REMARK This residue is converted from PDB Protein Databank automatically.The original name of this chemical component in PDB is = N-[(1R)-1-[(BENZYLSULFONYL)METHYL]-2-{[(1S)-1-METHYL-2-{[4-(TRIFLUOROMETHOXY)PHENYL]AMINO}ETHYL]AMINO}-2-OXOETHYL]MORPHOLINE-4-CARBOXAMIDE RESIDUE GNQ 20 84 1 84 1 CHI1 0 0 0.0000 1 2 4 5 21 2 CHI2 0 0 0.0000 2 4 5 6 16 3 PHI1 0 0 0.0000 1 2 22 26 0 4 PHI2 0 0 0.0000 2 22 26 50 0 5 CHI3 0 0 0.0000 22 26 27 28 48 6 CHI4 0 0 0.0000 26 27 28 29 47 7 CHI5 0 0 0.0000 27 28 30 31 47 8 CHI6 0 0 0.0000 28 30 31 32 38 9 CHI7 0 0 0.0000 30 31 32 33 35 10 CHI8 0 0 0.0000 28 30 39 40 47 11 CHI9 0 0 0.0000 30 39 40 41 44 12 PHI3 0 0 0.0000 22 26 50 52 0 13 PHI4 0 0 0.0000 26 50 52 54 0 14 PHI5 0 0 0.0000 50 52 54 61 0 15 CHI10 0 0 0.0000 52 54 55 56 59 16 PHI6 0 0 0.0000 52 54 61 65 0 17 PHI7 0 0 0.0000 54 61 65 67 0 18 PHI8 0 0 0.0000 61 65 67 72 0 19 PHI9 0 0 0.0000 69 76 80 81 0 20 PHI10 0 0 0.0000 76 80 81 84 0 1 O5 O_XXX 0 0.0000 4.0760 -1.3180 -0.3590 2 0 0 0 0 2 S S_XXX 0 0.0000 2.7330 -1.7060 -0.6160 1 3 4 22 0 3 O4 O_XXX 0 0.0000 2.3640 -2.1370 -1.9190 2 0 0 0 0 4 C17 C_ALI 0 0.0000 2.2450 -2.9750 0.5860 2 5 19 20 0 5 C18 C_ARO 0 0.0000 3.0550 -4.2240 0.3530 4 6 10 0 0 6 C20 C_ARO 0 0.0000 2.5890 -5.1990 -0.5090 5 7 9 0 0 7 C21 C_ARO 0 0.0000 3.3340 -6.3440 -0.7250 6 8 12 0 0 8 H21 H_ALI 0 0.0000 2.9720 -7.1030 -1.4030 7 0 0 0 17 9 H20 H_ALI 0 0.0000 1.6470 -5.0640 -1.0190 6 0 0 0 16 10 C19 C_ARO 0 0.0000 4.2600 -4.3990 1.0070 5 11 15 0 0 11 C23 C_ARO 0 0.0000 5.0030 -5.5450 0.7940 10 12 14 0 0 12 C22 C_ARO 0 0.0000 4.5400 -6.5170 -0.0720 7 11 13 0 0 13 H22 H_ALI 0 0.0000 5.1200 -7.4130 -0.2390 12 0 0 0 0 14 H23 H_ALI 0 0.0000 5.9450 -5.6810 1.3040 11 0 0 0 17 15 H19 H_ALI 0 0.0000 4.6220 -3.6390 1.6840 10 0 0 0 16 16 Q9 PSEUD 0 0.0000 3.1345 -4.3515 0.3325 0 0 0 0 18 17 Q10 PSEUD 0 0.0000 4.4585 -6.3920 -0.0495 0 0 0 0 18 18 QQA PSEUD 0 0.0000 3.7965 -5.3717 0.1415 0 0 0 0 0 19 H171 H_ALI 0 0.0000 2.4260 -2.6070 1.5960 4 0 0 0 21 20 H172 H_ALI 0 0.0000 1.1860 -3.2010 0.4660 4 0 0 0 21 21 Q1 PSEUD 0 0.0000 1.8060 -2.9040 1.0310 0 0 0 0 0 22 C16 C_ALI 0 0.0000 1.6230 -0.3670 -0.1000 2 23 24 26 0 23 H161 H_ALI 0 0.0000 1.8290 -0.1040 0.9370 22 0 0 0 25 24 H162 H_ALI 0 0.0000 0.5880 -0.6970 -0.1930 22 0 0 0 25 25 Q2 PSEUD 0 0.0000 1.2085 -0.4005 0.3720 0 0 0 0 0 26 CA C_ALI 0 0.0000 1.8510 0.8550 -0.9920 22 27 49 50 0 27 N N_AMO 0 0.0000 3.2410 1.2990 -0.8670 26 28 48 0 0 28 C11 C_BYL 0 0.0000 3.7230 1.6770 0.3340 27 29 30 0 0 29 O3 O_BYL 0 0.0000 3.0340 1.5610 1.3290 28 0 0 0 0 30 N3 N_AMO 0 0.0000 4.9680 2.1840 0.4310 28 31 39 0 0 31 C15 C_ALI 0 0.0000 5.7770 2.4610 -0.7690 30 32 36 37 0 32 C14 C_ALI 0 0.0000 6.3800 3.8620 -0.6250 31 33 34 41 0 33 H141 H_ALI 0 0.0000 7.0430 4.0610 -1.4670 32 0 0 0 35 34 H142 H_ALI 0 0.0000 5.5800 4.6020 -0.6100 32 0 0 0 35 35 Q3 PSEUD 0 0.0000 6.3115 4.3315 -1.0385 0 0 0 0 0 36 H151 H_ALI 0 0.0000 6.5750 1.7230 -0.8520 31 0 0 0 38 37 H152 H_ALI 0 0.0000 5.1450 2.4220 -1.6560 31 0 0 0 38 38 Q4 PSEUD 0 0.0000 5.8600 2.0725 -1.2540 0 0 0 0 0 39 C12 C_ALI 0 0.0000 5.5690 2.4890 1.7400 30 40 45 46 0 40 C13 C_ALI 0 0.0000 6.1930 3.8820 1.6720 39 41 42 43 0 41 O2 O_EST 0 0.0000 7.1230 3.9410 0.5920 32 40 0 0 0 42 H131 H_ALI 0 0.0000 6.7100 4.0960 2.6080 40 0 0 0 44 43 H132 H_ALI 0 0.0000 5.4070 4.6210 1.5150 40 0 0 0 44 44 Q5 PSEUD 0 0.0000 6.0585 4.3585 2.0615 0 0 0 0 0 45 H121 H_ALI 0 0.0000 4.8020 2.4660 2.5140 39 0 0 0 47 46 H122 H_ALI 0 0.0000 6.3400 1.7520 1.9650 39 0 0 0 47 47 Q6 PSEUD 0 0.0000 5.5710 2.1090 2.2395 0 0 0 0 0 48 HN H_AMI 0 0.0000 3.8160 1.3200 -1.6490 27 0 0 0 0 49 HA H_ALI 0 0.0000 1.6450 0.5920 -2.0290 26 0 0 0 0 50 C C_BYL 0 0.0000 0.9280 1.9680 -0.5640 26 51 52 0 0 51 O O_BYL 0 0.0000 1.3460 2.8670 0.1340 50 0 0 0 0 52 N2 N_AMI 0 0.0000 -0.3610 1.9630 -0.9560 50 53 54 0 0 53 HN2 H_AMI 0 0.0000 -0.6950 1.2440 -1.5150 52 0 0 0 0 54 C9 C_ALI 0 0.0000 -1.2570 3.0440 -0.5400 52 55 60 61 0 55 C10 C_ALI 0 0.0000 -1.1190 4.2220 -1.5080 54 56 57 58 0 56 H101 H_ALI 0 0.0000 -1.3840 3.8980 -2.5140 55 0 0 0 59 57 H102 H_ALI 0 0.0000 -1.7860 5.0260 -1.1980 55 0 0 0 59 58 H103 H_ALI 0 0.0000 -0.0900 4.5800 -1.5000 55 0 0 0 59 59 Q7 PSEUD 0 0.0000 -1.0867 4.5013 -1.7373 0 0 0 0 0 60 H9 H_ALI 0 0.0000 -0.9930 3.3680 0.4660 54 0 0 0 0 61 C8 C_ALI 0 0.0000 -2.7020 2.5420 -0.5510 54 62 63 65 0 62 H81 H_ALI 0 0.0000 -3.3600 3.3170 -0.1580 61 0 0 0 64 63 H82 H_ALI 0 0.0000 -2.9950 2.3010 -1.5730 61 0 0 0 64 64 Q8 PSEUD 0 0.0000 -3.1775 2.8090 -0.8655 0 0 0 0 0 65 N1 N_AMI 0 0.0000 -2.8080 1.3420 0.2820 61 66 67 0 0 66 HN1 H_AMI 0 0.0000 -2.0230 0.9940 0.7340 65 0 0 0 0 67 C7 C_ARO 0 0.0000 -4.0420 0.6970 0.4270 65 68 72 0 0 68 C4 C_ARO 0 0.0000 -5.1670 1.1980 -0.2140 67 69 71 0 0 69 C3 C_ARO 0 0.0000 -6.3830 0.5580 -0.0750 68 70 76 0 0 70 H3 H_ALI 0 0.0000 -7.2570 0.9440 -0.5780 69 0 0 0 78 71 H4 H_ALI 0 0.0000 -5.0890 2.0830 -0.8290 68 0 0 0 77 72 C6 C_ARO 0 0.0000 -4.1430 -0.4400 1.2170 67 73 74 0 0 73 H6 H_ALI 0 0.0000 -3.2690 -0.8280 1.7200 72 0 0 0 77 74 C5 C_ARO 0 0.0000 -5.3610 -1.0760 1.3600 72 75 76 0 0 75 H5 H_ALI 0 0.0000 -5.4390 -1.9610 1.9740 74 0 0 0 78 76 C2 C_ARO 0 0.0000 -6.4830 -0.5790 0.7140 69 74 80 0 0 77 Q11 PSEUD 0 0.0000 -4.1790 0.6275 0.4455 0 0 0 0 79 78 Q12 PSEUD 0 0.0000 -6.3480 -0.5085 0.6980 0 0 0 0 79 79 QQB PSEUD 0 0.0000 -5.2635 0.0595 0.5717 0 0 0 0 0 80 O1 O_EST 0 0.0000 -7.6810 -1.2050 0.8550 76 81 0 0 0 81 C1 C_ALI 0 0.0000 -8.6280 -0.4650 0.0800 80 82 83 84 0 82 F1 X_XXX 0 0.0000 -8.2270 -0.4560 -1.2600 81 0 0 0 0 83 F2 X_XXX 0 0.0000 -9.8870 -1.0650 0.1860 81 0 0 0 0 84 F3 X_XXX 0 0.0000 -8.6950 0.8480 0.5560 81 0 0 0 0