Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1r1w_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N GLU 96.A OE2 no hydrogen 3.000 N/A SER 7.A N ASP 5.A OD1 no hydrogen 3.001 N/A SER 7.A OG ASP 5.A OD1 no hydrogen 2.669 N/A SER 7.A OG ASP 5.A OD2 no hydrogen 3.232 N/A ALA 8.A N ASP 5.A O no hydrogen 3.263 N/A LEU 9.A N LEU 6.A O no hydrogen 3.119 N/A GLU 12.A N ASN 10.A OD1 no hydrogen 3.171 N/A VAL 14.A N ASN 10.A O no hydrogen 3.140 N/A GLN 15.A N PRO 11.A O no hydrogen 3.053 N/A ALA 16.A N GLU 12.A O no hydrogen 2.985 N/A VAL 17.A N LEU 13.A O no hydrogen 3.021 N/A GLN 18.A N GLN 15.A O no hydrogen 3.271 N/A GLN 18.A NE2 VAL 14.A O no hydrogen 2.698 N/A VAL 20.A N VAL 17.A O no hydrogen 2.950 N/A VAL 21.A N VAL 17.A O no hydrogen 3.317 N/A VAL 21.A N GLN 18.A O no hydrogen 3.234 N/A ILE 22.A N ILE 91.A O no hydrogen 2.906 N/A SER 26.A N GLY 23.A O no hydrogen 3.051 N/A LEU 27.A N PRO 24.A O no hydrogen 3.398 N/A ILE 28.A N THR 47.A O no hydrogen 2.906 N/A HIS 30.A N HIS 45.A O no hydrogen 2.996 N/A GLU 33.A N HIS 30.A O no hydrogen 2.991 N/A ILE 35.A N VAL 43.A O no hydrogen 2.693 N/A GLY 36.A N VAL 43.A O no hydrogen 3.131 N/A GLY 38.A N GLY 41.A O no hydrogen 3.056 N/A GLY 41.A N GLY 38.A O no hydrogen 3.178 N/A CYS 42.A N SER 57.A O no hydrogen 3.060 N/A CYS 42.A SG GLY 36.A O no hydrogen 3.651 N/A VAL 43.A N GLY 36.A O no hydrogen 2.635 N/A TYR 44.A N VAL 55.A O no hydrogen 2.830 N/A HIS 45.A N GLU 33.A O no hydrogen 3.022 N/A HIS 45.A ND1 HIS 52.A NE2 no hydrogen 2.902 N/A GLY 46.A N CYS 53.A O no hydrogen 2.848 N/A THR 47.A N ILE 28.A O no hydrogen 2.891 N/A LEU 48.A N ILE 51.A O no hydrogen 2.946 N/A LEU 49.A N SER 26.A O no hydrogen 2.912 N/A ILE 51.A N LEU 48.A O no hydrogen 2.793 N/A HIS 52.A NE2 HIS 45.A ND1 no hydrogen 2.902 N/A CYS 53.A N GLY 46.A O no hydrogen 3.099 N/A ALA 54.A N LEU 103.A O no hydrogen 2.767 N/A VAL 55.A N TYR 44.A O no hydrogen 2.770 N/A LYS 56.A N VAL 101.A O no hydrogen 2.860 N/A LYS 56.A NZ ARG 173.A O no hydrogen 2.877 N/A SER 57.A N CYS 42.A O no hydrogen 2.664 N/A LEU 58.A N PRO 99.A O no hydrogen 3.186 N/A ARG 60.A NH1 VAL 2.A O no hydrogen 2.935 N/A ARG 60.A NH1 GLU 96.A O no hydrogen 2.879 N/A ARG 60.A NH2 VAL 2.A O no hydrogen 2.866 N/A ILE 61.A N GLY 97.A O no hydrogen 2.893 N/A GLU 66.A N ASP 63.A OD1 no hydrogen 3.169 N/A VAL 67.A N ASP 63.A O no hydrogen 2.953 N/A SER 68.A N ILE 64.A O no hydrogen 2.867 N/A SER 68.A OG ILE 64.A O no hydrogen 2.708 N/A GLN 69.A N GLY 65.A O no hydrogen 3.000 N/A PHE 70.A N GLU 66.A O no hydrogen 3.101 N/A LEU 71.A N VAL 67.A O no hydrogen 2.980 N/A THR 72.A N SER 68.A O no hydrogen 2.998 N/A THR 72.A OG1 SER 68.A O no hydrogen 2.816 N/A GLU 73.A N GLN 69.A O no hydrogen 2.980 N/A GLY 74.A N PHE 70.A O no hydrogen 3.074 N/A ILE 75.A N LEU 71.A O no hydrogen 3.041 N/A ILE 76.A N THR 72.A O no hydrogen 3.111 N/A MET 77.A N GLU 73.A O no hydrogen 2.827 N/A LYS 78.A N GLY 74.A O no hydrogen 3.010 N/A ASP 79.A N ILE 76.A O no hydrogen 3.170 N/A PHE 80.A N MET 77.A O no hydrogen 3.000 N/A ASN 84.A N HIS 82.A ND1 no hydrogen 2.886 N/A ASN 84.A ND2 VAL 164.A O no hydrogen 3.096 N/A VAL 85.A N HIS 82.A O no hydrogen 3.109 N/A LEU 86.A N VAL 166.A O no hydrogen 2.898 N/A LEU 89.A N VAL 102.A O no hydrogen 2.944 N/A GLY 90.A N VAL 102.A O no hydrogen 3.443 N/A ILE 91.A N VAL 20.A O no hydrogen 2.935 N/A CYS 92.A N LEU 100.A O no hydrogen 3.002 N/A CYS 92.A SG ILE 22.A O no hydrogen 3.446 N/A ARG 94.A N SER 98.A O no hydrogen 3.005 N/A GLY 97.A N ARG 94.A O no hydrogen 3.182 N/A SER 98.A N ARG 94.A O no hydrogen 3.392 N/A SER 98.A OG SER 95.A O no hydrogen 3.284 N/A LEU 100.A N CYS 92.A O no hydrogen 2.832 N/A VAL 101.A N LYS 56.A O no hydrogen 2.885 N/A VAL 102.A N GLY 90.A O no hydrogen 2.901 N/A LEU 103.A N ALA 54.A O no hydrogen 2.913 N/A TYR 105.A N HIS 52.A O no hydrogen 3.354 N/A HIS 108.A N LEU 158.A O no hydrogen 3.010 N/A HIS 108.A ND1 ASP 159.A O no hydrogen 3.145 N/A GLY 109.A N MET 106.A O no hydrogen 3.102 N/A LEU 111.A N CYS 156.A O no hydrogen 2.834 N/A ARG 112.A NH2 GLY 212.A O no hydrogen 2.928 N/A ASN 113.A N ASP 110.A OD2 no hydrogen 2.875 N/A PHE 114.A N ASP 110.A O no hydrogen 3.064 N/A ILE 115.A N LEU 111.A O no hydrogen 3.022 N/A ARG 116.A N ARG 112.A O no hydrogen 3.077 N/A ARG 116.A NH1 GLY 212.A O no hydrogen 2.989 N/A ASN 117.A N ASN 113.A O no hydrogen 3.136 N/A GLU 118.A N GLU 118.A OE1 no hydrogen 2.770 N/A THR 119.A N ASN 117.A OD1 no hydrogen 2.861 N/A THR 119.A OG1 ASN 117.A OD1 no hydrogen 2.609 N/A HIS 120.A N ASN 117.A O no hydrogen 2.976 N/A HIS 120.A ND1 PHE 114.A O no hydrogen 3.015 N/A THR 123.A N ASP 126.A OD2 no hydrogen 3.262 N/A VAL 124.A N HIS 275.A O no hydrogen 2.831 N/A LYS 125.A NZ PHE 268.A O no hydrogen 2.795 N/A LYS 125.A NZ PHE 271.A O no hydrogen 2.898 N/A ASP 126.A N THR 123.A OG1 no hydrogen 3.165 N/A LEU 127.A N THR 123.A O no hydrogen 3.111 N/A ILE 128.A N VAL 124.A O no hydrogen 2.942 N/A GLY 129.A N LYS 125.A O no hydrogen 2.892 N/A PHE 130.A N ASP 126.A O no hydrogen 2.960 N/A GLY 131.A N LEU 127.A O no hydrogen 3.154 N/A LEU 132.A N ILE 128.A O no hydrogen 2.833 N/A GLN 133.A N GLY 129.A O no hydrogen 3.021 N/A GLN 133.A NE2 PHE 162.A O no hydrogen 3.426 N/A VAL 134.A N PHE 130.A O no hydrogen 3.031 N/A ALA 135.A N GLY 131.A O no hydrogen 2.934 N/A LYS 136.A N LEU 132.A O no hydrogen 2.924 N/A GLY 137.A N GLN 133.A O no hydrogen 3.000 N/A MET 138.A N VAL 134.A O no hydrogen 2.846 N/A LYS 139.A N ALA 135.A O no hydrogen 2.818 N/A PHE 140.A N LYS 136.A O no hydrogen 3.129 N/A LEU 141.A N GLY 137.A O no hydrogen 2.972 N/A ALA 142.A N MET 138.A O no hydrogen 2.828 N/A SER 143.A N LYS 139.A O no hydrogen 3.021 N/A SER 143.A OG PHE 140.A O no hydrogen 2.600 N/A LYS 144.A N PHE 140.A O no hydrogen 3.223 N/A LYS 144.A N LEU 141.A O no hydrogen 2.934 N/A LYS 145.A N ALA 142.A O no hydrogen 2.986 N/A PHE 146.A N LEU 141.A O no hydrogen 3.044 N/A HIS 148.A N ASP 197.A OD2 no hydrogen 2.821 N/A HIS 148.A NE2 ALA 167.A O no hydrogen 2.785 N/A ARG 149.A N ASP 197.A OD1 no hydrogen 3.100 N/A ASP 150.A N HIS 148.A ND1 no hydrogen 3.081 N/A ALA 153.A N GLU 207.A OE2 no hydrogen 2.939 N/A ARG 154.A NH1 ARG 154.A O no hydrogen 2.913 N/A ASN 155.A N ALA 152.A O no hydrogen 2.953 N/A ASN 155.A ND2 ASP 150.A O no hydrogen 2.705 N/A CYS 156.A N ALA 153.A O no hydrogen 3.187 N/A CYS 156.A SG ALA 152.A O no hydrogen 3.665 N/A MET 157.A N LYS 165.A O no hydrogen 2.808 N/A LEU 158.A N GLY 109.A O no hydrogen 2.919 N/A ASP 159.A N THR 163.A O no hydrogen 3.074 N/A GLU 160.A N GLU 160.A OE2 no hydrogen 2.810 N/A LYS 161.A N ASP 159.A OD1 no hydrogen 2.883 N/A LYS 161.A NZ GLU 160.A OE1 no hydrogen 3.235 N/A PHE 162.A N ASP 159.A O no hydrogen 2.906 N/A THR 163.A N ASP 159.A OD1 no hydrogen 3.021 N/A VAL 164.A N GLN 133.A OE1 no hydrogen 2.786 N/A LYS 165.A N MET 157.A O no hydrogen 2.778 N/A LYS 165.A NZ PRO 83.A O no hydrogen 2.721 N/A VAL 166.A N ASN 84.A O no hydrogen 2.890 N/A ALA 167.A N ASN 155.A O no hydrogen 2.886 N/A ALA 172.A N PHE 169.A O no hydrogen 2.858 N/A ARG 173.A N GLY 170.A O no hydrogen 3.213 N/A ARG 173.A NH1 GLU 73.A OE1 no hydrogen 3.012 N/A ARG 173.A NH2 GLU 73.A OE2 no hydrogen 2.632 N/A TYR 176.A OH ASN 155.A OD1 no hydrogen 2.551 N/A VAL 179.A N LEU 177.A O no hydrogen 2.877 N/A LYS 180.A NZ PRO 215.A O no hydrogen 2.820 N/A TRP 181.A N PRO 178.A O no hydrogen 2.994 N/A TRP 181.A NE1 GLU 207.A OE2 no hydrogen 2.954 N/A MET 182.A N VAL 179.A O no hydrogen 3.238 N/A GLU 185.A N GLU 185.A OE1 no hydrogen 2.874 N/A SER 186.A OG LYS 191.A O no hydrogen 2.814 N/A LEU 187.A N ALA 183.A O no hydrogen 3.026 N/A GLN 188.A N LEU 184.A O no hydrogen 3.107 N/A THR 189.A N GLU 185.A O no hydrogen 2.856 N/A THR 189.A OG1 GLU 185.A O no hydrogen 2.782 N/A GLN 190.A N SER 186.A O no hydrogen 2.822 N/A LYS 191.A N THR 189.A OG1 no hydrogen 3.349 N/A THR 193.A N SER 196.A OG no hydrogen 2.848 N/A LYS 195.A NZ ARG 254.A O no hydrogen 2.818 N/A SER 196.A N THR 193.A O no hydrogen 3.033 N/A SER 196.A N THR 193.A OG1 no hydrogen 3.142 N/A SER 196.A OG THR 193.A O no hydrogen 2.968 N/A ASP 197.A N THR 193.A O no hydrogen 3.027 N/A VAL 198.A N THR 194.A O no hydrogen 2.969 N/A TRP 199.A N LYS 195.A O no hydrogen 3.288 N/A SER 200.A N SER 196.A O no hydrogen 3.095 N/A SER 200.A OG TRP 181.A O no hydrogen 2.626 N/A SER 200.A OG SER 196.A O no hydrogen 3.316 N/A PHE 201.A N ASP 197.A O no hydrogen 2.809 N/A GLY 202.A N VAL 198.A O no hydrogen 3.018 N/A VAL 203.A N TRP 199.A O no hydrogen 3.226 N/A LEU 204.A N SER 200.A O no hydrogen 2.857 N/A LEU 205.A N PHE 201.A O no hydrogen 2.886 N/A TRP 206.A N GLY 202.A O no hydrogen 3.113 N/A TRP 206.A NE1 LEU 230.A O no hydrogen 2.801 N/A GLU 207.A N VAL 203.A O no hydrogen 2.824 N/A LEU 208.A N LEU 204.A O no hydrogen 2.891 N/A MET 209.A N LEU 205.A O no hydrogen 3.062 N/A THR 210.A N TRP 206.A O no hydrogen 3.080 N/A THR 210.A OG1 TRP 206.A O no hydrogen 2.990 N/A THR 210.A OG1 GLU 207.A O no hydrogen 3.200 N/A ARG 211.A N LEU 208.A O no hydrogen 3.091 N/A ARG 211.A NE ILE 115.A O no hydrogen 2.860 N/A ARG 211.A NH1 HIS 120.A O no hydrogen 3.537 N/A ARG 211.A NH1 VAL 277.A O no hydrogen 2.956 N/A ARG 211.A NH2 ILE 115.A O no hydrogen 3.136 N/A ARG 211.A NH2 HIS 120.A O no hydrogen 2.880 N/A GLY 212.A N GLU 207.A O no hydrogen 2.780 N/A ALA 213.A N THR 210.A OG1 no hydrogen 3.170 N/A TYR 222.A N ASP 218.A O no hydrogen 3.214 N/A LEU 223.A N ILE 219.A O no hydrogen 2.924 N/A LEU 224.A N THR 220.A O no hydrogen 3.017 N/A GLN 225.A N VAL 221.A O no hydrogen 3.181 N/A GLN 225.A N TYR 222.A O no hydrogen 3.227 N/A GLY 226.A N LEU 223.A O no hydrogen 2.981 N/A ARG 227.A N LEU 223.A O no hydrogen 3.283 N/A ARG 227.A NE GLN 225.A OE1 no hydrogen 2.771 N/A ARG 227.A NH2 GLN 225.A OE1 no hydrogen 3.092 N/A ARG 228.A NE TRP 247.A O no hydrogen 3.305 N/A ARG 228.A NH1 ARG 227.A O no hydrogen 2.891 N/A ARG 228.A NH2 TRP 247.A O no hydrogen 2.899 N/A CYS 235.A N PRO 232.A O no hydrogen 3.032 N/A CYS 235.A SG PRO 236.A O no hydrogen 3.436 N/A TYR 240.A N PRO 236.A O no hydrogen 3.045 N/A TYR 240.A OH LEU 229.A O no hydrogen 2.610 N/A GLU 241.A N ASP 237.A O no hydrogen 2.985 N/A VAL 242.A N PRO 238.A O no hydrogen 3.135 N/A MET 243.A N LEU 239.A O no hydrogen 3.017 N/A LEU 244.A N TYR 240.A O no hydrogen 2.978 N/A LYS 245.A N GLU 241.A O no hydrogen 3.085 N/A CYS 246.A N VAL 242.A O no hydrogen 2.946 N/A CYS 246.A SG VAL 242.A O no hydrogen 3.427 N/A TRP 247.A N MET 243.A O no hydrogen 3.089 N/A TRP 247.A N LEU 244.A O no hydrogen 3.181 N/A TRP 247.A NE1 TRP 199.A O no hydrogen 3.180 N/A HIS 248.A N LYS 245.A O no hydrogen 3.186 N/A LYS 250.A N HIS 248.A ND1 no hydrogen 2.966 N/A MET 253.A N LYS 250.A O no hydrogen 2.952 N/A ARG 254.A N ALA 251.A O no hydrogen 3.142 N/A ARG 254.A NE HIS 248.A O no hydrogen 2.894 N/A ARG 254.A NH1 GLU 185.A OE2 no hydrogen 2.820 N/A ARG 254.A NH1 LYS 195.A O no hydrogen 3.048 N/A ARG 254.A NH2 GLU 185.A OE1 no hydrogen 2.880 N/A ARG 254.A NH2 HIS 248.A O no hydrogen 2.966 N/A GLU 259.A N SER 256.A OG no hydrogen 3.032 N/A LEU 260.A N SER 256.A O no hydrogen 2.889 N/A VAL 261.A N PHE 257.A O no hydrogen 2.900 N/A SER 262.A N SER 258.A O no hydrogen 3.122 N/A ARG 263.A N GLU 259.A O no hydrogen 2.886 N/A ARG 263.A NE GLU 259.A OE1 no hydrogen 2.768 N/A ARG 263.A NH2 GLU 259.A OE1 no hydrogen 3.271 N/A ILE 264.A N LEU 260.A O no hydrogen 2.896 N/A SER 265.A N VAL 261.A O no hydrogen 2.930 N/A SER 265.A OG VAL 261.A O no hydrogen 3.256 N/A SER 265.A OG SER 262.A O no hydrogen 2.654 N/A ALA 266.A N SER 262.A O no hydrogen 3.238 N/A ILE 267.A N ARG 263.A O no hydrogen 3.143 N/A PHE 268.A N ILE 264.A O no hydrogen 2.795 N/A SER 269.A N SER 265.A O no hydrogen 3.060 N/A SER 269.A OG ALA 266.A O no hydrogen 2.700 N/A THR 270.A N ILE 267.A O no hydrogen 3.109 N/A THR 270.A OG1 ILE 267.A O no hydrogen 2.823 N/A PHE 271.A N PHE 268.A O no hydrogen 3.185 N/A VAL 277.A N PRO 122.A O no hydrogen 3.108 N/A THR 282.A N ASN 280.A OD1 no hydrogen 2.837 N/A THR 282.A OG1 ASN 280.A OD1 no hydrogen 2.798 N/A TYR 283.A N ASN 280.A O no hydrogen 2.911 N/A VAL 284.A N ASN 280.A O no hydrogen 3.171 N/A VAL 286.A N TYR 283.A O no hydrogen 3.067 N/A