Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4s3m_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A N ASP 62.A OD2 no hydrogen 3.249 N/A SER 2.A OG ASP 62.A OD2 no hydrogen 3.537 N/A ALA 4.A N VAL 63.A O no hydrogen 2.853 N/A ILE 5.A N THR 27.A O no hydrogen 2.830 N/A GLY 7.A N ILE 29.A O no hydrogen 3.114 N/A GLY 9.A N GLY 7.A O no hydrogen 2.824 N/A THR 13.A N GLY 9.A O no hydrogen 2.827 N/A THR 13.A OG1 GLY 9.A O no hydrogen 2.813 N/A THR 14.A OG1 ALA 10.A O no hydrogen 2.720 N/A THR 14.A OG1 TYR 38.A OH no hydrogen 3.312 N/A ILE 15.A N VAL 11.A O no hydrogen 3.007 N/A ALA 16.A N GLY 12.A O no hydrogen 2.814 N/A TYR 17.A N THR 13.A O no hydrogen 2.807 N/A GLU 18.A N THR 14.A O no hydrogen 3.312 N/A LEU 19.A N ILE 15.A O no hydrogen 3.020 N/A GLN 20.A N ALA 16.A O no hydrogen 3.086 N/A GLN 20.A NE2 THR 26.A O no hydrogen 2.931 N/A SER 22.A N LEU 19.A O no hydrogen 3.079 N/A LEU 23.A N LEU 19.A O no hydrogen 2.621 N/A THR 26.A N LEU 23.A O no hydrogen 2.794 N/A THR 26.A OG1 LEU 23.A O no hydrogen 2.900 N/A THR 27.A N VAL 3.A O no hydrogen 2.952 N/A THR 27.A OG1 HIS 25.A O no hydrogen 3.233 N/A ILE 29.A N ILE 5.A O no hydrogen 3.264 N/A GLY 30.A N LYS 52.A O no hydrogen 3.105 N/A LYS 34.A N VAL 51.A O no hydrogen 3.008 N/A LYS 34.A NZ ASP 122.A OD1 no hydrogen 3.069 N/A ILE 36.A N ILE 49.A O no hydrogen 3.155 N/A THR 37.A N ASP 122.A O no hydrogen 2.918 N/A TYR 38.A N GLN 47.A O no hydrogen 2.614 N/A TYR 38.A OH THR 14.A OG1 no hydrogen 3.312 N/A TYR 39.A N VAL 124.A O no hydrogen 2.991 N/A ALA 44.A N VAL 41.A O no hydrogen 3.217 N/A GLN 47.A N TYR 38.A O no hydrogen 2.968 N/A ILE 49.A N ILE 36.A O no hydrogen 2.896 N/A VAL 51.A N LYS 34.A O no hydrogen 2.997 N/A LYS 52.A N LEU 28.A O no hydrogen 2.927 N/A GLY 53.A N ASP 56.A OD2 no hydrogen 2.838 N/A ASP 56.A N GLY 53.A O no hydrogen 2.959 N/A ASN 59.A ND2 THR 60.A O no hydrogen 3.221 N/A PHE 61.A N LEU 83.A O no hydrogen 3.017 N/A ASP 62.A N SER 2.A O no hydrogen 3.232 N/A ASP 62.A N SER 2.A OG no hydrogen 3.221 N/A VAL 63.A N SER 2.A O no hydrogen 3.098 N/A ILE 64.A N LEU 89.A O no hydrogen 2.884 N/A ILE 65.A N ALA 4.A O no hydrogen 2.723 N/A ILE 66.A N ILE 91.A O no hydrogen 2.848 N/A ALA 67.A N ILE 6.A O no hydrogen 2.571 N/A LYS 69.A N GLN 72.A OE1 no hydrogen 2.859 N/A THR 70.A N GLU 231.A OE1 no hydrogen 2.995 N/A GLN 72.A N LYS 69.A O no hydrogen 2.814 N/A ALA 75.A N GLN 72.A O no hydrogen 3.300 N/A VAL 76.A N LEU 73.A O no hydrogen 2.936 N/A ILE 77.A N LEU 73.A O no hydrogen 3.173 N/A HIS 79.A N VAL 76.A O no hydrogen 3.000 N/A LEU 80.A N ILE 77.A O no hydrogen 2.909 N/A THR 81.A N PRO 78.A O no hydrogen 3.470 N/A THR 81.A OG1 PRO 78.A O no hydrogen 3.365 N/A TYR 82.A OH HIS 79.A ND1 no hydrogen 2.544 N/A LEU 83.A N HIS 79.A O no hydrogen 3.181 N/A ALA 84.A N LEU 80.A O no hydrogen 3.017 N/A HIS 85.A N THR 88.A OG1 no hydrogen 2.877 N/A HIS 85.A NE2 ASP 62.A OD1 no hydrogen 3.041 N/A ASP 87.A N HIS 85.A ND1 no hydrogen 3.140 N/A THR 88.A OG1 PHE 61.A O no hydrogen 2.674 N/A THR 88.A OG1 HIS 85.A O no hydrogen 3.550 N/A LEU 89.A N ASP 62.A O no hydrogen 2.822 N/A ILE 90.A N ASN 107.A O no hydrogen 2.674 N/A ILE 91.A N ILE 64.A O no hydrogen 2.828 N/A LEU 92.A N CYS 109.A O no hydrogen 2.852 N/A ALA 93.A N ILE 66.A O no hydrogen 2.830 N/A GLN 94.A NE2 VAL 68.A O no hydrogen 2.827 N/A TYR 97.A N ALA 234.A O no hydrogen 3.179 N/A TYR 97.A OH GLN 161.A OE1 no hydrogen 2.445 N/A GLY 98.A N GLN 110.A OE1 no hydrogen 2.851 N/A GLN 99.A N GLN 99.A OE1 no hydrogen 2.497 N/A GLN 99.A NE2 THR 70.A O no hydrogen 3.348 N/A LEU 100.A N GLY 98.A O no hydrogen 2.793 N/A HIS 102.A N GLN 99.A O no hydrogen 3.083 N/A ILE 103.A N LEU 100.A O no hydrogen 3.454 N/A LYS 106.A NZ ASP 87.A OD1 no hydrogen 3.260 N/A CYS 109.A N ILE 90.A O no hydrogen 2.748 N/A GLN 110.A NE2 ALA 111.A O no hydrogen 3.253 N/A ALA 111.A N LEU 92.A O no hydrogen 3.033 N/A VAL 112.A N ARG 133.A O no hydrogen 2.734 N/A TYR 114.A N GLN 131.A O no hydrogen 3.069 N/A SER 116.A N ARG 128.A O no hydrogen 3.140 N/A SER 116.A OG ARG 128.A O no hydrogen 2.996 N/A GLN 118.A N THR 125.A O no hydrogen 2.926 N/A LYS 119.A NZ PRO 8.A O no hydrogen 2.990 N/A LYS 120.A N VAL 123.A O no hydrogen 3.111 N/A VAL 123.A N LYS 120.A O no hydrogen 3.096 N/A VAL 124.A N THR 37.A O no hydrogen 2.784 N/A THR 125.A N GLN 118.A O no hydrogen 2.917 N/A HIS 126.A N TYR 39.A O no hydrogen 3.003 N/A HIS 126.A ND1 THR 40.A O no hydrogen 2.767 N/A HIS 126.A NE2 ASP 129.A O no hydrogen 2.667 N/A PHE 127.A N SER 116.A O no hydrogen 2.929 N/A ARG 128.A N SER 116.A OG no hydrogen 3.065 N/A GLN 131.A N TYR 114.A O no hydrogen 3.309 N/A LEU 132.A N ASP 153.A O no hydrogen 2.734 N/A ARG 133.A N VAL 112.A O no hydrogen 2.986 N/A ARG 133.A NE GLU 157.A OE1 no hydrogen 3.390 N/A ARG 133.A NH2 GLU 157.A OE1 no hydrogen 3.403 N/A ILE 134.A N VAL 155.A O no hydrogen 3.082 N/A GLN 135.A NE2 ASP 136.A O no hydrogen 3.161 N/A GLN 135.A NE2 ALA 158.A O no hydrogen 3.102 N/A ASP 136.A N GLU 157.A O no hydrogen 2.772 N/A ASN 137.A N THR 140.A OG1 no hydrogen 2.642 N/A THR 140.A N ASN 137.A OD1 no hydrogen 2.694 N/A THR 140.A OG1 GLN 135.A O no hydrogen 2.752 N/A THR 140.A OG1 ASN 137.A O no hydrogen 3.054 N/A THR 140.A OG1 ASN 137.A OD1 no hydrogen 2.840 N/A ARG 141.A N ASN 137.A O no hydrogen 2.890 N/A ARG 141.A NH2 ASP 136.A OD2 no hydrogen 3.043 N/A GLN 142.A N ALA 138.A O no hydrogen 3.102 N/A PHE 143.A N LEU 139.A O no hydrogen 2.939 N/A ARG 144.A N THR 140.A O no hydrogen 3.013 N/A ARG 144.A NE ASP 145.A OD1 no hydrogen 3.314 N/A ARG 144.A NH2 ASP 145.A OD1 no hydrogen 3.570 N/A ASP 145.A N ARG 141.A O no hydrogen 2.889 N/A LEU 146.A N GLN 142.A O no hydrogen 2.994 N/A VAL 147.A N PHE 143.A O no hydrogen 3.214 N/A SER 150.A OG VAL 147.A O no hydrogen 2.910 N/A GLN 151.A NE2 GLU 18.A OE1 no hydrogen 3.352 N/A GLN 151.A NE2 GLU 18.A OE2 no hydrogen 2.697 N/A ASP 153.A N TYR 130.A O no hydrogen 2.909 N/A VAL 155.A N LEU 132.A O no hydrogen 2.787 N/A GLU 157.A N ILE 134.A O no hydrogen 2.830 N/A ILE 160.A N GLN 135.A OE1 no hydrogen 2.995 N/A GLN 161.A N ASN 159.A OD1 no hydrogen 3.436 N/A GLN 162.A N ASN 159.A O no hydrogen 3.353 N/A ILE 164.A N ILE 160.A O no hydrogen 2.832 N/A TRP 165.A N GLN 161.A O no hydrogen 2.998 N/A TYR 166.A N GLN 162.A O no hydrogen 3.100 N/A LYS 167.A N ALA 163.A O no hydrogen 3.409 N/A LYS 167.A NZ ASN 95.A OD1 no hydrogen 2.943 N/A LYS 167.A NZ VAL 113.A O no hydrogen 2.253 N/A LEU 168.A N ILE 164.A O no hydrogen 3.083 N/A LEU 169.A N TRP 165.A O no hydrogen 3.032 N/A VAL 170.A N TYR 166.A O no hydrogen 3.065 N/A ASN 171.A N LYS 167.A O no hydrogen 2.942 N/A LEU 172.A N LEU 168.A O no hydrogen 3.010 N/A GLY 173.A N LEU 169.A O no hydrogen 3.141 N/A ILE 174.A N TYR 227.A OH no hydrogen 3.169 N/A SER 176.A OG LEU 172.A O no hydrogen 2.748 N/A THR 178.A N ILE 174.A O no hydrogen 3.000 N/A THR 178.A OG1 ILE 174.A O no hydrogen 2.685 N/A THR 178.A OG1 ASN 175.A O no hydrogen 3.100 N/A LEU 179.A N ASN 175.A O no hydrogen 3.005 N/A LEU 180.A N SER 176.A O no hydrogen 2.959 N/A GLY 181.A N ILE 177.A O no hydrogen 2.737 N/A ARG 182.A N LEU 179.A O no hydrogen 3.225 N/A GLN 183.A N THR 178.A O no hydrogen 3.257 N/A ALA 186.A N THR 184.A OG1 no hydrogen 3.382 N/A ILE 187.A N THR 184.A O no hydrogen 3.338 N/A MET 188.A N VAL 185.A O no hydrogen 2.813 N/A HIS 189.A N ALA 186.A O no hydrogen 3.095 N/A ASN 190.A N ILE 187.A O no hydrogen 3.367 N/A ASN 190.A ND2 ILE 187.A O no hydrogen 2.684 N/A GLU 192.A N GLU 192.A OE1 no hydrogen 2.701 N/A ILE 193.A N ASN 190.A O no hydrogen 2.936 N/A ARG 194.A N ASN 190.A O no hydrogen 3.230 N/A ARG 194.A NH1 MET 188.A O no hydrogen 2.866 N/A ARG 194.A NH1 HIS 189.A O no hydrogen 2.933 N/A ILE 195.A N PRO 191.A O no hydrogen 3.198 N/A LEU 196.A N GLU 192.A O no hydrogen 3.152 N/A CYS 197.A N ILE 193.A O no hydrogen 2.805 N/A ARG 198.A N ARG 194.A O no hydrogen 3.148 N/A ARG 198.A NH2 ASP 221.A OD1 no hydrogen 3.461 N/A GLN 199.A N ILE 195.A O no hydrogen 3.082 N/A GLN 199.A NE2 TYR 252.A OH no hydrogen 2.902 N/A LEU 200.A N LEU 196.A O no hydrogen 2.664 N/A LEU 201.A N CYS 197.A O no hydrogen 2.751 N/A LEU 202.A N ARG 198.A O no hydrogen 2.691 N/A ASP 203.A N GLN 199.A O no hydrogen 3.015 N/A GLY 204.A N LEU 200.A O no hydrogen 3.250 N/A CYS 205.A N LEU 201.A O no hydrogen 2.688 N/A CYS 205.A SG PHE 215.A O no hydrogen 3.206 N/A CYS 205.A SG SER 216.A O no hydrogen 3.174 N/A ARG 206.A N LEU 202.A O no hydrogen 2.907 N/A ARG 206.A N ASP 203.A O no hydrogen 3.142 N/A ARG 206.A NH2 ASP 203.A OD1 no hydrogen 2.592 N/A ARG 206.A NH2 ASP 249.A O no hydrogen 3.053 N/A VAL 207.A N ASP 203.A O no hydrogen 3.206 N/A ALA 208.A N GLY 204.A O no hydrogen 2.972 N/A GLN 209.A N CYS 205.A O no hydrogen 3.123 N/A GLN 209.A NE2 PHE 215.A O no hydrogen 2.931 N/A ALA 210.A N ARG 206.A O no hydrogen 3.282 N/A GLU 211.A N VAL 207.A O no hydrogen 3.051 N/A GLY 212.A N GLN 209.A O no hydrogen 3.038 N/A LEU 213.A N ALA 208.A O no hydrogen 2.994 N/A ASN 214.A ND2 GLN 162.A OE1 no hydrogen 3.129 N/A ASN 214.A ND2 ASN 214.A O no hydrogen 2.581 N/A PHE 215.A N LEU 213.A O no hydrogen 3.037 N/A SER 216.A N THR 219.A OG1 no hydrogen 3.157 N/A THR 219.A N SER 216.A O no hydrogen 3.144 N/A ASP 221.A N GLU 217.A O no hydrogen 3.123 N/A THR 222.A N GLN 218.A O no hydrogen 3.077 N/A THR 222.A OG1 THR 219.A O no hydrogen 2.795 N/A ILE 223.A N THR 219.A O no hydrogen 3.151 N/A MET 224.A N VAL 220.A O no hydrogen 2.865 N/A THR 225.A N ASP 221.A O no hydrogen 3.027 N/A THR 225.A OG1 ASP 221.A O no hydrogen 2.760 N/A ILE 226.A N THR 222.A O no hydrogen 3.116 N/A TYR 227.A N ILE 223.A O no hydrogen 3.187 N/A TYR 227.A OH VAL 170.A O no hydrogen 2.487 N/A GLN 228.A N THR 225.A O no hydrogen 3.140 N/A GLY 229.A N ILE 226.A O no hydrogen 3.012 N/A ALA 234.A N GLU 231.A O no hydrogen 3.174 N/A ILE 235.A N GLU 231.A O no hydrogen 3.231 N/A ILE 235.A N VAL 232.A O no hydrogen 3.207 N/A GLN 236.A N GLN 236.A OE1 no hydrogen 2.772 N/A GLN 236.A NE2 SER 176.A OG no hydrogen 3.051 N/A GLY 237.A N VAL 232.A O no hydrogen 2.619 N/A ILE 239.A N ILE 235.A O no hydrogen 3.175 N/A TYR 240.A N GLN 236.A O no hydrogen 2.879 N/A ARG 241.A N GLY 237.A O no hydrogen 2.923 N/A ARG 241.A NH1 GLU 233.A O no hydrogen 3.306 N/A ARG 241.A NH2 GLU 233.A O no hydrogen 2.980 N/A ARG 242.A N PHE 238.A O no hydrogen 3.117 N/A ALA 243.A N ILE 239.A O no hydrogen 3.025 N/A ARG 244.A N TYR 240.A O no hydrogen 3.141 N/A ARG 244.A NH1 ASP 254.A OD1 no hydrogen 2.803 N/A ARG 244.A NH1 ASP 254.A OD2 no hydrogen 2.812 N/A ARG 244.A NH2 ASP 254.A OD1 no hydrogen 2.943 N/A GLU 245.A N ARG 241.A O no hydrogen 2.906 N/A HIS 246.A N ARG 242.A O no hydrogen 3.178 N/A HIS 246.A NE2 GLU 211.A OE2 no hydrogen 2.825 N/A ASN 247.A N ARG 244.A O no hydrogen 3.180 N/A LEU 248.A N ALA 243.A O no hydrogen 2.679 N/A THR 250.A OG1 ASP 254.A OD1 no hydrogen 3.142 N/A LEU 253.A N ASP 203.A OD2 no hydrogen 3.093 N/A ASP 254.A N THR 250.A O no hydrogen 2.903 N/A THR 255.A N PRO 251.A O no hydrogen 2.963 N/A THR 255.A OG1 PRO 251.A O no hydrogen 2.916 N/A ILE 256.A N TYR 252.A O no hydrogen 3.220 N/A TYR 257.A N LEU 253.A O no hydrogen 2.953 N/A TYR 257.A OH GLU 233.A OE1 no hydrogen 3.400 N/A SER 258.A N ASP 254.A O no hydrogen 2.998 N/A SER 258.A OG ASP 254.A O no hydrogen 2.597 N/A PHE 259.A N THR 255.A O no hydrogen 3.276 N/A LEU 260.A N ILE 256.A O no hydrogen 2.996 N/A ARG 261.A N TYR 257.A O no hydrogen 2.998 N/A ARG 261.A NH2 GLU 233.A OE1 no hydrogen 2.488 N/A ALA 262.A N PHE 259.A O no hydrogen 3.015 N/A TYR 263.A N LEU 260.A O no hydrogen 3.143 N/A