Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6upy_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 2.A N SER 1.A OG no hydrogen 2.410 N/A GLN 6.A N SER 22.A O no hydrogen 2.707 N/A GLN 6.A NE2 GLU 2.A O no hydrogen 3.164 N/A GLN 6.A NE2 GLY 4.A O no hydrogen 2.574 N/A LYS 8.A N ILE 20.A O no hydrogen 2.983 N/A ARG 10.A N ASP 18.A O no hydrogen 2.577 N/A GLU 11.A N ASP 18.A O no hydrogen 2.804 N/A SER 13.A OG ASP 15.A OD1 no hydrogen 3.424 N/A SER 13.A OG ASN 16.A O no hydrogen 3.029 N/A ASN 16.A N SER 13.A OG no hydrogen 2.793 N/A VAL 17.A N VAL 231.A O no hydrogen 2.992 N/A ASP 18.A N GLU 11.A O no hydrogen 2.568 N/A PHE 19.A N MET 229.A O no hydrogen 3.042 N/A ILE 20.A N LYS 8.A O no hydrogen 2.697 N/A LEU 21.A N PHE 227.A O no hydrogen 2.882 N/A SER 22.A N GLN 6.A O no hydrogen 2.895 N/A LEU 26.A N ASP 25.A OD1 no hydrogen 3.265 N/A MET 28.A N ASP 25.A O no hydrogen 3.058 N/A ALA 29.A N ASP 25.A O no hydrogen 3.454 N/A ASN 30.A N LEU 26.A O no hydrogen 2.993 N/A SER 31.A N ALA 27.A O no hydrogen 2.801 N/A LEU 32.A N MET 28.A O no hydrogen 2.751 N/A ARG 33.A N ALA 29.A O no hydrogen 3.228 N/A ARG 34.A N ASN 30.A O no hydrogen 2.936 N/A VAL 35.A N SER 31.A O no hydrogen 3.282 N/A MET 36.A N LEU 32.A O no hydrogen 2.726 N/A ILE 37.A N ARG 33.A O no hydrogen 3.089 N/A ILE 37.A N ARG 34.A O no hydrogen 3.306 N/A ALA 38.A N ARG 34.A O no hydrogen 3.041 N/A GLU 39.A N VAL 35.A O no hydrogen 2.978 N/A ILE 40.A N VAL 35.A O no hydrogen 3.139 N/A THR 42.A N GLY 161.A O no hydrogen 3.003 N/A THR 42.A OG1 PRO 41.A O no hydrogen 2.566 N/A LEU 43.A N SER 73.A OG no hydrogen 2.860 N/A ALA 44.A N LYS 159.A O no hydrogen 3.132 N/A ASP 46.A N VAL 157.A O no hydrogen 3.208 N/A SER 47.A N VAL 157.A O no hydrogen 3.209 N/A GLU 49.A N THR 155.A O no hydrogen 2.902 N/A GLU 51.A N LYS 153.A O no hydrogen 2.517 N/A THR 52.A N LYS 153.A O no hydrogen 3.135 N/A THR 52.A OG1 GLU 151.A OE2 no hydrogen 3.198 N/A ASN 53.A ND2 LEU 57.A O no hydrogen 3.076 N/A ASN 53.A ND2 ASP 59.A OD1 no hydrogen 2.282 N/A THR 54.A N GLU 151.A O no hydrogen 3.182 N/A THR 54.A OG1 GLU 151.A O no hydrogen 2.417 N/A THR 55.A N ASN 53.A OD1 no hydrogen 3.365 N/A THR 55.A OG1 ASN 53.A OD1 no hydrogen 2.152 N/A ILE 62.A N ALA 58.A O no hydrogen 2.944 N/A ALA 63.A N ASP 59.A O no hydrogen 2.575 N/A HIS 64.A N GLU 60.A O no hydrogen 2.909 N/A ARG 65.A N PHE 61.A O no hydrogen 3.085 N/A ARG 65.A NH2 ILE 143.A O no hydrogen 3.068 N/A LEU 66.A N ILE 62.A O no hydrogen 3.052 N/A GLY 67.A N ALA 63.A O no hydrogen 3.109 N/A ILE 69.A N LEU 66.A O no hydrogen 3.133 N/A GLN 72.A N HIS 130.A O no hydrogen 2.918 N/A SER 73.A N SER 236.A O no hydrogen 3.028 N/A SER 73.A OG LEU 71.A O no hydrogen 3.458 N/A MET 74.A N GLN 72.A OE1 no hydrogen 2.525 N/A ASP 75.A N ASN 127.A O no hydrogen 3.288 N/A ILE 76.A N SER 73.A O no hydrogen 3.411 N/A GLN 78.A N ASP 75.A O no hydrogen 3.071 N/A LEU 79.A N ILE 76.A O no hydrogen 3.146 N/A GLU 80.A N LYS 93.A O no hydrogen 2.898 N/A ASP 84.A N TYR 81.A O no hydrogen 3.021 N/A CYS 85.A N TYR 81.A O no hydrogen 3.200 N/A CYS 94.A SG CYS 91.A O no hydrogen 3.693 N/A SER 95.A N CYS 91.A O no hydrogen 3.320 N/A SER 95.A OG CYS 91.A O no hydrogen 2.366 N/A VAL 96.A N ALA 158.A O no hydrogen 2.857 N/A LEU 98.A N CYS 156.A O no hydrogen 2.541 N/A THR 99.A N VAL 118.A O no hydrogen 2.521 N/A LEU 100.A N LEU 154.A O no hydrogen 3.204 N/A ALA 102.A N LEU 152.A O no hydrogen 3.201 N/A GLY 104.A N GLN 150.A O no hydrogen 2.804 N/A GLU 105.A N PHE 103.A O no hydrogen 2.891 N/A SER 106.A OG SER 108.A O no hydrogen 3.399 N/A SER 106.A OG THR 110.A OG1 no hydrogen 2.209 N/A THR 110.A N LEU 146.A O no hydrogen 2.836 N/A ASN 111.A ND2 TYR 113.A OH no hydrogen 2.385 N/A VAL 112.A N CYS 144.A O no hydrogen 2.657 N/A SER 114.A OG ASN 139.A O no hydrogen 3.033 N/A LYS 115.A N ASN 139.A O no hydrogen 2.958 N/A LYS 115.A NZ ASP 116.A OD1 no hydrogen 2.785 N/A LEU 117.A N SER 114.A O no hydrogen 3.306 N/A VAL 118.A N THR 99.A O no hydrogen 2.871 N/A VAL 120.A N VAL 97.A O no hydrogen 2.889 N/A ARG 126.A NE LEU 123.A O no hydrogen 2.996 N/A ASN 127.A N ASP 75.A OD2 no hydrogen 2.627 N/A GLY 129.A N GLN 72.A O no hydrogen 3.123 N/A HIS 130.A ND1 ASN 127.A OD1 no hydrogen 3.275 N/A ILE 132.A N PRO 70.A O no hydrogen 2.636 N/A GLN 134.A NE2 VAL 234.A O no hydrogen 2.372 N/A LYS 136.A NZ GLU 137.A OE2 no hydrogen 2.813 N/A GLY 138.A N ASP 135.A O no hydrogen 2.895 N/A ASN 139.A N ASP 135.A OD1 no hydrogen 3.089 N/A VAL 141.A N SER 114.A OG no hydrogen 2.987 N/A ILE 143.A N VAL 112.A O no hydrogen 2.756 N/A CYS 144.A N VAL 112.A O no hydrogen 3.358 N/A CYS 144.A SG LYS 145.A O no hydrogen 3.296 N/A LEU 146.A N THR 110.A O no hydrogen 2.611 N/A ARG 147.A N GLN 150.A OE1 no hydrogen 2.462 N/A GLU 151.A N THR 54.A OG1 no hydrogen 2.465 N/A LEU 152.A N ALA 102.A O no hydrogen 3.040 N/A LYS 153.A N THR 52.A O no hydrogen 2.928 N/A LEU 154.A N LEU 100.A O no hydrogen 3.131 N/A THR 155.A N GLU 49.A O no hydrogen 2.723 N/A CYS 156.A N LEU 98.A O no hydrogen 2.757 N/A VAL 157.A N SER 47.A O no hydrogen 3.050 N/A ALA 158.A N VAL 96.A O no hydrogen 2.623 N/A LYS 160.A NZ ILE 76.A O no hydrogen 2.462 N/A LYS 160.A NZ LEU 79.A O no hydrogen 3.262 N/A GLY 161.A N THR 42.A O no hydrogen 3.160 N/A GLU 165.A N ILE 162.A O no hydrogen 2.874 N/A LYS 168.A N HIS 166.A ND1 no hydrogen 3.103 N/A LYS 168.A NZ ILE 45.A O no hydrogen 2.713 N/A LYS 168.A NZ ASP 46.A OD1 no hydrogen 3.110 N/A TRP 169.A N HIS 166.A O no hydrogen 3.255 N/A GLY 170.A N ALA 167.A O no hydrogen 3.004 N/A ALA 173.A N GLU 232.A O no hydrogen 2.761 N/A GLU 176.A N ASN 230.A O no hydrogen 2.752 N/A GLU 178.A N TYR 228.A O no hydrogen 3.166 N/A TYR 179.A OH HIS 187.A ND1 no hydrogen 2.773 N/A TRP 182.A N ASP 180.A OD1 no hydrogen 3.334 N/A ASN 183.A ND2 THR 188.A O no hydrogen 2.503 N/A LYS 184.A N ASP 180.A OD1 no hydrogen 3.446 N/A LYS 184.A NZ ASP 210.A O no hydrogen 2.529 N/A LEU 185.A N ASP 180.A OD2 no hydrogen 3.106 N/A LYS 186.A N ASN 183.A O no hydrogen 3.141 N/A HIS 187.A N ASN 183.A OD1 no hydrogen 2.827 N/A HIS 187.A ND1 TYR 179.A OH no hydrogen 2.773 N/A THR 188.A N ASN 183.A OD1 no hydrogen 3.463 N/A GLU 193.A N GLU 199.A OE1 no hydrogen 2.498 N/A GLU 193.A N GLU 199.A OE2 no hydrogen 3.239 N/A GLN 194.A N GLU 199.A OE2 no hydrogen 2.320 N/A ASP 195.A N GLU 199.A OE2 no hydrogen 3.048 N/A LYS 198.A N ASP 195.A O no hydrogen 3.056 N/A LYS 198.A NZ ASP 195.A OD2 no hydrogen 2.759 N/A GLU 199.A N ASP 195.A O no hydrogen 2.949 N/A TRP 200.A N SER 196.A O no hydrogen 3.102 N/A TRP 200.A NE1 TRP 191.A O no hydrogen 2.676 N/A SER 203.A OG GLU 178.A OE1 no hydrogen 2.291 N/A SER 203.A OG GLU 178.A OE2 no hydrogen 3.152 N/A LYS 204.A NZ GLU 207.A OE1 no hydrogen 3.367 N/A ASN 205.A N SER 203.A OG no hydrogen 3.026 N/A ASN 205.A ND2 GLU 178.A OE1 no hydrogen 2.634 N/A CYS 206.A N SER 203.A O no hydrogen 2.996 N/A CYS 206.A SG PRO 181.A O no hydrogen 3.543 N/A CYS 206.A SG SER 203.A O no hydrogen 3.306 N/A GLU 207.A N LYS 204.A O no hydrogen 3.438 N/A TYR 208.A N ASN 205.A O no hydrogen 3.110 N/A GLU 209.A N CYS 206.A O no hydrogen 3.494 N/A GLY 215.A N GLU 214.A OE2 no hydrogen 3.175 N/A ASP 216.A N ASN 213.A O no hydrogen 2.831 N/A PHE 227.A N LEU 21.A O no hydrogen 2.857 N/A TYR 228.A N GLU 178.A O no hydrogen 3.063 N/A TYR 228.A OH TYR 208.A O no hydrogen 2.885 N/A MET 229.A N PHE 19.A O no hydrogen 3.147 N/A ASN 230.A N GLU 176.A O no hydrogen 3.248 N/A VAL 231.A N VAL 17.A O no hydrogen 2.879 N/A SER 233.A N ASP 15.A O no hydrogen 3.050 N/A SER 233.A OG PRO 171.A O no hydrogen 3.337 N/A SER 233.A OG ILE 237.A O no hydrogen 2.520 N/A GLY 235.A N SER 233.A OG no hydrogen 3.329 N/A GLN 241.A NE2 ASP 240.A OD2 no hydrogen 3.448 N/A VAL 242.A N PRO 238.A O no hydrogen 3.031 N/A VAL 243.A N VAL 239.A O no hydrogen 3.462 N/A VAL 244.A N ASP 240.A O no hydrogen 3.119 N/A ARG 245.A N GLN 241.A O no hydrogen 2.635 N/A ARG 245.A NE GLN 241.A OE1 no hydrogen 3.353 N/A ARG 245.A NH1 MET 74.A O no hydrogen 3.091 N/A ARG 245.A NH2 GLN 241.A OE1 no hydrogen 2.533 N/A GLY 246.A N VAL 242.A O no hydrogen 2.986 N/A ILE 247.A N VAL 243.A O no hydrogen 2.636 N/A ASP 248.A N VAL 244.A O no hydrogen 2.808 N/A THR 249.A N ARG 245.A O no hydrogen 2.805 N/A THR 249.A OG1 ARG 245.A O no hydrogen 2.224 N/A LEU 250.A N GLY 246.A O no hydrogen 3.111 N/A GLN 251.A N ILE 247.A O no hydrogen 3.117 N/A LYS 252.A N ASP 248.A O no hydrogen 2.972 N/A LYS 253.A N THR 249.A O no hydrogen 3.080 N/A LYS 253.A NZ GLU 39.A OE1 no hydrogen 2.688 N/A VAL 254.A N LEU 250.A O no hydrogen 3.015 N/A ALA 255.A N GLN 251.A O no hydrogen 2.809 N/A SER 256.A N LYS 252.A O no hydrogen 3.230 N/A SER 256.A OG LYS 252.A O no hydrogen 3.238 N/A SER 256.A OG LYS 253.A O no hydrogen 2.475 N/A LEU 258.A N VAL 254.A O no hydrogen 2.982 N/A LEU 259.A N ALA 255.A O no hydrogen 2.481 N/A ALA 260.A N SER 256.A O no hydrogen 2.758 N/A LEU 261.A N ILE 257.A O no hydrogen 2.842 N/A THR 262.A N LEU 258.A O no hydrogen 3.283 N/A THR 262.A OG1 LEU 258.A O no hydrogen 2.877 N/A GLN 263.A N LEU 259.A O no hydrogen 3.117 N/A GLN 263.A N ALA 260.A O no hydrogen 3.032 N/A MET 264.A N ALA 260.A O no hydrogen 3.157 N/A MET 264.A N LEU 261.A O no hydrogen 3.250 N/A GLN 266.A N GLN 263.A O no hydrogen 3.370 N/A