen 2.854 N/A ALA 12.A N LEU 8.A O no hydrogen 3.016 N/A LYS 13.A N LYS 9.A O no hydrogen 3.054 N/A ARG 14.A N SER 10.A O no hydrogen 2.941 N/A ILE 15.A N LEU 11.A O no hydrogen 3.004 N/A TYR 16.A N ALA 12.A O no hydrogen 3.098 N/A GLU 17.A N LYS 13.A O no hydrogen 2.904 N/A ALA 18.A N ARG 14.A O no hydrogen 2.994 N/A TYR 19.A N ILE 15.A O no hydrogen 3.000 N/A TYR 19.A OH ASP 174.A OD1 no hydrogen 2.773 N/A LEU 20.A N TYR 16.A O no hydrogen 2.943 N/A LYS 21.A N GLU 17.A O no hydrogen 2.879 N/A ASN 22.A N TYR 19.A O no hydrogen 3.350 N/A ASN 22.A ND2 ALA 18.A O no hydrogen 2.487 N/A PHE 23.A N TYR 19.A O no hydrogen 3.187 N/A ASN 24.A N GLU 88.A OE2 no hydrogen 3.390 N/A ASN 24.A ND2 GLU 88.A OE2 no hydrogen 2.898 N/A LYS 27.A N ASP 174.A OD1 no hydrogen 2.826 N/A LYS 27.A NZ LEU 172.A O no hydrogen 2.944 N/A VAL 28.A N ASP 174.A OD2 no hydrogen 3.202 N/A LYS 29.A N ASN 26.A OD1 no hydrogen 2.741 N/A LYS 29.A NZ ASN 24.A O no hydrogen 2.832 N/A ALA 30.A N ASN 26.A O no hydrogen 2.854 N/A ARG 31.A N LYS 27.A O no hydrogen 2.971 N/A VAL 32.A N VAL 28.A O no hydrogen 2.938 N/A ILE 33.A N LYS 29.A O no hydrogen 3.148 N/A LEU 34.A N ALA 30.A O no hydrogen 2.853 N/A SER 35.A N ARG 31.A O no hydrogen 2.565 N/A SER 35.A OG ARG 31.A O no hydrogen 2.928 N/A SER 35.A OG VAL 32.A O no hydrogen 2.545 N/A SER 35.A OG LYS 37.A O no hydrogen 3.362 N/A LYS 37.A N SER 35.A OG no hydrogen 2.574 N/A PHE 44.A N ASN 138.A O no hydrogen 3.046 N/A ILE 46.A N PHE 140.A O no hydrogen 2.753 N/A HIS 47.A N THR 51.A OG1 no hydrogen 2.896 N/A ASP 48.A N THR 51.A OG1 no hydrogen 3.005 N/A THR 51.A N ASP 48.A OD1 no hydrogen 3.044 N/A THR 51.A OG1 ASP 48.A O no hydrogen 2.939 N/A THR 51.A OG1 ASP 48.A OD1 no hydrogen 2.606 N/A LEU 52.A N ASP 48.A O no hydrogen 2.994 N/A CYS 53.A N MET 49.A O no hydrogen 3.056 N/A CYS 53.A SG MET 49.A O no hydrogen 3.354 N/A MET 54.A N GLU 50.A O no hydrogen 3.035 N/A ALA 55.A N THR 51.A O no hydrogen 2.947 N/A GLU 56.A N LEU 52.A O no hydrogen 2.936 N/A LYS 57.A N CYS 53.A O no hydrogen 3.003 N/A THR 58.A N MET 54.A O no hydrogen 3.326 N/A THR 58.A N ALA 55.A O no hydrogen 3.155 N/A THR 58.A OG1 ALA 55.A O no hydrogen 3.270 N/A LEU 59.A N ALA 55.A O no hydrogen 2.709 N/A VAL 60.A N GLU 56.A O no hydrogen 3.001 N/A LEU 63.A N VAL 60.A O no hydrogen 2.946 N/A VAL 64.A N ALA 61.A O no hydrogen 2.913 N/A ALA 65.A N LYS 62.A O no hydrogen 3.151 N/A GLU 71.A N GLU 71.A OE1 no hydrogen 2.798 N/A VAL 72.A N GLU 69.A O no hydrogen 2.850 N/A ARG 73.A N GLU 69.A O no hydrogen 3.053 N/A ARG 73.A NE GLU 56.A OE1 no hydrogen 3.236 N/A ARG 73.A NE GLU 56.A OE2 no hydrogen 2.812 N/A ARG 73.A NH1 LYS 68.A O no hydrogen 2.762 N/A ARG 73.A NH2 GLU 56.A OE1 no hydrogen 2.827 N/A ARG 73.A NH2 GLU 56.A OE2 no hydrogen 3.555 N/A ILE 74.A N ALA 70.A O no hydrogen 3.048 N/A PHE 75.A N GLU 71.A O no hydrogen 3.084 N/A HIS 76.A N VAL 72.A O no hydrogen 2.868 N/A CYS 77.A N ARG 73.A O no hydrogen 3.096 N/A CYS 77.A SG ARG 73.A O no hydrogen 3.226 N/A CYS 78.A N ILE 74.A O no hydrogen 2.883 N/A CYS 78.A SG ILE 74.A O no hydrogen 3.128 N/A GLN 79.A N PHE 75.A O no hydrogen 3.021 N/A GLN 79.A NE2 PHE 75.A O no hydrogen 3.684 N/A GLN 79.A NE2 ALA 257.A O no hydrogen 3.180 N/A CYS 80.A N HIS 76.A O no hydrogen 2.995 N/A CYS 80.A SG HIS 76.A NE2 no hydrogen 3.604 N/A CYS 80.A SG HIS 76.A O no hydrogen 3.425 N/A THR 81.A N CYS 77.A O no hydrogen 3.036 N/A THR 81.A OG1 CYS 77.A O no hydrogen 2.995 N/A SER 82.A N CYS 78.A O no hydrogen 2.997 N/A SER 82.A OG CYS 78.A O no hydrogen 3.203 N/A VAL 83.A N GLN 79.A O no hydrogen 2.881 N/A GLU 84.A N CYS 80.A O no hydrogen 3.170 N/A THR 85.A N THR 81.A O no hydrogen 2.976 N/A THR 85.A OG1 THR 81.A O no hydrogen 2.880 N/A VAL 86.A N SER 82.A O no hydrogen 2.827 N/A THR 87.A N VAL 83.A O no hydrogen 3.075 N/A THR 87.A OG1 VAL 83.A O no hydrogen 2.966 N/A GLU 88.A N GLU 84.A O no hydrogen 2.937 N/A LEU 89.A N THR 85.A O no hydrogen 2.824 N/A THR 90.A N VAL 86.A O no hydrogen 3.069 N/A THR 90.A OG1 VAL 86.A O no hydrogen 2.775 N/A GLU 91.A N THR 87.A O no hydrogen 3.440 N/A PHE 92.A N GLU 88.A O no hydrogen 3.074 N/A ALA 93.A N LEU 89.A O no hydrogen 2.834 N/A LYS 94.A N THR 90.A O no hydrogen 3.076 N/A ALA 95.A N PHE 92.A O no hydrogen 3.003 N/A ILE 96.A N ALA 93.A O no hydrogen 3.132 N/A PHE 99.A N ILE 96.A O no hydrogen 2.879 N/A ASN 101.A N GLY 98.A O no hydrogen 3.224 N/A LEU 102.A N PHE 99.A O no hydrogen 3.042 N/A ASN 105.A N ASP 103.A OD2 no hydrogen 2.834 N/A GLN 107.A N ASP 103.A O no hydrogen 2.935 N/A GLN 107.A NE2 LEU 102.A O no hydrogen 2.721 N/A VAL 108.A N LEU 104.A O no hydrogen 3.015 N/A THR 109.A N ASN 105.A O no hydrogen 3.173 N/A THR 109.A OG1 ASN 105.A O no hydrogen 2.878 N/A LEU 110.A N ASP 106.A O no hydrogen 3.006 N/A LEU 111.A N GLN 107.A O no hydrogen 3.028 N/A LYS 112.A N VAL 108.A O no hydrogen 2.766 N/A LYS 112.A NZ ILE 265.A O no hydrogen 3.127 N/A LYS 112.A NZ ARG 267.A O no hydrogen 2.833 N/A TYR 113.A N THR 109.A O no hydrogen 3.146 N/A TYR 113.A OH MET 269.A O no hydrogen 3.181 N/A GLY 114.A N LEU 110.A O no hydrogen 2.842 N/A VAL 115.A N LEU 111.A O no hydrogen 2.862 N/A ALA 118.A N GLY 114.A O no hydrogen 3.041 N/A ILE 119.A N VAL 115.A O no hydrogen 2.710 N/A PHE 120.A N TYR 116.A O no hydrogen 3.058 N/A ALA 121.A N GLU 117.A O no hydrogen 3.100 N/A MET 122.A N ALA 118.A O no hydrogen 2.927 N/A LEU 123.A N ILE 119.A O no hydrogen 2.876 N/A SER 124.A OG PHE 120.A O no hydrogen 3.412 N/A SER 124.A OG ALA 121.A O no hydrogen 3.283 N/A SER 125.A N MET 122.A O no hydrogen 3.055 N/A SER 125.A OG MET 122.A O no hydrogen 3.444 N/A VAL 126.A N LEU 123.A O no hydrogen 2.967 N/A MET 127.A N SER 124.A O no hydrogen 3.171 N/A ASN 128.A N GLY 131.A O no hydrogen 2.910 N/A ASP 130.A N ASN 128.A OD1 no hydrogen 2.753 N/A GLY 131.A N ASN 128.A O no hydrogen 3.342 N/A GLY 131.A N ASN 128.A OD1 no hydrogen 3.034 N/A MET 132.A N ILE 141.A O no hydrogen 3.012 N/A LEU 133.A N VAL 126.A O no hydrogen 2.866 N/A VAL 134.A N GLY 139.A O no hydrogen 2.790 N/A ASN 138.A N ALA 135.A O no hydrogen 3.000 N/A GLY 139.A N VAL 134.A O no hydrogen 3.095 N/A PHE 140.A N PHE 44.A O no hydrogen 2.902 N/A ILE 141.A N MET 132.A O no hydrogen 2.938 N/A THR 142.A N ILE 46.A O no hydrogen 3.050 N/A ARG 143.A N ASP 130.A O no hydrogen 2.807 N/A ARG 143.A NE GLU 158.A OE1 no hydrogen 2.798 N/A ARG 143.A NE GLU 158.A OE2 no hydrogen 3.180 N/A ARG 143.A NH2 GLU 158.A OE2 no hydrogen 2.689 N/A PHE 145.A N THR 142.A OG1 no hydrogen 3.073 N/A LEU 146.A N THR 142.A O no hydrogen 3.225 N/A LYS 147.A N ARG 143.A O no hydrogen 2.972 N/A LYS 147.A NZ GLU 144.A OE2 no hydrogen 2.859 N/A SER 148.A N PHE 145.A O no hydrogen 3.019 N/A SER 148.A OG PHE 145.A O no hydrogen 2.587 N/A LEU 149.A N LEU 146.A O no hydrogen 3.257 N/A ARG 150.A N GLU 71.A OE2 no hydrogen 2.833 N/A ARG 150.A NE GLU 69.A OE2 no hydrogen 2.634 N/A ARG 150.A NH1 LYS 151.A O no hydrogen 3.084 N/A ARG 150.A NH1 GLU 253.A OE2 no hydrogen 2.974 N/A ARG 150.A NH2 GLU 69.A OE1 no hydrogen 3.163 N/A ARG 150.A NH2 GLU 69.A OE2 no hydrogen 3.509 N/A ARG 150.A NH2 GLU 253.A OE1 no hydrogen 2.715 N/A LYS 151.A NZ ASP 155.A OD1 no hydrogen 3.375 N/A LYS 151.A NZ ASP 155.A OD2 no hydrogen 2.956 N/A CYS 154.A N ARG 150.A O no hydrogen 3.398 N/A CYS 154.A SG ASP 155.A OD1 no hydrogen 3.582 N/A ASP 155.A N PRO 152.A O no hydrogen 2.986 N/A ILE 156.A N PHE 153.A O no hydrogen 3.285 N/A LYS 160.A N MET 157.A O no hydrogen 2.630 N/A LYS 160.A NZ ILE 156.A O no hydrogen 2.591 N/A LYS 160.A NZ HIS 242.A ND1 no hydrogen 2.964 N/A PHE 161.A N MET 157.A O no hydrogen 2.918 N/A ASP 162.A N GLU 158.A O no hydrogen 2.903 N/A PHE 163.A N PRO 159.A O no hydrogen 3.037 N/A ALA 164.A N LYS 160.A O no hydrogen 2.945 N/A MET 165.A N PHE 161.A O no hydrogen 2.882 N/A PHE 167.A N PHE 163.A O no hydrogen 2.853 N/A ASN 168.A N ALA 164.A O no hydrogen 2.726 N/A ASN 168.A ND2 SER 124.A O no hydrogen 3.350 N/A LEU 170.A N PHE 167.A O no hydrogen 3.092 N/A GLU 171.A N ASN 168.A O no hydrogen 3.040 N/A ASP 173.A N ASP 176.A OD2 no hydrogen 2.782 N/A SER 175.A OG ASP 173.A OD1 no hydrogen 2.591 N/A SER 175.A OG HIS 213.A NE2 no hydrogen 2.888 N/A ASP 176.A N ASP 173.A OD1 no hydrogen 3.038 N/A ILE 177.A N ASP 173.A O no hydrogen 3.023 N/A SER 178.A N ASP 174.A O no hydrogen 2.930 N/A SER 178.A OG ASP 174.A O no hydrogen 3.203 N/A SER 178.A OG SER 175.A O no hydrogen 2.978 N/A PHE 180.A N ASP 176.A O no hydrogen 3.116 N/A VAL 181.A N ILE 177.A O no hydrogen 2.933 N/A ALA 182.A N SER 178.A O no hydrogen 3.026 N/A ALA 183.A N LEU 179.A O no hydrogen 2.931 N/A ILE 184.A N PHE 180.A O no hydrogen 2.969 N/A ILE 185.A N VAL 181.A O no hydrogen 3.088 N/A CYS 186.A N ALA 182.A O no hydrogen 3.020 N/A CYS 186.A SG ALA 182.A O no hydrogen 3.656 N/A CYS 187.A N ILE 185.A O no hydrogen 3.122 N/A CYS 187.A SG ASP 189.A OD1 no hydrogen 2.732 N/A GLY 188.A N GLN 203.A OE1 no hydrogen 2.997 N/A ARG 190.A NH1 GLU 117.A OE2 no hydrogen 3.131 N/A ARG 190.A NH2 GLU 117.A OE1 no hydrogen 2.984 N/A ARG 190.A NH2 ILE 184.A O no hydrogen 2.994 N/A LEU 194.A N ASP 106.A OD1 no hydrogen 2.819 N/A ASN 195.A N ASP 106.A OD2 no hydrogen 2.962 N/A ILE 199.A N ASN 195.A O no hydrogen 3.362 N/A GLU 200.A N VAL 196.A O no hydrogen 2.940 N/A LYS 201.A N GLY 197.A O no hydrogen 3.368 N/A MET 202.A N HIS 198.A O no hydrogen 3.041 N/A GLN 203.A N ILE 199.A O no hydrogen 2.718 N/A GLU 204.A N GLU 200.A O no hydrogen 2.920 N/A GLY 205.A N LYS 201.A O no hydrogen 2.922 N/A ILE 206.A N MET 202.A O no hydrogen 3.074 N/A VAL 207.A N GLN 203.A O no hydrogen 2.866 N/A HIS 208.A N GLU 204.A O no hydrogen 2.983 N/A VAL 209.A N GLY 205.A O no hydrogen 3.099 N/A LEU 210.A N ILE 206.A O no hydrogen 2.866 N/A ARG 211.A N VAL 207.A O no hydrogen 2.774 N/A LEU 212.A N HIS 208.A O no hydrogen 3.061 N/A HIS 213.A N VAL 209.A O no hydrogen 2.845 N/A HIS 213.A NE2 SER 175.A OG no hydrogen 2.888 N/A LEU 214.A N LEU 210.A O no hydrogen 2.933 N/A GLN 215.A N ARG 211.A O no hydrogen 3.153 N/A SER 216.A N LEU 212.A O no hydrogen 3.034 N/A SER 216.A OG LEU 212.A O no hydrogen 3.234 N/A ASN 217.A N HIS 213.A O no hydrogen 2.749 N/A ASN 217.A ND2 ASP 173.A OD1 no hydrogen 3.536 N/A ASN 217.A ND2 ASP 173.A OD2 no hydrogen 2.924 N/A ASN 217.A ND2 ASP 176.A OD1 no hydrogen 2.748 N/A HIS 218.A N LEU 214.A O no hydrogen 2.836 N/A HIS 218.A NE2 ASP 176.A OD2 no hydrogen 2.571 N/A ASP 221.A N HIS 218.A O no hydrogen 3.162 N/A LEU 224.A N ASP 221.A O no hydrogen 3.139 N/A LYS 227.A N PHE 223.A O no hydrogen 3.154 N/A LYS 227.A NZ ASP 221.A OD1 no hydrogen 3.365 N/A LYS 227.A NZ ASP 221.A OD2 no hydrogen 2.982 N/A LEU 228.A N LEU 224.A O no hydrogen 3.027 N/A LEU 229.A N PHE 225.A O no hydrogen 2.938 N/A GLN 230.A N PRO 226.A O no hydrogen 3.010 N/A LYS 231.A N LYS 227.A O no hydrogen 2.970 N/A MET 232.A N LEU 228.A O no hydrogen 2.956 N/A ALA 233.A N LEU 229.A O no hydrogen 3.269 N/A ASP 234.A N GLN 230.A O no hydrogen 2.870 N/A LEU 235.A N LYS 231.A O no hydrogen 2.803 N/A ARG 236.A N MET 232.A O no hydrogen 3.146 N/A ARG 236.A NH1 ASP 189.A OD2 no hydrogen 3.221 N/A ARG 236.A NH2 ASP 189.A OD1 no hydrogen 2.981 N/A ARG 236.A NH2 ASP 189.A OD2 no hydrogen 3.444 N/A GLN 237.A N ALA 233.A O no hydrogen 3.275 N/A GLN 237.A NE2 GLU 241.A OE2 no hydrogen 2.504 N/A LEU 238.A N ASP 234.A O no hydrogen 2.828 N/A VAL 239.A N LEU 235.A O no hydrogen 2.882 N/A THR 240.A N ARG 236.A O no hydrogen 3.060 N/A THR 240.A OG1 ARG 236.A O no hydrogen 3.051 N/A GLU 241.A N GLN 237.A O no hydrogen 3.064 N/A HIS 242.A N LEU 238.A O no hydrogen 2.968 N/A ALA 243.A N VAL 239.A O no hydrogen 2.963 N/A GLN 244.A N THR 240.A O no hydrogen 3.070 N/A LEU 245.A N GLU 241.A O no hydrogen 3.084 N/A VAL 246.A N HIS 242.A O no hydrogen 2.802 N/A GLN 247.A N ALA 243.A O no hydrogen 2.858 N/A ILE 248.A N GLN 244.A O no hydrogen 3.167 N/A ILE 249.A N LEU 245.A O no hydrogen 3.051 N/A LYS 250.A N VAL 246.A O no hydrogen 2.936 N/A LYS 251.A N GLN 247.A O no hydrogen 2.999 N/A THR 252.A N ILE 248.A O no hydrogen 3.045 N/A THR 252.A N ILE 249.A O no hydrogen 3.178 N/A THR 252.A OG1 ILE 248.A O no hydrogen 2.813 N/A GLU 253.A N ILE 249.A O no hydrogen 2.783 N/A ALA 256.A N GLU 253.A O no hydrogen 3.381 N/A HIS 259.A N GLN 79.A OE1 no hydrogen 2.541 N/A GLN 263.A N HIS 259.A O no hydrogen 2.960 N/A GLU 264.A N PRO 260.A O no hydrogen 3.099 N/A ILE 265.A N LEU 261.A O no hydrogen 3.013 N/A TYR 266.A N LEU 262.A O no hydrogen 2.938 N/A TYR 266.A OH HIS 242.A NE2 no hydrogen 3.004 N/A ARG 267.A N GLN 263.A O no hydrogen 2.800 N/A MET 269.A N TYR 266.A O no hydrogen 2.970 N/A