# Name: A2-S6 # Creating user name: jsharley # Creation time: Sat Jun 28 14:33:16 2008 # Modifying user name: jsharley # Modification time: Sat Jun 28 14:38:41 2008 @MOLECULE A2-S6 190 191 13 1 3 BIOPOLYMER FORMAL_CHARGES @DICT BIOPOLYMER macromol @ATOM 1 N 11.1989 12.3423 26.7662 N.am 1 GLU356 0.0000 BACKBONE|DICT|DIRECT 2 CA 10.1261 12.7022 27.6735 C.3 1 GLU356 0.0000 BACKBONE|DICT|DIRECT 3 C 9.4348 11.4553 28.1413 C.2 1 GLU356 0.0000 BACKBONE|DICT|DIRECT 4 O 9.4221 11.1818 29.3307 O.2 1 GLU356 0.0000 BACKBONE|DICT|DIRECT 5 CB 9.1153 13.6192 26.9574 C.3 1 GLU356 0.0000 DICT 6 CG 9.7993 14.9329 26.5330 C.3 1 GLU356 0.0000 DICT 7 CD 10.0717 15.7809 27.7414 C.2 1 GLU356 0.0000 DICT 8 OE1 9.1897 16.6082 28.0948 O.co2 1 GLU356 -0.5000 DICT 9 OE2 11.1751 15.6317 28.3313 O.co2 1 GLU356 -0.5000 DICT 10 N 8.8621 10.6973 27.1857 N.am 2 GLU357 0.0000 BACKBONE|DICT|DIRECT 11 CA 8.2112 9.4506 27.5493 C.3 2 GLU357 0.0000 BACKBONE|DICT|DIRECT 12 C 9.2126 8.5009 28.1442 C.2 2 GLU357 0.0000 BACKBONE|DICT|DIRECT 13 O 8.9512 7.9222 29.1863 O.2 2 GLU357 0.0000 BACKBONE|DICT|DIRECT 14 CB 7.5359 8.8397 26.3028 C.3 2 GLU357 0.0000 DICT 15 CG 8.5661 8.3793 25.2498 C.3 2 GLU357 0.0000 DICT 16 CD 9.2776 9.5538 24.6418 C.2 2 GLU357 0.0000 DICT 17 OE1 10.4875 9.7328 24.9449 O.co2 2 GLU357 -0.5000 DICT 18 OE2 8.6317 10.2969 23.8557 O.co2 2 GLU357 -0.5000 DICT 19 N 10.3742 8.3604 27.4761 N.am 3 VAL358 0.0000 BACKBONE|DICT|DIRECT 20 CA 11.4057 7.4897 28.0120 C.3 3 VAL358 0.0000 BACKBONE|DICT|DIRECT 21 C 12.0222 8.1115 29.2360 C.2 3 VAL358 0.0000 BACKBONE|DICT|DIRECT 22 O 11.7464 9.2609 29.5425 O.2 3 VAL358 0.0000 BACKBONE|DICT|DIRECT 23 CB 12.4803 7.2475 26.9320 C.3 3 VAL358 0.0000 DICT 24 CG1 13.4481 6.1368 27.3830 C.3 3 VAL358 0.0000 DICT 25 CG2 11.8133 6.8227 25.6095 C.3 3 VAL358 0.0000 DICT 26 N 12.8646 7.3388 29.9487 N.am 4 ASP359 0.0000 BACKBONE|DICT|DIRECT 27 CA 13.4578 7.8906 31.1516 C.3 4 ASP359 0.0000 BACKBONE|DICT|DIRECT 28 C 14.8187 7.3090 31.4025 C.2 4 ASP359 0.0000 BACKBONE|DICT|DIRECT 29 O 14.9751 6.1005 31.4696 O.2 4 ASP359 0.0000 BACKBONE|DICT|DIRECT 30 CB 12.5155 7.6767 32.3538 C.3 4 ASP359 0.0000 DICT 31 CG 13.1321 8.1317 33.6462 C.2 4 ASP359 0.0000 DICT 32 OD1 13.7625 9.2231 33.6605 O.co2 4 ASP359 -0.5000 DICT 33 OD2 12.9924 7.3880 34.6529 O.co2 4 ASP359 -0.5000 DICT 34 N 15.8098 8.2086 31.5509 N.am 5 CHU360 0.0000 BACKBONE|DICT|DIRECT 35 CA 17.1387 7.7519 31.9179 C.3 5 CHU360 0.0000 BACKBONE|DICT|DIRECT 36 C 17.0934 7.2337 33.3266 C.2 5 CHU360 0.0000 BACKBONE|DICT|DIRECT 37 O 17.7676 6.2663 33.6414 O.2 5 CHU360 0.0000 BACKBONE|DICT|DIRECT 38 H3 17.5265 9.3216 35.2398 H 9 CHV364 0.0000 DICT 39 HB3 20.8510 6.6167 37.0229 H 9 CHV364 0.0000 DICT 40 CB1 18.0456 1.3270 33.8120 C.3 8 AIB363 0.0000 DICT 41 CB 18.0977 8.9565 31.8915 C.3 5 CHU360 0.0000 DICT 42 N 16.2716 7.8942 34.1671 N.am 6 GLU361 0.0000 BACKBONE|DICT|DIRECT 43 CA 16.1451 7.4568 35.5447 C.3 6 GLU361 0.0000 BACKBONE|DICT|DIRECT 44 C 15.6045 6.0577 35.6242 C.2 6 GLU361 0.0000 BACKBONE|DICT|DIRECT 45 O 15.6645 5.4574 36.6838 O.2 6 GLU361 0.0000 BACKBONE|DICT|DIRECT 46 CB 15.2393 8.4435 36.3059 C.3 6 GLU361 0.0000 DICT 47 CG 15.2966 8.1704 37.8219 C.3 6 GLU361 0.0000 DICT 48 CD 16.7142 8.2288 38.3137 C.2 6 GLU361 0.0000 DICT 49 OE1 17.2618 9.3591 38.4127 O.co2 6 GLU361 -0.5000 DICT 50 OE2 17.2805 7.1435 38.6102 O.co2 6 GLU361 -0.5000 DICT 51 N 15.0933 5.5209 34.4991 N.am 7 ASP362 0.0000 BACKBONE|DICT|DIRECT 52 CA 14.7107 4.1212 34.5063 C.3 7 ASP362 0.0000 BACKBONE|DICT|DIRECT 53 C 15.9535 3.3056 34.7222 C.2 7 ASP362 0.0000 BACKBONE|DICT|DIRECT 54 O 16.0025 2.5084 35.6446 O.2 7 ASP362 0.0000 BACKBONE|DICT|DIRECT 55 CB 14.0875 3.7621 33.1437 C.3 7 ASP362 0.0000 DICT 56 CG 12.7785 4.4670 32.9259 C.2 7 ASP362 0.0000 DICT 57 OD1 12.0584 4.7299 33.9266 O.co2 7 ASP362 -0.5000 DICT 58 OD2 12.4698 4.7717 31.7431 O.co2 7 ASP362 -0.5000 DICT 59 N 16.9649 3.5376 33.8609 N.am 8 AIB363 0.0000 BACKBONE|DICT|DIRECT 60 CA 18.2344 2.8450 34.0092 C.3 8 AIB363 0.0000 BACKBONE|DICT|DIRECT 61 C 18.8620 3.1576 35.3421 C.2 8 AIB363 0.0000 BACKBONE|DICT|DIRECT 62 O 19.2119 2.2500 36.0803 O.2 8 AIB363 0.0000 BACKBONE|DICT|DIRECT 63 HB2 19.4098 6.6136 38.0950 H 9 CHV364 0.0000 DICT 64 H1 20.3980 8.6639 36.2464 H 9 CHV364 0.0000 DICT 65 CB2 19.1741 3.3622 32.9044 C.3 8 AIB363 0.0000 DICT 66 H2 18.9505 8.7853 37.3032 H 9 CHV364 0.0000 DICT 67 OG 17.5597 10.0182 32.6877 O.3 5 CHU360 0.0000 DICT 68 H 11.3955 11.3794 26.5811 H 1 GLU356 0.0000 BACKBONE|DICT|ESSENTIAL|DIRECT 69 HA 10.5458 13.2335 28.5404 H 1 GLU356 0.0000 BACKBONE|DICT|DIRECT 70 HB3 8.2832 13.8465 27.6401 H 1 GLU356 0.0000 DICT 71 N 19.0066 4.4627 35.6534 N.am 9 CHV364 0.0000 BACKBONE|DICT|DIRECT 72 CA 19.6494 4.8249 36.9072 C.3 9 CHV364 0.0000 BACKBONE|DICT|DIRECT 73 C 18.9285 4.2202 38.0766 C.2 9 CHV364 0.0000 BACKBONE|DICT|DIRECT 74 O 19.5635 3.5995 38.9138 O.2 9 CHV364 0.0000 BACKBONE|DICT|DIRECT 75 HB2 8.7275 13.1062 26.0649 H 1 GLU356 0.0000 DICT 76 H4 19.0751 8.6549 32.2962 H 5 CHU360 0.0000 77 HG3 9.1401 15.4812 25.8438 H 1 GLU356 0.0000 DICT 78 N 17.5931 4.3875 38.1168 N.am 10 ALA365 0.0000 BACKBONE|DICT|DIRECT 79 CA 16.8311 3.7389 39.1675 C.3 10 ALA365 0.0000 BACKBONE|DICT|DIRECT 80 C 16.6116 2.2993 38.7900 C.2 10 ALA365 0.0000 BACKBONE|DICT|DIRECT 81 O 15.4877 1.8656 38.5915 O.2 10 ALA365 0.0000 BACKBONE|DICT|DIRECT 82 CB 15.5033 4.4895 39.3883 C.3 10 ALA365 0.0000 DICT 83 N 17.7298 1.5549 38.6959 N.am 11 ARG366 0.0000 BACKBONE|DICT|DIRECT 84 CA 17.6330 0.1477 38.3541 C.3 11 ARG366 0.0000 BACKBONE|DICT|DIRECT 85 C 18.8839 -0.5691 38.7831 C.2 11 ARG366 0.0000 BACKBONE|DICT|DIRECT 86 O 19.8626 0.0876 39.1025 O.2 11 ARG366 0.0000 BACKBONE|DICT|DIRECT 87 CB 17.4483 -0.0238 36.8348 C.3 11 ARG366 0.0000 DICT 88 CG 15.9640 -0.2933 36.5328 C.3 11 ARG366 0.0000 DICT 89 CD 15.7857 -0.5538 35.0267 C.3 11 ARG366 0.0000 DICT 90 NE 14.4529 -0.1399 34.6291 N.pl3 11 ARG366 0.0000 DICT 91 CZ 14.2626 0.6011 33.5763 C.cat 11 ARG366 1.0000 DICT 92 NH1 15.2579 0.9929 32.8360 N.pl3 11 ARG366 0.0000 DICT 93 NH2 13.0529 0.9545 33.2579 N.pl3 11 ARG366 0.0000 DICT 94 N 18.8776 -1.9200 38.7997 N.am 12 PRO367 0.0000 BACKBONE|DICT|DIRECT 95 CA 20.0702 -2.6483 39.1797 C.3 12 PRO367 0.0000 BACKBONE|DICT|DIRECT 96 C 21.1306 -2.4007 38.1470 C.2 12 PRO367 0.0000 BACKBONE|DICT|DIRECT 97 O 22.2557 -2.0823 38.4961 O.2 12 PRO367 0.0000 BACKBONE|DICT|DIRECT 98 CB 19.6018 -4.1145 39.0939 C.3 12 PRO367 0.0000 DICT 99 CG 18.1867 -4.1199 38.4740 C.3 12 PRO367 0.0000 DICT 100 CD 17.6944 -2.6606 38.4158 C.3 12 PRO367 0.0000 DICT 101 N 20.7492 -2.5371 36.8628 N.am 13 ASP368 0.0000 BACKBONE|DICT|DIRECT 102 CA 21.7021 -2.2409 35.8094 C.3 13 ASP368 0.0000 BACKBONE|DICT|DIRECT 103 C 21.6670 -0.7755 35.4759 C.2 13 ASP368 0.0000 BACKBONE|DICT|DIRECT 104 O 20.9047 -0.0195 36.0564 O.2 13 ASP368 0.0000 BACKBONE|DICT|DIRECT 105 CB 21.3433 -3.0629 34.5579 C.3 13 ASP368 0.0000 DICT 106 CG 21.4306 -4.5267 34.8809 C.2 13 ASP368 0.0000 DICT 107 OD1 22.5011 -5.1305 34.6043 O.co2 13 ASP368 -0.5000 DICT 108 OD2 20.4241 -5.0783 35.4011 O.co2 13 ASP368 -0.5000 DICT 109 HG2 10.7486 14.7030 26.0272 H 1 GLU356 0.0000 DICT 110 H 8.8851 10.9917 26.2303 H 2 GLU357 0.0000 BACKBONE|DICT|ESSENTIAL|DIRECT 111 HA 7.4370 9.6596 28.3023 H 2 GLU357 0.0000 BACKBONE|DICT|DIRECT 112 HB3 6.8790 9.5963 25.8488 H 2 GLU357 0.0000 DICT 113 HB2 6.9354 7.9722 26.6142 H 2 GLU357 0.0000 DICT 114 HNCAP 11.7530 13.0714 26.3169 H 1 GLU356 0.0000 CAP|DICT 115 HG3 8.0451 7.8242 24.4558 H 2 GLU357 0.0000 DICT 116 HG2 9.3045 7.7222 25.7326 H 2 GLU357 0.0000 DICT 117 H 10.5248 8.8516 26.6181 H 3 VAL358 0.0000 BACKBONE|DICT|ESSENTIAL|DIRECT 118 HA 10.9543 6.5263 28.2913 H 3 VAL358 0.0000 BACKBONE|DICT|DIRECT 119 HB 13.0449 8.1780 26.7721 H 3 VAL358 0.0000 DICT 120 HG13 13.9482 6.4421 28.3140 H 3 VAL358 0.0000 DICT 121 HG12 14.2022 5.9674 26.6003 H 3 VAL358 0.0000 DICT 122 HG11 12.8850 5.2081 27.5568 H 3 VAL358 0.0000 DICT 123 HG23 11.2524 5.8893 25.7651 H 3 VAL358 0.0000 DICT 124 HG22 12.5865 6.6625 24.8437 H 3 VAL358 0.0000 DICT 125 HG21 11.1248 7.6129 25.2757 H 3 VAL358 0.0000 DICT 126 H 13.0760 6.4065 29.6552 H 4 ASP359 0.0000 BACKBONE|DICT|ESSENTIAL|DIRECT 127 HA 13.5790 8.9741 31.0051 H 4 ASP359 0.0000 BACKBONE|DICT|DIRECT 128 HB3 12.2788 6.6053 32.4322 H 4 ASP359 0.0000 DICT 129 HB2 11.5894 8.2453 32.1837 H 4 ASP359 0.0000 DICT 130 H 15.6323 9.1825 31.4096 H 5 CHU360 0.0000 BACKBONE|DICT|ESSENTIAL|DIRECT 131 HA 17.4812 6.9679 31.2265 H 5 CHU360 0.0000 BACKBONE|DICT|DIRECT 132 H5 18.2212 9.3031 30.8549 H 5 CHU360 0.0000 133 CB 19.7871 6.3470 37.0968 C.3 9 CHV364 0.0000 DICT 134 C1 18.6230 10.7759 33.2742 C.3 5 CHU360 0.0000 DICT 135 C3 19.3106 9.9744 34.3443 C.2 5 CHU360 0.0000 DICT 136 HB11 17.6484 1.1348 32.8043 H 8 AIB363 0.0000 DICT 137 HB12 17.3393 0.9446 34.5635 H 8 AIB363 0.0000 DICT 138 HB13 19.0144 0.8189 33.9273 H 8 AIB363 0.0000 DICT 139 H 15.7506 8.6834 33.8418 H 6 GLU361 0.0000 BACKBONE|DICT|ESSENTIAL|DIRECT 140 HA 17.1426 7.4664 36.0084 H 6 GLU361 0.0000 BACKBONE|DICT|DIRECT 141 HB3 14.2029 8.3269 35.9561 H 6 GLU361 0.0000 DICT 142 HB2 15.5789 9.4713 36.1102 H 6 GLU361 0.0000 DICT 143 HG3 14.8837 7.1714 38.0256 H 6 GLU361 0.0000 DICT 144 HG2 14.6991 8.9286 38.3492 H 6 GLU361 0.0000 DICT 145 H 14.9797 6.0761 33.6752 H 7 ASP362 0.0000 BACKBONE|DICT|ESSENTIAL|DIRECT 146 HA 13.9865 3.9287 35.3115 H 7 ASP362 0.0000 BACKBONE|DICT|DIRECT 147 HB3 13.9178 2.6759 33.1049 H 7 ASP362 0.0000 DICT 148 HB2 14.7858 4.0528 32.3450 H 7 ASP362 0.0000 DICT 149 H 16.8407 4.1913 33.1144 H 8 AIB363 0.0000 BACKBONE|DICT|ESSENTIAL 150 HB21 18.7919 3.0488 31.9217 H 8 AIB363 0.0000 DICT 151 HB22 20.1813 2.9468 33.0555 H 8 AIB363 0.0000 DICT 152 HB23 19.2203 4.4604 32.9467 H 8 AIB363 0.0000 DICT 153 H 18.6761 5.1716 35.0302 H 9 CHV364 0.0000 BACKBONE|DICT|ESSENTIAL|DIRECT 154 HA 20.6654 4.4039 36.8853 H 9 CHV364 0.0000 BACKBONE|DICT|DIRECT 155 H 17.1324 4.9515 37.4315 H 10 ALA365 0.0000 BACKBONE|DICT|ESSENTIAL|DIRECT 156 HA 17.4087 3.7721 40.1031 H 10 ALA365 0.0000 BACKBONE|DICT|DIRECT 157 HB3 14.9184 4.4816 38.4567 H 10 ALA365 0.0000 DICT 158 HB2 15.7138 5.5289 39.6802 H 10 ALA365 0.0000 DICT 159 HB1 14.9299 3.9937 40.1854 H 10 ALA365 0.0000 DICT 160 H 18.6242 1.9704 38.8610 H 11 ARG366 0.0000 BACKBONE|DICT|ESSENTIAL|DIRECT 161 HA 16.7679 -0.2890 38.8745 H 11 ARG366 0.0000 BACKBONE|DICT|DIRECT 162 HB3 18.0550 -0.8716 36.4838 H 11 ARG366 0.0000 DICT 163 HB2 17.7679 0.8940 36.3194 H 11 ARG366 0.0000 DICT 164 HG3 15.3653 0.5814 36.8270 H 11 ARG366 0.0000 DICT 165 HG2 15.6287 -1.1744 37.0996 H 11 ARG366 0.0000 DICT 166 HD3 15.9155 -1.6264 34.8202 H 11 ARG366 0.0000 DICT 167 HD2 16.5341 0.0214 34.4620 H 11 ARG366 0.0000 DICT 168 HE 13.6425 -0.4382 35.1906 H 11 ARG366 0.0000 DICT|ESSENTIAL 169 HH11 16.2201 0.7170 33.0787 H 11 ARG366 0.0000 DICT|ESSENTIAL 170 HH12 15.0837 1.5791 32.0072 H 11 ARG366 0.0000 DICT|ESSENTIAL 171 HH21 12.2578 0.6482 33.8366 H 11 ARG366 0.0000 DICT|ESSENTIAL 172 HH22 12.8895 1.5409 32.4270 H 11 ARG366 0.0000 DICT|ESSENTIAL 173 HA 20.4259 -2.3804 40.1856 H 12 PRO367 0.0000 BACKBONE|DICT|DIRECT 174 HB3 19.5717 -4.5577 40.1002 H 12 PRO367 0.0000 DICT 175 HB2 20.2909 -4.6914 38.4597 H 12 PRO367 0.0000 DICT 176 HG2 18.2238 -4.5434 37.4595 H 12 PRO367 0.0000 DICT 177 HG3 17.5071 -4.7198 39.0971 H 12 PRO367 0.0000 DICT 178 HD2 17.3675 -2.3908 37.4007 H 12 PRO367 0.0000 DICT 179 HD3 16.8702 -2.4897 39.1239 H 12 PRO367 0.0000 DICT 180 H 19.8224 -2.8382 36.6383 H 13 ASP368 0.0000 BACKBONE|DICT|ESSENTIAL|DIRECT 181 HA 22.7134 -2.5113 36.1472 H 13 ASP368 0.0000 BACKBONE|DICT|DIRECT 182 HB3 22.0472 -2.8235 33.7472 H 13 ASP368 0.0000 DICT 183 HB2 20.3195 -2.8179 34.2389 H 13 ASP368 0.0000 DICT 184 H6 18.2115 11.6945 33.7177 H 5 CHU360 0.0000 185 C2 19.3149 8.4828 36.3104 C.3 9 CHV364 0.0000 DICT 186 C4 18.6149 9.2910 35.2587 C.2 9 CHV364 0.0000 DICT 187 OG 19.0570 7.0896 36.1172 O.3 9 CHV364 0.0000 DICT 188 H8 19.3525 11.0401 32.4944 H 5 CHU360 0.0000 189 H9 20.3989 9.9500 34.3751 H 5 CHU360 0.0000 190 H7 22.3303 -0.3834 34.7064 H 13 ASP368 0.0000 @BOND 1 2 1 1 BACKBONE|DICT 2 2 5 1 DICT 3 2 3 1 BACKBONE|DICT 4 3 4 2 BACKBONE|DICT 5 5 6 1 DICT 6 6 7 1 DICT 7 7 9 ar DICT 8 7 8 ar DICT 9 11 10 1 BACKBONE|DICT 10 11 14 1 DICT 11 11 12 1 BACKBONE|DICT 12 12 13 2 BACKBONE|DICT 13 14 15 1 DICT 14 15 16 1 DICT 15 16 18 ar DICT 16 16 17 ar DICT 17 3 10 am BACKBONE|DICT|INTERRES 18 20 19 1 BACKBONE|DICT 19 20 23 1 DICT 20 20 21 1 BACKBONE|DICT 21 21 22 2 BACKBONE|DICT 22 23 25 1 DICT 23 23 24 1 DICT 24 12 19 am BACKBONE|DICT|INTERRES 25 27 26 1 BACKBONE|DICT 26 27 30 1 DICT 27 27 28 1 BACKBONE|DICT 28 28 29 2 BACKBONE|DICT 29 30 31 1 DICT 30 31 32 ar DICT 31 31 33 ar DICT 32 21 26 am BACKBONE|DICT|INTERRES 33 35 34 1 BACKBONE|DICT 34 35 41 1 DICT 35 35 36 1 BACKBONE|DICT 36 36 37 2 BACKBONE|DICT 37 72 133 1 DICT 38 186 135 2 39 133 39 1 DICT 40 28 34 am BACKBONE|DICT|INTERRES 41 43 42 1 BACKBONE|DICT 42 43 46 1 DICT 43 43 44 1 BACKBONE|DICT 44 44 45 2 BACKBONE|DICT 45 46 47 1 DICT 46 47 48 1 DICT 47 48 50 ar DICT 48 48 49 ar DICT 49 36 42 am BACKBONE|DICT|INTERRES 50 52 51 1 BACKBONE|DICT 51 52 55 1 DICT 52 52 53 1 BACKBONE|DICT 53 53 54 2 BACKBONE|DICT 54 55 56 1 DICT 55 56 57 ar DICT 56 56 58 ar DICT 57 44 51 am BACKBONE|DICT|INTERRES 58 60 59 1 BACKBONE|DICT 59 60 65 1 DICT 60 60 61 1 BACKBONE|DICT 61 61 62 2 BACKBONE|DICT 62 60 40 1 DICT 63 133 63 1 DICT 64 41 67 1 DICT 65 67 134 1 DICT 66 134 135 1 DICT 67 1 114 1 CAP|DICT 68 1 68 1 BACKBONE|DICT 69 2 69 1 BACKBONE|DICT 70 53 59 am BACKBONE|DICT|INTERRES 71 72 71 1 BACKBONE|DICT 72 5 70 1 DICT 73 72 73 1 BACKBONE|DICT 74 73 74 2 BACKBONE|DICT 75 185 64 1 DICT 76 5 75 1 DICT 77 61 71 am BACKBONE|DICT|INTERRES 78 79 78 1 BACKBONE|DICT 79 79 82 1 DICT 80 79 80 1 BACKBONE|DICT 81 80 81 2 BACKBONE|DICT 82 73 78 am BACKBONE|DICT|INTERRES 83 84 83 1 BACKBONE|DICT 84 84 87 1 DICT 85 84 85 1 BACKBONE|DICT 86 85 86 2 BACKBONE|DICT 87 87 88 1 DICT 88 88 89 1 DICT 89 89 90 1 DICT 90 90 91 ar DICT 91 91 93 ar DICT 92 91 92 ar DICT 93 80 83 am BACKBONE|DICT|INTERRES 94 95 96 1 BACKBONE|DICT 95 95 98 1 DICT 96 95 94 1 BACKBONE|DICT 97 94 100 1 DICT 98 100 99 1 DICT 99 99 98 1 DICT 100 96 97 2 BACKBONE|DICT 101 85 94 am BACKBONE|DICT|INTERRES 102 102 101 1 BACKBONE|DICT 103 102 105 1 DICT 104 102 103 1 BACKBONE|DICT 105 103 104 2 BACKBONE|DICT 106 105 106 1 DICT 107 106 107 ar DICT 108 106 108 ar DICT 109 96 101 am BACKBONE|DICT|INTERRES 110 6 77 1 DICT 111 6 109 1 DICT 112 10 110 1 BACKBONE|DICT 113 11 111 1 BACKBONE|DICT 114 14 112 1 DICT 115 14 113 1 DICT 116 15 115 1 DICT 117 15 116 1 DICT 118 19 117 1 BACKBONE|DICT 119 20 118 1 BACKBONE|DICT 120 23 119 1 DICT 121 24 120 1 DICT 122 24 121 1 DICT 123 24 122 1 DICT 124 25 123 1 DICT 125 25 124 1 DICT 126 25 125 1 DICT 127 26 126 1 BACKBONE|DICT 128 27 127 1 BACKBONE|DICT 129 30 128 1 DICT 130 30 129 1 DICT 131 34 130 1 BACKBONE|DICT 132 35 131 1 BACKBONE|DICT 133 185 66 1 DICT 134 186 38 1 DICT 135 41 76 1 136 187 185 1 DICT 137 40 136 1 DICT 138 40 137 1 DICT 139 40 138 1 DICT 140 42 139 1 BACKBONE|DICT 141 43 140 1 BACKBONE|DICT 142 46 141 1 DICT 143 46 142 1 DICT 144 47 143 1 DICT 145 47 144 1 DICT 146 51 145 1 BACKBONE|DICT 147 52 146 1 BACKBONE|DICT 148 55 147 1 DICT 149 55 148 1 DICT 150 59 149 1 BACKBONE|DICT 151 65 150 1 DICT 152 65 151 1 DICT 153 65 152 1 DICT 154 71 153 1 BACKBONE|DICT 155 72 154 1 BACKBONE|DICT 156 78 155 1 BACKBONE|DICT 157 79 156 1 BACKBONE|DICT 158 82 157 1 DICT 159 82 158 1 DICT 160 82 159 1 DICT 161 83 160 1 BACKBONE|DICT 162 84 161 1 BACKBONE|DICT 163 87 162 1 DICT 164 87 163 1 DICT 165 88 164 1 DICT 166 88 165 1 DICT 167 89 166 1 DICT 168 89 167 1 DICT 169 90 168 1 DICT 170 92 169 1 DICT 171 92 170 1 DICT 172 93 171 1 DICT 173 93 172 1 DICT 174 95 173 1 BACKBONE|DICT 175 98 174 1 DICT 176 98 175 1 DICT 177 99 176 1 DICT 178 99 177 1 DICT 179 100 178 1 DICT 180 100 179 1 DICT 181 101 180 1 BACKBONE|DICT 182 102 181 1 BACKBONE|DICT 183 105 182 1 DICT 184 105 183 1 DICT 185 185 186 1 DICT 186 133 187 1 DICT 187 41 132 1 188 134 184 1 189 134 188 1 190 135 189 1 191 103 190 1 @SUBSTRUCTURE 1 GLU356 2 RESIDUE 4 B GLU 1 ROOT GLU B 356 2 GLU357 11 RESIDUE 4 B GLU 2 **** GLU B 357 3 VAL358 20 RESIDUE 4 B VAL 2 **** VAL B 358 4 ASP359 27 RESIDUE 4 B ASP 2 **** ASP B 359 5 CHU360 35 RESIDUE 4 B CHU 3 **** LEU B 360 6 GLU361 43 RESIDUE 4 B GLU 2 **** GLU B 361 7 ASP362 52 RESIDUE 4 B ASP 2 **** ASP B 362 8 AIB363 60 RESIDUE 4 B AIB 2 **** TYR B 363 9 CHV364 72 RESIDUE 4 B CHV 3 **** VAL B 364 10 ALA365 79 RESIDUE 4 B ALA 2 **** ALA B 365 11 ARG366 84 RESIDUE 4 B ARG 2 **** ARG B 366 12 PRO367 95 RESIDUE 4 B PRO 2 **** PRO B 367 13 ASP368 102 RESIDUE 4 B ASP 1 **** ASP B 368 @SET HELIX_1_PDB STATIC SUBSTS AMSOM **** Class 1 helix; 6 35 43 52 60 72 79 CHAIN_HEAD STATIC SUBSTS AMSOM **** 1 2 CHAIN_TAIL STATIC SUBSTS AMSOM **** 1 102 @NORMAL @FF_PBC FORCE_FIELD_SETUP_FEATURE Force Field Setup information v1.0 0 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 NONE 0 0 0 0 0 0 0 0 0 0 0 0 0