REMARK This residue is converted from PDB Protein Databank automatically.The original name of this chemical component in PDB is = "C15-(R)-METHYLTHIENYL RAPAMYCIN" RESIDUE ARD 55 173 1 173 1 CHI1 0 0 0.0000 41 1 2 3 40 2 CHI2 0 0 0.0000 1 2 3 4 39 3 CHI3 0 0 0.0000 2 3 4 5 8 4 CHI4 0 0 0.0000 2 3 9 10 38 5 CHI5 0 0 0.0000 3 9 10 11 35 6 CHI6 0 0 0.0000 9 10 11 12 34 7 CHI7 0 0 0.0000 10 11 12 13 31 8 CHI8 0 0 0.0000 11 12 13 14 18 9 CHI9 0 0 0.0000 12 13 14 15 18 10 CHI10 0 0 0.0000 11 12 19 20 30 11 CHI11 0 0 0.0000 12 19 20 21 21 12 CHI12 0 0 0.0000 12 19 22 23 29 13 CHI13 0 0 0.0000 19 22 23 24 26 14 PHI1 0 0 0.0000 2 1 41 43 0 15 PHI2 0 0 0.0000 1 41 43 61 0 16 CHI14 0 0 0.0000 41 43 44 45 59 17 CHI15 0 0 0.0000 43 44 45 46 56 18 CHI16 0 0 0.0000 44 45 46 47 53 19 CHI17 0 0 0.0000 45 46 47 48 50 20 PHI3 0 0 0.0000 41 43 61 62 0 21 PHI4 0 0 0.0000 43 61 62 64 0 22 PHI5 0 0 0.0000 61 62 64 66 0 23 PHI6 0 0 0.0000 62 64 66 84 0 24 CHI18 0 0 0.0000 64 66 67 68 81 25 CHI19 0 0 0.0000 66 67 68 69 75 26 CHI20 0 0 0.0000 67 68 69 70 72 27 CHI21 0 0 0.0000 66 67 76 77 80 28 CHI22 0 0 0.0000 64 66 82 83 83 29 PHI7 0 0 0.0000 64 66 84 85 0 30 PHI8 0 0 0.0000 66 84 85 87 0 31 PHI9 0 0 0.0000 84 85 87 91 0 32 PHI10 0 0 0.0000 85 87 91 162 0 33 CHI23 0 0 0.0000 87 91 92 93 160 34 CHI24 0 0 0.0000 91 92 93 94 97 35 CHI25 0 0 0.0000 92 98 99 100 159 36 CHI26 0 0 0.0000 99 100 101 102 157 37 CHI27 0 0 0.0000 101 102 103 104 155 38 CHI28 0 0 0.0000 102 103 104 105 108 39 CHI29 0 0 0.0000 102 103 109 110 154 40 CHI30 0 0 0.0000 103 109 110 111 151 41 CHI31 0 0 0.0000 109 110 111 112 115 42 CHI32 0 0 0.0000 109 110 116 117 150 43 CHI33 0 0 0.0000 110 116 118 119 150 44 CHI34 0 0 0.0000 116 118 119 120 124 45 CHI35 0 0 0.0000 118 119 120 121 124 46 CHI36 0 0 0.0000 116 118 125 126 149 47 CHI37 0 0 0.0000 118 125 126 127 127 48 CHI38 0 0 0.0000 118 125 128 129 148 49 CHI39 0 0 0.0000 125 128 129 130 133 50 CHI40 0 0 0.0000 128 134 135 136 147 51 CHI41 0 0 0.0000 134 135 136 137 140 52 CHI42 0 0 0.0000 134 135 141 142 146 53 CHI43 0 0 0.0000 135 141 143 144 146 54 PHI11 0 0 0.0000 87 91 162 173 0 55 CHI44 0 0 0.0000 164 165 166 167 170 1 O1 O_EST 0 0.0000 -1.7790 -1.8400 2.4660 2 41 0 0 0 2 C33 C_ALI 0 0.0000 -2.6090 -1.2170 1.4520 1 3 40 143 0 3 C34 C_ALI 0 0.0000 -3.5900 -0.2550 2.1240 2 4 9 39 0 4 C48 C_ALI 0 0.0000 -4.4730 0.3980 1.0580 3 5 6 7 0 5 H481 H_ALI 0 0.0000 -3.8430 0.8690 0.3030 4 0 0 0 8 6 H482 H_ALI 0 0.0000 -5.0980 -0.3600 0.5880 4 0 0 0 8 7 H483 H_ALI 0 0.0000 -5.1060 1.1530 1.5250 4 0 0 0 8 8 Q1 PSEUD 0 0.0000 -4.6823 0.5540 0.8053 0 0 0 0 0 9 C35 C_ALI 0 0.0000 -2.8110 0.8260 2.8740 3 10 36 37 0 10 C36 C_ALI 0 0.0000 -3.7860 1.7040 3.6610 9 11 23 35 0 11 C37 C_ALI 0 0.0000 -4.4510 0.8710 4.7590 10 12 32 33 0 12 C38 C_ALI 0 0.0000 -5.4260 1.7490 5.5460 11 13 19 31 0 13 O12 O_EST 0 0.0000 -6.0460 0.9710 6.5720 12 14 0 0 0 14 C51 C_ALI 0 0.0000 -7.3460 1.5260 6.7810 13 15 16 17 0 15 H511 H_ALI 0 0.0000 -7.8610 0.9620 7.5590 14 0 0 0 18 16 H512 H_ALI 0 0.0000 -7.2520 2.5670 7.0890 14 0 0 0 18 17 H513 H_ALI 0 0.0000 -7.9180 1.4710 5.8550 14 0 0 0 18 18 Q2 PSEUD 0 0.0000 -7.6770 1.6667 6.8343 0 0 0 0 0 19 C39 C_ALI 0 0.0000 -4.6640 2.9150 6.1800 12 20 22 30 0 20 O13 O_HYD 0 0.0000 -5.5750 3.7350 6.9150 19 21 0 0 0 21 HO' H_OXY 0 0.0000 -5.0560 4.4560 7.2970 20 0 0 0 0 22 C40 C_ALI 0 0.0000 -4.0000 3.7480 5.0820 19 23 27 28 0 23 C41 C_ALI 0 0.0000 -3.0250 2.8700 4.2950 10 22 24 25 0 24 H411 H_ALI 0 0.0000 -2.2610 2.4820 4.9690 23 0 0 0 26 25 H412 H_ALI 0 0.0000 -2.5520 3.4630 3.5130 23 0 0 0 26 26 Q3 PSEUD 0 0.0000 -2.4065 2.9725 4.2410 0 0 0 0 0 27 H401 H_ALI 0 0.0000 -3.4580 4.5790 5.5340 22 0 0 0 29 28 H402 H_ALI 0 0.0000 -4.7640 4.1360 4.4080 22 0 0 0 29 29 Q4 PSEUD 0 0.0000 -4.1110 4.3575 4.9710 0 0 0 0 0 30 H39 H_ALI 0 0.0000 -3.9010 2.5270 6.8540 19 0 0 0 0 31 H38 H_ALI 0 0.0000 -6.1890 2.1380 4.8720 12 0 0 0 0 32 H371 H_ALI 0 0.0000 -3.6870 0.4830 5.4330 11 0 0 0 34 33 H372 H_ALI 0 0.0000 -4.9930 0.0410 4.3070 11 0 0 0 34 34 Q5 PSEUD 0 0.0000 -4.3400 0.2620 4.8700 0 0 0 0 0 35 H36 H_ALI 0 0.0000 -4.5500 2.0930 2.9870 10 0 0 0 0 36 H351 H_ALI 0 0.0000 -2.2630 1.4410 2.1600 9 0 0 0 38 37 H352 H_ALI 0 0.0000 -2.1090 0.3560 3.5630 9 0 0 0 38 38 Q6 PSEUD 0 0.0000 -2.1860 0.8985 2.8615 0 0 0 0 0 39 H34 H_ALI 0 0.0000 -4.2160 -0.8050 2.8260 3 0 0 0 0 40 H33 H_ALI 0 0.0000 -1.9770 -0.6780 0.7470 2 0 0 0 0 41 C1 C_BYL 0 0.0000 -0.5750 -1.3280 2.8030 1 42 43 0 0 42 O2 O_BYL 0 0.0000 -0.1380 -0.4090 2.1630 41 0 0 0 0 43 C2 C_ALI 0 0.0000 0.1530 -1.9370 3.9570 41 44 60 61 0 44 C3 C_ALI 0 0.0000 -0.5340 -1.5700 5.2770 43 45 57 58 0 45 C4 C_ALI 0 0.0000 0.1240 -2.3500 6.4190 44 46 54 55 0 46 C5 C_ALI 0 0.0000 1.6170 -2.0190 6.4880 45 47 51 52 0 47 C6 C_ALI 0 0.0000 2.2820 -2.4020 5.1570 46 48 49 61 0 48 H61 H_ALI 0 0.0000 2.1540 -3.4630 4.9650 47 0 0 0 50 49 H62 H_ALI 0 0.0000 3.3350 -2.1320 5.1760 47 0 0 0 50 50 Q7 PSEUD 0 0.0000 2.7445 -2.7975 5.0705 0 0 0 0 0 51 H51 H_ALI 0 0.0000 2.0800 -2.5780 7.3010 46 0 0 0 53 52 H52 H_ALI 0 0.0000 1.7450 -0.9500 6.6630 46 0 0 0 53 53 Q8 PSEUD 0 0.0000 1.9125 -1.7640 6.9820 0 0 0 0 0 54 H41 H_ALI 0 0.0000 -0.0020 -3.4180 6.2480 45 0 0 0 56 55 H42 H_ALI 0 0.0000 -0.3530 -2.0760 7.3610 45 0 0 0 56 56 Q9 PSEUD 0 0.0000 -0.1775 -2.7470 6.8045 0 0 0 0 0 57 H31 H_ALI 0 0.0000 -1.5890 -1.8360 5.2140 44 0 0 0 59 58 H32 H_ALI 0 0.0000 -0.4290 -0.5030 5.4520 44 0 0 0 59 59 Q10 PSEUD 0 0.0000 -1.0090 -1.1695 5.3330 0 0 0 0 0 60 H2 H_ALI 0 0.0000 0.0770 -3.0380 3.8490 43 0 0 0 0 61 N1 N_AMI 0 0.0000 1.5790 -1.6200 4.1030 43 47 62 0 0 62 C7 C_BYL 0 0.0000 2.2890 -0.7310 3.4090 61 63 64 0 0 63 O3 O_BYL 0 0.0000 1.7590 0.2990 3.0480 62 0 0 0 0 64 C8 C_BYL 0 0.0000 3.7290 -0.8580 3.1350 62 65 66 0 0 65 O4 O_BYL 0 0.0000 4.1990 -1.9680 3.1760 64 0 0 0 0 66 C9 C_ALI 0 0.0000 4.6500 0.2750 2.7820 64 67 82 84 0 67 C10 C_ALI 0 0.0000 6.0730 -0.0990 3.2010 66 68 76 81 0 68 C11 C_ALI 0 0.0000 7.0540 1.0150 2.8270 67 69 73 74 0 69 C12 C_ALI 0 0.0000 6.9100 1.2850 1.3170 68 70 71 85 0 70 H121 H_ALI 0 0.0000 7.1900 0.3900 0.7630 69 0 0 0 72 71 H122 H_ALI 0 0.0000 7.5510 2.1180 1.0280 69 0 0 0 72 72 Q11 PSEUD 0 0.0000 7.3705 1.2540 0.8955 0 0 0 0 0 73 H111 H_ALI 0 0.0000 8.0740 0.6960 3.0480 68 0 0 0 75 74 H112 H_ALI 0 0.0000 6.8170 1.9170 3.3880 68 0 0 0 75 75 Q12 PSEUD 0 0.0000 7.4455 1.3065 3.2180 0 0 0 0 0 76 C42 C_ALI 0 0.0000 6.1240 -0.3020 4.7200 67 77 78 79 0 77 H421 H_ALI 0 0.0000 7.1360 -0.5820 5.0150 76 0 0 0 80 78 H422 H_ALI 0 0.0000 5.8430 0.6230 5.2200 76 0 0 0 80 79 H423 H_ALI 0 0.0000 5.4310 -1.0940 5.0040 76 0 0 0 80 80 Q13 PSEUD 0 0.0000 6.1367 -0.3510 5.0797 0 0 0 0 0 81 H10 H_ALI 0 0.0000 6.3710 -1.0230 2.7070 67 0 0 0 0 82 O6 O_HYD 0 0.0000 4.2490 1.4380 3.5170 66 83 0 0 0 83 HO6 H_OXY 0 0.0000 3.3500 1.6510 3.2330 82 0 0 0 0 84 O5 O_EST 0 0.0000 4.6020 0.5430 1.3850 66 85 0 0 0 85 C13 C_ALI 0 0.0000 5.4410 1.6400 1.0770 69 84 86 87 0 86 H13 H_ALI 0 0.0000 5.2120 2.4360 1.8310 85 0 0 0 0 87 C14 C_ALI 0 0.0000 5.2000 2.2840 -0.2620 85 88 89 91 0 88 H141 H_ALI 0 0.0000 5.6660 3.2750 -0.2390 87 0 0 0 90 89 H142 H_ALI 0 0.0000 4.1180 2.4310 -0.3660 87 0 0 0 90 90 Q14 PSEUD 0 0.0000 4.8920 2.8530 -0.3025 0 0 0 0 0 91 C15 C_ALI 0 0.0000 5.7060 1.5450 -1.4960 87 92 161 162 0 92 C16 C_BYL 0 0.0000 4.8870 2.0220 -2.6780 91 93 98 0 0 93 C43 C_ALI 0 0.0000 4.6730 3.5180 -2.8110 92 94 95 96 0 94 H431 H_ALI 0 0.0000 5.1280 3.8690 -3.7370 93 0 0 0 97 95 H432 H_ALI 0 0.0000 3.6040 3.7320 -2.8280 93 0 0 0 97 96 H433 H_ALI 0 0.0000 5.1320 4.0280 -1.9650 93 0 0 0 97 97 Q15 PSEUD 0 0.0000 4.6213 3.8763 -2.8433 0 0 0 0 0 98 C17 C_BYL 0 0.0000 4.3300 1.2230 -3.5690 92 99 160 0 0 99 C18 C_BYL 0 0.0000 3.4840 1.7930 -4.6240 98 100 159 0 0 100 C19 C_BYL 0 0.0000 2.7570 0.9680 -5.4040 99 101 158 0 0 101 C20 C_BYL 0 0.0000 1.8610 1.5580 -6.3980 100 102 157 0 0 102 C21 C_BYL 0 0.0000 1.0770 0.7650 -7.1230 101 103 156 0 0 103 C22 C_ALI 0 0.0000 0.1320 1.3510 -8.1390 102 104 109 155 0 104 C44 C_ALI 0 0.0000 0.7560 1.2520 -9.5340 103 105 106 107 0 105 H441 H_ALI 0 0.0000 1.6870 1.8180 -9.5570 104 0 0 0 108 106 H442 H_ALI 0 0.0000 0.9600 0.2070 -9.7670 104 0 0 0 108 107 H443 H_ALI 0 0.0000 0.0650 1.6600 -10.2710 104 0 0 0 108 108 Q16 PSEUD 0 0.0000 0.9040 1.2283 -9.8650 0 0 0 0 0 109 C23 C_ALI 0 0.0000 -1.1760 0.5550 -8.1080 103 110 152 153 0 110 C24 C_ALI 0 0.0000 -1.9730 0.9210 -6.8550 109 111 116 151 0 111 C45 C_ALI 0 0.0000 -2.7810 2.1950 -7.1240 110 112 113 114 0 112 H451 H_ALI 0 0.0000 -3.3510 2.4590 -6.2340 111 0 0 0 115 113 H452 H_ALI 0 0.0000 -2.1010 3.0090 -7.3750 111 0 0 0 115 114 H453 H_ALI 0 0.0000 -3.4640 2.0230 -7.9560 111 0 0 0 115 115 Q17 PSEUD 0 0.0000 -2.9720 2.4970 -7.1883 0 0 0 0 0 116 C25 C_BYL 0 0.0000 -2.9200 -0.2000 -6.5090 110 117 118 0 0 117 O8 O_BYL 0 0.0000 -2.9910 -1.1750 -7.2160 116 0 0 0 0 118 C26 C_ALI 0 0.0000 -3.7750 -0.1010 -5.2690 116 119 125 150 0 119 O9 O_EST 0 0.0000 -2.9350 0.0970 -4.1300 118 120 0 0 0 120 C50 C_ALI 0 0.0000 -2.7650 1.5080 -3.9830 119 121 122 123 0 121 H501 H_ALI 0 0.0000 -2.1280 1.7100 -3.1220 120 0 0 0 124 122 H502 H_ALI 0 0.0000 -2.3010 1.9140 -4.8820 120 0 0 0 124 123 H503 H_ALI 0 0.0000 -3.7380 1.9770 -3.8330 120 0 0 0 124 124 Q18 PSEUD 0 0.0000 -2.7223 1.8670 -3.9457 0 0 0 0 0 125 C27 C_ALI 0 0.0000 -4.5910 -1.3810 -5.0870 118 126 128 149 0 126 O10 O_HYD 0 0.0000 -5.7300 -1.3510 -5.9480 125 127 0 0 0 127 HO1 H_OXY 0 0.0000 -6.2150 -2.1740 -5.7980 126 0 0 0 0 128 C28 C_BYL 0 0.0000 -5.0540 -1.4780 -3.6520 125 129 134 0 0 129 C46 C_ALI 0 0.0000 -6.1090 -0.5300 -3.1490 128 130 131 132 0 130 H461 H_ALI 0 0.0000 -6.3130 -0.7370 -2.0990 129 0 0 0 133 131 H462 H_ALI 0 0.0000 -5.7550 0.4950 -3.2540 129 0 0 0 133 132 H463 H_ALI 0 0.0000 -7.0220 -0.6610 -3.7300 129 0 0 0 133 133 Q19 PSEUD 0 0.0000 -6.3633 -0.3010 -3.0277 0 0 0 0 0 134 C29 C_BYL 0 0.0000 -4.5170 -2.3830 -2.8800 128 135 148 0 0 135 C30 C_ALI 0 0.0000 -4.8930 -2.5500 -1.4300 134 136 141 147 0 136 C47 C_ALI 0 0.0000 -4.8210 -4.0370 -1.0630 135 137 138 139 0 137 H471 H_ALI 0 0.0000 -5.5460 -4.5940 -1.6570 136 0 0 0 140 138 H472 H_ALI 0 0.0000 -3.8190 -4.4140 -1.2660 136 0 0 0 140 139 H473 H_ALI 0 0.0000 -5.0480 -4.1610 -0.0040 136 0 0 0 140 140 Q20 PSEUD 0 0.0000 -4.8043 -4.3897 -0.9757 0 0 0 0 0 141 C31 C_BYL 0 0.0000 -3.8900 -1.7740 -0.6090 135 142 143 0 0 142 O11 O_BYL 0 0.0000 -3.4830 -0.7100 -1.0220 141 0 0 0 0 143 C32 C_ALI 0 0.0000 -3.3920 -2.3030 0.7040 2 141 144 145 0 144 H321 H_ALI 0 0.0000 -2.7370 -3.1570 0.5320 143 0 0 0 146 145 H322 H_ALI 0 0.0000 -4.2360 -2.6120 1.3210 143 0 0 0 146 146 Q21 PSEUD 0 0.0000 -3.4865 -2.8845 0.9265 0 0 0 0 0 147 H30 H_ALI 0 0.0000 -5.8960 -2.1880 -1.2300 135 0 0 0 0 148 H29 H_ALI 0 0.0000 -3.7640 -3.0400 -3.3040 134 0 0 0 0 149 H27 H_ALI 0 0.0000 -3.9720 -2.2470 -5.3190 125 0 0 0 0 150 H26 H_ALI 0 0.0000 -4.4560 0.7450 -5.3670 118 0 0 0 0 151 H24 H_ALI 0 0.0000 -1.2920 1.0940 -6.0220 110 0 0 0 0 152 H231 H_ALI 0 0.0000 -0.9490 -0.5100 -8.0980 109 0 0 0 154 153 H232 H_ALI 0 0.0000 -1.7640 0.7950 -8.9950 109 0 0 0 154 154 Q22 PSEUD 0 0.0000 -1.3565 0.1425 -8.5465 0 0 0 0 0 155 H22 H_ALI 0 0.0000 -0.0570 2.3960 -7.9020 103 0 0 0 0 156 H21 H_ALI 0 0.0000 1.1250 -0.3040 -6.9730 102 0 0 0 0 157 H20 H_ALI 0 0.0000 1.8440 2.6280 -6.5350 101 0 0 0 0 158 H19 H_ALI 0 0.0000 2.8420 -0.0990 -5.2940 100 0 0 0 0 159 H18 H_ALI 0 0.0000 3.4240 2.8510 -4.8190 99 0 0 0 0 160 H17 H_ALI 0 0.0000 4.4740 0.1510 -3.5930 98 0 0 0 0 161 H15 H_ALI 0 0.0000 6.7560 1.7870 -1.6720 91 0 0 0 0 162 C49 C_ARO 0 0.0000 5.5470 0.0580 -1.3360 91 163 173 0 0 163 C54 C_ARO 0 0.0000 6.4930 -0.9110 -1.3840 162 164 172 0 0 164 C53 C_ARO 0 0.0000 6.1120 -2.2280 -1.2040 163 165 171 0 0 165 C52 C_ARO 0 0.0000 4.8030 -2.5110 -0.9950 164 166 173 0 0 166 C55 C_ALI 0 0.0000 4.1450 -3.8500 -0.7790 165 167 168 169 0 167 H551 H_ALI 0 0.0000 3.0730 -3.7090 -0.6420 166 0 0 0 170 168 H552 H_ALI 0 0.0000 4.3200 -4.4850 -1.6480 166 0 0 0 170 169 H553 H_ALI 0 0.0000 4.5660 -4.3230 0.1070 166 0 0 0 170 170 Q23 PSEUD 0 0.0000 3.9863 -4.1723 -0.7277 0 0 0 0 0 171 H53 H_ALI 0 0.0000 6.8470 -3.0190 -1.2330 164 0 0 0 0 172 H54 H_ALI 0 0.0000 7.5290 -0.6580 -1.5530 163 0 0 0 0 173 S1 S_RED 0 0.0000 4.0620 -0.8880 -1.0410 162 165 0 0 0