Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3m6m_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N ASP 32.A OD2 no hydrogen 3.422 N/A THR 2.A N ASP 32.A OD2 no hydrogen 3.390 N/A THR 2.A OG1 ASP 32.A OD2 no hydrogen 2.625 N/A ARG 4.A N HIS 17.A O no hydrogen 2.973 N/A ILE 6.A N TRP 15.A O no hydrogen 3.077 N/A GLU 8.A N VAL 13.A O no hydrogen 2.888 N/A ARG 11.A N GLU 8.A O no hydrogen 3.145 N/A ARG 11.A NE GLU 8.A OE1 no hydrogen 3.096 N/A ARG 11.A NH1 GLU 201.A OE1 no hydrogen 3.035 N/A ARG 11.A NH2 GLU 8.A OE1 no hydrogen 3.070 N/A ARG 11.A NH2 GLU 8.A OE2 no hydrogen 2.909 N/A ARG 11.A NH2 GLU 201.A OE1 no hydrogen 3.235 N/A VAL 13.A N GLU 8.A O no hydrogen 3.300 N/A TYR 14.A N HIS 53.A O no hydrogen 2.776 N/A TYR 14.A OH ASP 12.A OD1 no hydrogen 2.771 N/A TRP 15.A N ILE 6.A O no hydrogen 2.821 N/A TRP 15.A NE1 GLU 8.A OE2 no hydrogen 3.062 N/A ILE 16.A N VAL 55.A O no hydrogen 2.703 N/A HIS 17.A N ARG 4.A O no hydrogen 3.107 N/A HIS 17.A ND1 ARG 4.A O no hydrogen 3.265 N/A MET 18.A N ALA 57.A O no hydrogen 2.816 N/A ALA 20.A N THR 2.A O no hydrogen 2.935 N/A CYS 24.A SG ARG 22.A O no hydrogen 4.004 N/A PHE 25.A N GLY 66.A O no hydrogen 2.628 N/A SER 26.A N CYS 24.A O no hydrogen 2.986 N/A ARG 28.A NH2 ASP 21.A OD2 no hydrogen 3.220 N/A LEU 29.A N SER 26.A OG no hydrogen 3.322 N/A VAL 30.A N SER 26.A O no hydrogen 2.960 N/A ASP 31.A N THR 27.A O no hydrogen 2.981 N/A ASP 32.A N ARG 28.A O no hydrogen 2.986 N/A ILE 33.A N LEU 29.A O no hydrogen 2.999 N/A THR 34.A N VAL 30.A O no hydrogen 2.974 N/A THR 34.A OG1 VAL 30.A O no hydrogen 3.147 N/A THR 34.A OG1 ASP 31.A O no hydrogen 3.175 N/A GLY 35.A N ASP 31.A O no hydrogen 2.893 N/A TYR 36.A N ASP 32.A O no hydrogen 3.024 N/A TYR 36.A OH GLU 7.A OE2 no hydrogen 2.704 N/A GLN 37.A N ILE 33.A O no hydrogen 2.797 N/A GLN 37.A NE2 GLY 94.A O no hydrogen 2.784 N/A THR 38.A N THR 34.A O no hydrogen 2.986 N/A THR 38.A OG1 THR 34.A O no hydrogen 2.871 N/A ASN 39.A N GLY 35.A O no hydrogen 3.121 N/A LEU 40.A N TYR 36.A O no hydrogen 2.762 N/A GLY 41.A N GLN 37.A O no hydrogen 2.912 N/A GLN 42.A N THR 38.A O no hydrogen 3.131 N/A ARG 43.A N ASN 39.A O no hydrogen 3.175 N/A ARG 43.A NE ASN 39.A OD1 no hydrogen 3.065 N/A ARG 43.A NH1 GLU 7.A OE1 no hydrogen 3.176 N/A ARG 43.A NH2 GLU 7.A OE2 no hydrogen 2.949 N/A ARG 43.A NH2 ASN 39.A OD1 no hydrogen 3.022 N/A LEU 44.A N LEU 40.A O no hydrogen 2.916 N/A ASN 45.A N GLY 41.A O no hydrogen 2.998 N/A ASN 45.A ND2 GLY 103.A O no hydrogen 3.275 N/A THR 46.A N GLN 42.A O no hydrogen 3.116 N/A THR 46.A OG1 GLN 42.A O no hydrogen 2.937 N/A THR 46.A OG1 ARG 43.A O no hydrogen 3.252 N/A ALA 47.A N ARG 43.A O no hydrogen 3.176 N/A GLY 48.A N ASN 45.A O no hydrogen 3.093 N/A VAL 49.A N LEU 44.A O no hydrogen 2.980 N/A HIS 53.A N ASP 12.A O no hydrogen 2.926 N/A HIS 53.A NE2 SER 207.A OG no hydrogen 2.639 N/A VAL 54.A N HIS 107.A O no hydrogen 2.902 N/A VAL 55.A N TYR 14.A O no hydrogen 2.781 N/A LEU 56.A N ILE 109.A O no hydrogen 2.793 N/A ALA 57.A N ILE 16.A O no hydrogen 2.670 N/A SER 58.A OG VAL 62.A O no hydrogen 2.704 N/A SER 58.A OG PHE 63.A O no hydrogen 3.323 N/A ASP 59.A N MET 18.A O no hydrogen 2.929 N/A SER 60.A N SER 58.A OG no hydrogen 3.120 N/A SER 60.A OG ASP 61.A OD1 no hydrogen 3.271 N/A PHE 63.A N ASN 115.A O no hydrogen 2.841 N/A ASN 64.A N ASN 115.A O no hydrogen 3.230 N/A LEU 65.A N ALA 23.A O no hydrogen 2.867 N/A GLY 66.A N ASN 64.A OD1 no hydrogen 2.770 N/A ASP 68.A N TYR 87.A OH no hydrogen 3.176 N/A LEU 71.A N ASP 68.A OD1 no hydrogen 3.360 N/A PHE 72.A N ASP 68.A O no hydrogen 2.955 N/A CYS 73.A N LEU 69.A O no hydrogen 2.799 N/A CYS 73.A SG LEU 69.A O no hydrogen 3.334 N/A CYS 73.A SG LEU 251.A O no hydrogen 3.850 N/A CYS 73.A SG ASP 255.A OD1 no hydrogen 3.329 N/A GLN 74.A N ALA 70.A O no hydrogen 3.329 N/A LEU 75.A N LEU 71.A O no hydrogen 3.063 N/A ILE 76.A N PHE 72.A O no hydrogen 2.948 N/A ARG 77.A N CYS 73.A O no hydrogen 3.104 N/A ARG 77.A NH2 ASP 255.A OD2 no hydrogen 3.018 N/A GLU 78.A N GLN 74.A O no hydrogen 3.003 N/A GLY 79.A N ILE 76.A O no hydrogen 3.243 N/A ASP 80.A N LEU 75.A O no hydrogen 2.899 N/A ARG 81.A N GLY 79.A O no hydrogen 3.099 N/A ARG 81.A NE ASP 241.A OD1 no hydrogen 2.798 N/A ARG 81.A NH2 GLU 237.A OE1 no hydrogen 2.919 N/A ARG 81.A NH2 ASP 241.A OD1 no hydrogen 3.055 N/A ARG 83.A N ASP 80.A OD1 no hydrogen 3.133 N/A LEU 84.A N ASP 80.A O no hydrogen 3.383 N/A LEU 85.A N ARG 81.A O no hydrogen 2.865 N/A ASP 86.A N ALA 82.A O no hydrogen 3.098 N/A TYR 87.A N ARG 83.A O no hydrogen 3.026 N/A TYR 87.A OH PHE 25.A O no hydrogen 2.610 N/A ALA 88.A N LEU 84.A O no hydrogen 2.986 N/A GLN 89.A N LEU 85.A O no hydrogen 2.817 N/A ARG 90.A N ASP 86.A O no hydrogen 3.140 N/A CYS 91.A N TYR 87.A O no hydrogen 3.039 N/A CYS 91.A SG TYR 87.A O no hydrogen 3.369 N/A VAL 92.A N ALA 88.A O no hydrogen 3.086 N/A ARG 93.A N GLN 89.A O no hydrogen 3.080 N/A GLY 94.A N ARG 90.A O no hydrogen 3.212 N/A VAL 95.A N CYS 91.A O no hydrogen 3.187 N/A HIS 96.A N VAL 92.A O no hydrogen 2.826 N/A HIS 96.A NE2 VAL 227.A O no hydrogen 2.786 N/A ALA 97.A N ARG 93.A O no hydrogen 3.082 N/A HIS 99.A N VAL 95.A O no hydrogen 3.245 N/A VAL 100.A N HIS 96.A O no hydrogen 2.983 N/A GLY 101.A N PHE 98.A O no hydrogen 3.332 N/A LEU 102.A N ALA 97.A O no hydrogen 2.589 N/A ALA 104.A N GLY 101.A O no hydrogen 2.939 N/A ALA 106.A N GLY 101.A O no hydrogen 3.067 N/A HIS 107.A N PRO 52.A O no hydrogen 2.770 N/A HIS 107.A NE2 THR 129.A OG1 no hydrogen 2.781 N/A SER 108.A N HIS 128.A ND1 no hydrogen 3.016 N/A SER 108.A OG PHE 98.A O no hydrogen 2.839 N/A ILE 109.A N VAL 54.A O no hydrogen 2.820 N/A ALA 110.A N THR 129.A O no hydrogen 2.743 N/A LEU 111.A N LEU 56.A O no hydrogen 2.853 N/A VAL 112.A N ILE 131.A O no hydrogen 2.789 N/A GLN 113.A NE2 GLU 133.A OE2 no hydrogen 2.971 N/A ALA 116.A N MET 137.A O no hydrogen 3.022 N/A LEU 117.A N ASN 64.A O no hydrogen 2.898 N/A GLY 118.A N GLY 139.A O no hydrogen 2.837 N/A GLY 120.A N LEU 117.A O no hydrogen 2.902 N/A GLU 122.A N GLY 118.A O no hydrogen 2.920 N/A ALA 123.A N GLY 119.A O no hydrogen 2.845 N/A ALA 124.A N GLY 120.A O no hydrogen 3.277 N/A LEU 125.A N PHE 121.A O no hydrogen 2.990 N/A SER 126.A OG ALA 123.A O no hydrogen 2.618 N/A CYS 127.A N ALA 124.A O no hydrogen 3.209 N/A CYS 127.A SG ALA 123.A O no hydrogen 3.783 N/A HIS 128.A N SER 108.A O no hydrogen 2.887 N/A HIS 128.A NE2 HIS 99.A O no hydrogen 2.896 N/A THR 129.A N SER 108.A O no hydrogen 3.149 N/A THR 129.A OG1 HIS 107.A NE2 no hydrogen 2.781 N/A ILE 130.A N ASP 188.A OD2 no hydrogen 2.910 N/A ILE 131.A N ALA 110.A O no hydrogen 2.813 N/A ALA 132.A N ARG 189.A O no hydrogen 2.851 N/A GLU 133.A N VAL 112.A O no hydrogen 3.137 N/A GLU 134.A N VAL 191.A O no hydrogen 2.841 N/A VAL 136.A N GLU 133.A O no hydrogen 3.311 N/A MET 137.A N ASN 115.A OD1 no hydrogen 2.838 N/A MET 138.A N TYR 176.A O no hydrogen 2.848 N/A GLY 139.A N ALA 116.A O no hydrogen 3.292 N/A LEU 144.A N PRO 141.A O no hydrogen 2.954 N/A PHE 145.A N GLU 142.A O no hydrogen 3.290 N/A ASP 146.A N VAL 143.A O no hydrogen 2.848 N/A LEU 147.A N GLU 142.A O no hydrogen 2.834 N/A ALA 153.A N GLU 122.A OE2 no hydrogen 2.908 N/A PHE 156.A N GLY 152.A O no hydrogen 2.827 N/A MET 157.A N ALA 153.A O no hydrogen 2.948 N/A CYS 158.A N TYR 154.A O no hydrogen 3.130 N/A CYS 158.A SG TYR 154.A O no hydrogen 3.213 N/A GLN 159.A N PHE 156.A O no hydrogen 3.259 N/A GLN 159.A NE2 THR 225.A O no hydrogen 2.674 N/A ARG 160.A N MET 157.A O no hydrogen 2.782 N/A ARG 160.A NH1 GLY 185.A O no hydrogen 3.018 N/A ARG 160.A NH1 ASP 188.A OD1 no hydrogen 3.086 N/A ARG 160.A NH2 ASP 188.A OD2 no hydrogen 2.868 N/A ILE 161.A N MET 157.A O no hydrogen 2.789 N/A LEU 165.A N SER 162.A OG no hydrogen 3.167 N/A ALA 166.A N SER 162.A O no hydrogen 3.016 N/A GLN 167.A N ALA 163.A O no hydrogen 3.104 N/A LYS 168.A N HIS 164.A O no hydrogen 3.145 N/A ILE 169.A N LEU 165.A O no hydrogen 3.051 N/A MET 170.A N ALA 166.A O no hydrogen 3.127 N/A LEU 171.A N GLN 167.A O no hydrogen 3.145 N/A LEU 171.A N LYS 168.A O no hydrogen 3.074 N/A GLU 172.A N LYS 168.A O no hydrogen 2.908 N/A TYR 176.A N MET 138.A O no hydrogen 2.754 N/A SER 177.A N GLN 180.A OE1 no hydrogen 3.024 N/A GLN 180.A N SER 177.A OG no hydrogen 3.381 N/A LEU 181.A N SER 177.A O no hydrogen 3.012 N/A LEU 182.A N ALA 178.A O no hydrogen 2.950 N/A GLY 183.A N GLU 179.A O no hydrogen 3.254 N/A MET 184.A N GLN 180.A O no hydrogen 3.036 N/A GLY 185.A N LEU 182.A O no hydrogen 3.101 N/A LEU 186.A N LEU 181.A O no hydrogen 2.860 N/A ASP 188.A N ILE 130.A O no hydrogen 3.147 N/A ARG 189.A N ILE 130.A O no hydrogen 3.258 N/A VAL 191.A N ALA 132.A O no hydrogen 2.942 N/A GLY 194.A N GLU 133.A OE1 no hydrogen 2.821 N/A GLN 195.A N PRO 192.A O no hydrogen 3.148 N/A GLY 196.A N GLU 133.A OE2 no hydrogen 2.990 N/A ALA 199.A N GLN 195.A O no hydrogen 3.139 N/A VAL 200.A N GLY 196.A O no hydrogen 2.913 N/A GLU 201.A N VAL 197.A O no hydrogen 2.926 N/A GLN 202.A N ALA 198.A O no hydrogen 3.067 N/A VAL 203.A N ALA 199.A O no hydrogen 3.169 N/A ILE 204.A N VAL 200.A O no hydrogen 2.852 N/A ARG 205.A N GLU 201.A O no hydrogen 2.898 N/A GLU 206.A N GLN 202.A O no hydrogen 3.007 N/A SER 207.A N VAL 203.A O no hydrogen 3.085 N/A SER 207.A OG HIS 53.A NE2 no hydrogen 2.639 N/A SER 207.A OG HIS 107.A ND1 no hydrogen 3.246 N/A SER 207.A OG VAL 203.A O no hydrogen 3.046 N/A SER 207.A OG ILE 204.A O no hydrogen 3.480 N/A LYS 208.A N ILE 204.A O no hydrogen 2.834 N/A LYS 208.A NZ ARG 11.A O no hydrogen 2.782 N/A THR 210.A N SER 207.A O no hydrogen 3.321 N/A TRP 214.A N THR 210.A O no hydrogen 3.103 N/A ALA 215.A N PRO 211.A O no hydrogen 3.063 N/A ALA 216.A N HIS 212.A O no hydrogen 3.021 N/A MET 217.A N ALA 213.A O no hydrogen 3.101 N/A GLN 218.A N TRP 214.A O no hydrogen 3.099 N/A GLN 219.A N ALA 215.A O no hydrogen 3.277 N/A VAL 220.A N ALA 216.A O no hydrogen 3.056 N/A ARG 221.A N MET 217.A O no hydrogen 2.893 N/A ARG 221.A NH1 HIS 99.A O no hydrogen 3.197 N/A ARG 221.A NH2 HIS 99.A O no hydrogen 3.140 N/A GLU 222.A N GLN 218.A O no hydrogen 2.845 N/A MET 223.A N GLN 219.A O no hydrogen 3.304 N/A THR 224.A N ARG 221.A O no hydrogen 3.006 N/A THR 224.A OG1 VAL 220.A O no hydrogen 2.610 N/A ALA 226.A N ARG 221.A O no hydrogen 2.958 N/A VAL 227.A N HIS 99.A NE2 no hydrogen 3.082 N/A MET 232.A N PRO 228.A O no hydrogen 3.439 N/A MET 233.A N LEU 229.A O no hydrogen 2.925 N/A ARG 234.A N GLU 230.A O no hydrogen 3.026 N/A ARG 234.A NH2 GLU 230.A OE1 no hydrogen 2.706 N/A ILE 235.A N GLU 231.A O no hydrogen 3.151 N/A THR 236.A N MET 232.A O no hydrogen 3.085 N/A THR 236.A OG1 MET 232.A O no hydrogen 3.107 N/A THR 236.A OG1 MET 233.A O no hydrogen 2.933 N/A GLU 237.A N MET 233.A O no hydrogen 3.169 N/A ILE 238.A N ARG 234.A O no hydrogen 3.400 N/A TRP 239.A N ILE 235.A O no hydrogen 2.982 N/A VAL 240.A N THR 236.A O no hydrogen 2.812 N/A ASP 241.A N GLU 237.A O no hydrogen 3.220 N/A THR 242.A N ILE 238.A O no hydrogen 3.015 N/A THR 242.A OG1 ILE 238.A O no hydrogen 2.742 N/A ALA 243.A N TRP 239.A O no hydrogen 2.959 N/A MET 244.A N VAL 240.A O no hydrogen 2.978 N/A GLN 245.A N THR 242.A O no hydrogen 3.026 N/A LEU 246.A N ALA 243.A O no hydrogen 3.282 N/A SER 250.A OG PHE 145.A O no hydrogen 3.216 N/A LEU 251.A N GLY 247.A O no hydrogen 3.155 N/A ARG 252.A N GLU 248.A O no hydrogen 2.957 N/A THR 253.A N LYS 249.A O no hydrogen 3.150 N/A THR 253.A OG1 LYS 249.A O no hydrogen 3.064 N/A MET 254.A N SER 250.A O no hydrogen 2.993 N/A ASP 255.A N LEU 251.A O no hydrogen 2.991 N/A ARG 256.A N ARG 252.A O no hydrogen 3.020 N/A LEU 257.A N THR 253.A O no hydrogen 3.114 N/A VAL 258.A N MET 254.A O no hydrogen 2.947 N/A ARG 259.A N ASP 255.A O no hydrogen 3.175 N/A ALA 260.A N ARG 256.A O no hydrogen 3.131 N/A GLN 261.A N LEU 257.A O no hydrogen 2.986 N/A