A0A087WQ41_MOUSE Loading...

Calcium-activated potassium channel subunit alpha-1

Potassium channel activated by both membrane depolarization or increase in cytosolic Ca(2+) that mediates export of K(+).

AlphaFold DB , UniProt , Accession A0A087WQ41, Species MOUSE (Mus musculus, Mouse), Gene Kcnma1, Length 1,178 aa.

						>A0A087WQ41_MOUSE|A0A087WQ41|Kcnma1
MANGGGGGGGSSGGGGGGGGGSGLRMSSNIHANHLSLDASSSSSSSSSSSSSSSSSSSSSVHEPKMDALIIPVTMEVPCDSRGQRMWWAFLASSMVTFFGGLFIILLWRTLKYLWTVCCHCGGKTKEAQKINNGSSQADGTLKPVDEKEEVVAAEVGWMTSVKDWAGVMISAQTLTGRVLVVLVFALSIGALVIYFIDSSNPIESCQNFYKDFTLQIDMAFNVFFLLYFGLRFIAANDKLWFWLEVNSVVDFFTVPPVFVSVYLNRSWLGLRFLRALRLIQFSEILQFLNILKTSNSIKLVNLLSIFISTWLTAAGFIHLVENSGDPWENFQNNQALTYWECVYLLMVTMSTVGYGDVYAKTTLGRLFMVFFILGGLAMFASYVPEIIELIGNRKKYGGSYSAVSGRKHIVVCGHITLESVSNFLKDFLHKDRDDVNVEIVFLHNISPNLELEALFKRHFTQVEFYQGSVLNPHDLARVKIESADACLILANKYCADPDAEDASNIMRVISIKNYHPKIRIITQMLQYHNKAHLLNIPSWNWKEGDDAICLAELKLGFIAQSCLAQGLSTMLANLFSMRSFIKIEEDTWQKYYLEGVSNEMYTEYLSSAFVGLSFPTVCELCFVKLKLLMIAIEYKSANRESRILINPGNHLKIQEGTLGFFIASDAKEVKRAFFYCKACHDDVTDPKRIKKCGCRRLEDEQPPTLSPKKKQRNGGMRNSPNTSPKLMRHDPLLIPGNDQIDNMDSNVKKYDSTGMFHWCAPKEIEKVILTRSEAAMTVLSGHVVVCIFGDVSSALIGLRNLVMPLRASNFHYHELKHIVFVGSIEYLKREWETLHNFPKVSILPGTPLSRADLRAVNINLCDMCVILSANQNNIDDTSLQDKECILASLNIKSMQFDDSIGVLQANSQGFTPPGMDRSSPDNSPVHGMLRQPSITTGVNIPIITELVNDTNVQFLDQDDDDDPDTELYLTQPFACGTAFAVSVLDSLMSATYFNDNILTLIRTLVTGGATPELEALIAEENALRGGYSTPQTLANRDRCRVAQLALLDGPFADLGDGGCYGDLFCKALKTYNMLCFGIYRLRDAHLSTPSQCTKRYVITNPPYEFELVPTDLIFCLMQFDHNAGQSRASLSHSSHSSQSSSKKSSSVHSIPSTANRPNRPKSRESRDKQNRKEMVYR
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.4	Very low	31.5	Very low	248 Å²	248	109.5 Å²	109.5	100%	1.222	88%	0.881	S	S	*	*				0	153.5	0	-79.2	173.7	167.3	0	0	108.4
2	A	30.5	Very low	31.4	Very low	90 Å²	90	110.5 Å²	110.5	74%	0.744	88%	0.878	S	S	*	*			trans	-68.4	155.4	-176.1	0	0	0	0	0	111.5
3	N	34.4	Very low	31.2	Very low	168 Å²	168	108.5 Å²	108.5	90%	0.898	88%	0.877	S	S	*	*				-162	163.3	67.3	-110	-14.8	0	0	0	112.9
4	G	33.7	Very low	31.1	Very low	79 Å²	79	106.8 Å²	106.8	81%	0.814	88%	0.877	S	S	*	*			trans	-110	-170.6	172.6	0	0	0	0	0	113.8
5	G	30.9	Very low	30.8	Very low	85 Å²	85	105.5 Å²	105.5	88%	0.876	88%	0.878	S	S	*	*			trans	151.6	136.9	-179.5	0	0	0	0	0	107.3
6	G	30.6	Very low	30.6	Very low	78 Å²	78	103.9 Å²	103.9	80%	0.804	88%	0.876	S	S	*	*			cis	151.3	116.4	9.8	0	0	0	0	0	105.5
7	G	33.6	Very low	30.6	Very low	91 Å²	91	103.1 Å²	103.1	94%	0.938	88%	0.879	S	S	*	*			trans	-74.2	164.3	-164.8	0	0	0	0	0	115
8	G	30	Very low	30.4	Very low	82 Å²	82	102.1 Å²	102.1	85%	0.845	88%	0.879	S	S	*	*			trans	-155.9	113.8	168.7	0	0	0	0	0	110.2
9	G	32.4	Very low	30.3	Very low	86 Å²	86	101.3 Å²	101.3	89%	0.887	88%	0.879	S	S	*	*			trans	-91.6	155.1	172.4	0	0	0	0	0	111.7
10	G	29.1	Very low	30.2	Very low	83 Å²	83	100.6 Å²	100.6	86%	0.856	88%	0.88	S	S	*	*			trans	-155.7	121.3	174.6	0	0	0	0	0	110.7
11	S	30.6	Very low	30.2	Very low	115 Å²	115	99.6 Å²	99.6	80%	0.804	88%	0.878	S	S	*	*			trans	-97.5	155.9	-172.9	-78.8	0	0	0	0	114.1
12	S	30.5	Very low	30.1	Very low	121 Å²	121	93.9 Å²	93.9	85%	0.846	86%	0.862	S	S	*	*			trans	70.6	131.1	138.8	62.1	0	0	0	0	121.6
13	G	29.3	Very low	30	Very low	84 Å²	84	93.2 Å²	93.2	87%	0.866	86%	0.864	S	S	*	*			trans	139.1	115.4	161.8	0	0	0	0	0	111.8
14	G	28.9	Very low	29.7	Very low	85 Å²	85	93.6 Å²	93.6	88%	0.876	87%	0.865	S	S	*	*			cis	142.3	100.2	-4.1	0	0	0	0	0	112.2
15	G	27.3	Very low	29.5	Very low	87 Å²	87	100.5 Å²	100.5	90%	0.897	87%	0.867	S	S	*	*			trans	108.1	143.2	172.6	0	0	0	0	0	114.8
16	G	28.1	Very low	29.3	Very low	81 Å²	81	105.1 Å²	105.1	84%	0.835	87%	0.868	S	S	*	*			cis	156	135.4	-9.8	0	0	0	0	0	114.4
17	G	29.2	Very low	29.1	Very low	90 Å²	90	106.4 Å²	106.4	93%	0.928	86%	0.864	S	S	*	*			trans	97.6	135	158.2	0	0	0	0	0	117.5
18	G	27.2	Very low	28.9	Very low	85 Å²	85	107 Å²	107	88%	0.876	86%	0.855	S	S	*	*			trans	148.2	58.3	171.9	0	0	0	0	0	115.1
19	G	29.4	Very low	28.7	Very low	87 Å²	87	110.2 Å²	110.2	90%	0.897	85%	0.852	S	S	*	*			trans	-86	164.1	-172.6	0	0	0	0	0	116
20	G	27.4	Very low	28.5	Very low	86 Å²	86	113.3 Å²	113.3	89%	0.887	85%	0.847	S	S	*	*			trans	-168.4	107.1	168.8	0	0	0	0	0	109.8
21	G	29.7	Very low	28.4	Very low	81 Å²	81	117 Å²	117	84%	0.835	84%	0.841	S	S	*	*			trans	-122.9	153.3	-172.9	0	0	0	0	0	113.4
22	S	29.5	Very low	28.2	Very low	127 Å²	127	116.4 Å²	116.4	89%	0.888	84%	0.843	S	S	*	*			trans	-150.1	135.5	153.9	57.1	0	0	0	0	108.3
23	G	28.5	Very low	28.1	Very low	77 Å²	77	116.8 Å²	116.8	79%	0.794	84%	0.836	S	S	*	*			trans	-110.3	156	-175.7	0	0	0	0	0	112
24	L	28.4	Very low	28	Very low	176 Å²	176	121.3 Å²	121.3	92%	0.921	83%	0.834	S	S	*	*			trans	-131.9	127.2	171	-95.2	163.3	0	0	0	110.8
25	R	28.3	Very low	27.9	Very low	223 Å²	223	124 Å²	124	84%	0.842	83%	0.828	S	S	*	*			trans	-91.2	142.3	169.4	-70.2	171.6	166.5	173	-5.9	109.4
26	M	27.3	Very low	27.8	Very low	182 Å²	182	124.4 Å²	124.4	90%	0.897	82%	0.817	S	S	*	*			trans	-141.8	125.8	143	-68.2	-168.5	177.8	0	0	106.4
27	S	27.1	Very low	27.7	Very low	105 Å²	105	127.4 Å²	127.4	73%	0.734	81%	0.813	S	S	*	*			cis	74.1	86.1	29.4	-49.3	0	0	0	0	113.4
28	S	28	Very low	27.5	Very low	105 Å²	105	130.2 Å²	130.2	73%	0.734	81%	0.807	S	S	*	*			trans	-81.5	134.3	166	37.1	0	0	0	0	111.6
29	N	27.1	Very low	27.4	Very low	148 Å²	148	130.5 Å²	130.5	79%	0.791	80%	0.801	S	S	*	*				158.8	158.6	129.7	-86.9	-17.1	0	0	0	115.1
30	I	27.7	Very low	27.3	Very low	151 Å²	151	131.6 Å²	131.6	77%	0.774	80%	0.795	S	S	*	*			trans	93.7	103.8	159	-63.9	139.3	0	0	0	119
31	H	27.8	Very low	27.2	Very low	160 Å²	160	132.6 Å²	132.6	74%	0.741	79%	0.788	S	S	*	*			trans	24.5	137.7	138	-68.4	-91.2	0	0	0	122.8
32	A	26.1	Very low	27.1	Very low	103 Å²	103	133.9 Å²	133.9	85%	0.851	78%	0.784	S	S	*	*			trans	-132	136.4	131.4	0	0	0	0	0	110.1
33	N	28.1	Very low	27.1	Very low	130 Å²	130	132.8 Å²	132.8	70%	0.695	78%	0.777	S	S	*	*			trans	-94.9	147.9	179	-68.1	-31.6	0	0	0	111.2
34	H	27.6	Very low	27.1	Very low	179 Å²	179	133.5 Å²	133.5	83%	0.829	77%	0.769	S	S	*	*			trans	-150.9	100.4	147.2	-114.7	-94	0	0	0	107.2
35	L	26.3	Very low	27.2	Very low	141 Å²	141	130.4 Å²	130.4	74%	0.738	76%	0.762	S	S	*	*				77.2	105.1	93	-92.8	162.9	0	0	0	114.1
36	S	25.4	Very low	27.2	Very low	95 Å²	95	124.8 Å²	124.8	66%	0.664	76%	0.757	S	S	*	*			trans	-66.2	156.7	167.7	49.2	0	0	0	0	113.8
37	L	26.2	Very low	27.3	Very low	144 Å²	144	120.8 Å²	120.8	75%	0.754	75%	0.747	S	S	*	*				176	131.4	116.7	-92.4	159.1	0	0	0	113.8
38	D	24.7	Very low	27.4	Very low	150 Å²	150	120.9 Å²	120.9	80%	0.802	75%	0.748	S	S	*	*			trans	34.7	123.6	139	-58.8	-4.9	0	0	0	124.1
39	A	24.9	Very low	27.5	Very low	90 Å²	90	121 Å²	121	74%	0.744	75%	0.749	S	S	*	*				-170.5	111	125	0	0	0	0	0	107.9
40	S	26.8	Very low	27.6	Very low	110 Å²	110	118.5 Å²	118.5	77%	0.769	74%	0.743	S	S	*	*				87.3	146.4	54.8	77.9	0	0	0	0	114.8
41	S	26.2	Very low	27.6	Very low	107 Å²	107	116.4 Å²	116.4	75%	0.748	74%	0.742	S	S	*	*			trans	85.4	103.5	-179.9	78.5	0	0	0	0	115.3
42	S	27.1	Very low	27.7	Very low	108 Å²	108	113.5 Å²	113.5	76%	0.755	74%	0.739	S	S	*	*				76	139.3	64.5	74.3	0	0	0	0	112.6
43	S	28.9	Very low	27.8	Very low	105 Å²	105	113.9 Å²	113.9	73%	0.734	74%	0.736	S	S	*	*			cis	-166.9	-168.5	-2.8	52.3	0	0	0	0	106.4
44	S	29.2	Very low	27.9	Very low	91 Å²	91	112.4 Å²	112.4	64%	0.636	74%	0.736	S	S	*	*			cis	-174.8	151.3	17	9.8	0	0	0	0	109.9
45	S	30.1	Very low	28	Very low	111 Å²	111	109.3 Å²	109.3	78%	0.776	73%	0.734	S	S	*	*			trans	59.7	150.4	149.1	57.9	0	0	0	0	119.2
46	S	28.9	Very low	28	Very low	105 Å²	105	107.6 Å²	107.6	73%	0.734	73%	0.734	S	S	*	*			cis	-168.9	161.9	18.8	14.6	0	0	0	0	108.3
47	S	29.6	Very low	28.2	Very low	98 Å²	98	108.4 Å²	108.4	69%	0.685	74%	0.74	S	S	*	*			cis	-177.4	156.6	-7.1	46.8	0	0	0	0	110.3
48	S	28.7	Very low	28.2	Very low	107 Å²	107	106.5 Å²	106.5	75%	0.748	74%	0.738	S	S	*	*			trans	58.8	152.8	146.2	56.6	0	0	0	0	120.4
49	S	29.6	Very low	28.4	Very low	108 Å²	108	104 Å²	104	76%	0.755	73%	0.733	S	S	*	*			cis	177.4	162.1	-4.3	44.7	0	0	0	0	108
50	S	29.3	Very low	28.6	Very low	96 Å²	96	105.1 Å²	105.1	67%	0.671	74%	0.735	S	S	*	*			cis	-176.6	170.8	-19.5	56.3	0	0	0	0	109.4
51	S	28.8	Very low	28.6	Very low	106 Å²	106	106.9 Å²	106.9	74%	0.741	74%	0.741	S	S	*	*			trans	63.4	149.3	151.7	44.6	0	0	0	0	120.4
52	S	28.7	Very low	28.6	Very low	99 Å²	99	110.4 Å²	110.4	69%	0.692	75%	0.745	S	S	*	*			cis	-170.4	146.8	6.7	40	0	0	0	0	114.4
53	S	29.6	Very low	28.9	Very low	112 Å²	112	114 Å²	114	78%	0.783	75%	0.75	S	S	*	*			trans	58.1	154.8	141.8	68.4	0	0	0	0	121.4
54	S	28.6	Very low	29.1	Very low	98 Å²	98	115 Å²	115	69%	0.685	75%	0.754	S	S	*	*			cis	-163.8	142.4	26.2	52.8	0	0	0	0	115.8
55	S	29.7	Very low	29.1	Very low	115 Å²	115	120.3 Å²	120.3	80%	0.804	77%	0.766	S	S	*	*			trans	52.9	146.7	144.7	60.7	0	0	0	0	122.2
56	S	27.5	Very low	28.9	Very low	105 Å²	105	123.3 Å²	123.3	73%	0.734	77%	0.77	S	S	*	*			cis	-156.4	147.8	32.6	50	0	0	0	0	116.7
57	S	28.3	Very low	28.7	Very low	112 Å²	112	125.3 Å²	125.3	78%	0.783	77%	0.772	S	S	*	*			trans	17.8	146.1	148.3	60.7	0	0	0	0	122.8
58	S	27	Very low	29.2	Very low	103 Å²	103	125.3 Å²	125.3	72%	0.72	78%	0.778	S	S	*	*			cis	-162.9	140.4	32.9	54.8	0	0	0	0	117.7
59	S	28.3	Very low	29.2	Very low	99 Å²	99	127.2 Å²	127.2	69%	0.692	78%	0.779	S	S	*	*			trans	50.8	96.4	141.8	63	0	0	0	0	124.6
60	S	28.8	Very low	29.7	Very low	112 Å²	112	130.1 Å²	130.1	78%	0.783	78%	0.784	S	S	*	*				29.5	129.2	119.7	62.4	0	0	0	0	124
61	V	27.4	Very low	29.5	Very low	148 Å²	148	132 Å²	132	90%	0.897	79%	0.785	S	S	*	*			trans	-152.1	151.4	131.7	172.9	0	0	0	0	110.4
62	H	26.4	Very low	29.5	Very low	180 Å²	180	131.5 Å²	131.5	83%	0.833	78%	0.78	S	S	*	*			trans	-37.5	145	174.4	-84.8	-82.3	0	0	0	119.8
63	E	33.1	Very low	29.4	Very low	185 Å²	185	133.6 Å²	133.6	86%	0.864	79%	0.788	S	S	*	*			trans	-80.7	149.3	150.4	-67.7	-177.1	128.9	0	0	111.7
64	P	33.3	Very low	29.9	Very low	126 Å²	126	134.1 Å²	134.1	82%	0.818	79%	0.786	S	S	*	*				-142.8	170.8	117	38.3	-25.2	0	0	0	115.5
65	K	28.8	Very low	30.2	Very low	202 Å²	202	137.1 Å²	137.1	88%	0.878	79%	0.792	S	S	*	*			trans	-47.2	155	175.4	-60.2	172.7	174.4	179.3	0	115.4
66	M	26.8	Very low	30.5	Very low	174 Å²	174	139.6 Å²	139.6	86%	0.857	79%	0.791	S	S	*	*				-166.3	173.4	129.4	-104	-71.4	173.3	0	0	112.4
67	D	25.1	Very low	31.1	Very low	146 Å²	146	140.3 Å²	140.3	78%	0.781	79%	0.79	S	S	*	*			trans	-68.4	174	-159.4	-74.8	-63	0	0	0	119.6
68	A	40	Very low	31.8	Very low	98 Å²	98	139 Å²	139	81%	0.81	78%	0.779	S	S	*	*			trans	-57	137.2	-175.6	0	0	0	0	0	115.4
69	L	27.2	Very low	32.9	Very low	148 Å²	148	136.8 Å²	136.8	78%	0.775	76%	0.763	S	S	*	*			trans	-127.9	126.2	161	-156	84.3	0	0	0	109.3	I71	L69-I71 HydrophobicContact CD2-CD1 4.25Å; L69-I71 HydrophobicContact CD2-CG1 4.38Å; L69-I71 PolarHBondContact O-N 3.4Å
70	I	39.9	Very low	33.7	Very low	169 Å²	169	135.9 Å²	135.9	87%	0.867	75%	0.75	S	S	*	*			trans	-76	117.3	176.8	-63.6	169.3	0	0	0	108.8
71	I	26.6	Very low	34.5	Very low	135 Å²	135	135.8 Å²	135.8	69%	0.692	75%	0.75	S	S	*	*			trans	-131.1	134.1	164.6	-65.1	-176.1	0	0	0	106.4	L69	L69-I71 HydrophobicContact CD2-CD1 4.25Å; L69-I71 HydrophobicContact CD2-CG1 4.38Å; L69-I71 PolarHBondContact O-N 3.4Å
72	P	27.4	Very low	35.6	Very low	96 Å²	96	138 Å²	138	62%	0.623	74%	0.742	S	S	*	*			trans	-70.5	150.1	-165.6	28.1	-36.5	0	0	0	113.1	T74	P72-T74 VanDerWaalsContact C-N 3.25Å; P72-T74 PolarHBondContact O-N 2.88Å
73	V	28.2	Very low	37	Very low	143 Å²	143	132.2 Å²	132.2	87%	0.867	73%	0.731	S	S	*	*			trans	-73.3	81.2	169.4	-176.6	0	0	0	0	109.3
74	T	40.1	Very low	38.4	Very low	122 Å²	122	129.5 Å²	129.5	75%	0.748	72%	0.718	S	S	*	*			trans	-90.6	93.6	160.9	53.7	0	0	0	0	108.8	P72	P72-T74 VanDerWaalsContact C-N 3.25Å; P72-T74 PolarHBondContact O-N 2.88Å
75	M	33.4	Very low	40.1	Very low	162 Å²	162	131.2 Å²	131.2	80%	0.798	71%	0.709	S	S	*	*			trans	-127.4	75	163.6	-78.6	-156.7	72.5	0	0	110.2
76	E	36.6	Very low	42.6	Very low	167 Å²	167	124 Å²	124	78%	0.78	68%	0.678	S	S	*	*			trans	-80.2	124.5	150.8	-69.7	-165.8	158.1	0	0	108.8
77	V	39.6	Very low	45.3	Very low	119 Å²	119	120.1 Å²	120.1	72%	0.721	65%	0.654	S	S	*	*			trans	-124.1	125.2	142.6	179.5	0	0	0	0	106.1
78	P	44	Very low	48.2	Very low	86 Å²	86	119.9 Å²	119.9	56%	0.558	64%	0.643	S	S	*	*			trans	-88.3	143.2	-156.6	-8.6	28.1	0	0	0	112.9	D80	P78-D80 VanDerWaalsContact C-N 3.26Å; P78-D80 WeakPolarHBondContact CB-O 3.14Å
79	C	50.8	Low	50.5	Low	56 Å²	56	116.2 Å²	116.2	38%	0.378	61%	0.612	S	S	.	*	S	Bend	trans	-82.1	0.3	160.5	-78.8	0	0	0	0	113.3	C206 R266	C79-C206 WeakPolarHBondContact CB-SG 3.37Å; C79-C206 WeakPolarHBondContact SG-CB 3.48Å; C79-C206 CovalentContact SG-SG 2.03Å; C79-C206 PolarHBondContact SG-SG 3.12Å; C79-R266 VanDerWaalsContact CB-NH2 3.27Å
80	D	44.1	Very low	53.4	Low	79 Å²	79	109.2 Å²	109.2	42%	0.422	58%	0.575	S	S	.	*	S	Bend	trans	-162.7	150	162.6	-171.2	9.1	0	0	0	109.9	P78 R82 G83	P78-D80 VanDerWaalsContact C-N 3.26Å; P78-D80 WeakPolarHBondContact CB-O 3.14Å; D80-R82 PolarHBondContact O-N 3.33Å; D80-G83 PolarHBondContact O-N 2.89Å
81	S	45.1	Very low	55.8	Low	111 Å²	111	103.6 Å²	103.6	78%	0.776	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-0.1	176.7	60.3	0	0	0	0	116.4
82	R	51.7	Low	58.9	Low	194 Å²	194	99.2 Å²	99.2	73%	0.732	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.8	3	-174.5	-67.8	-177.2	174.2	-173.5	-1.4	115.2	D80 Q84	D80-R82 PolarHBondContact O-N 3.33Å; R82-Q84 PolarHBondContact O-N 3.1Å; R82-Q84 VanDerWaalsContact O-N 3.1Å
83	G	56	Low	62	Low	59 Å²	59	95.9 Å²	95.9	61%	0.608	51%	0.51	S	S	*	.			trans	63.8	15.5	174.2	0	0	0	0	0	116.3	D80	D80-G83 PolarHBondContact O-N 2.89Å
84	Q	62.9	Low	65.1	Low	127 Å²	127	89.1 Å²	89.1	59%	0.593	47%	0.469	S	S	*	.			trans	-80.1	131.7	-177.2	-70.3	-172.9	-27.2	0	0	112.7	R82 R266	R82-Q84 PolarHBondContact O-N 3.1Å; R82-Q84 VanDerWaalsContact O-N 3.1Å; Q84-R266 PolarHBondContact O-NH1 3.01Å; Q84-R266 VanDerWaalsContact O-NH1 3.1Å
85	R	68.3	Low	67.6	Low	163 Å²	163	86.7 Å²	86.7	62%	0.615	45%	0.45	S	S	*	.			trans	-70.8	135.4	170.6	-65.9	-171.5	-179	176.8	-0.4	110.2	W88 E204	R85-W88 PolarHBondContact O-NE1 3.47Å; R85-E204 VanDerWaalsContact CB-OE2 3.31Å; R85-E204 WeakPolarHBondContact CB-OE2 3.23Å
86	M	81.9	Confident	70.5	Confident	49 Å²	49	84 Å²	84	24%	0.241	44%	0.442	C	S	.	.			trans	-116.9	13	-171.9	-67.3	-65.5	-74.1	0	0	113.6	W88 A89 F90 E204	M86-W88 HydrophobicContact CE-CH2 4.14Å; M86-W88 HydrophobicContact CE-CZ2 3.54Å; M86-W88 PolarHBondContact O-N 3.17Å; M86-W88 HydrophobicContact SD-CZ2 3.71Å; M86-A89 WeakPolarHBondContact O-CB 3.37Å; M86-A89 PolarHBondContact O-N 2.9Å; M86-F90 WeakPolarHBondContact O-CD2 3.34Å; M86-E204 PolarHBondContact N-OE1 3.2Å
87	W	83.3	Confident	73.1	Confident	93 Å²	93	78.7 Å²	78.7	35%	0.352	42%	0.422	S	S	.	.	H	α-helix	trans	-47.6	-33.2	176.8	66.9	-91.9	0	0	0	114.5	A89 F90 L91 W268	W87-A89 VanDerWaalsContact C-N 3.26Å; W87-A89 PolarHBondContact O-N 3.46Å; W87-F90 PolarHBondContact O-N 3.04Å; W87-L91 HydrophobicContact CZ3-CD2 4.3Å; W87-W268 HydrophobicContact CB-CD2 4.33Å; W87-W268 HydrophobicContact CB-CG 4.29Å; W87-W268 HydrophobicContact CB-CZ2 4.42Å; W87-W268 HydrophobicContact CE3-CZ2 4.3Å
88	W	85.5	Confident	75.7	Confident	142 Å²	142	74.4 Å²	74.4	54%	0.538	39%	0.393	S	S	.	.	H	α-helix	trans	-63.1	-28.5	179.9	58.6	-92.3	0	0	0	113.3	R85 M86 F90 L91 A92	R85-W88 PolarHBondContact O-NE1 3.47Å; M86-W88 HydrophobicContact CE-CH2 4.14Å; M86-W88 HydrophobicContact CE-CZ2 3.54Å; M86-W88 PolarHBondContact O-N 3.17Å; M86-W88 HydrophobicContact SD-CZ2 3.71Å; W88-F90 VanDerWaalsContact C-N 3.34Å; W88-F90 PolarHBondContact O-N 3.44Å; W88-L91 PolarHBondContact O-N 2.82Å; W88-A92 WeakPolarHBondContact O-CB 3.28Å; W88-A92 PolarHBondContact O-N 2.03Å
89	A	87.9	Confident	78	Confident	20 Å²	20	75 Å²	75	17%	0.165	39%	0.387	C	S	.	.	H	α-helix	trans	-65.1	-37.4	179.2	0	0	0	0	0	112.3	M86 W87 S93 V260 L264	M86-A89 WeakPolarHBondContact O-CB 3.37Å; M86-A89 PolarHBondContact O-N 2.9Å; W87-A89 VanDerWaalsContact C-N 3.26Å; W87-A89 PolarHBondContact O-N 3.46Å; A89-S93 PolarHBondContact O-N 2.73Å; A89-S93 PolarHBondContact O-OG 3.24Å; A89-V260 HydrophobicContact CB-CG1 4.37Å; A89-L264 HydrophobicContact CB-CD1 4.25Å
90	F	88.9	Confident	80	Confident	1 Å²	1	73.7 Å²	73.7	0%	0.004	38%	0.384	C	S	.	.	H	α-helix	trans	-69.7	-42.3	178.2	-58.9	-99.8	0	0	0	112.2	M86 W87 W88 S93 S94 P257 V260 L264 R266 W268	M86-F90 WeakPolarHBondContact O-CD2 3.34Å; W87-F90 PolarHBondContact O-N 3.04Å; W88-F90 VanDerWaalsContact C-N 3.34Å; W88-F90 PolarHBondContact O-N 3.44Å; F90-S93 PolarHBondContact O-OG 2.99Å; F90-S94 PolarHBondContact O-N 3Å; F90-S94 PolarHBondContact O-OG 3.25Å; F90-P257 HydrophobicContact CB-CB 4.24Å; F90-P257 HydrophobicContact CD1-CB 4.14Å; F90-P257 WeakPolarHBondContact CD1-O 3.42Å; F90-V260 HydrophobicContact CD1-CB 4.11Å; F90-V260 HydrophobicContact CD1-CG1 3.9Å; F90-V260 HydrophobicContact CD2-CG1 4.43Å; F90-V260 HydrophobicContact CE1-CB 4.39Å; F90-V260 HydrophobicContact CE1-CG1 4.04Å; F90-V260 HydrophobicContact CG-CG1 4.11Å; F90-V260 HydrophobicContact CZ-CG1 4.36Å; F90-L264 HydrophobicContact CE2-CD1 4.29Å; F90-L264 HydrophobicContact CZ-CD1 4.39Å; F90-R266 WeakPolarHBondContact CZ-O 3.15Å; F90-W268 HydrophobicContact CB-CD2 4.23Å; F90-W268 HydrophobicContact CB-CE3 3.29Å; F90-W268 HydrophobicContact CB-CZ3 3.57Å; F90-W268 HydrophobicContact CD1-CB 4.21Å; F90-W268 HydrophobicContact CD1-CE3 4.32Å; F90-W268 HydrophobicContact CD2-CB 4.04Å; F90-W268 HydrophobicContact CD2-CD2 4.45Å; F90-W268 HydrophobicContact CD2-CE3 4.27Å; F90-W268 HydrophobicContact CD2-CG 4.41Å; F90-W268 HydrophobicContact CE1-CB 4.1Å; F90-W268 HydrophobicContact CE2-CB 3.95Å; F90-W268 HydrophobicContact CG-CB 4.18Å; F90-W268 HydrophobicContact CG-CD2 4.34Å; F90-W268 AromaticContact CG-CE3 3.76Å; F90-W268 HydrophobicContact CG-CE3 3.76Å; F90-W268 HydrophobicContact CZ-CB 3.99Å
91	L	89.7	Confident	82.2	Confident	52 Å²	52	70.6 Å²	70.6	27%	0.272	37%	0.37	S	S	.	.	H	α-helix	trans	-68.9	-42.4	175.9	-173.8	61.2	0	0	0	110.7	W87 W88 S93 S94 M95 W268 L271	W87-L91 HydrophobicContact CZ3-CD2 4.3Å; W88-L91 PolarHBondContact O-N 2.82Å; L91-S93 PolarHBondContact O-N 3.1Å; L91-S94 PolarHBondContact O-N 3.28Å; L91-M95 HydrophobicContact CD1-CE 4.11Å; L91-M95 HydrophobicContact CD1-CG 4.45Å; L91-M95 HydrophobicContact CG-CG 4.46Å; L91-M95 WeakPolarHBondContact O-CG 3.01Å; L91-M95 PolarHBondContact O-N 3.15Å; L91-W268 HydrophobicContact CB-CH2 4.17Å; L91-W268 HydrophobicContact CB-CZ3 4.5Å; L91-L271 HydrophobicContact CD1-CD1 3.86Å
92	A	90.7	Very high	84.5	Confident	43 Å²	43	66.5 Å²	66.5	36%	0.355	34%	0.339	S	S	.	.	H	α-helix	trans	-60	-43.9	176.1	0	0	0	0	0	112	W88 S94 M95 V96	W88-A92 WeakPolarHBondContact O-CB 3.28Å; W88-A92 PolarHBondContact O-N 2.03Å; A92-S94 VanDerWaalsContact C-N 3.28Å; A92-S94 PolarHBondContact O-N 2.82Å; A92-M95 PolarHBondContact O-N 3.46Å; A92-V96 VanDerWaalsContact O-CB 3.3Å; A92-V96 WeakPolarHBondContact O-CB 3.49Å; A92-V96 VanDerWaalsContact O-CG2 3.24Å; A92-V96 WeakPolarHBondContact O-CG2 3.07Å; A92-V96 PolarHBondContact O-N 3.03Å
93	S	93.2	Very high	86.4	Confident	26 Å²	26	63.2 Å²	63.2	18%	0.182	33%	0.331	C	S	.	.	H	α-helix	trans	-60.1	-38.8	177.1	65.3	0	0	0	0	112.5	A89 F90 L91 T97 V260	A89-S93 PolarHBondContact O-N 2.73Å; A89-S93 PolarHBondContact O-OG 3.24Å; F90-S93 PolarHBondContact O-OG 2.99Å; L91-S93 PolarHBondContact O-N 3.1Å; S93-T97 VanDerWaalsContact O-CB 3.32Å; S93-T97 WeakPolarHBondContact O-CB 3.35Å; S93-T97 PolarHBondContact O-N 3.43Å; S93-T97 PolarHBondContact O-OG1 3.48Å; S93-V260 WeakPolarHBondContact OG-CG2 3.48Å
94	S	93.6	Very high	88.2	Confident	1 Å²	1	66 Å²	66	1%	0.007	33%	0.33	C	S	.	.	H	α-helix	trans	-67.7	-49	177.4	-49.6	0	0	0	0	111.5	F90 L91 A92 T97 F98 F252 F253 P257	F90-S94 PolarHBondContact O-N 3Å; F90-S94 PolarHBondContact O-OG 3.25Å; L91-S94 PolarHBondContact O-N 3.28Å; A92-S94 VanDerWaalsContact C-N 3.28Å; A92-S94 PolarHBondContact O-N 2.82Å; S94-T97 PolarHBondContact O-N 3.22Å; S94-F98 WeakPolarHBondContact O-CB 3.32Å; S94-F98 PolarHBondContact O-N 3.06Å; S94-F252 WeakPolarHBondContact CB-O 3.34Å; S94-F253 VanDerWaalsContact CB-CD1 3.44Å; S94-P257 WeakPolarHBondContact OG-CD 3.41Å; S94-P257 WeakPolarHBondContact OG-CG 3.33Å
95	M	91.8	Very high	89.5	Confident	71 Å²	71	60.9 Å²	60.9	35%	0.35	31%	0.307	S	S	.	.	H	α-helix	trans	-65.3	-41.8	-179.8	-68.8	-63.6	-177.9	0	0	112.5	L91 A92 F98 F99 F253	L91-M95 HydrophobicContact CD1-CE 4.11Å; L91-M95 HydrophobicContact CD1-CG 4.45Å; L91-M95 HydrophobicContact CG-CG 4.46Å; L91-M95 WeakPolarHBondContact O-CG 3.01Å; L91-M95 PolarHBondContact O-N 3.15Å; A92-M95 PolarHBondContact O-N 3.46Å; M95-F98 PolarHBondContact O-N 3.38Å; M95-F99 HydrophobicContact CB-CD2 4.39Å; M95-F99 WeakPolarHBondContact O-CB 3.46Å; M95-F99 WeakPolarHBondContact O-CD2 3.49Å; M95-F99 PolarHBondContact O-N 3Å; M95-F99 HydrophobicContact SD-CD2 4.33Å; M95-F99 HydrophobicContact SD-CE2 3.8Å; M95-F253 HydrophobicContact CE-CE1 3.61Å; M95-F253 HydrophobicContact CE-CZ 3.75Å; M95-F253 HydrophobicContact CG-CE1 4.38Å; M95-F253 HydrophobicContact SD-CE1 3.76Å; M95-F253 HydrophobicContact SD-CZ 3.73Å
96	V	94	Very high	90.6	Very high	104 Å²	104	56.5 Å²	56.5	63%	0.63	30%	0.295	S	S	*	.	H	α-helix	trans	-64.8	-39.9	175.7	171.2	0	0	0	0	110.9	A92 G100	A92-V96 VanDerWaalsContact O-CB 3.3Å; A92-V96 WeakPolarHBondContact O-CB 3.49Å; A92-V96 VanDerWaalsContact O-CG2 3.24Å; A92-V96 WeakPolarHBondContact O-CG2 3.07Å; A92-V96 PolarHBondContact O-N 3.03Å; V96-G100 VanDerWaalsContact O-CA 3.24Å; V96-G100 WeakPolarHBondContact O-CA 3.38Å; V96-G100 PolarHBondContact O-N 3.45Å
97	T	92.6	Very high	91	Very high	57 Å²	57	58.8 Å²	58.8	35%	0.35	31%	0.308	S	S	.	.	H	α-helix	trans	-63.4	-49	175.4	-57.4	0	0	0	0	111	S93 S94 G101 F252 P256	S93-T97 VanDerWaalsContact O-CB 3.32Å; S93-T97 WeakPolarHBondContact O-CB 3.35Å; S93-T97 PolarHBondContact O-N 3.43Å; S93-T97 PolarHBondContact O-OG1 3.48Å; S94-T97 PolarHBondContact O-N 3.22Å; T97-G101 PolarHBondContact O-N 3.42Å; T97-G101 VanDerWaalsContact O-N 3.1Å; T97-F252 HydrophobicContact CG2-CD1 3.93Å; T97-F252 HydrophobicContact CG2-CE1 4.35Å; T97-P256 HydrophobicContact CG2-CG 4.31Å
98	F	93.3	Very high	91.3	Very high	28 Å²	28	62.7 Å²	62.7	12%	0.123	32%	0.323	C	S	.	.	H	α-helix	trans	-64.4	-58.3	-178.5	178	-109.4	0	0	0	112.7	S94 M95 L102 W243 L244 V249 F252	S94-F98 WeakPolarHBondContact O-CB 3.32Å; S94-F98 PolarHBondContact O-N 3.06Å; M95-F98 PolarHBondContact O-N 3.38Å; F98-L102 VanDerWaalsContact O-CB 3.29Å; F98-L102 WeakPolarHBondContact O-CB 3.43Å; F98-L102 PolarHBondContact O-N 2.92Å; F98-W243 AromaticContact CD2-NE1 3.98Å; F98-W243 PolarHBondContact O-NE1 3.01Å; F98-L244 HydrophobicContact CE2-CD2 4.3Å; F98-L244 HydrophobicContact CZ-CD2 3.97Å; F98-V249 HydrophobicContact CE2-CG2 4.26Å; F98-F252 AromaticContact CD2-CD2 3.62Å; F98-F252 HydrophobicContact CD2-CD2 3.62Å; F98-F252 AromaticContact CD2-CE2 3.99Å; F98-F252 HydrophobicContact CD2-CE2 3.99Å; F98-F252 HydrophobicContact CD2-CG 4.38Å; F98-F252 HydrophobicContact CE2-CD2 4.34Å
99	F	92.9	Very high	91.5	Very high	98 Å²	98	60.3 Å²	60.3	43%	0.43	31%	0.314	S	S	.	.	H	α-helix	trans	-71.9	-37.2	-177.3	-72.2	-67.2	0	0	0	112.4	M95 L102 F103	M95-F99 HydrophobicContact CB-CD2 4.39Å; M95-F99 WeakPolarHBondContact O-CB 3.46Å; M95-F99 WeakPolarHBondContact O-CD2 3.49Å; M95-F99 PolarHBondContact O-N 3Å; M95-F99 HydrophobicContact SD-CD2 4.33Å; M95-F99 HydrophobicContact SD-CE2 3.8Å; F99-L102 HydrophobicContact CD1-CD2 4.41Å; F99-L102 PolarHBondContact O-N 3.22Å; F99-F103 HydrophobicContact CB-CD2 4.43Å; F99-F103 HydrophobicContact CB-CE2 4.31Å; F99-F103 WeakPolarHBondContact O-CB 3.43Å; F99-F103 WeakPolarHBondContact O-CD2 3.41Å; F99-F103 WeakPolarHBondContact O-CG 3.43Å; F99-F103 PolarHBondContact O-N 3.36Å
100	G	92.6	Very high	91.5	Very high	30 Å²	30	63.2 Å²	63.2	31%	0.309	33%	0.33	S	S	.	.	H	α-helix	trans	-61.3	-48.4	176.6	0	0	0	0	0	111.9	V96 F103 I104	V96-G100 VanDerWaalsContact O-CA 3.24Å; V96-G100 WeakPolarHBondContact O-CA 3.38Å; V96-G100 PolarHBondContact O-N 3.45Å; G100-F103 PolarHBondContact O-N 2.79Å; G100-I104 VanDerWaalsContact O-CG1 3.28Å; G100-I104 WeakPolarHBondContact O-CG1 3.33Å; G100-I104 PolarHBondContact O-N 2.97Å
101	G	91.1	Very high	91.4	Very high	13 Å²	13	68.1 Å²	68.1	13%	0.134	36%	0.355	C	S	.	.	H	α-helix	trans	-65.5	-38	174.9	0	0	0	0	0	113.3	T97 I104 I105	T97-G101 PolarHBondContact O-N 3.42Å; T97-G101 VanDerWaalsContact O-N 3.1Å; G101-I104 PolarHBondContact O-N 2.9Å; G101-I105 WeakPolarHBondContact O-CG1 3.22Å; G101-I105 PolarHBondContact O-N 3.13Å
102	L	92.2	Very high	91.1	Very high	26 Å²	26	71.9 Å²	71.9	14%	0.136	37%	0.369	C	S	.	.	H	α-helix	trans	-60.7	-46.7	174.2	-177.7	64.6	0	0	0	111.4	F98 F99 I104 I105 L106 L240 L244	F98-L102 VanDerWaalsContact O-CB 3.29Å; F98-L102 WeakPolarHBondContact O-CB 3.43Å; F98-L102 PolarHBondContact O-N 2.92Å; F99-L102 HydrophobicContact CD1-CD2 4.41Å; F99-L102 PolarHBondContact O-N 3.22Å; L102-I104 PolarHBondContact O-N 3.28Å; L102-I105 PolarHBondContact O-N 3.38Å; L102-L106 HydrophobicContact CD1-CD1 4.44Å; L102-L106 HydrophobicContact CG-CD1 4.18Å; L102-L106 WeakPolarHBondContact O-CG 3Å; L102-L106 PolarHBondContact O-N 3.32Å; L102-L240 HydrophobicContact CD1-CD1 3.48Å; L102-L240 VanDerWaalsContact CD1-CD1 3.48Å; L102-L244 HydrophobicContact CD1-CD2 4.23Å
103	F	92.3	Very high	90.6	Very high	125 Å²	125	78 Å²	78	55%	0.548	39%	0.385	S	S	.	.	H	α-helix	trans	-63.4	-39	175	-75.8	-56	0	0	0	112.1	F99 G100 I105 L106 L107	F99-F103 HydrophobicContact CB-CD2 4.43Å; F99-F103 HydrophobicContact CB-CE2 4.31Å; F99-F103 WeakPolarHBondContact O-CB 3.43Å; F99-F103 WeakPolarHBondContact O-CD2 3.41Å; F99-F103 WeakPolarHBondContact O-CG 3.43Å; F99-F103 PolarHBondContact O-N 3.36Å; G100-F103 PolarHBondContact O-N 2.79Å; F103-I105 PolarHBondContact O-N 3.46Å; F103-L106 PolarHBondContact O-N 2.66Å; F103-L107 WeakPolarHBondContact O-CB 3.45Å; F103-L107 WeakPolarHBondContact O-CG 3.32Å; F103-L107 PolarHBondContact O-N 3.18Å
104	I	92.9	Very high	90	Very high	117 Å²	117	81.4 Å²	81.4	60%	0.6	40%	0.4	S	S	*	.	H	α-helix	trans	-61	-44	174.5	-70.9	163.6	0	0	0	111.1	G100 G101 L102 W108	G100-I104 VanDerWaalsContact O-CG1 3.28Å; G100-I104 WeakPolarHBondContact O-CG1 3.33Å; G100-I104 PolarHBondContact O-N 2.97Å; G101-I104 PolarHBondContact O-N 2.9Å; L102-I104 PolarHBondContact O-N 3.28Å; I104-W108 VanDerWaalsContact O-CB 3.26Å; I104-W108 WeakPolarHBondContact O-CB 3.42Å; I104-W108 PolarHBondContact O-N 2.85Å
105	I	90.7	Very high	89.1	Confident	20 Å²	20	90 Å²	90	10%	0.103	43%	0.432	C	S	.	.	H	α-helix	trans	-65.2	-43.8	177.9	-68	166.3	0	0	0	111.2	G101 L102 F103 W108 R109 L240 W243	G101-I105 WeakPolarHBondContact O-CG1 3.22Å; G101-I105 PolarHBondContact O-N 3.13Å; L102-I105 PolarHBondContact O-N 3.38Å; F103-I105 PolarHBondContact O-N 3.46Å; I105-W108 PolarHBondContact O-N 2.98Å; I105-R109 WeakPolarHBondContact O-CG 3.42Å; I105-R109 PolarHBondContact O-N 3.21Å; I105-L240 HydrophobicContact CG2-CB 3.91Å; I105-L240 HydrophobicContact CG2-CD1 4.03Å; I105-W243 HydrophobicContact CD1-CB 3.87Å; I105-W243 HydrophobicContact CD1-CD2 3.56Å; I105-W243 HydrophobicContact CD1-CE3 3.52Å; I105-W243 HydrophobicContact CD1-CG 3.72Å; I105-W243 HydrophobicContact CD1-CZ3 4.3Å
106	L	90.6	Very high	88.1	Confident	70 Å²	70	90.8 Å²	90.8	37%	0.366	44%	0.441	S	S	.	.	H	α-helix	trans	-65.9	-45	177.8	-69.1	174.7	0	0	0	111.6	L102 F103 R109 T110 L240	L102-L106 HydrophobicContact CD1-CD1 4.44Å; L102-L106 HydrophobicContact CG-CD1 4.18Å; L102-L106 WeakPolarHBondContact O-CG 3Å; L102-L106 PolarHBondContact O-N 3.32Å; F103-L106 PolarHBondContact O-N 2.66Å; L106-R109 PolarHBondContact O-N 3.05Å; L106-T110 WeakPolarHBondContact O-CG2 3.31Å; L106-T110 PolarHBondContact O-N 3.16Å; L106-T110 PolarHBondContact O-OG1 3.17Å; L106-L240 HydrophobicContact CD2-CD1 4.12Å; L106-L240 HydrophobicContact CD2-CD2 4.13Å
107	L	90.3	Very high	86.9	Confident	98 Å²	98	90.1 Å²	90.1	51%	0.513	44%	0.437	S	S	.	.	H	α-helix	trans	-63.2	-39.4	175	-73.3	171.1	0	0	0	111.9	F103 T110 L111	F103-L107 WeakPolarHBondContact O-CB 3.45Å; F103-L107 WeakPolarHBondContact O-CG 3.32Å; F103-L107 PolarHBondContact O-N 3.18Å; L107-T110 WeakPolarHBondContact CA-OG1 3.33Å; L107-T110 PolarHBondContact O-N 3.03Å; L107-T110 PolarHBondContact O-OG1 2.89Å; L107-L111 WeakPolarHBondContact O-CB 3.47Å; L107-L111 WeakPolarHBondContact O-CG 3.44Å; L107-L111 PolarHBondContact O-N 2.78Å
108	W	90.6	Very high	85.5	Confident	175 Å²	175	91.3 Å²	91.3	66%	0.663	45%	0.447	S	S	*	.	H	α-helix	trans	-64.3	-40.8	175.4	-174.4	-96.2	0	0	0	111.9	I104 I105 K112	I104-W108 VanDerWaalsContact O-CB 3.26Å; I104-W108 WeakPolarHBondContact O-CB 3.42Å; I104-W108 PolarHBondContact O-N 2.85Å; I105-W108 PolarHBondContact O-N 2.98Å; W108-K112 WeakPolarHBondContact O-CB 3.25Å; W108-K112 WeakPolarHBondContact O-CG 3.42Å; W108-K112 PolarHBondContact O-N 3.22Å
109	R	90.1	Very high	83.8	Confident	92 Å²	92	93.1 Å²	93.1	35%	0.347	46%	0.462	S	S	.	.	H	α-helix	trans	-63.2	-53.1	173.1	-77.3	-176.4	169.5	-158.7	-8.6	111.3	I105 L106 L111 K112 Y113 D238	I105-R109 WeakPolarHBondContact O-CG 3.42Å; I105-R109 PolarHBondContact O-N 3.21Å; L106-R109 PolarHBondContact O-N 3.05Å; R109-L111 PolarHBondContact O-N 3.16Å; R109-K112 PolarHBondContact O-N 3.34Å; R109-Y113 VanDerWaalsContact O-CD2 3.31Å; R109-Y113 WeakPolarHBondContact O-CD2 3.29Å; R109-Y113 PolarHBondContact O-N 3.17Å; R109-D238 IonicContact CZ-OD1 3.75Å; R109-D238 IonicContact CZ-OD2 2.74Å; R109-D238 IonicContact NH1-OD1 2.86Å; R109-D238 IonicContact NH1-OD2 2.8Å; R109-D238 IonicContact NH2-OD1 4Å; R109-D238 PolarHBondContact NH2-OD1 2.99Å; R109-D238 IonicContact NH2-OD2 2.61Å; R109-D238 PolarHBondContact NH2-OD2 3.19Å
110	T	86.7	Confident	81.8	Confident	81 Å²	81	96.1 Å²	96.1	50%	0.497	48%	0.478	S	S	.	.	H	α-helix	trans	-63.1	-41.1	-178.9	57	0	0	0	0	111.4	L106 L107 Y113 L114	L106-T110 WeakPolarHBondContact O-CG2 3.31Å; L106-T110 PolarHBondContact O-N 3.16Å; L106-T110 PolarHBondContact O-OG1 3.17Å; L107-T110 WeakPolarHBondContact CA-OG1 3.33Å; L107-T110 PolarHBondContact O-N 3.03Å; L107-T110 PolarHBondContact O-OG1 2.89Å; T110-Y113 PolarHBondContact O-N 2.86Å; T110-L114 WeakPolarHBondContact O-CB 3.42Å; T110-L114 PolarHBondContact O-N 3.29Å
111	L	87.4	Confident	79.4	Confident	104 Å²	104	100.1 Å²	100.1	55%	0.545	50%	0.499	S	S	.	.	H	α-helix	trans	-65	-38.1	174.9	-71.4	170.1	0	0	0	112.6	L107 R109 W115	L107-L111 WeakPolarHBondContact O-CB 3.47Å; L107-L111 WeakPolarHBondContact O-CG 3.44Å; L107-L111 PolarHBondContact O-N 2.78Å; R109-L111 PolarHBondContact O-N 3.16Å; L111-W115 WeakPolarHBondContact O-CB 3.43Å; L111-W115 PolarHBondContact O-N 3.47Å
112	K	83.6	Confident	77.2	Confident	130 Å²	130	103.1 Å²	103.1	57%	0.565	53%	0.53	S	S	*	.	H	α-helix	trans	-63.2	-46.9	173.9	-87.8	-74.7	-176.4	179.4	0	112.1	W108 R109 W115 T116	W108-K112 WeakPolarHBondContact O-CB 3.25Å; W108-K112 WeakPolarHBondContact O-CG 3.42Å; W108-K112 PolarHBondContact O-N 3.22Å; R109-K112 PolarHBondContact O-N 3.34Å; K112-W115 PolarHBondContact O-N 2.82Å; K112-T116 PolarHBondContact O-N 2.86Å; K112-T116 PolarHBondContact O-OG1 3.16Å
113	Y	81.1	Confident	74.9	Confident	173 Å²	173	105 Å²	105	68%	0.678	56%	0.556	S	S	*	*	H	α-helix	trans	-67.7	-40	176.4	-82.7	-75.4	0	0	0	112.4	R109 T110 W115 T116 V117	R109-Y113 VanDerWaalsContact O-CD2 3.31Å; R109-Y113 WeakPolarHBondContact O-CD2 3.29Å; R109-Y113 PolarHBondContact O-N 3.17Å; T110-Y113 PolarHBondContact O-N 2.86Å; Y113-W115 VanDerWaalsContact C-N 3.33Å; Y113-T116 WeakPolarHBondContact CA-OG1 3.45Å; Y113-T116 PolarHBondContact O-N 3.44Å; Y113-T116 PolarHBondContact O-OG1 3.13Å; Y113-V117 WeakPolarHBondContact O-CB 3.39Å; Y113-V117 VanDerWaalsContact O-CG2 3.27Å; Y113-V117 WeakPolarHBondContact O-CG2 3.36Å; Y113-V117 PolarHBondContact O-N 2.85Å
114	L	78.8	Confident	72.1	Confident	96 Å²	96	108.7 Å²	108.7	50%	0.503	57%	0.572	S	S	.	*	H	α-helix	trans	-68.4	-33.3	177.3	-168.3	73	0	0	0	111.2	T110 V117 C118	T110-L114 WeakPolarHBondContact O-CB 3.42Å; T110-L114 PolarHBondContact O-N 3.29Å; L114-V117 PolarHBondContact O-N 3.47Å; L114-C118 VanDerWaalsContact CD1-SG 3.5Å; L114-C118 WeakPolarHBondContact O-CA 3.47Å; L114-C118 WeakPolarHBondContact O-CB 3.41Å; L114-C118 PolarHBondContact O-N 3.01Å
115	W	75.5	Confident	69.2	Low	182 Å²	182	109.3 Å²	109.3	69%	0.689	58%	0.581	S	S	*	*	H	α-helix	trans	-66.9	-42.1	173.6	-169.4	-92.4	0	0	0	111.6	L111 K112 Y113 C119	L111-W115 WeakPolarHBondContact O-CB 3.43Å; L111-W115 PolarHBondContact O-N 3.47Å; K112-W115 PolarHBondContact O-N 2.82Å; Y113-W115 VanDerWaalsContact C-N 3.33Å; W115-C119 HydrophobicContact CD2-CB 4.06Å; W115-C119 HydrophobicContact CE3-CB 4.44Å; W115-C119 VanDerWaalsContact CE3-SG 3.57Å; W115-C119 HydrophobicContact CG-CB 4.34Å; W115-C119 HydrophobicContact CZ2-CB 4.42Å; W115-C119 WeakPolarHBondContact O-CA 3.27Å; W115-C119 WeakPolarHBondContact O-CB 3.43Å; W115-C119 PolarHBondContact O-N 3.39Å
116	T	70.6	Confident	66.8	Low	87 Å²	87	118.1 Å²	118.1	53%	0.534	62%	0.619	S	S	.	*	H	α-helix	trans	-69.6	-29.9	173.5	41.2	0	0	0	0	113.5	K112 Y113 H120	K112-T116 PolarHBondContact O-N 2.86Å; K112-T116 PolarHBondContact O-OG1 3.16Å; Y113-T116 WeakPolarHBondContact CA-OG1 3.45Å; Y113-T116 PolarHBondContact O-N 3.44Å; Y113-T116 PolarHBondContact O-OG1 3.13Å; T116-H120 WeakPolarHBondContact O-CB 3.49Å
117	V	69.4	Low	63.9	Low	91 Å²	91	124.5 Å²	124.5	55%	0.552	65%	0.647	S	S	*	*	H	α-helix	trans	-83.1	-45.7	178.6	172	0	0	0	0	112.5	Y113 L114 C121	Y113-V117 WeakPolarHBondContact O-CB 3.39Å; Y113-V117 VanDerWaalsContact O-CG2 3.27Å; Y113-V117 WeakPolarHBondContact O-CG2 3.36Å; Y113-V117 PolarHBondContact O-N 2.85Å; L114-V117 PolarHBondContact O-N 3.47Å; V117-C121 WeakPolarHBondContact O-CB 3.37Å; V117-C121 PolarHBondContact O-SG 2.81Å; V117-C121 VanDerWaalsContact O-SG 3.38Å
118	C	62.5	Low	61.2	Low	82 Å²	82	124.2 Å²	124.2	55%	0.554	66%	0.658	S	S	*	*	H	α-helix	trans	-87.9	-35.9	-176.3	-64.8	0	0	0	0	113.6	L114	L114-C118 VanDerWaalsContact CD1-SG 3.5Å; L114-C118 WeakPolarHBondContact O-CA 3.47Å; L114-C118 WeakPolarHBondContact O-CB 3.41Å; L114-C118 PolarHBondContact O-N 3.01Å
119	C	58.2	Low	58.4	Low	66 Å²	66	124.8 Å²	124.8	45%	0.446	67%	0.668	S	S	.	*	S	Bend	trans	-96	-2.6	-177	-55	0	0	0	0	113.8	W115	W115-C119 HydrophobicContact CD2-CB 4.06Å; W115-C119 HydrophobicContact CE3-CB 4.44Å; W115-C119 VanDerWaalsContact CE3-SG 3.57Å; W115-C119 HydrophobicContact CG-CB 4.34Å; W115-C119 HydrophobicContact CZ2-CB 4.42Å; W115-C119 WeakPolarHBondContact O-CA 3.27Å; W115-C119 WeakPolarHBondContact O-CB 3.43Å; W115-C119 PolarHBondContact O-N 3.39Å
120	H	50.3	Low	55.5	Low	161 Å²	161	129.6 Å²	129.6	75%	0.745	69%	0.692	S	S	*	*	S	Bend	trans	-109.3	-7	170.1	-122	56.7	0	0	0	114.1	T116 G122	T116-H120 WeakPolarHBondContact O-CB 3.49Å; H120-G122 PolarHBondContact O-N 2.79Å; H120-G122 VanDerWaalsContact O-N 3.08Å
121	C	43.5	Very low	53.1	Low	114 Å²	114	132.9 Å²	132.9	77%	0.77	71%	0.705	S	S	*	*	S	Bend	trans	-80.5	33.4	167.7	-83.9	0	0	0	0	113.5	V117	V117-C121 WeakPolarHBondContact O-CB 3.37Å; V117-C121 PolarHBondContact O-SG 2.81Å; V117-C121 VanDerWaalsContact O-SG 3.38Å
122	G	43.6	Very low	50.2	Low	76 Å²	76	135.4 Å²	135.4	78%	0.784	72%	0.719	S	S	*	*	S	Bend	trans	-131.6	25.4	-172.8	0	0	0	0	0	115.3	H120	H120-G122 PolarHBondContact O-N 2.79Å; H120-G122 VanDerWaalsContact O-N 3.08Å
123	G	44	Very low	47.6	Very low	66 Å²	66	136.4 Å²	136.4	68%	0.68	73%	0.73	S	S	*	*	S	Bend	trans	172.8	118.3	173.6	0	0	0	0	0	117.3
124	K	34.8	Very low	45.1	Very low	202 Å²	202	131.4 Å²	131.4	88%	0.878	73%	0.731	S	S	*	*			trans	74.5	96.5	158.6	-59.5	-173.4	178.4	-178.8	0	119.6
125	T	31.5	Very low	42.6	Very low	130 Å²	130	132.7 Å²	132.7	80%	0.798	75%	0.749	S	S	*	*				23.5	117.6	129.6	49	0	0	0	0	121
126	K	39.8	Very low	40.4	Very low	204 Å²	204	129.6 Å²	129.6	89%	0.887	76%	0.755	S	S	*	*			trans	21.6	127.6	136.1	-64.8	-177.6	177.8	-179.3	0	118.9
127	E	30.6	Very low	38.4	Very low	205 Å²	205	134.9 Å²	134.9	96%	0.958	77%	0.773	S	S	*	*				-144.9	159.9	114.6	-124.6	170.1	-150.5	0	0	110.7
128	A	33.2	Very low	36.6	Very low	91 Å²	91	134.9 Å²	134.9	75%	0.752	78%	0.783	S	S	*	*			trans	-139.3	132.3	-167.3	0	0	0	0	0	111.9
129	Q	31.6	Very low	34.8	Very low	187 Å²	187	138.7 Å²	138.7	87%	0.874	80%	0.798	S	S	*	*			trans	179.8	151.1	163.5	-102.3	170.3	21	0	0	108.2
130	K	29.8	Very low	33.5	Very low	193 Å²	193	138 Å²	138	84%	0.839	80%	0.802	S	S	*	*			cis	-159.7	150.7	-25.7	-138.2	-177.1	-174.9	179.2	0	107.2
131	I	35.6	Very low	32.5	Very low	151 Å²	151	137.4 Å²	137.4	77%	0.774	81%	0.81	S	S	*	*			trans	-73	139.9	173.5	-64.8	159.6	0	0	0	109.8
132	N	26.6	Very low	31.9	Very low	157 Å²	157	138.8 Å²	138.8	84%	0.84	81%	0.809	S	S	*	*			trans	-154.8	144.8	133.5	-137.2	4.4	0	0	0	115
133	N	28.7	Very low	31.1	Very low	150 Å²	150	144 Å²	144	80%	0.802	81%	0.81	S	S	*	*			trans	-90.4	166	172.9	-69.4	-34.9	0	0	0	110.9
134	G	28.4	Very low	30.9	Very low	68 Å²	68	145.9 Å²	145.9	70%	0.701	81%	0.81	S	S	*	*			trans	173.6	81.8	164.5	0	0	0	0	0	118.3
135	S	27.3	Very low	30.6	Very low	124 Å²	124	142 Å²	142	87%	0.867	80%	0.803	S	S	*	*			trans	38.3	133.4	139.2	55.9	0	0	0	0	123.4
136	S	29.2	Very low	30.6	Very low	117 Å²	117	142.5 Å²	142.5	82%	0.818	80%	0.801	S	S	*	*			trans	-65.1	145.9	167.7	-19.5	0	0	0	0	115.3
137	Q	28.8	Very low	30.1	Very low	197 Å²	197	142.2 Å²	142.2	92%	0.921	80%	0.802	S	S	*	*				-168.6	171.8	122.7	-113.9	179.9	-14.3	0	0	113.3
138	A	30.1	Very low	30.1	Very low	91 Å²	91	141.7 Å²	141.7	75%	0.752	80%	0.797	S	S	*	*			trans	-67.7	177.5	-175.3	0	0	0	0	0	113.1
139	D	26.1	Very low	30	Very low	163 Å²	163	145.9 Å²	145.9	87%	0.872	80%	0.801	S	S	*	*			cis	-164	168.5	24.4	-163.9	3.2	0	0	0	111.2
140	G	30.1	Very low	29.9	Very low	51 Å²	51	145.9 Å²	145.9	53%	0.526	80%	0.801	S	S	.	*			trans	100	117	146.7	0	0	0	0	0	120.8
141	T	29.7	Very low	30	Very low	148 Å²	148	142.6 Å²	142.6	91%	0.908	80%	0.797	S	S	*	*			trans	82.2	140.7	148.7	8.2	0	0	0	0	121.1
142	L	30.4	Very low	29.7	Very low	144 Å²	144	141.7 Å²	141.7	75%	0.754	80%	0.798	S	S	*	*			trans	-97.8	142	-168.7	-90.1	77.9	0	0	0	114.5
143	K	27.8	Very low	30	Very low	185 Å²	185	138.5 Å²	138.5	80%	0.804	79%	0.794	S	S	*	*			trans	68	160	142.2	-78.9	-176.2	-179.6	-178.5	0	118.6
144	P	39.4	Very low	30.4	Very low	106 Å²	106	135.5 Å²	135.5	69%	0.688	79%	0.789	S	S	*	*			cis	-138.9	-177.7	-17.6	31.8	-9.5	0	0	0	115.7
145	V	28.3	Very low	31	Very low	120 Å²	120	141.5 Å²	141.5	73%	0.727	80%	0.799	S	S	*	*			trans	81.7	130.3	157.8	-166.9	0	0	0	0	118.6
146	D	32.3	Very low	32.3	Very low	140 Å²	140	140.6 Å²	140.6	75%	0.749	79%	0.789	S	S	*	*			trans	34.8	107.7	160.8	-59.2	-25.8	0	0	0	120.8
147	E	29.3	Very low	34.3	Very low	198 Å²	198	137 Å²	137	93%	0.925	77%	0.769	S	S	*	*				-143.4	125	119	-117.5	169.8	-157.5	0	0	109.1	E149	E147-E149 PolarHBondContact O-N 3.15Å
148	K	30.6	Very low	36.8	Very low	195 Å²	195	138 Å²	138	85%	0.848	77%	0.765	S	S	*	*			trans	-80.5	110.4	174.7	-77.4	177.3	177.6	173.1	0	108.4	E150	K148-E150 PolarHBondContact O-N 3.07Å; K148-E150 VanDerWaalsContact O-N 3.12Å
149	E	30.4	Very low	39	Very low	178 Å²	178	141.4 Å²	141.4	83%	0.832	77%	0.767	S	S	*	*			trans	-61.1	113.5	155.3	-74.9	-172.9	130.4	0	0	108.4	E147 V151	E147-E149 PolarHBondContact O-N 3.15Å; E149-V151 PolarHBondContact O-N 3.26Å
150	E	28.9	Very low	41.7	Very low	187 Å²	187	136.6 Å²	136.6	87%	0.874	74%	0.744	S	S	*	*			trans	-67	83.8	163.1	-77.7	-168.1	131.5	0	0	108.8	K148 V152	K148-E150 PolarHBondContact O-N 3.07Å; K148-E150 VanDerWaalsContact O-N 3.12Å; E150-V152 PolarHBondContact O-N 3.2Å
151	V	32.9	Very low	44.3	Very low	124 Å²	124	137 Å²	137	75%	0.752	74%	0.739	S	S	*	*			trans	-60.6	106.1	160.1	-179.9	0	0	0	0	106.5	E149 A153	E149-V151 PolarHBondContact O-N 3.26Å; V151-A153 PolarHBondContact O-N 3.48Å
152	V	29.1	Very low	47	Very low	133 Å²	133	132.1 Å²	132.1	81%	0.806	71%	0.708	S	S	*	*			trans	-50.2	109.6	175.2	176	0	0	0	0	108.3	E150 A154	E150-V152 PolarHBondContact O-N 3.2Å; V152-A154 VanDerWaalsContact C-N 3.33Å; V152-A154 PolarHBondContact O-N 2.85Å
153	A	32.2	Very low	49.8	Very low	90 Å²	90	128.1 Å²	128.1	74%	0.744	69%	0.685	S	S	*	*			trans	-68.7	92.6	-179	0	0	0	0	0	109.1	V151 E155	V151-A153 PolarHBondContact O-N 3.48Å; A153-E155 PolarHBondContact O-N 3.15Å
154	A	38.1	Very low	52.6	Low	86 Å²	86	123.8 Å²	123.8	71%	0.711	67%	0.67	S	S	*	*			trans	-55.7	122	163.2	0	0	0	0	0	107.7	V152 V156	V152-A154 VanDerWaalsContact C-N 3.33Å; V152-A154 PolarHBondContact O-N 2.85Å; A154-V156 PolarHBondContact O-N 3.33Å; A154-V156 VanDerWaalsContact O-N 3.13Å
155	E	39.3	Very low	54.9	Low	194 Å²	194	126 Å²	126	91%	0.907	67%	0.665	S	S	*	*			trans	-51.1	121.3	-172.6	-65.5	-178.8	139.1	0	0	110.9	A153 G157	A153-E155 PolarHBondContact O-N 3.15Å; E155-G157 VanDerWaalsContact C-N 3.34Å; E155-G157 PolarHBondContact O-N 3.44Å
156	V	55	Low	57.7	Low	106 Å²	106	120.2 Å²	120.2	64%	0.642	63%	0.631	S	S	*	*			trans	-68.5	93.8	-178.7	-175	0	0	0	0	108.1	A154 T160	A154-V156 PolarHBondContact O-N 3.33Å; A154-V156 VanDerWaalsContact O-N 3.13Å; V156-T160 WeakPolarHBondContact CG1-OG1 3.29Å
157	G	71.7	Confident	60.2	Low	40 Å²	40	114.9 Å²	114.9	41%	0.412	61%	0.608	S	S	.	*			trans	-58.5	146.8	-174	0	0	0	0	0	112.3	E155 M159 T160 S161	E155-G157 VanDerWaalsContact C-N 3.34Å; E155-G157 PolarHBondContact O-N 3.44Å; G157-M159 PolarHBondContact O-N 3Å; G157-T160 PolarHBondContact O-N 3.48Å; G157-T160 PolarHBondContact O-OG1 3.21Å; G157-S161 PolarHBondContact O-N 3.12Å
158	W	80.4	Confident	63	Low	218 Å²	218	108.3 Å²	108.3	83%	0.826	58%	0.581	S	S	*	*	H	α-helix	trans	-44.1	-38.6	178.8	173.6	-89	0	0	0	114	T160 S161 V162	W158-T160 PolarHBondContact O-N 2.92Å; W158-S161 PolarHBondContact O-N 3.39Å; W158-V162 HydrophobicContact CD2-CG2 4.29Å; W158-V162 HydrophobicContact CG-CG2 4.46Å; W158-V162 HydrophobicContact CZ2-CG2 4.08Å; W158-V162 WeakPolarHBondContact O-CG2 3.43Å; W158-V162 PolarHBondContact O-N 3.27Å
159	M	76.6	Confident	65.6	Low	163 Å²	163	100.6 Å²	100.6	80%	0.803	55%	0.549	S	S	*	.	H	α-helix	trans	-72.2	-23.3	-178.1	-162.2	159.4	72.6	0	0	114.4	G157 K163	G157-M159 PolarHBondContact O-N 3Å; M159-K163 VanDerWaalsContact O-CB 3.28Å; M159-K163 WeakPolarHBondContact O-CB 3.46Å; M159-K163 PolarHBondContact O-N 2.84Å
160	T	83.4	Confident	68.2	Low	63 Å²	63	93.8 Å²	93.8	39%	0.387	52%	0.518	S	S	.	.	H	α-helix	trans	-76.4	-45.6	168.5	52.9	0	0	0	0	110.1	V156 G157 W158 V162 K163 D164	V156-T160 WeakPolarHBondContact CG1-OG1 3.29Å; G157-T160 PolarHBondContact O-N 3.48Å; G157-T160 PolarHBondContact O-OG1 3.21Å; W158-T160 PolarHBondContact O-N 2.92Å; T160-V162 VanDerWaalsContact C-N 3.34Å; T160-V162 PolarHBondContact O-N 3.15Å; T160-K163 WeakPolarHBondContact O-CB 3.36Å; T160-K163 PolarHBondContact O-N 3.42Å; T160-D164 PolarHBondContact O-N 2.72Å
161	S	83.8	Confident	70.6	Confident	59 Å²	59	86.6 Å²	86.6	41%	0.413	49%	0.488	S	S	.	.	H	α-helix	trans	-57.4	-42.5	177.7	-53.2	0	0	0	0	113.4	G157 W158 W165	G157-S161 PolarHBondContact O-N 3.12Å; W158-S161 PolarHBondContact O-N 3.39Å; S161-W165 WeakPolarHBondContact O-CB 3.4Å; S161-W165 PolarHBondContact O-N 3.43Å
162	V	87.9	Confident	72.7	Confident	45 Å²	45	80.9 Å²	80.9	27%	0.273	45%	0.454	S	S	.	.	H	α-helix	trans	-69.1	-35.9	176.2	170.3	0	0	0	0	112.2	W158 T160 A166 I234	W158-V162 HydrophobicContact CD2-CG2 4.29Å; W158-V162 HydrophobicContact CG-CG2 4.46Å; W158-V162 HydrophobicContact CZ2-CG2 4.08Å; W158-V162 WeakPolarHBondContact O-CG2 3.43Å; W158-V162 PolarHBondContact O-N 3.27Å; T160-V162 VanDerWaalsContact C-N 3.34Å; T160-V162 PolarHBondContact O-N 3.15Å; V162-A166 WeakPolarHBondContact O-CB 3.25Å; V162-A166 PolarHBondContact O-N 3.17Å; V162-I234 HydrophobicContact CG1-CG2 3.92Å
163	K	88.9	Confident	75.2	Confident	60 Å²	60	81.3 Å²	81.3	26%	0.261	45%	0.447	S	S	.	.	H	α-helix	trans	-66.4	-43.7	175.4	176.8	-170.5	171.4	-155.3	0	111.4	M159 T160 A166 G167 A235 N237	M159-K163 VanDerWaalsContact O-CB 3.28Å; M159-K163 WeakPolarHBondContact O-CB 3.46Å; M159-K163 PolarHBondContact O-N 2.84Å; T160-K163 WeakPolarHBondContact O-CB 3.36Å; T160-K163 PolarHBondContact O-N 3.42Å; K163-A166 PolarHBondContact O-N 3.08Å; K163-G167 PolarHBondContact O-N 3.46Å; K163-A235 WeakPolarHBondContact CE-O 3.14Å; K163-N237 WeakPolarHBondContact CE-OD1 3.34Å; K163-N237 PolarHBondContact NZ-OD1 3.33Å
164	D	86.4	Confident	77.8	Confident	94 Å²	94	79.1 Å²	79.1	50%	0.503	43%	0.425	S	S	.	.	H	α-helix	trans	-67.8	-41.1	-179.6	-62.2	-24.2	0	0	0	110.7	T160 A166 G167 V168	T160-D164 PolarHBondContact O-N 2.72Å; D164-A166 PolarHBondContact O-N 3.02Å; D164-G167 PolarHBondContact O-N 3.49Å; D164-V168 WeakPolarHBondContact O-CB 3.35Å; D164-V168 WeakPolarHBondContact O-CG2 3.47Å; D164-V168 PolarHBondContact O-N 3.04Å
165	W	87.5	Confident	80.1	Confident	152 Å²	152	81.6 Å²	81.6	58%	0.576	43%	0.425	S	S	*	.	H	α-helix	trans	-57.3	-48.4	170.7	175.1	82	0	0	0	112.4	S161 G167 V168 M169 L231	S161-W165 WeakPolarHBondContact O-CB 3.4Å; S161-W165 PolarHBondContact O-N 3.43Å; W165-G167 PolarHBondContact O-N 2.83Å; W165-V168 PolarHBondContact O-N 2.68Å; W165-M169 HydrophobicContact CD2-SD 4.2Å; W165-M169 HydrophobicContact CE3-SD 4.39Å; W165-M169 HydrophobicContact CH2-SD 3.55Å; W165-M169 VanDerWaalsContact CH2-SD 3.55Å; W165-M169 HydrophobicContact CZ2-SD 3.29Å; W165-M169 WeakPolarHBondContact CZ2-SD 3.49Å; W165-M169 HydrophobicContact CZ3-SD 4.09Å; W165-M169 PolarHBondContact O-N 3.14Å; W165-M169 VanDerWaalsContact O-N 3.09Å; W165-L231 HydrophobicContact CH2-CD2 4.32Å; W165-L231 HydrophobicContact CZ3-CD2 3.9Å
166	A	86.8	Confident	82.4	Confident	0 Å²	0	76.8 Å²	76.8	0%	0	41%	0.409	C	S	.	.	H	α-helix	trans	-63.6	-40.2	176.5	0	0	0	0	0	111.8	V162 K163 D164 V168 M169 I170 I234 A235	V162-A166 WeakPolarHBondContact O-CB 3.25Å; V162-A166 PolarHBondContact O-N 3.17Å; K163-A166 PolarHBondContact O-N 3.08Å; D164-A166 PolarHBondContact O-N 3.02Å; A166-V168 PolarHBondContact O-N 3.31Å; A166-M169 PolarHBondContact O-N 3.36Å; A166-I170 WeakPolarHBondContact O-CG1 3.35Å; A166-I170 PolarHBondContact O-N 3.19Å; A166-I234 HydrophobicContact CB-CB 4.21Å; A166-I234 HydrophobicContact CB-CG2 3.72Å; A166-A235 HydrophobicContact CB-CB 4.03Å
167	G	85.4	Confident	84	Confident	27 Å²	27	71.7 Å²	71.7	28%	0.278	38%	0.378	S	S	.	.	H	α-helix	trans	-60.3	-42.8	175.5	0	0	0	0	0	113.1	K163 D164 W165 M169 I170 S171	K163-G167 PolarHBondContact O-N 3.46Å; D164-G167 PolarHBondContact O-N 3.49Å; W165-G167 PolarHBondContact O-N 2.83Å; G167-M169 VanDerWaalsContact C-N 3.3Å; G167-M169 PolarHBondContact O-N 2.93Å; G167-I170 PolarHBondContact O-N 2.9Å; G167-S171 VanDerWaalsContact O-CB 3.32Å; G167-S171 WeakPolarHBondContact O-CB 3.39Å; G167-S171 PolarHBondContact O-N 3.23Å; G167-S171 PolarHBondContact O-OG 3.17Å
168	V	86.8	Confident	84.7	Confident	60 Å²	60	74.9 Å²	74.9	36%	0.364	38%	0.378	S	S	.	.	H	α-helix	trans	-69.1	-25.8	176.5	170.4	0	0	0	0	112.8	D164 W165 A166 S171 T174	D164-V168 WeakPolarHBondContact O-CB 3.35Å; D164-V168 WeakPolarHBondContact O-CG2 3.47Å; D164-V168 PolarHBondContact O-N 3.04Å; W165-V168 PolarHBondContact O-N 2.68Å; A166-V168 PolarHBondContact O-N 3.31Å; V168-S171 PolarHBondContact O-OG 2.83Å; V168-T174 HydrophobicContact CG1-CG2 3.48Å; V168-T174 VanDerWaalsContact CG1-CG2 3.48Å; V168-T174 PolarHBondContact O-OG1 3.49Å
169	M	86.3	Confident	85.1	Confident	34 Å²	34	68.3 Å²	68.3	17%	0.167	36%	0.362	C	S	.	.	H	α-helix	trans	-75.4	-38.8	170.5	-74.9	-169.7	63.5	0	0	112.9	W165 A166 G167 G177 L180 L231	W165-M169 HydrophobicContact CD2-SD 4.2Å; W165-M169 HydrophobicContact CE3-SD 4.39Å; W165-M169 HydrophobicContact CH2-SD 3.55Å; W165-M169 VanDerWaalsContact CH2-SD 3.55Å; W165-M169 HydrophobicContact CZ2-SD 3.29Å; W165-M169 WeakPolarHBondContact CZ2-SD 3.49Å; W165-M169 HydrophobicContact CZ3-SD 4.09Å; W165-M169 PolarHBondContact O-N 3.14Å; W165-M169 VanDerWaalsContact O-N 3.09Å; A166-M169 PolarHBondContact O-N 3.36Å; G167-M169 VanDerWaalsContact C-N 3.3Å; G167-M169 PolarHBondContact O-N 2.93Å; M169-G177 WeakPolarHBondContact O-CA 3.3Å; M169-L180 HydrophobicContact CE-CD2 4.22Å; M169-L231 HydrophobicContact CE-CD1 4.27Å
170	I	85.3	Confident	85.7	Confident	34 Å²	34	61.5 Å²	61.5	17%	0.174	33%	0.329	C	S	.	.	H	α-helix	trans	-75.1	-35.4	179.1	-62.6	-59.5	0	0	0	111.9	A166 G167 A172 L180 Y228 L231 R232 A235	A166-I170 WeakPolarHBondContact O-CG1 3.35Å; A166-I170 PolarHBondContact O-N 3.19Å; G167-I170 PolarHBondContact O-N 2.9Å; I170-A172 PolarHBondContact O-N 3.17Å; I170-L180 HydrophobicContact CD1-CD2 4.24Å; I170-Y228 HydrophobicContact CD1-CD2 4.05Å; I170-Y228 HydrophobicContact CD1-CE2 3.47Å; I170-Y228 VanDerWaalsContact CD1-CE2 3.47Å; I170-L231 HydrophobicContact CD1-CB 4.17Å; I170-R232 HydrophobicContact CD1-CG 3.72Å; I170-R232 HydrophobicContact CG1-CG 4.26Å; I170-A235 HydrophobicContact CG1-CB 4.48Å
171	S	78.3	Confident	85.9	Confident	36 Å²	36	58.7 Å²	58.7	25%	0.252	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	3.8	-174.2	68.6	0	0	0	0	116	G167 V168 Q173	G167-S171 VanDerWaalsContact O-CB 3.32Å; G167-S171 WeakPolarHBondContact O-CB 3.39Å; G167-S171 PolarHBondContact O-N 3.23Å; G167-S171 PolarHBondContact O-OG 3.17Å; V168-S171 PolarHBondContact O-OG 2.83Å; S171-Q173 PolarHBondContact O-N 3.18Å; S171-Q173 VanDerWaalsContact OG-CD 3.3Å; S171-Q173 WeakPolarHBondContact OG-CG 3.4Å
172	A	77.4	Confident	86.1	Confident	4 Å²	4	59 Å²	59	3%	0.033	31%	0.31	C	S	.	.	S	Bend	trans	53.3	17.2	-179.1	0	0	0	0	0	115.7	I170 T174 R178 V181 F288	I170-A172 PolarHBondContact O-N 3.17Å; A172-T174 VanDerWaalsContact C-N 3.33Å; A172-R178 HydrophobicContact CB-CG 4.04Å; A172-R178 WeakPolarHBondContact O-CG 3.33Å; A172-R178 PolarHBondContact O-NE 3.46Å; A172-V181 HydrophobicContact CB-CG2 4.33Å; A172-F288 HydrophobicContact CB-CB 3.77Å; A172-F288 HydrophobicContact CB-CD2 4.47Å; A172-F288 HydrophobicContact CB-CG 4.16Å
173	Q	81.9	Confident	86.2	Confident	142 Å²	142	60.6 Å²	60.6	66%	0.664	32%	0.317	S	S	*	.			trans	-69	-34.7	176.2	-70.1	173.8	-2.5	0	0	111.3	S171	S171-Q173 PolarHBondContact O-N 3.18Å; S171-Q173 VanDerWaalsContact OG-CD 3.3Å; S171-Q173 WeakPolarHBondContact OG-CG 3.4Å
174	T	87.3	Confident	86.3	Confident	45 Å²	45	57.8 Å²	57.8	28%	0.276	31%	0.305	S	S	.	.	S	Bend	trans	-91.4	154.3	176.6	53.3	0	0	0	0	112.2	V168 A172 T176 G177 R178	V168-T174 HydrophobicContact CG1-CG2 3.48Å; V168-T174 VanDerWaalsContact CG1-CG2 3.48Å; V168-T174 PolarHBondContact O-OG1 3.49Å; A172-T174 VanDerWaalsContact C-N 3.33Å; T174-T176 VanDerWaalsContact C-N 3.28Å; T174-T176 PolarHBondContact O-N 3.46Å; T174-T176 PolarHBondContact OG1-OG1 3.31Å; T174-G177 PolarHBondContact O-N 3.3Å; T174-G177 PolarHBondContact OG1-N 3Å; T174-G177 VanDerWaalsContact OG1-N 3.12Å; T174-R178 WeakPolarHBondContact O-CG 3.38Å; T174-R178 PolarHBondContact O-N 3.03Å
175	L	85.7	Confident	86.3	Confident	138 Å²	138	55.8 Å²	55.8	72%	0.723	29%	0.292	S	S	*	.	H	α-helix	trans	-58.1	-41.7	173.5	180	64.1	0	0	0	111.7	R178 V179	L175-R178 PolarHBondContact O-N 2.63Å; L175-V179 WeakPolarHBondContact O-CG2 3.48Å; L175-V179 PolarHBondContact O-N 2.94Å
176	T	88.4	Confident	86.5	Confident	92 Å²	92	51.1 Å²	51.1	56%	0.564	29%	0.285	S	S	*	.	H	α-helix	trans	-62.8	-41.3	175.4	44.6	0	0	0	0	112	T174 V179 L180	T174-T176 VanDerWaalsContact C-N 3.28Å; T174-T176 PolarHBondContact O-N 3.46Å; T174-T176 PolarHBondContact OG1-OG1 3.31Å; T176-V179 PolarHBondContact O-N 3.41Å; T176-L180 WeakPolarHBondContact O-CB 3.3Å; T176-L180 PolarHBondContact O-N 3.03Å
177	G	87.3	Confident	86.8	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-62.7	-40.7	172.9	0	0	0	0	0	113.3	M169 T174 L180 V181	M169-G177 WeakPolarHBondContact O-CA 3.3Å; T174-G177 PolarHBondContact O-N 3.3Å; T174-G177 PolarHBondContact OG1-N 3Å; T174-G177 VanDerWaalsContact OG1-N 3.12Å; G177-L180 WeakPolarHBondContact O-CB 3.14Å; G177-L180 PolarHBondContact O-N 3.08Å; G177-V181 WeakPolarHBondContact O-CB 3.46Å; G177-V181 WeakPolarHBondContact O-CG2 3.33Å; G177-V181 PolarHBondContact O-N 2.65Å
178	R	85.9	Confident	87	Confident	106 Å²	106	51.9 Å²	51.9	40%	0.4	28%	0.284	S	S	.	.	H	α-helix	trans	-62.6	-43.8	174.2	-68.1	177.4	-171.9	-177.6	2.4	112.3	A172 T174 L175 V181 V182 L289	A172-R178 HydrophobicContact CB-CG 4.04Å; A172-R178 WeakPolarHBondContact O-CG 3.33Å; A172-R178 PolarHBondContact O-NE 3.46Å; T174-R178 WeakPolarHBondContact O-CG 3.38Å; T174-R178 PolarHBondContact O-N 3.03Å; L175-R178 PolarHBondContact O-N 2.63Å; R178-V181 PolarHBondContact O-N 3.43Å; R178-V182 WeakPolarHBondContact O-CG2 3.17Å; R178-V182 PolarHBondContact O-N 2.86Å; R178-L289 HydrophobicContact CB-CD2 4.36Å
179	V	89.3	Confident	87.3	Confident	80 Å²	80	52.2 Å²	52.2	49%	0.485	28%	0.283	S	S	.	.	H	α-helix	trans	-62.3	-43.9	175.6	172.3	0	0	0	0	110.7	L175 T176 V181 V182 L183	L175-V179 WeakPolarHBondContact O-CG2 3.48Å; L175-V179 PolarHBondContact O-N 2.94Å; T176-V179 PolarHBondContact O-N 3.41Å; V179-V181 PolarHBondContact O-N 2.91Å; V179-V182 PolarHBondContact O-N 3.26Å; V179-L183 HydrophobicContact CG1-CD1 3.93Å; V179-L183 HydrophobicContact CG1-CG 4.4Å; V179-L183 WeakPolarHBondContact O-CB 3.39Å; V179-L183 VanDerWaalsContact O-CG 3.29Å; V179-L183 WeakPolarHBondContact O-CG 3.44Å; V179-L183 PolarHBondContact O-N 3.49Å
180	L	90.3	Very high	87.6	Confident	21 Å²	21	51.5 Å²	51.5	11%	0.11	28%	0.284	C	S	.	.	H	α-helix	trans	-57	-49.1	175	-179.4	69.1	0	0	0	111.4	M169 I170 T176 G177 L183 V184 F224 Y228 L231	M169-L180 HydrophobicContact CE-CD2 4.22Å; I170-L180 HydrophobicContact CD1-CD2 4.24Å; T176-L180 WeakPolarHBondContact O-CB 3.3Å; T176-L180 PolarHBondContact O-N 3.03Å; G177-L180 WeakPolarHBondContact O-CB 3.14Å; G177-L180 PolarHBondContact O-N 3.08Å; L180-L183 PolarHBondContact O-N 3.36Å; L180-V184 VanDerWaalsContact O-CG2 3.25Å; L180-V184 WeakPolarHBondContact O-CG2 3.3Å; L180-V184 PolarHBondContact O-N 3.15Å; L180-F224 HydrophobicContact CD1-CE2 4.26Å; L180-F224 HydrophobicContact CD1-CZ 3.95Å; L180-Y228 HydrophobicContact CD1-CD2 4.35Å; L180-Y228 HydrophobicContact CD2-CD2 4.18Å; L180-Y228 HydrophobicContact CD2-CE2 4.25Å; L180-Y228 HydrophobicContact CG-CD2 4.25Å; L180-Y228 HydrophobicContact CG-CE2 4.38Å; L180-L231 HydrophobicContact CD2-CD1 3.97Å
181	V	87.1	Confident	87.9	Confident	4 Å²	4	49.9 Å²	49.9	2%	0.024	28%	0.276	C	S	.	.	H	α-helix	trans	-63.7	-40.9	-179.9	164.8	0	0	0	0	112.3	A172 G177 R178 V179 V184 F185 I285	A172-V181 HydrophobicContact CB-CG2 4.33Å; G177-V181 WeakPolarHBondContact O-CB 3.46Å; G177-V181 WeakPolarHBondContact O-CG2 3.33Å; G177-V181 PolarHBondContact O-N 2.65Å; R178-V181 PolarHBondContact O-N 3.43Å; V179-V181 PolarHBondContact O-N 2.91Å; V181-V184 PolarHBondContact O-N 2.57Å; V181-F185 PolarHBondContact O-N 3.18Å; V181-F185 VanDerWaalsContact O-N 3.08Å; V181-I285 HydrophobicContact CG1-CB 4.22Å; V181-I285 HydrophobicContact CG1-CG1 3.98Å; V181-I285 HydrophobicContact CG1-CG2 3.7Å
182	V	87.9	Confident	88.7	Confident	65 Å²	65	48.6 Å²	48.6	39%	0.394	27%	0.266	S	S	.	.	H	α-helix	trans	-64.5	-40.3	174	171.7	0	0	0	0	111.6	R178 V179 F185 A186 L289	R178-V182 WeakPolarHBondContact O-CG2 3.17Å; R178-V182 PolarHBondContact O-N 2.86Å; V179-V182 PolarHBondContact O-N 3.26Å; V182-F185 PolarHBondContact O-N 3Å; V182-A186 WeakPolarHBondContact O-CB 3.31Å; V182-A186 PolarHBondContact O-N 2.95Å; V182-L289 HydrophobicContact CG2-CD1 3.8Å; V182-L289 HydrophobicContact CG2-CD2 3.75Å; V182-L289 HydrophobicContact CG2-CG 4.41Å
183	L	90.6	Very high	89.4	Confident	78 Å²	78	51.6 Å²	51.6	41%	0.408	28%	0.284	S	S	.	.	H	α-helix	trans	-65.2	-45.1	176	-72.9	170.8	0	0	0	111.5	V179 L180 F185 A186 L187 F224	V179-L183 HydrophobicContact CG1-CD1 3.93Å; V179-L183 HydrophobicContact CG1-CG 4.4Å; V179-L183 WeakPolarHBondContact O-CB 3.39Å; V179-L183 VanDerWaalsContact O-CG 3.29Å; V179-L183 WeakPolarHBondContact O-CG 3.44Å; V179-L183 PolarHBondContact O-N 3.49Å; L180-L183 PolarHBondContact O-N 3.36Å; L183-F185 PolarHBondContact O-N 3.39Å; L183-A186 PolarHBondContact O-N 3.44Å; L183-L187 HydrophobicContact CB-CD1 4.4Å; L183-L187 VanDerWaalsContact O-CB 3.24Å; L183-L187 WeakPolarHBondContact O-CB 3.28Å; L183-L187 WeakPolarHBondContact O-CG 3.47Å; L183-L187 PolarHBondContact O-N 2.87Å; L183-F224 HydrophobicContact CB-CE2 4.25Å; L183-F224 HydrophobicContact CB-CZ 3.8Å
184	V	89.7	Confident	89.9	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.012	26%	0.256	C	S	.	.	H	α-helix	trans	-54.7	-43.3	174.4	170.9	0	0	0	0	111.2	L180 V181 S188 F224 Y228	L180-V184 VanDerWaalsContact O-CG2 3.25Å; L180-V184 WeakPolarHBondContact O-CG2 3.3Å; L180-V184 PolarHBondContact O-N 3.15Å; V181-V184 PolarHBondContact O-N 2.57Å; V184-S188 VanDerWaalsContact O-CB 3.22Å; V184-S188 WeakPolarHBondContact O-CB 3.41Å; V184-S188 PolarHBondContact O-N 3.12Å; V184-S188 PolarHBondContact O-OG 2.79Å; V184-F224 HydrophobicContact CB-CE1 4.38Å; V184-F224 HydrophobicContact CG2-CE1 3.63Å; V184-F224 HydrophobicContact CG2-CZ 3.92Å; V184-Y228 HydrophobicContact CB-CE1 4.42Å; V184-Y228 HydrophobicContact CG1-CD1 4.09Å; V184-Y228 HydrophobicContact CG1-CE1 3.67Å; V184-Y228 HydrophobicContact CG2-CD1 3.82Å; V184-Y228 HydrophobicContact CG2-CD2 3.5Å; V184-Y228 HydrophobicContact CG2-CE1 3.84Å; V184-Y228 HydrophobicContact CG2-CE2 3.55Å; V184-Y228 HydrophobicContact CG2-CG 3.64Å
185	F	87.1	Confident	90.2	Very high	52 Å²	52	43.4 Å²	43.4	23%	0.228	24%	0.243	C	C	.	.	H	α-helix	trans	-64.7	-55.3	177.2	178.8	-112.6	0	0	0	112.7	V181 V182 L183 L187 S188 I189 F282 I285	V181-F185 PolarHBondContact O-N 3.18Å; V181-F185 VanDerWaalsContact O-N 3.08Å; V182-F185 PolarHBondContact O-N 3Å; L183-F185 PolarHBondContact O-N 3.39Å; F185-L187 VanDerWaalsContact C-N 3.35Å; F185-L187 PolarHBondContact O-N 3.48Å; F185-S188 PolarHBondContact O-N 3.16Å; F185-S188 VanDerWaalsContact O-N 3.13Å; F185-I189 HydrophobicContact CE1-CD1 3.77Å; F185-I189 HydrophobicContact CE2-CD1 3.74Å; F185-I189 HydrophobicContact CE2-CG1 4.32Å; F185-I189 HydrophobicContact CZ-CD1 3.33Å; F185-I189 HydrophobicContact CZ-CG1 4.36Å; F185-I189 PolarHBondContact O-N 3.36Å; F185-I189 VanDerWaalsContact O-N 3.11Å; F185-F282 AromaticContact CD2-CD2 3.96Å; F185-F282 HydrophobicContact CD2-CD2 3.96Å; F185-F282 HydrophobicContact CE1-CD2 4.32Å; F185-F282 AromaticContact CE1-CE2 3.97Å; F185-F282 HydrophobicContact CE1-CE2 3.97Å; F185-F282 HydrophobicContact CE2-CB 4.27Å; F185-F282 AromaticContact CE2-CD2 3.13Å; F185-F282 HydrophobicContact CE2-CD2 3.13Å; F185-F282 AromaticContact CE2-CE2 3.56Å; F185-F282 HydrophobicContact CE2-CE2 3.56Å; F185-F282 AromaticContact CE2-CG 3.91Å; F185-F282 HydrophobicContact CE2-CG 3.91Å; F185-F282 AromaticContact CZ-CD2 3.35Å; F185-F282 HydrophobicContact CZ-CD2 3.35Å; F185-F282 AromaticContact CZ-CE2 3.18Å; F185-F282 HydrophobicContact CZ-CE2 3.18Å; F185-F282 HydrophobicContact CZ-CG 4.34Å; F185-F282 HydrophobicContact CZ-CZ 4.09Å; F185-I285 HydrophobicContact CB-CD1 4.18Å; F185-I285 HydrophobicContact CB-CG2 4.2Å; F185-I285 HydrophobicContact CD2-CD1 4.34Å; F185-I285 HydrophobicContact CG-CG2 4.43Å
186	A	90.8	Very high	90.6	Very high	53 Å²	53	39 Å²	39	44%	0.438	22%	0.218	S	C	.	.	H	α-helix	trans	-61.1	-42.4	-177.5	0	0	0	0	0	112.2	V182 L183 S188 I189 G190	V182-A186 WeakPolarHBondContact O-CB 3.31Å; V182-A186 PolarHBondContact O-N 2.95Å; L183-A186 PolarHBondContact O-N 3.44Å; A186-S188 VanDerWaalsContact C-N 3.34Å; A186-I189 PolarHBondContact O-N 2.9Å; A186-G190 PolarHBondContact O-N 2.94Å
187	L	93.1	Very high	90.7	Very high	35 Å²	35	38.7 Å²	38.7	18%	0.183	21%	0.212	C	C	.	.	H	α-helix	trans	-70.9	-29	177.7	-61.4	172	0	0	0	111.8	L183 F185 G190 A191 F221 F224 F225	L183-L187 HydrophobicContact CB-CD1 4.4Å; L183-L187 VanDerWaalsContact O-CB 3.24Å; L183-L187 WeakPolarHBondContact O-CB 3.28Å; L183-L187 WeakPolarHBondContact O-CG 3.47Å; L183-L187 PolarHBondContact O-N 2.87Å; F185-L187 VanDerWaalsContact C-N 3.35Å; F185-L187 PolarHBondContact O-N 3.48Å; L187-G190 PolarHBondContact O-N 3.37Å; L187-A191 WeakPolarHBondContact O-CB 3.49Å; L187-A191 PolarHBondContact O-N 2.83Å; L187-F221 HydrophobicContact CD2-CD1 3.61Å; L187-F221 HydrophobicContact CD2-CE1 3.39Å; L187-F221 HydrophobicContact CD2-CG 4.37Å; L187-F221 HydrophobicContact CD2-CZ 4Å; L187-F224 HydrophobicContact CD1-CB 4.26Å; L187-F224 HydrophobicContact CD1-CD1 3.43Å; L187-F224 VanDerWaalsContact CD1-CD1 3.43Å; L187-F224 HydrophobicContact CD1-CD2 3.97Å; L187-F224 HydrophobicContact CD1-CE1 3.64Å; L187-F224 HydrophobicContact CD1-CE2 4.15Å; L187-F224 HydrophobicContact CD1-CG 3.61Å; L187-F224 HydrophobicContact CD1-CZ 3.99Å; L187-F225 HydrophobicContact CB-CE1 4.4Å; L187-F225 HydrophobicContact CB-CZ 3.92Å
188	S	91.1	Very high	90.8	Very high	9 Å²	9	39 Å²	39	6%	0.063	21%	0.214	C	C	.	.	H	α-helix	trans	-69.5	-40.3	175.3	-66.3	0	0	0	0	111.8	V184 F185 A186 A191 L192 F225 R278	V184-S188 VanDerWaalsContact O-CB 3.22Å; V184-S188 WeakPolarHBondContact O-CB 3.41Å; V184-S188 PolarHBondContact O-N 3.12Å; V184-S188 PolarHBondContact O-OG 2.79Å; F185-S188 PolarHBondContact O-N 3.16Å; F185-S188 VanDerWaalsContact O-N 3.13Å; A186-S188 VanDerWaalsContact C-N 3.34Å; S188-A191 PolarHBondContact O-N 3.48Å; S188-L192 PolarHBondContact O-N 2.94Å; S188-L192 VanDerWaalsContact O-N 3.09Å; S188-F225 WeakPolarHBondContact OG-CE1 3.49Å; S188-R278 WeakPolarHBondContact OG-CD 3.44Å
189	I	92.1	Very high	90.9	Very high	67 Å²	67	34.5 Å²	34.5	34%	0.344	20%	0.198	S	C	.	.	H	α-helix	trans	-63.4	-45.5	169.7	-66.6	178.4	0	0	0	110.1	F185 A186 A191 L192 V193 L279	F185-I189 HydrophobicContact CE1-CD1 3.77Å; F185-I189 HydrophobicContact CE2-CD1 3.74Å; F185-I189 HydrophobicContact CE2-CG1 4.32Å; F185-I189 HydrophobicContact CZ-CD1 3.33Å; F185-I189 HydrophobicContact CZ-CG1 4.36Å; F185-I189 PolarHBondContact O-N 3.36Å; F185-I189 VanDerWaalsContact O-N 3.11Å; A186-I189 PolarHBondContact O-N 2.9Å; I189-A191 VanDerWaalsContact C-N 3.35Å; I189-A191 PolarHBondContact O-N 2.84Å; I189-L192 WeakPolarHBondContact O-CB 3.48Å; I189-L192 PolarHBondContact O-N 3.03Å; I189-L192 VanDerWaalsContact O-N 3.12Å; I189-V193 HydrophobicContact CG2-CG2 4.33Å; I189-V193 WeakPolarHBondContact O-CG2 3.32Å; I189-V193 PolarHBondContact O-N 3.11Å; I189-L279 HydrophobicContact CG1-CD2 4.38Å
190	G	93.3	Very high	90.8	Very high	18 Å²	18	35.5 Å²	35.5	19%	0.186	21%	0.208	C	C	.	.	H	α-helix	trans	-55.9	-45.9	176.1	0	0	0	0	0	113.1	A186 L187 L192 V193 I194	A186-G190 PolarHBondContact O-N 2.94Å; L187-G190 PolarHBondContact O-N 3.37Å; G190-L192 VanDerWaalsContact C-N 3.3Å; G190-L192 PolarHBondContact O-N 2.87Å; G190-V193 PolarHBondContact O-N 3.12Å; G190-I194 WeakPolarHBondContact O-CG1 3.27Å; G190-I194 PolarHBondContact O-N 3.38Å
191	A	92	Very high	90.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-67.6	-27.7	178.1	0	0	0	0	0	113.4	L187 S188 I189 Y195 F221 F225 R275	L187-A191 WeakPolarHBondContact O-CB 3.49Å; L187-A191 PolarHBondContact O-N 2.83Å; S188-A191 PolarHBondContact O-N 3.48Å; I189-A191 VanDerWaalsContact C-N 3.35Å; I189-A191 PolarHBondContact O-N 2.84Å; A191-Y195 PolarHBondContact O-N 3.41Å; A191-F221 HydrophobicContact CB-CD2 4.07Å; A191-F225 HydrophobicContact CB-CE2 3.95Å; A191-F225 HydrophobicContact CB-CZ 4.43Å; A191-R275 VanDerWaalsContact O-CD 3.27Å; A191-R275 WeakPolarHBondContact O-CD 3.3Å; A191-R275 PolarHBondContact O-NH1 3.41Å
192	L	93.6	Very high	90.2	Very high	9 Å²	9	42.2 Å²	42.2	5%	0.047	25%	0.25	C	C	.	.	H	α-helix	trans	-75.6	-38.8	171.9	-178.8	62.1	0	0	0	111.8	S188 I189 G190 Y195 F196 A276 L279	S188-L192 PolarHBondContact O-N 2.94Å; S188-L192 VanDerWaalsContact O-N 3.09Å; I189-L192 WeakPolarHBondContact O-CB 3.48Å; I189-L192 PolarHBondContact O-N 3.03Å; I189-L192 VanDerWaalsContact O-N 3.12Å; G190-L192 VanDerWaalsContact C-N 3.3Å; G190-L192 PolarHBondContact O-N 2.87Å; L192-Y195 HydrophobicContact CD1-CD1 4.08Å; L192-Y195 WeakPolarHBondContact O-CB 3.49Å; L192-Y195 PolarHBondContact O-N 2.74Å; L192-Y195 VanDerWaalsContact O-N 3.15Å; L192-F196 HydrophobicContact CD1-CE1 3.83Å; L192-F196 HydrophobicContact CD1-CE2 4.47Å; L192-F196 HydrophobicContact CD1-CZ 3.78Å; L192-F196 HydrophobicContact CD2-CE2 4.27Å; L192-F196 HydrophobicContact CD2-CZ 3.94Å; L192-F196 HydrophobicContact CG-CE1 4.13Å; L192-F196 HydrophobicContact CG-CE2 3.87Å; L192-F196 HydrophobicContact CG-CZ 3.61Å; L192-F196 WeakPolarHBondContact O-CG 3.45Å; L192-F196 PolarHBondContact O-N 3.25Å; L192-A276 HydrophobicContact CD1-CB 3.86Å; L192-A276 HydrophobicContact CD2-CB 4.42Å; L192-L279 HydrophobicContact CD2-CD1 3.94Å; L192-L279 HydrophobicContact CD2-CG 4.37Å
193	V	93.7	Very high	89.8	Confident	68 Å²	68	40.9 Å²	40.9	41%	0.412	24%	0.24	S	C	.	.	H	α-helix	trans	-63.9	-40.1	173.3	171.6	0	0	0	0	111.2	I189 G190 Y195 F196 I197	I189-V193 HydrophobicContact CG2-CG2 4.33Å; I189-V193 WeakPolarHBondContact O-CG2 3.32Å; I189-V193 PolarHBondContact O-N 3.11Å; G190-V193 PolarHBondContact O-N 3.12Å; V193-Y195 VanDerWaalsContact C-N 3.3Å; V193-Y195 PolarHBondContact O-N 2.91Å; V193-F196 PolarHBondContact O-N 3.3Å; V193-F196 VanDerWaalsContact O-N 3.12Å; V193-I197 HydrophobicContact CG1-CD1 4.19Å; V193-I197 WeakPolarHBondContact O-CG1 3.41Å; V193-I197 PolarHBondContact O-N 2.91Å
194	I	92.4	Very high	89.4	Confident	14 Å²	14	39 Å²	39	7%	0.072	23%	0.229	C	C	.	.	H	α-helix	trans	-59	-42.7	171.6	-68.8	169.5	0	0	0	110.7	G190 F196 I197 D198 I217 D218 F221	G190-I194 WeakPolarHBondContact O-CG1 3.27Å; G190-I194 PolarHBondContact O-N 3.38Å; I194-F196 VanDerWaalsContact C-N 3.34Å; I194-F196 PolarHBondContact O-N 3.33Å; I194-I197 PolarHBondContact O-N 2.99Å; I194-D198 WeakPolarHBondContact O-CB 3.38Å; I194-D198 PolarHBondContact O-N 2.94Å; I194-I217 HydrophobicContact CD1-CB 4.31Å; I194-I217 HydrophobicContact CD1-CG2 3.77Å; I194-D218 HydrophobicContact CD1-CB 4.25Å; I194-D218 HydrophobicContact CG2-CB 4.25Å; I194-F221 HydrophobicContact CD1-CD2 3.73Å; I194-F221 HydrophobicContact CD1-CE2 3.59Å
195	Y	92.8	Very high	88.9	Confident	1 Å²	1	40.3 Å²	40.3	0%	0.004	24%	0.238	C	C	.	.	H	α-helix	trans	-60.9	-39.4	174	165.4	-103.2	0	0	0	112.7	A191 L192 V193 I197 D198 S199 L269 R272 F273 G316 Y339	A191-Y195 PolarHBondContact O-N 3.41Å; L192-Y195 HydrophobicContact CD1-CD1 4.08Å; L192-Y195 WeakPolarHBondContact O-CB 3.49Å; L192-Y195 PolarHBondContact O-N 2.74Å; L192-Y195 VanDerWaalsContact O-N 3.15Å; V193-Y195 VanDerWaalsContact C-N 3.3Å; V193-Y195 PolarHBondContact O-N 2.91Å; Y195-I197 VanDerWaalsContact C-N 3.34Å; Y195-I197 PolarHBondContact O-N 3.09Å; Y195-D198 PolarHBondContact O-N 2.9Å; Y195-S199 VanDerWaalsContact O-CB 3.29Å; Y195-S199 WeakPolarHBondContact O-CB 3.42Å; Y195-S199 PolarHBondContact O-N 3.23Å; Y195-L269 HydrophobicContact CD2-CD1 3.89Å; Y195-L269 HydrophobicContact CE2-CD1 3.78Å; Y195-L269 HydrophobicContact CE2-CD2 4.41Å; Y195-L269 HydrophobicContact CE2-CG 4.05Å; Y195-R272 HydrophobicContact CD2-CB 3.55Å; Y195-R272 HydrophobicContact CE2-CB 4.24Å; Y195-R272 HydrophobicContact CG-CB 4.3Å; Y195-F273 HydrophobicContact CE1-CB 3.9Å; Y195-F273 HydrophobicContact CE2-CB 4Å; Y195-G316 WeakPolarHBondContact OH-CA 3.39Å; Y195-Y339 HydrophobicContact CE1-CD2 4.03Å; Y195-Y339 AromaticContact CE1-CE2 3.67Å; Y195-Y339 HydrophobicContact CE1-CE2 3.67Å; Y195-Y339 AromaticContact CE1-CZ 3.97Å; Y195-Y339 AromaticContact CZ-CE2 3.97Å; Y195-Y339 VanDerWaalsContact OH-CD2 3.25Å; Y195-Y339 WeakPolarHBondContact OH-CD2 3.42Å; Y195-Y339 WeakPolarHBondContact OH-CE2 3.39Å
196	F	93.7	Very high	88.5	Confident	45 Å²	45	41.2 Å²	41.2	20%	0.197	25%	0.25	C	S	.	.	H	α-helix	trans	-65.6	-35.1	175.5	-60.9	-30	0	0	0	112.9	L192 V193 I194 S199 L312 Y339 W340	L192-F196 HydrophobicContact CD1-CE1 3.83Å; L192-F196 HydrophobicContact CD1-CE2 4.47Å; L192-F196 HydrophobicContact CD1-CZ 3.78Å; L192-F196 HydrophobicContact CD2-CE2 4.27Å; L192-F196 HydrophobicContact CD2-CZ 3.94Å; L192-F196 HydrophobicContact CG-CE1 4.13Å; L192-F196 HydrophobicContact CG-CE2 3.87Å; L192-F196 HydrophobicContact CG-CZ 3.61Å; L192-F196 WeakPolarHBondContact O-CG 3.45Å; L192-F196 PolarHBondContact O-N 3.25Å; V193-F196 PolarHBondContact O-N 3.3Å; V193-F196 VanDerWaalsContact O-N 3.12Å; I194-F196 VanDerWaalsContact C-N 3.34Å; I194-F196 PolarHBondContact O-N 3.33Å; F196-S199 PolarHBondContact O-OG 3.12Å; F196-L312 HydrophobicContact CZ-CD1 4.38Å; F196-Y339 HydrophobicContact CD1-CD1 4Å; F196-Y339 AromaticContact CD1-CE1 3.63Å; F196-Y339 HydrophobicContact CD1-CE1 3.63Å; F196-Y339 HydrophobicContact CE1-CD1 4.22Å; F196-Y339 AromaticContact CE1-CE1 3.37Å; F196-Y339 HydrophobicContact CE1-CE1 3.37Å; F196-Y339 AromaticContact CE1-CZ 3.75Å; F196-Y339 HydrophobicContact CZ-CE1 4.35Å; F196-W340 HydrophobicContact CB-CZ2 4.12Å; F196-W340 HydrophobicContact CD1-CH2 4.17Å; F196-W340 HydrophobicContact CD1-CZ2 4.33Å; F196-W340 HydrophobicContact CD2-CH2 4.04Å; F196-W340 HydrophobicContact CD2-CZ2 4.28Å; F196-W340 HydrophobicContact CE1-CH2 4.3Å; F196-W340 HydrophobicContact CE2-CH2 4.15Å; F196-W340 HydrophobicContact CG-CH2 4.06Å; F196-W340 HydrophobicContact CG-CZ2 4.01Å; F196-W340 HydrophobicContact CZ-CH2 4.28Å
197	I	90.5	Very high	87.7	Confident	86 Å²	86	39.8 Å²	39.8	44%	0.441	23%	0.234	S	C	.	.	H	α-helix	trans	-68.6	-48.1	172.8	-64.1	164.7	0	0	0	110.2	V193 I194 Y195 S199 S200	V193-I197 HydrophobicContact CG1-CD1 4.19Å; V193-I197 WeakPolarHBondContact O-CG1 3.41Å; V193-I197 PolarHBondContact O-N 2.91Å; I194-I197 PolarHBondContact O-N 2.99Å; Y195-I197 VanDerWaalsContact C-N 3.34Å; Y195-I197 PolarHBondContact O-N 3.09Å; I197-S199 PolarHBondContact O-N 2.91Å; I197-S200 PolarHBondContact O-N 2.7Å; I197-S200 PolarHBondContact O-OG 3.19Å
198	D	89.1	Confident	87.1	Confident	7 Å²	7	42 Å²	42	4%	0.037	25%	0.246	C	C	.	.	H	α-helix	trans	-64.3	-27.6	179	-74	-19.7	0	0	0	112.6	I194 Y195 S200 N201 L269 R272	I194-D198 WeakPolarHBondContact O-CB 3.38Å; I194-D198 PolarHBondContact O-N 2.94Å; Y195-D198 PolarHBondContact O-N 2.9Å; D198-S200 PolarHBondContact O-N 3.07Å; D198-N201 WeakPolarHBondContact O-CB 3.3Å; D198-N201 PolarHBondContact O-N 3.24Å; D198-L269 HydrophobicContact CB-CD1 3.82Å; D198-R272 IonicContact OD2-CZ 3.72Å; D198-R272 IonicContact OD2-NH1 2.72Å; D198-R272 PolarHBondContact OD2-NH1 2.74Å
199	S	89.8	Confident	86.5	Confident	10 Å²	10	43.7 Å²	43.7	7%	0.07	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-15.8	-178.6	74.9	0	0	0	0	114.5	Y195 F196 I197 N201 Y339	Y195-S199 VanDerWaalsContact O-CB 3.29Å; Y195-S199 WeakPolarHBondContact O-CB 3.42Å; Y195-S199 PolarHBondContact O-N 3.23Å; F196-S199 PolarHBondContact O-OG 3.12Å; I197-S199 PolarHBondContact O-N 2.91Å; S199-N201 VanDerWaalsContact C-N 3.34Å; S199-Y339 WeakPolarHBondContact OG-CB 3.15Å
200	S	87.3	Confident	85.8	Confident	101 Å²	101	49.5 Å²	49.5	71%	0.706	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-9.4	170.2	61.9	0	0	0	0	113.8	I197 D198	I197-S200 PolarHBondContact O-N 2.7Å; I197-S200 PolarHBondContact O-OG 3.19Å; D198-S200 PolarHBondContact O-N 3.07Å
201	N	83.8	Confident	85.1	Confident	69 Å²	69	57.4 Å²	57.4	37%	0.369	30%	0.301	S	S	.	.	S	Bend	trans	-89.6	159.1	177.7	-65.4	-42.9	0	0	0	111.5	D198 S199	D198-N201 WeakPolarHBondContact O-CB 3.3Å; D198-N201 PolarHBondContact O-N 3.24Å; S199-N201 VanDerWaalsContact C-N 3.34Å
202	P	79.6	Confident	84.7	Confident	98 Å²	98	59.2 Å²	59.2	64%	0.636	31%	0.311	S	S	*	.			trans	-56.1	148.3	171.3	-24.6	34.8	0	0	0	112.8	E204	P202-E204 PolarHBondContact O-N 3.4Å
203	I	79.9	Confident	84.3	Confident	36 Å²	36	65.7 Å²	65.7	19%	0.185	34%	0.339	C	S	.	.	S	Bend	trans	-51.9	-34.3	-173.6	-62.7	-62.5	0	0	0	114.1	W268 L269 N323	I203-W268 WeakPolarHBondContact O-CA 3.15Å; I203-W268 VanDerWaalsContact O-CD1 3.29Å; I203-L269 HydrophobicContact CD1-CD2 4.03Å; I203-L269 PolarHBondContact O-N 3.12Å; I203-N323 HydrophobicContact CD1-CB 3.82Å; I203-N323 HydrophobicContact CG1-CB 4.04Å
204	E	81.1	Confident	84	Confident	40 Å²	40	64.2 Å²	64.2	19%	0.187	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	127	174.3	-172.3	174.5	-179.6	0	0	108.6	R85 M86 P202 R266 S267	R85-E204 VanDerWaalsContact CB-OE2 3.31Å; R85-E204 WeakPolarHBondContact CB-OE2 3.23Å; M86-E204 PolarHBondContact N-OE1 3.2Å; P202-E204 PolarHBondContact O-N 3.4Å; E204-R266 HydrophobicContact CG-CG 4.19Å; E204-R266 WeakPolarHBondContact OE1-CD 3.26Å; E204-R266 IonicContact OE1-CZ 3.61Å; E204-R266 IonicContact OE1-NE 3.72Å; E204-R266 IonicContact OE1-NH1 2.73Å; E204-R266 PolarHBondContact OE1-NH1 3.24Å; E204-S267 WeakPolarHBondContact CA-O 3.29Å
205	S	80.4	Confident	83.7	Confident	28 Å²	28	63.7 Å²	63.7	20%	0.196	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	147.6	-178.9	62.2	0	0	0	0	112.4	R266 S267	S205-R266 CarbonylContact O-C 3.6Å; S205-R266 WeakPolarHBondContact O-CA 3.44Å; S205-R266 VanDerWaalsContact O-CG 3.28Å; S205-R266 WeakPolarHBondContact O-CG 3.18Å; S205-S267 PolarHBondContact N-O 3.23Å; S205-S267 PolarHBondContact O-N 3.1Å
206	C	79.1	Confident	83.5	Confident	72 Å²	72	66.9 Å²	66.9	49%	0.486	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	113	177.1	-73.5	0	0	0	0	110.1	C79	C79-C206 WeakPolarHBondContact CB-SG 3.37Å; C79-C206 WeakPolarHBondContact SG-CB 3.48Å; C79-C206 CovalentContact SG-SG 2.03Å; C79-C206 PolarHBondContact SG-SG 3.12Å
207	Q	74.5	Confident	83.3	Confident	22 Å²	22	67.5 Å²	67.5	10%	0.103	35%	0.347	C	S	.	.			trans	-126.3	113.6	-178.1	-73.4	177.6	-20.7	0	0	108.9	F209 D212 N265 S267	Q207-F209 PolarHBondContact O-N 3.5Å; Q207-D212 HydrophobicContact CB-CB 4.39Å; Q207-D212 WeakPolarHBondContact CG-OD2 3.46Å; Q207-D212 PolarHBondContact NE2-OD2 3.48Å; Q207-D212 PolarHBondContact OE1-OD2 2.88Å; Q207-N265 PolarHBondContact N-O 3.2Å; Q207-N265 CarbonylContact O-C 3.27Å; Q207-N265 VanDerWaalsContact O-C 3.27Å; Q207-N265 VanDerWaalsContact O-O 3.06Å; Q207-S267 PolarHBondContact OE1-OG 2.87Å
208	N	79.1	Confident	83.3	Confident	81 Å²	81	63.4 Å²	63.4	43%	0.433	33%	0.326	S	S	.	.			trans	-75.4	121.1	175.8	-178.4	-0	0	0	0	109.4	Y210 K211 D212	N208-Y210 PolarHBondContact O-N 2.86Å; N208-K211 PolarHBondContact O-N 3.24Å; N208-D212 PolarHBondContact O-N 3.38Å
209	F	79.5	Confident	83.4	Confident	46 Å²	46	65 Å²	65	20%	0.202	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.3	-36.6	-173.7	179.8	-103.6	0	0	0	114.2	Q207 K211 L215 Q216 M219 V262 N265	Q207-F209 PolarHBondContact O-N 3.5Å; F209-K211 VanDerWaalsContact C-N 3.33Å; F209-K211 PolarHBondContact O-N 3.44Å; F209-L215 HydrophobicContact CD2-CD2 4.1Å; F209-L215 HydrophobicContact CD2-CG 4.11Å; F209-Q216 HydrophobicContact CE2-CG 4.12Å; F209-Q216 HydrophobicContact CZ-CG 4.13Å; F209-Q216 WeakPolarHBondContact O-CG 3.45Å; F209-Q216 PolarHBondContact O-NE2 3.26Å; F209-M219 HydrophobicContact CE2-CB 4.23Å; F209-M219 HydrophobicContact CE2-CG 4.36Å; F209-V262 HydrophobicContact CD2-CB 4.37Å; F209-V262 HydrophobicContact CD2-CG1 3.83Å; F209-V262 HydrophobicContact CD2-CG2 3.76Å; F209-V262 HydrophobicContact CE2-CG1 4.12Å; F209-V262 HydrophobicContact CE2-CG2 3.86Å; F209-V262 HydrophobicContact CG-CG1 4.12Å; F209-N265 PolarHBondContact N-OD1 2.98Å
210	Y	75.9	Confident	83.5	Confident	188 Å²	188	67.3 Å²	67.3	74%	0.737	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-16.6	-179.2	-63.6	-77.8	0	0	0	114.7	N208 Q216	N208-Y210 PolarHBondContact O-N 2.86Å; Y210-Q216 PolarHBondContact O-NE2 3.06Å
211	K	79.1	Confident	83.8	Confident	185 Å²	185	64.4 Å²	64.4	80%	0.804	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	-28.4	-179.8	-72.1	-167.8	174.3	-173.2	0	113.3	N208 F209	N208-K211 PolarHBondContact O-N 3.24Å; F209-K211 VanDerWaalsContact C-N 3.33Å; F209-K211 PolarHBondContact O-N 3.44Å
212	D	83.6	Confident	84.3	Confident	37 Å²	37	61.1 Å²	61.1	20%	0.198	31%	0.311	C	S	.	.			trans	-94.1	115.6	-176.8	-156.3	-23.6	0	0	0	112.4	Q207 N208 T214 L215 Q216	Q207-D212 HydrophobicContact CB-CB 4.39Å; Q207-D212 WeakPolarHBondContact CG-OD2 3.46Å; Q207-D212 PolarHBondContact NE2-OD2 3.48Å; Q207-D212 PolarHBondContact OE1-OD2 2.88Å; N208-D212 PolarHBondContact O-N 3.38Å; D212-T214 PolarHBondContact OD1-N 2.97Å; D212-T214 PolarHBondContact OD1-OG1 2.95Å; D212-L215 HydrophobicContact CB-CB 4.3Å; D212-Q216 WeakPolarHBondContact O-CG 3.46Å; D212-Q216 PolarHBondContact O-N 3.05Å
213	F	86.5	Confident	84.9	Confident	146 Å²	146	59.3 Å²	59.3	64%	0.64	30%	0.298	S	S	*	.	H	α-helix	trans	-76.8	-26.9	-179	-165.6	-118	0	0	0	112.4	Q216 I217	F213-Q216 PolarHBondContact O-N 3.45Å; F213-I217 HydrophobicContact CD1-CD1 3.76Å; F213-I217 HydrophobicContact CE1-CD1 3.46Å; F213-I217 VanDerWaalsContact CE1-CD1 3.46Å; F213-I217 HydrophobicContact CE1-CG1 4.33Å; F213-I217 HydrophobicContact CG-CD1 4.49Å; F213-I217 HydrophobicContact CZ-CD1 3.94Å; F213-I217 HydrophobicContact CZ-CG1 4.42Å; F213-I217 WeakPolarHBondContact O-CG1 3.37Å; F213-I217 PolarHBondContact O-N 3.35Å; F213-I217 VanDerWaalsContact O-N 3.15Å
214	T	87.1	Confident	85.6	Confident	37 Å²	37	59.7 Å²	59.7	23%	0.227	30%	0.298	C	S	.	.	H	α-helix	trans	-67.9	-44	178	66.1	0	0	0	0	110.4	D212 Q216 I217 D218	D212-T214 PolarHBondContact OD1-N 2.97Å; D212-T214 PolarHBondContact OD1-OG1 2.95Å; T214-Q216 VanDerWaalsContact C-N 3.34Å; T214-Q216 PolarHBondContact O-N 2.95Å; T214-I217 PolarHBondContact O-N 3.04Å; T214-D218 WeakPolarHBondContact O-CB 3.44Å; T214-D218 PolarHBondContact O-N 3.08Å
215	L	85.4	Confident	86.2	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.01	29%	0.289	C	S	.	.	H	α-helix	trans	-65.6	-34	178.1	-174.1	60.9	0	0	0	112.5	F209 D212 M219 V262	F209-L215 HydrophobicContact CD2-CD2 4.1Å; F209-L215 HydrophobicContact CD2-CG 4.11Å; D212-L215 HydrophobicContact CB-CB 4.3Å; L215-M219 VanDerWaalsContact O-CB 3.29Å; L215-M219 WeakPolarHBondContact O-CB 3.39Å; L215-M219 PolarHBondContact O-N 3.41Å; L215-V262 HydrophobicContact CD1-CG2 4.33Å; L215-V262 HydrophobicContact CG-CG2 4.35Å
216	Q	88.3	Confident	86.9	Confident	68 Å²	68	60.5 Å²	60.5	32%	0.318	30%	0.301	S	S	.	.	H	α-helix	trans	-66	-45.1	174.5	-71.5	171.3	18.8	0	0	112.2	F209 Y210 D212 F213 T214 A220	F209-Q216 HydrophobicContact CE2-CG 4.12Å; F209-Q216 HydrophobicContact CZ-CG 4.13Å; F209-Q216 WeakPolarHBondContact O-CG 3.45Å; F209-Q216 PolarHBondContact O-NE2 3.26Å; Y210-Q216 PolarHBondContact O-NE2 3.06Å; D212-Q216 WeakPolarHBondContact O-CG 3.46Å; D212-Q216 PolarHBondContact O-N 3.05Å; F213-Q216 PolarHBondContact O-N 3.45Å; T214-Q216 VanDerWaalsContact C-N 3.34Å; T214-Q216 PolarHBondContact O-N 2.95Å; Q216-A220 PolarHBondContact O-N 3.3Å; Q216-A220 VanDerWaalsContact O-N 3.15Å
217	I	90.9	Very high	87.5	Confident	58 Å²	58	62.6 Å²	62.6	30%	0.297	31%	0.307	S	S	.	.	H	α-helix	trans	-67.1	-43.2	175.6	-64.9	174.1	0	0	0	110.5	I194 F213 T214 M219 A220 F221	I194-I217 HydrophobicContact CD1-CB 4.31Å; I194-I217 HydrophobicContact CD1-CG2 3.77Å; F213-I217 HydrophobicContact CD1-CD1 3.76Å; F213-I217 HydrophobicContact CE1-CD1 3.46Å; F213-I217 VanDerWaalsContact CE1-CD1 3.46Å; F213-I217 HydrophobicContact CE1-CG1 4.33Å; F213-I217 HydrophobicContact CG-CD1 4.49Å; F213-I217 HydrophobicContact CZ-CD1 3.94Å; F213-I217 HydrophobicContact CZ-CG1 4.42Å; F213-I217 WeakPolarHBondContact O-CG1 3.37Å; F213-I217 PolarHBondContact O-N 3.35Å; F213-I217 VanDerWaalsContact O-N 3.15Å; T214-I217 PolarHBondContact O-N 3.04Å; I217-M219 VanDerWaalsContact C-N 3.3Å; I217-M219 PolarHBondContact O-N 3.26Å; I217-A220 WeakPolarHBondContact O-CB 3.45Å; I217-A220 PolarHBondContact O-N 3.01Å; I217-A220 VanDerWaalsContact O-N 3.12Å; I217-F221 HydrophobicContact CG2-CD1 4.09Å; I217-F221 HydrophobicContact CG2-CD2 4.16Å; I217-F221 HydrophobicContact CG2-CE1 3.57Å; I217-F221 HydrophobicContact CG2-CE2 3.65Å; I217-F221 HydrophobicContact CG2-CG 4.37Å; I217-F221 HydrophobicContact CG2-CZ 3.34Å; I217-F221 WeakPolarHBondContact O-CD1 3.32Å; I217-F221 WeakPolarHBondContact O-CG 3.46Å; I217-F221 PolarHBondContact O-N 3.24Å
218	D	90.5	Very high	88.3	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-62.1	-39.6	179	-160.2	40.4	0	0	0	111.4	I194 T214 F221 N222 V258 R272 R275	I194-D218 HydrophobicContact CD1-CB 4.25Å; I194-D218 HydrophobicContact CG2-CB 4.25Å; T214-D218 WeakPolarHBondContact O-CB 3.44Å; T214-D218 PolarHBondContact O-N 3.08Å; D218-F221 PolarHBondContact O-N 3.18Å; D218-N222 WeakPolarHBondContact O-CB 3.41Å; D218-N222 PolarHBondContact O-N 3.44Å; D218-N222 PolarHBondContact O-ND2 3.12Å; D218-N222 PolarHBondContact OD1-ND2 2.98Å; D218-N222 VanDerWaalsContact OD1-ND2 3.07Å; D218-V258 WeakPolarHBondContact OD2-CG2 3.44Å; D218-R272 IonicContact OD2-CZ 2.79Å; D218-R272 IonicContact OD2-NH1 3.33Å; D218-R272 PolarHBondContact OD2-NH1 3.49Å; D218-R275 VanDerWaalsContact CG-NH2 3.28Å; D218-R275 IonicContact OD1-CZ 3.68Å; D218-R275 IonicContact OD1-NH1 3.6Å; D218-R275 PolarHBondContact OD1-NH1 3.05Å; D218-R275 IonicContact OD1-NH2 2.83Å; D218-R275 PolarHBondContact OD1-NH2 3.25Å; D218-R275 IonicContact OD2-CZ 2.66Å; D218-R275 IonicContact OD2-NH1 3.59Å; D218-R275 IonicContact OD2-NH2 3.54Å; D218-R275 PolarHBondContact OD2-NH2 2.87Å
219	M	89.8	Confident	89	Confident	40 Å²	40	59.9 Å²	59.9	20%	0.197	29%	0.291	C	S	.	.	H	α-helix	trans	-59.1	-47.2	172	-176.4	64.3	147.6	0	0	111.7	F209 L215 I217 F221 N222 V223 V258 F259 V262	F209-M219 HydrophobicContact CE2-CB 4.23Å; F209-M219 HydrophobicContact CE2-CG 4.36Å; L215-M219 VanDerWaalsContact O-CB 3.29Å; L215-M219 WeakPolarHBondContact O-CB 3.39Å; L215-M219 PolarHBondContact O-N 3.41Å; I217-M219 VanDerWaalsContact C-N 3.3Å; I217-M219 PolarHBondContact O-N 3.26Å; M219-F221 VanDerWaalsContact C-N 3.33Å; M219-F221 PolarHBondContact O-N 3.01Å; M219-N222 PolarHBondContact O-N 2.69Å; M219-V223 WeakPolarHBondContact O-CB 3.18Å; M219-V223 VanDerWaalsContact O-CG2 3.32Å; M219-V223 WeakPolarHBondContact O-CG2 3.43Å; M219-V223 PolarHBondContact O-N 3.06Å; M219-V223 HydrophobicContact SD-CG2 4.4Å; M219-V258 HydrophobicContact SD-CG1 4.35Å; M219-F259 HydrophobicContact CE-CD1 3.74Å; M219-F259 HydrophobicContact CE-CE1 3.83Å; M219-F259 HydrophobicContact SD-CD1 3.9Å; M219-F259 HydrophobicContact SD-CE1 3.81Å; M219-V262 HydrophobicContact CE-CB 4.23Å; M219-V262 HydrophobicContact CE-CG1 4.19Å; M219-V262 HydrophobicContact CE-CG2 3.98Å; M219-V262 HydrophobicContact CG-CG2 4.45Å; M219-V262 HydrophobicContact SD-CG2 3.95Å
220	A	92.3	Very high	89.6	Confident	60 Å²	60	59 Å²	59	50%	0.496	29%	0.294	S	S	.	.	H	α-helix	trans	-60.6	-41.5	177.7	0	0	0	0	0	112.3	Q216 I217 F224	Q216-A220 PolarHBondContact O-N 3.3Å; Q216-A220 VanDerWaalsContact O-N 3.15Å; I217-A220 WeakPolarHBondContact O-CB 3.45Å; I217-A220 PolarHBondContact O-N 3.01Å; I217-A220 VanDerWaalsContact O-N 3.12Å; A220-F224 PolarHBondContact O-N 3.04Å; A220-F224 VanDerWaalsContact O-N 3.11Å
221	F	94.5	Very high	90.3	Very high	39 Å²	39	51.5 Å²	51.5	17%	0.171	27%	0.267	C	S	.	.	H	α-helix	trans	-65.7	-44	176.7	-67.5	-1.3	0	0	0	111.7	L187 A191 I194 I217 D218 M219 F224 F225	L187-F221 HydrophobicContact CD2-CD1 3.61Å; L187-F221 HydrophobicContact CD2-CE1 3.39Å; L187-F221 HydrophobicContact CD2-CG 4.37Å; L187-F221 HydrophobicContact CD2-CZ 4Å; A191-F221 HydrophobicContact CB-CD2 4.07Å; I194-F221 HydrophobicContact CD1-CD2 3.73Å; I194-F221 HydrophobicContact CD1-CE2 3.59Å; I217-F221 HydrophobicContact CG2-CD1 4.09Å; I217-F221 HydrophobicContact CG2-CD2 4.16Å; I217-F221 HydrophobicContact CG2-CE1 3.57Å; I217-F221 HydrophobicContact CG2-CE2 3.65Å; I217-F221 HydrophobicContact CG2-CG 4.37Å; I217-F221 HydrophobicContact CG2-CZ 3.34Å; I217-F221 WeakPolarHBondContact O-CD1 3.32Å; I217-F221 WeakPolarHBondContact O-CG 3.46Å; I217-F221 PolarHBondContact O-N 3.24Å; D218-F221 PolarHBondContact O-N 3.18Å; M219-F221 VanDerWaalsContact C-N 3.33Å; M219-F221 PolarHBondContact O-N 3.01Å; F221-F224 WeakPolarHBondContact O-CB 3.42Å; F221-F224 PolarHBondContact O-N 3.11Å; F221-F225 HydrophobicContact CB-CE2 4.01Å; F221-F225 WeakPolarHBondContact O-CD2 3.41Å; F221-F225 WeakPolarHBondContact O-CG 3.39Å; F221-F225 PolarHBondContact O-N 2.86Å
222	N	92.6	Very high	90.8	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-73.3	-28.7	-179.2	-71.5	-80.2	0	0	0	113.3	D218 M219 F225 L226 V255 V258 R275	D218-N222 WeakPolarHBondContact O-CB 3.41Å; D218-N222 PolarHBondContact O-N 3.44Å; D218-N222 PolarHBondContact O-ND2 3.12Å; D218-N222 PolarHBondContact OD1-ND2 2.98Å; D218-N222 VanDerWaalsContact OD1-ND2 3.07Å; M219-N222 PolarHBondContact O-N 2.69Å; N222-F225 PolarHBondContact O-N 3.26Å; N222-L226 WeakPolarHBondContact O-CB 3.37Å; N222-L226 PolarHBondContact O-N 2.95Å; N222-V255 HydrophobicContact CB-CG1 4.48Å; N222-V255 HydrophobicContact CB-CG2 4.36Å; N222-V258 HydrophobicContact CB-CB 4.33Å; N222-V258 HydrophobicContact CB-CG1 4.24Å; N222-R275 PolarHBondContact ND2-NH2 3.46Å
223	V	93.9	Very high	91.2	Very high	60 Å²	60	45 Å²	45	36%	0.364	24%	0.236	S	C	.	.	H	α-helix	trans	-63.9	-42.5	166.6	169.4	0	0	0	0	111	M219 L226 L227 F259	M219-V223 WeakPolarHBondContact O-CB 3.18Å; M219-V223 VanDerWaalsContact O-CG2 3.32Å; M219-V223 WeakPolarHBondContact O-CG2 3.43Å; M219-V223 PolarHBondContact O-N 3.06Å; M219-V223 HydrophobicContact SD-CG2 4.4Å; V223-L226 PolarHBondContact O-N 3.46Å; V223-L227 WeakPolarHBondContact O-CG 3.29Å; V223-L227 PolarHBondContact O-N 3.26Å; V223-L227 VanDerWaalsContact O-N 3.16Å; V223-F259 HydrophobicContact CG2-CE1 4.02Å; V223-F259 HydrophobicContact CG2-CZ 4.02Å
224	F	94.7	Very high	91.4	Very high	44 Å²	44	41.2 Å²	41.2	19%	0.193	22%	0.222	C	C	.	.	H	α-helix	trans	-62.7	-43.4	173.6	176.8	-87	0	0	0	112.1	L180 L183 V184 L187 A220 F221 L226 L227 Y228	L180-F224 HydrophobicContact CD1-CE2 4.26Å; L180-F224 HydrophobicContact CD1-CZ 3.95Å; L183-F224 HydrophobicContact CB-CE2 4.25Å; L183-F224 HydrophobicContact CB-CZ 3.8Å; V184-F224 HydrophobicContact CB-CE1 4.38Å; V184-F224 HydrophobicContact CG2-CE1 3.63Å; V184-F224 HydrophobicContact CG2-CZ 3.92Å; L187-F224 HydrophobicContact CD1-CB 4.26Å; L187-F224 HydrophobicContact CD1-CD1 3.43Å; L187-F224 VanDerWaalsContact CD1-CD1 3.43Å; L187-F224 HydrophobicContact CD1-CD2 3.97Å; L187-F224 HydrophobicContact CD1-CE1 3.64Å; L187-F224 HydrophobicContact CD1-CE2 4.15Å; L187-F224 HydrophobicContact CD1-CG 3.61Å; L187-F224 HydrophobicContact CD1-CZ 3.99Å; A220-F224 PolarHBondContact O-N 3.04Å; A220-F224 VanDerWaalsContact O-N 3.11Å; F221-F224 WeakPolarHBondContact O-CB 3.42Å; F221-F224 PolarHBondContact O-N 3.11Å; F224-L226 VanDerWaalsContact C-N 3.33Å; F224-L226 PolarHBondContact O-N 3.41Å; F224-L227 PolarHBondContact O-N 3.08Å; F224-Y228 PolarHBondContact O-N 3.33Å
225	F	93.5	Very high	91.5	Very high	1 Å²	1	40.3 Å²	40.3	0%	0.004	22%	0.219	C	C	.	.	H	α-helix	trans	-64	-35.3	176	-65	-53.2	0	0	0	113	L187 S188 A191 F221 N222 Y228 F229 V255	L187-F225 HydrophobicContact CB-CE1 4.4Å; L187-F225 HydrophobicContact CB-CZ 3.92Å; S188-F225 WeakPolarHBondContact OG-CE1 3.49Å; A191-F225 HydrophobicContact CB-CE2 3.95Å; A191-F225 HydrophobicContact CB-CZ 4.43Å; F221-F225 HydrophobicContact CB-CE2 4.01Å; F221-F225 WeakPolarHBondContact O-CD2 3.41Å; F221-F225 WeakPolarHBondContact O-CG 3.39Å; F221-F225 PolarHBondContact O-N 2.86Å; N222-F225 PolarHBondContact O-N 3.26Å; F225-Y228 PolarHBondContact O-N 3.3Å; F225-F229 VanDerWaalsContact O-CB 3.28Å; F225-F229 WeakPolarHBondContact O-CB 3.32Å; F225-F229 PolarHBondContact O-N 2.89Å; F225-V255 HydrophobicContact CB-CG2 4.03Å
226	L	93.6	Very high	91.7	Very high	85 Å²	85	41 Å²	41	45%	0.445	23%	0.225	S	C	.	.	H	α-helix	trans	-61.6	-43.2	173.4	-178.1	63.6	0	0	0	111.9	N222 V223 F224 G230 V255 F259	N222-L226 WeakPolarHBondContact O-CB 3.37Å; N222-L226 PolarHBondContact O-N 2.95Å; V223-L226 PolarHBondContact O-N 3.46Å; F224-L226 VanDerWaalsContact C-N 3.33Å; F224-L226 PolarHBondContact O-N 3.41Å; L226-G230 PolarHBondContact O-N 2.97Å; L226-V255 HydrophobicContact CB-CG1 4.21Å; L226-V255 HydrophobicContact CD1-CG1 4.48Å; L226-F259 HydrophobicContact CD2-CE2 4.04Å; L226-F259 HydrophobicContact CD2-CZ 3.96Å
227	L	92.7	Very high	91.7	Very high	116 Å²	116	44.6 Å²	44.6	61%	0.607	25%	0.246	S	C	*	.	H	α-helix	trans	-65.3	-42.9	175.7	-67	172.6	0	0	0	111.6	V223 F224 G230 L231	V223-L227 WeakPolarHBondContact O-CG 3.29Å; V223-L227 PolarHBondContact O-N 3.26Å; V223-L227 VanDerWaalsContact O-N 3.16Å; F224-L227 PolarHBondContact O-N 3.08Å; L227-G230 PolarHBondContact O-N 3.44Å; L227-L231 PolarHBondContact O-N 2.97Å
228	Y	91.5	Very high	91.7	Very high	20 Å²	20	44.7 Å²	44.7	8%	0.078	25%	0.247	C	C	.	.	H	α-helix	trans	-64.3	-43.5	176.7	-177.9	-116.6	0	0	0	112.5	I170 L180 V184 F224 F225 G230 L231 R232	I170-Y228 HydrophobicContact CD1-CD2 4.05Å; I170-Y228 HydrophobicContact CD1-CE2 3.47Å; I170-Y228 VanDerWaalsContact CD1-CE2 3.47Å; L180-Y228 HydrophobicContact CD1-CD2 4.35Å; L180-Y228 HydrophobicContact CD2-CD2 4.18Å; L180-Y228 HydrophobicContact CD2-CE2 4.25Å; L180-Y228 HydrophobicContact CG-CD2 4.25Å; L180-Y228 HydrophobicContact CG-CE2 4.38Å; V184-Y228 HydrophobicContact CB-CE1 4.42Å; V184-Y228 HydrophobicContact CG1-CD1 4.09Å; V184-Y228 HydrophobicContact CG1-CE1 3.67Å; V184-Y228 HydrophobicContact CG2-CD1 3.82Å; V184-Y228 HydrophobicContact CG2-CD2 3.5Å; V184-Y228 HydrophobicContact CG2-CE1 3.84Å; V184-Y228 HydrophobicContact CG2-CE2 3.55Å; V184-Y228 HydrophobicContact CG2-CG 3.64Å; F224-Y228 PolarHBondContact O-N 3.33Å; F225-Y228 PolarHBondContact O-N 3.3Å; Y228-G230 VanDerWaalsContact C-N 3.3Å; Y228-G230 PolarHBondContact O-N 3.45Å; Y228-L231 PolarHBondContact O-N 3.13Å; Y228-R232 HydrophobicContact CE1-CG 4.2Å; Y228-R232 HydrophobicContact CE2-CG 4.24Å; Y228-R232 WeakPolarHBondContact O-CG 3.27Å; Y228-R232 PolarHBondContact O-N 3.01Å
229	F	92.4	Very high	91.6	Very high	26 Å²	26	47.8 Å²	47.8	11%	0.114	26%	0.26	C	S	.	.	H	α-helix	trans	-56.7	-44.3	171.3	173.9	-90.4	0	0	0	111.2	F225 L231 R232 F233 F242 W243 D251 F252	F225-F229 VanDerWaalsContact O-CB 3.28Å; F225-F229 WeakPolarHBondContact O-CB 3.32Å; F225-F229 PolarHBondContact O-N 2.89Å; F229-L231 PolarHBondContact O-N 3.39Å; F229-R232 PolarHBondContact O-N 2.91Å; F229-F233 HydrophobicContact CE1-CB 4.46Å; F229-F233 WeakPolarHBondContact O-CB 3.46Å; F229-F233 PolarHBondContact O-N 3.34Å; F229-F242 HydrophobicContact CD2-CE1 4.23Å; F229-F242 AromaticContact CD2-CZ 4Å; F229-F242 HydrophobicContact CD2-CZ 4Å; F229-F242 AromaticContact CE2-CE1 3.62Å; F229-F242 HydrophobicContact CE2-CE1 3.62Å; F229-F242 AromaticContact CE2-CZ 3.82Å; F229-F242 HydrophobicContact CE2-CZ 3.82Å; F229-F242 AromaticContact CZ-CE1 3.86Å; F229-F242 HydrophobicContact CZ-CE1 3.86Å; F229-F242 HydrophobicContact CZ-CZ 4.44Å; F229-W243 HydrophobicContact CZ-CE3 4.44Å; F229-W243 HydrophobicContact CZ-CH2 4.48Å; F229-W243 HydrophobicContact CZ-CZ3 4.01Å; F229-D251 HydrophobicContact CD2-CB 4.11Å; F229-F252 HydrophobicContact CE1-CE1 4.28Å; F229-F252 AromaticContact CE2-CE1 3.87Å; F229-F252 HydrophobicContact CE2-CE1 3.87Å; F229-F252 HydrophobicContact CE2-CE2 4.42Å; F229-F252 AromaticContact CE2-CZ 3.69Å; F229-F252 HydrophobicContact CE2-CZ 3.69Å; F229-F252 AromaticContact CZ-CE1 3.52Å; F229-F252 HydrophobicContact CZ-CE1 3.52Å; F229-F252 AromaticContact CZ-CZ 3.48Å; F229-F252 HydrophobicContact CZ-CZ 3.48Å; F229-F252 VanDerWaalsContact CZ-CZ 3.48Å
230	G	92.3	Very high	91.7	Very high	26 Å²	26	47.4 Å²	47.4	27%	0.268	26%	0.259	S	S	.	.	H	α-helix	trans	-58.9	-44.8	175.4	0	0	0	0	0	113.4	L226 L227 Y228 F233 I234	L226-G230 PolarHBondContact O-N 2.97Å; L227-G230 PolarHBondContact O-N 3.44Å; Y228-G230 VanDerWaalsContact C-N 3.3Å; Y228-G230 PolarHBondContact O-N 3.45Å; G230-F233 PolarHBondContact O-N 2.93Å; G230-I234 VanDerWaalsContact O-CG1 3.31Å; G230-I234 WeakPolarHBondContact O-CG1 3.49Å; G230-I234 PolarHBondContact O-N 3.11Å
231	L	90.6	Very high	91.7	Very high	32 Å²	32	54 Å²	54	17%	0.168	27%	0.271	C	S	.	.	H	α-helix	trans	-62.6	-45.8	175.5	-69.5	174.4	0	0	0	112	W165 M169 I170 L180 L227 Y228 F229 I234 A235	W165-L231 HydrophobicContact CH2-CD2 4.32Å; W165-L231 HydrophobicContact CZ3-CD2 3.9Å; M169-L231 HydrophobicContact CE-CD1 4.27Å; I170-L231 HydrophobicContact CD1-CB 4.17Å; L180-L231 HydrophobicContact CD2-CD1 3.97Å; L227-L231 PolarHBondContact O-N 2.97Å; Y228-L231 PolarHBondContact O-N 3.13Å; F229-L231 PolarHBondContact O-N 3.39Å; L231-I234 PolarHBondContact O-N 2.68Å; L231-A235 WeakPolarHBondContact O-CB 3.48Å; L231-A235 PolarHBondContact O-N 2.68Å
232	R	91.1	Very high	91.6	Very high	18 Å²	18	52.5 Å²	52.5	7%	0.068	27%	0.265	C	S	.	.	H	α-helix	trans	-62.5	-42.8	175.8	-65.8	-165.2	-66.4	141.4	-3.9	111.9	I170 Y228 F229 I234 A235 A236 F242 E245 N247 D251	I170-R232 HydrophobicContact CD1-CG 3.72Å; I170-R232 HydrophobicContact CG1-CG 4.26Å; Y228-R232 HydrophobicContact CE1-CG 4.2Å; Y228-R232 HydrophobicContact CE2-CG 4.24Å; Y228-R232 WeakPolarHBondContact O-CG 3.27Å; Y228-R232 PolarHBondContact O-N 3.01Å; F229-R232 PolarHBondContact O-N 2.91Å; R232-I234 VanDerWaalsContact C-N 3.32Å; R232-I234 PolarHBondContact O-N 3.41Å; R232-A235 PolarHBondContact O-N 3.43Å; R232-A236 PolarHBondContact O-N 3.35Å; R232-F242 HydrophobicContact CB-CE2 3.5Å; R232-F242 HydrophobicContact CB-CZ 3.67Å; R232-E245 IonicContact NH1-OE1 3.35Å; R232-E245 PolarHBondContact NH1-OE1 3.45Å; R232-N247 PolarHBondContact NH2-O 3.21Å; R232-D251 IonicContact CZ-OD2 3.52Å; R232-D251 IonicContact NH2-OD2 2.99Å; R232-D251 PolarHBondContact NH2-OD2 3.33Å
233	F	91.9	Very high	91.6	Very high	66 Å²	66	53.7 Å²	53.7	29%	0.289	27%	0.269	S	S	.	.	H	α-helix	trans	-60.2	-40.3	176.6	-179.4	-96.4	0	0	0	112	F229 G230 K239 F242 W243	F229-F233 HydrophobicContact CE1-CB 4.46Å; F229-F233 WeakPolarHBondContact O-CB 3.46Å; F229-F233 PolarHBondContact O-N 3.34Å; G230-F233 PolarHBondContact O-N 2.93Å; F233-K239 HydrophobicContact CE2-CB 4.28Å; F233-K239 HydrophobicContact CE2-CD 4.35Å; F233-K239 HydrophobicContact CZ-CD 4.32Å; F233-K239 HydrophobicContact CZ-CG 4.49Å; F233-K239 WeakPolarHBondContact O-CE 3.43Å; F233-K239 PolarHBondContact O-NZ 3.43Å; F233-F242 HydrophobicContact CB-CD1 4.21Å; F233-F242 HydrophobicContact CB-CE1 3.61Å; F233-F242 HydrophobicContact CB-CZ 4.22Å; F233-F242 AromaticContact CD2-CD1 3.7Å; F233-F242 HydrophobicContact CD2-CD1 3.7Å; F233-F242 AromaticContact CD2-CE1 3.75Å; F233-F242 HydrophobicContact CD2-CE1 3.75Å; F233-F242 HydrophobicContact CG-CD1 4.42Å; F233-F242 HydrophobicContact CG-CE1 4.19Å; F233-W243 HydrophobicContact CD2-CE3 4.19Å; F233-W243 HydrophobicContact CD2-CZ3 4.15Å; F233-W243 AromaticContact CE2-CE3 3.89Å; F233-W243 HydrophobicContact CE2-CE3 3.89Å; F233-W243 AromaticContact CE2-CZ3 3.89Å; F233-W243 HydrophobicContact CE2-CZ3 3.89Å
234	I	90.5	Very high	91.4	Very high	67 Å²	67	55.2 Å²	55.2	34%	0.344	28%	0.275	S	S	.	.	H	α-helix	trans	-65.9	-49	175.6	-70.5	166.7	0	0	0	110.8	V162 A166 G230 L231 R232 A236 K239	V162-I234 HydrophobicContact CG1-CG2 3.92Å; A166-I234 HydrophobicContact CB-CB 4.21Å; A166-I234 HydrophobicContact CB-CG2 3.72Å; G230-I234 VanDerWaalsContact O-CG1 3.31Å; G230-I234 WeakPolarHBondContact O-CG1 3.49Å; G230-I234 PolarHBondContact O-N 3.11Å; L231-I234 PolarHBondContact O-N 2.68Å; R232-I234 VanDerWaalsContact C-N 3.32Å; R232-I234 PolarHBondContact O-N 3.41Å; I234-A236 VanDerWaalsContact C-N 3.32Å; I234-A236 PolarHBondContact O-N 3.03Å; I234-K239 PolarHBondContact O-NZ 3.16Å
235	A	88.6	Confident	91.2	Very high	19 Å²	19	55.7 Å²	55.7	16%	0.157	28%	0.278	C	S	.	.	H	α-helix	trans	-63.1	-32.4	-178.2	0	0	0	0	0	113.9	K163 A166 I170 L231 R232 N237	K163-A235 WeakPolarHBondContact CE-O 3.14Å; A166-A235 HydrophobicContact CB-CB 4.03Å; I170-A235 HydrophobicContact CG1-CB 4.48Å; L231-A235 WeakPolarHBondContact O-CB 3.48Å; L231-A235 PolarHBondContact O-N 2.68Å; R232-A235 PolarHBondContact O-N 3.43Å; A235-N237 PolarHBondContact O-N 3.3Å
236	A	89.7	Confident	91	Very high	17 Å²	17	59.6 Å²	59.6	14%	0.14	30%	0.302	C	S	.	.			trans	-53.8	132.1	-174.5	0	0	0	0	0	114	R232 I234 K239 F242	R232-A236 PolarHBondContact O-N 3.35Å; I234-A236 VanDerWaalsContact C-N 3.32Å; I234-A236 PolarHBondContact O-N 3.03Å; A236-K239 HydrophobicContact CB-CD 4.31Å; A236-K239 PolarHBondContact O-NZ 3.17Å; A236-F242 HydrophobicContact CB-CB 3.64Å; A236-F242 HydrophobicContact CB-CD2 4.18Å; A236-F242 HydrophobicContact CB-CG 3.84Å
237	N	87.8	Confident	90.7	Very high	143 Å²	143	56.8 Å²	56.8	77%	0.765	29%	0.287	S	S	*	.	S	Bend	trans	-67.9	-51.1	174	-74.5	-37.9	0	0	0	111.8	K163 A235	K163-N237 WeakPolarHBondContact CE-OD1 3.34Å; K163-N237 PolarHBondContact NZ-OD1 3.33Å; A235-N237 PolarHBondContact O-N 3.3Å
238	D	90.7	Very high	90.6	Very high	59 Å²	59	51.2 Å²	51.2	32%	0.316	26%	0.258	S	S	.	.			trans	-107.5	117.3	174.6	-172.4	-44.6	0	0	0	109.6	R109 L240 W241 F242	R109-D238 IonicContact CZ-OD1 3.75Å; R109-D238 IonicContact CZ-OD2 2.74Å; R109-D238 IonicContact NH1-OD1 2.86Å; R109-D238 IonicContact NH1-OD2 2.8Å; R109-D238 IonicContact NH2-OD1 4Å; R109-D238 PolarHBondContact NH2-OD1 2.99Å; R109-D238 IonicContact NH2-OD2 2.61Å; R109-D238 PolarHBondContact NH2-OD2 3.19Å; D238-L240 WeakPolarHBondContact OD1-CA 3.43Å; D238-L240 WeakPolarHBondContact OD1-CB 3.24Å; D238-L240 PolarHBondContact OD1-N 3.07Å; D238-W241 HydrophobicContact CB-CB 3.9Å; D238-W241 PolarHBondContact OD1-N 2.68Å; D238-F242 WeakPolarHBondContact O-CB 3.44Å; D238-F242 PolarHBondContact O-N 3.37Å; D238-F242 VanDerWaalsContact O-N 3.15Å
239	K	89.8	Confident	90.5	Very high	65 Å²	65	52.3 Å²	52.3	28%	0.283	27%	0.266	S	S	.	.	H	α-helix	trans	-71.8	-28.6	-179.5	-53	-51.7	-175.1	-166.1	0	113.5	F233 I234 A236 W243	F233-K239 HydrophobicContact CE2-CB 4.28Å; F233-K239 HydrophobicContact CE2-CD 4.35Å; F233-K239 HydrophobicContact CZ-CD 4.32Å; F233-K239 HydrophobicContact CZ-CG 4.49Å; F233-K239 WeakPolarHBondContact O-CE 3.43Å; F233-K239 PolarHBondContact O-NZ 3.43Å; I234-K239 PolarHBondContact O-NZ 3.16Å; A236-K239 HydrophobicContact CB-CD 4.31Å; A236-K239 PolarHBondContact O-NZ 3.17Å; K239-W243 WeakPolarHBondContact O-CB 2.98Å; K239-W243 PolarHBondContact O-N 3.34Å; K239-W243 VanDerWaalsContact O-N 3.15Å
240	L	91.2	Very high	90.5	Very high	33 Å²	33	51.2 Å²	51.2	17%	0.173	26%	0.262	C	S	.	.	H	α-helix	trans	-75.4	-43.2	177.1	-179.6	65.5	0	0	0	110.6	L102 I105 L106 D238 W243 L244	L102-L240 HydrophobicContact CD1-CD1 3.48Å; L102-L240 VanDerWaalsContact CD1-CD1 3.48Å; I105-L240 HydrophobicContact CG2-CB 3.91Å; I105-L240 HydrophobicContact CG2-CD1 4.03Å; L106-L240 HydrophobicContact CD2-CD1 4.12Å; L106-L240 HydrophobicContact CD2-CD2 4.13Å; D238-L240 WeakPolarHBondContact OD1-CA 3.43Å; D238-L240 WeakPolarHBondContact OD1-CB 3.24Å; D238-L240 PolarHBondContact OD1-N 3.07Å; L240-W243 WeakPolarHBondContact O-CB 3.43Å; L240-W243 PolarHBondContact O-N 3.22Å; L240-L244 PolarHBondContact O-N 3.41Å
241	W	91.7	Very high	90.5	Very high	197 Å²	197	50.2 Å²	50.2	75%	0.746	25%	0.25	S	S	*	.	H	α-helix	trans	-63.7	-44.1	177.6	-166	67.9	0	0	0	111.2	D238 W243 L244 E245	D238-W241 HydrophobicContact CB-CB 3.9Å; D238-W241 PolarHBondContact OD1-N 2.68Å; W241-W243 VanDerWaalsContact C-N 3.31Å; W241-W243 PolarHBondContact O-N 2.67Å; W241-L244 PolarHBondContact O-N 3.14Å; W241-E245 PolarHBondContact O-N 2.93Å; W241-E245 VanDerWaalsContact O-N 3.11Å
242	F	92.6	Very high	90.6	Very high	8 Å²	8	49.1 Å²	49.1	4%	0.035	24%	0.244	C	C	.	.	H	α-helix	trans	-60.8	-35.6	172.4	174.6	-96.6	0	0	0	113.4	F229 R232 F233 A236 D238 L244 E245 S248	F229-F242 HydrophobicContact CD2-CE1 4.23Å; F229-F242 AromaticContact CD2-CZ 4Å; F229-F242 HydrophobicContact CD2-CZ 4Å; F229-F242 AromaticContact CE2-CE1 3.62Å; F229-F242 HydrophobicContact CE2-CE1 3.62Å; F229-F242 AromaticContact CE2-CZ 3.82Å; F229-F242 HydrophobicContact CE2-CZ 3.82Å; F229-F242 AromaticContact CZ-CE1 3.86Å; F229-F242 HydrophobicContact CZ-CE1 3.86Å; F229-F242 HydrophobicContact CZ-CZ 4.44Å; R232-F242 HydrophobicContact CB-CE2 3.5Å; R232-F242 HydrophobicContact CB-CZ 3.67Å; F233-F242 HydrophobicContact CB-CD1 4.21Å; F233-F242 HydrophobicContact CB-CE1 3.61Å; F233-F242 HydrophobicContact CB-CZ 4.22Å; F233-F242 AromaticContact CD2-CD1 3.7Å; F233-F242 HydrophobicContact CD2-CD1 3.7Å; F233-F242 AromaticContact CD2-CE1 3.75Å; F233-F242 HydrophobicContact CD2-CE1 3.75Å; F233-F242 HydrophobicContact CG-CD1 4.42Å; F233-F242 HydrophobicContact CG-CE1 4.19Å; A236-F242 HydrophobicContact CB-CB 3.64Å; A236-F242 HydrophobicContact CB-CD2 4.18Å; A236-F242 HydrophobicContact CB-CG 3.84Å; D238-F242 WeakPolarHBondContact O-CB 3.44Å; D238-F242 PolarHBondContact O-N 3.37Å; D238-F242 VanDerWaalsContact O-N 3.15Å; F242-L244 VanDerWaalsContact C-N 3.26Å; F242-L244 PolarHBondContact O-N 2.91Å; F242-E245 WeakPolarHBondContact CD2-OE2 3.35Å; F242-E245 WeakPolarHBondContact O-CB 3.44Å; F242-E245 PolarHBondContact O-N 3.28Å; F242-S248 WeakPolarHBondContact CE2-OG 3.22Å; F242-S248 VanDerWaalsContact CZ-OG 3.32Å; F242-S248 WeakPolarHBondContact CZ-OG 3.33Å; F242-S248 WeakPolarHBondContact O-CB 3.31Å; F242-S248 PolarHBondContact O-OG 3.47Å
243	W	92.4	Very high	90.6	Very high	25 Å²	25	49.4 Å²	49.4	10%	0.095	25%	0.246	C	C	.	.	H	α-helix	trans	-67.5	-26.4	178	-155.8	-92.6	0	0	0	113.2	F98 I105 F229 F233 K239 L240 W241 F252	F98-W243 AromaticContact CD2-NE1 3.98Å; F98-W243 PolarHBondContact O-NE1 3.01Å; I105-W243 HydrophobicContact CD1-CB 3.87Å; I105-W243 HydrophobicContact CD1-CD2 3.56Å; I105-W243 HydrophobicContact CD1-CE3 3.52Å; I105-W243 HydrophobicContact CD1-CG 3.72Å; I105-W243 HydrophobicContact CD1-CZ3 4.3Å; F229-W243 HydrophobicContact CZ-CE3 4.44Å; F229-W243 HydrophobicContact CZ-CH2 4.48Å; F229-W243 HydrophobicContact CZ-CZ3 4.01Å; F233-W243 HydrophobicContact CD2-CE3 4.19Å; F233-W243 HydrophobicContact CD2-CZ3 4.15Å; F233-W243 AromaticContact CE2-CE3 3.89Å; F233-W243 HydrophobicContact CE2-CE3 3.89Å; F233-W243 AromaticContact CE2-CZ3 3.89Å; F233-W243 HydrophobicContact CE2-CZ3 3.89Å; K239-W243 WeakPolarHBondContact O-CB 2.98Å; K239-W243 PolarHBondContact O-N 3.34Å; K239-W243 VanDerWaalsContact O-N 3.15Å; L240-W243 WeakPolarHBondContact O-CB 3.43Å; L240-W243 PolarHBondContact O-N 3.22Å; W241-W243 VanDerWaalsContact C-N 3.31Å; W241-W243 PolarHBondContact O-N 2.67Å; W243-F252 HydrophobicContact CD2-CE2 4.05Å; W243-F252 AromaticContact CD2-CZ 3.57Å; W243-F252 HydrophobicContact CD2-CZ 3.57Å; W243-F252 AromaticContact CE2-CE2 3.82Å; W243-F252 AromaticContact CE2-CZ 3.33Å; W243-F252 AromaticContact CE3-CZ 3.78Å; W243-F252 HydrophobicContact CE3-CZ 3.78Å; W243-F252 HydrophobicContact CG-CE2 4.26Å; W243-F252 HydrophobicContact CG-CZ 4.25Å; W243-F252 AromaticContact CH2-CE1 3.65Å; W243-F252 HydrophobicContact CH2-CE1 3.65Å; W243-F252 AromaticContact CH2-CZ 3.59Å; W243-F252 HydrophobicContact CH2-CZ 3.59Å; W243-F252 AromaticContact CZ2-CE1 3.54Å; W243-F252 HydrophobicContact CZ2-CE1 3.54Å; W243-F252 HydrophobicContact CZ2-CE2 4.19Å; W243-F252 AromaticContact CZ2-CZ 3.33Å; W243-F252 HydrophobicContact CZ2-CZ 3.33Å; W243-F252 HydrophobicContact CZ3-CE1 4.21Å; W243-F252 AromaticContact CZ3-CZ 3.81Å; W243-F252 HydrophobicContact CZ3-CZ 3.81Å; W243-F252 AromaticContact NE1-CE2 3.93Å; W243-F252 AromaticContact NE1-CZ 3.92Å
244	L	90.9	Very high	90.6	Very high	93 Å²	93	46.4 Å²	46.4	49%	0.487	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	1.1	178.1	-61.2	176.9	0	0	0	113.1	F98 L102 L240 W241 F242	F98-L244 HydrophobicContact CE2-CD2 4.3Å; F98-L244 HydrophobicContact CZ-CD2 3.97Å; L102-L244 HydrophobicContact CD1-CD2 4.23Å; L240-L244 PolarHBondContact O-N 3.41Å; W241-L244 PolarHBondContact O-N 3.14Å; F242-L244 VanDerWaalsContact C-N 3.26Å; F242-L244 PolarHBondContact O-N 2.91Å
245	E	90.6	Very high	90.7	Very high	54 Å²	54	43.6 Å²	43.6	25%	0.252	22%	0.219	S	C	.	.	S	Bend	trans	-65.8	135	175.3	-167.4	-164.3	130	0	0	110.4	R232 W241 F242 N247 S248 V249	R232-E245 IonicContact NH1-OE1 3.35Å; R232-E245 PolarHBondContact NH1-OE1 3.45Å; W241-E245 PolarHBondContact O-N 2.93Å; W241-E245 VanDerWaalsContact O-N 3.11Å; F242-E245 WeakPolarHBondContact CD2-OE2 3.35Å; F242-E245 WeakPolarHBondContact O-CB 3.44Å; F242-E245 PolarHBondContact O-N 3.28Å; E245-N247 PolarHBondContact O-N 3.4Å; E245-N247 VanDerWaalsContact O-N 3.14Å; E245-N247 WeakPolarHBondContact OE1-CB 3.37Å; E245-N247 PolarHBondContact OE1-ND2 3.48Å; E245-S248 WeakPolarHBondContact O-CA 3.24Å; E245-S248 VanDerWaalsContact O-CB 3.32Å; E245-S248 WeakPolarHBondContact O-CB 3.46Å; E245-S248 PolarHBondContact O-N 2.63Å; E245-V249 PolarHBondContact O-N 3Å
246	V	88.3	Confident	90.9	Very high	83 Å²	83	43.6 Å²	43.6	50%	0.503	22%	0.217	S	C	.	.	H	α-helix	trans	-54	-39.6	-176.5	179.6	0	0	0	0	112.2	S248 V249 V250 L277	V246-S248 VanDerWaalsContact C-N 3.3Å; V246-S248 PolarHBondContact O-N 3.03Å; V246-V249 WeakPolarHBondContact O-CB 3.49Å; V246-V249 PolarHBondContact O-N 3.47Å; V246-V250 WeakPolarHBondContact O-CG2 3.36Å; V246-V250 PolarHBondContact O-N 2.93Å; V246-L277 HydrophobicContact CG1-CD1 4.47Å
247	N	86.7	Confident	91	Very high	25 Å²	25	43.4 Å²	43.4	13%	0.134	22%	0.215	C	C	.	.	H	α-helix	trans	-66.9	-30.5	178.9	-55.1	-54.5	0	0	0	112.6	R232 E245 D251 Q281	R232-N247 PolarHBondContact NH2-O 3.21Å; E245-N247 PolarHBondContact O-N 3.4Å; E245-N247 VanDerWaalsContact O-N 3.14Å; E245-N247 WeakPolarHBondContact OE1-CB 3.37Å; E245-N247 PolarHBondContact OE1-ND2 3.48Å; N247-D251 PolarHBondContact O-N 3.33Å; N247-Q281 PolarHBondContact ND2-NE2 3.07Å; N247-Q281 VanDerWaalsContact ND2-NE2 3.12Å; N247-Q281 PolarHBondContact OD1-NE2 2.9Å
248	S	90.7	Very high	91.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-73.9	-39.8	173	-59.6	0	0	0	0	111.1	F242 E245 V246 V250 D251 F252	F242-S248 WeakPolarHBondContact CE2-OG 3.22Å; F242-S248 VanDerWaalsContact CZ-OG 3.32Å; F242-S248 WeakPolarHBondContact CZ-OG 3.33Å; F242-S248 WeakPolarHBondContact O-CB 3.31Å; F242-S248 PolarHBondContact O-OG 3.47Å; E245-S248 WeakPolarHBondContact O-CA 3.24Å; E245-S248 VanDerWaalsContact O-CB 3.32Å; E245-S248 WeakPolarHBondContact O-CB 3.46Å; E245-S248 PolarHBondContact O-N 2.63Å; V246-S248 VanDerWaalsContact C-N 3.3Å; V246-S248 PolarHBondContact O-N 3.03Å; S248-V250 VanDerWaalsContact C-N 3.33Å; S248-V250 PolarHBondContact O-N 3.3Å; S248-D251 PolarHBondContact O-N 2.97Å; S248-D251 VanDerWaalsContact O-N 3.13Å; S248-F252 WeakPolarHBondContact O-CD2 3.27Å; S248-F252 WeakPolarHBondContact O-CG 3.34Å; S248-F252 PolarHBondContact O-N 3.24Å
249	V	90.8	Very high	91.1	Very high	43 Å²	43	37.1 Å²	37.1	26%	0.261	18%	0.178	S	C	.	.	H	α-helix	trans	-59.2	-42.6	174.3	176.6	0	0	0	0	111.4	F98 E245 V246 D251 F252 F253	F98-V249 HydrophobicContact CE2-CG2 4.26Å; E245-V249 PolarHBondContact O-N 3Å; V246-V249 WeakPolarHBondContact O-CB 3.49Å; V246-V249 PolarHBondContact O-N 3.47Å; V249-D251 VanDerWaalsContact C-N 3.33Å; V249-D251 PolarHBondContact O-N 2.93Å; V249-F252 PolarHBondContact O-N 3.05Å; V249-F253 HydrophobicContact CG1-CD2 3.85Å; V249-F253 HydrophobicContact CG1-CE2 3.9Å; V249-F253 VanDerWaalsContact O-CD2 3.31Å; V249-F253 WeakPolarHBondContact O-CD2 3.36Å; V249-F253 PolarHBondContact O-N 3.32Å
250	V	91.9	Very high	91.1	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.012	17%	0.172	C	C	.	.	H	α-helix	trans	-59.5	-43.5	173.8	174.3	0	0	0	0	111.4	V246 S248 F253 T254 L274 L277 R278	V246-V250 WeakPolarHBondContact O-CG2 3.36Å; V246-V250 PolarHBondContact O-N 2.93Å; S248-V250 VanDerWaalsContact C-N 3.33Å; S248-V250 PolarHBondContact O-N 3.3Å; V250-F253 PolarHBondContact O-N 3.06Å; V250-T254 HydrophobicContact CG1-CG2 4.25Å; V250-T254 WeakPolarHBondContact O-CB 3.37Å; V250-T254 VanDerWaalsContact O-CG2 3.27Å; V250-T254 WeakPolarHBondContact O-CG2 3.21Å; V250-T254 PolarHBondContact O-N 2.84Å; V250-T254 VanDerWaalsContact O-N 3.14Å; V250-T254 PolarHBondContact O-OG1 3.48Å; V250-L274 HydrophobicContact CG1-CB 4.47Å; V250-L274 WeakPolarHBondContact CG1-O 3.18Å; V250-L277 HydrophobicContact CG2-CB 3.76Å; V250-L277 HydrophobicContact CG2-CD1 3.95Å; V250-L277 HydrophobicContact CG2-CG 4.47Å; V250-R278 HydrophobicContact CG1-CG 3.92Å
251	D	91.3	Very high	90.9	Very high	5 Å²	5	33.7 Å²	33.7	3%	0.027	16%	0.164	C	C	.	.	H	α-helix	trans	-63	-42.6	178.3	-66.1	-14.5	0	0	0	111.3	F229 R232 N247 S248 V249 F253 T254 V255 P256 R278	F229-D251 HydrophobicContact CD2-CB 4.11Å; R232-D251 IonicContact CZ-OD2 3.52Å; R232-D251 IonicContact NH2-OD2 2.99Å; R232-D251 PolarHBondContact NH2-OD2 3.33Å; N247-D251 PolarHBondContact O-N 3.33Å; S248-D251 PolarHBondContact O-N 2.97Å; S248-D251 VanDerWaalsContact O-N 3.13Å; V249-D251 VanDerWaalsContact C-N 3.33Å; V249-D251 PolarHBondContact O-N 2.93Å; D251-F253 VanDerWaalsContact C-N 3.33Å; D251-F253 PolarHBondContact O-N 3.1Å; D251-T254 PolarHBondContact O-N 3.41Å; D251-V255 WeakPolarHBondContact O-CB 3.49Å; D251-V255 PolarHBondContact O-N 2.82Å; D251-P256 WeakPolarHBondContact O-CD 3.37Å; D251-R278 IonicContact OD1-CZ 3.92Å; D251-R278 IonicContact OD1-NE 3.19Å; D251-R278 PolarHBondContact OD1-NE 3.31Å; D251-R278 IonicContact OD1-NH2 3.73Å; D251-R278 PolarHBondContact OD1-NH2 3.22Å
252	F	92.6	Very high	90.7	Very high	9 Å²	9	25.7 Å²	25.7	4%	0.039	14%	0.136	C	C	.	.	H	α-helix	trans	-63.8	-30.2	178	-63.4	-49.6	0	0	0	114.8	S94 T97 F98 F229 W243 S248 V249 P256	S94-F252 WeakPolarHBondContact CB-O 3.34Å; T97-F252 HydrophobicContact CG2-CD1 3.93Å; T97-F252 HydrophobicContact CG2-CE1 4.35Å; F98-F252 AromaticContact CD2-CD2 3.62Å; F98-F252 HydrophobicContact CD2-CD2 3.62Å; F98-F252 AromaticContact CD2-CE2 3.99Å; F98-F252 HydrophobicContact CD2-CE2 3.99Å; F98-F252 HydrophobicContact CD2-CG 4.38Å; F98-F252 HydrophobicContact CE2-CD2 4.34Å; F229-F252 HydrophobicContact CE1-CE1 4.28Å; F229-F252 AromaticContact CE2-CE1 3.87Å; F229-F252 HydrophobicContact CE2-CE1 3.87Å; F229-F252 HydrophobicContact CE2-CE2 4.42Å; F229-F252 AromaticContact CE2-CZ 3.69Å; F229-F252 HydrophobicContact CE2-CZ 3.69Å; F229-F252 AromaticContact CZ-CE1 3.52Å; F229-F252 HydrophobicContact CZ-CE1 3.52Å; F229-F252 AromaticContact CZ-CZ 3.48Å; F229-F252 HydrophobicContact CZ-CZ 3.48Å; F229-F252 VanDerWaalsContact CZ-CZ 3.48Å; W243-F252 HydrophobicContact CD2-CE2 4.05Å; W243-F252 AromaticContact CD2-CZ 3.57Å; W243-F252 HydrophobicContact CD2-CZ 3.57Å; W243-F252 AromaticContact CE2-CE2 3.82Å; W243-F252 AromaticContact CE2-CZ 3.33Å; W243-F252 AromaticContact CE3-CZ 3.78Å; W243-F252 HydrophobicContact CE3-CZ 3.78Å; W243-F252 HydrophobicContact CG-CE2 4.26Å; W243-F252 HydrophobicContact CG-CZ 4.25Å; W243-F252 AromaticContact CH2-CE1 3.65Å; W243-F252 HydrophobicContact CH2-CE1 3.65Å; W243-F252 AromaticContact CH2-CZ 3.59Å; W243-F252 HydrophobicContact CH2-CZ 3.59Å; W243-F252 AromaticContact CZ2-CE1 3.54Å; W243-F252 HydrophobicContact CZ2-CE1 3.54Å; W243-F252 HydrophobicContact CZ2-CE2 4.19Å; W243-F252 AromaticContact CZ2-CZ 3.33Å; W243-F252 HydrophobicContact CZ2-CZ 3.33Å; W243-F252 HydrophobicContact CZ3-CE1 4.21Å; W243-F252 AromaticContact CZ3-CZ 3.81Å; W243-F252 HydrophobicContact CZ3-CZ 3.81Å; W243-F252 AromaticContact NE1-CE2 3.93Å; W243-F252 AromaticContact NE1-CZ 3.92Å; S248-F252 WeakPolarHBondContact O-CD2 3.27Å; S248-F252 WeakPolarHBondContact O-CG 3.34Å; S248-F252 PolarHBondContact O-N 3.24Å; V249-F252 PolarHBondContact O-N 3.05Å; F252-P256 WeakPolarHBondContact O-CD 3.33Å; F252-P256 WeakPolarHBondContact O-CG 3.4Å
253	F	92.3	Very high	90.4	Very high	25 Å²	25	34.7 Å²	34.7	11%	0.11	17%	0.172	C	C	.	.	H	α-helix	trans	-95.6	-2.9	178.7	-73.4	-67.3	0	0	0	114.3	S94 M95 V249 V250 D251 L271 L274	S94-F253 VanDerWaalsContact CB-CD1 3.44Å; M95-F253 HydrophobicContact CE-CE1 3.61Å; M95-F253 HydrophobicContact CE-CZ 3.75Å; M95-F253 HydrophobicContact CG-CE1 4.38Å; M95-F253 HydrophobicContact SD-CE1 3.76Å; M95-F253 HydrophobicContact SD-CZ 3.73Å; V249-F253 HydrophobicContact CG1-CD2 3.85Å; V249-F253 HydrophobicContact CG1-CE2 3.9Å; V249-F253 VanDerWaalsContact O-CD2 3.31Å; V249-F253 WeakPolarHBondContact O-CD2 3.36Å; V249-F253 PolarHBondContact O-N 3.32Å; V250-F253 PolarHBondContact O-N 3.06Å; D251-F253 VanDerWaalsContact C-N 3.33Å; D251-F253 PolarHBondContact O-N 3.1Å; F253-L271 HydrophobicContact CB-CB 4.47Å; F253-L271 HydrophobicContact CB-CD1 4.26Å; F253-L271 HydrophobicContact CD1-CD1 3.57Å; F253-L271 HydrophobicContact CE1-CD1 4.22Å; F253-L271 HydrophobicContact CG-CD1 4.09Å; F253-L274 HydrophobicContact CB-CD1 3.57Å; F253-L274 HydrophobicContact CD2-CD1 4.35Å; F253-L274 HydrophobicContact CG-CD1 4.14Å
254	T	91.4	Very high	90.1	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.012	18%	0.181	C	C	.	.	H	α-helix	trans	-118.7	-33.7	-178.9	58.3	0	0	0	0	113.8	V250 D251 V258 L274 R275 R278	V250-T254 HydrophobicContact CG1-CG2 4.25Å; V250-T254 WeakPolarHBondContact O-CB 3.37Å; V250-T254 VanDerWaalsContact O-CG2 3.27Å; V250-T254 WeakPolarHBondContact O-CG2 3.21Å; V250-T254 PolarHBondContact O-N 2.84Å; V250-T254 VanDerWaalsContact O-N 3.14Å; V250-T254 PolarHBondContact O-OG1 3.48Å; D251-T254 PolarHBondContact O-N 3.41Å; T254-V258 WeakPolarHBondContact O-CG2 3.25Å; T254-L274 HydrophobicContact CG2-CB 4.26Å; T254-R275 HydrophobicContact CG2-CG 3.74Å; T254-R278 PolarHBondContact OG1-NH2 2.99Å
255	V	93.2	Very high	89.7	Confident	8 Å²	8	34.7 Å²	34.7	5%	0.048	17%	0.173	C	C	.	.	H	α-helix	trans	-83.4	-52.1	-175.4	174.4	0	0	0	0	112.9	N222 F225 L226 D251 V258 F259	N222-V255 HydrophobicContact CB-CG1 4.48Å; N222-V255 HydrophobicContact CB-CG2 4.36Å; F225-V255 HydrophobicContact CB-CG2 4.03Å; L226-V255 HydrophobicContact CB-CG1 4.21Å; L226-V255 HydrophobicContact CD1-CG1 4.48Å; D251-V255 WeakPolarHBondContact O-CB 3.49Å; D251-V255 PolarHBondContact O-N 2.82Å; V255-V258 PolarHBondContact O-N 2.81Å; V255-F259 HydrophobicContact CG1-CD2 4.15Å; V255-F259 HydrophobicContact CG1-CE2 3.57Å; V255-F259 WeakPolarHBondContact O-CD2 3.39Å
256	P	93.2	Very high	89.3	Confident	20 Å²	20	33.3 Å²	33.3	13%	0.13	17%	0.166	C	C	.	.	H	α-helix	trans	-58.3	-41.7	178.6	-21.6	32.5	0	0	0	115	T97 D251 F252 V258 F259 V260	T97-P256 HydrophobicContact CG2-CG 4.31Å; D251-P256 WeakPolarHBondContact O-CD 3.37Å; F252-P256 WeakPolarHBondContact O-CD 3.33Å; F252-P256 WeakPolarHBondContact O-CG 3.4Å; P256-V258 PolarHBondContact O-N 3.4Å; P256-F259 PolarHBondContact O-N 3.33Å; P256-V260 PolarHBondContact O-N 3.34Å; P256-V260 VanDerWaalsContact O-N 3.12Å
257	P	90.9	Very high	89.1	Confident	12 Å²	12	29.7 Å²	29.7	8%	0.078	14%	0.144	C	C	.	.	H	α-helix	trans	-57.3	-31.9	175.6	-30.3	39	0	0	0	114.6	F90 S94 V260 S261	F90-P257 HydrophobicContact CB-CB 4.24Å; F90-P257 HydrophobicContact CD1-CB 4.14Å; F90-P257 WeakPolarHBondContact CD1-O 3.42Å; S94-P257 WeakPolarHBondContact OG-CD 3.41Å; S94-P257 WeakPolarHBondContact OG-CG 3.33Å; P257-V260 PolarHBondContact O-N 3.47Å; P257-S261 WeakPolarHBondContact O-CB 3.24Å; P257-S261 PolarHBondContact O-N 2.73Å
258	V	90.5	Very high	89.2	Confident	1 Å²	1	29.5 Å²	29.5	1%	0.006	14%	0.142	C	C	.	.	H	α-helix	trans	-72.2	-38.1	179.9	175	0	0	0	0	110.8	D218 M219 N222 T254 V255 P256 S261 V262	D218-V258 WeakPolarHBondContact OD2-CG2 3.44Å; M219-V258 HydrophobicContact SD-CG1 4.35Å; N222-V258 HydrophobicContact CB-CB 4.33Å; N222-V258 HydrophobicContact CB-CG1 4.24Å; T254-V258 WeakPolarHBondContact O-CG2 3.25Å; V255-V258 PolarHBondContact O-N 2.81Å; P256-V258 PolarHBondContact O-N 3.4Å; V258-S261 VanDerWaalsContact O-CB 3.27Å; V258-S261 WeakPolarHBondContact O-CB 3.3Å; V258-S261 PolarHBondContact O-N 3.17Å; V258-V262 PolarHBondContact O-N 3.3Å; V258-V262 VanDerWaalsContact O-N 3.08Å
259	F	90.6	Very high	89	Confident	70 Å²	70	29.9 Å²	29.9	31%	0.307	14%	0.144	S	C	.	.	H	α-helix	trans	-63.8	-40.2	171.2	-68.1	-64.7	0	0	0	112.4	M219 V223 L226 V255 P256 S261 V262 Y263	M219-F259 HydrophobicContact CE-CD1 3.74Å; M219-F259 HydrophobicContact CE-CE1 3.83Å; M219-F259 HydrophobicContact SD-CD1 3.9Å; M219-F259 HydrophobicContact SD-CE1 3.81Å; V223-F259 HydrophobicContact CG2-CE1 4.02Å; V223-F259 HydrophobicContact CG2-CZ 4.02Å; L226-F259 HydrophobicContact CD2-CE2 4.04Å; L226-F259 HydrophobicContact CD2-CZ 3.96Å; V255-F259 HydrophobicContact CG1-CD2 4.15Å; V255-F259 HydrophobicContact CG1-CE2 3.57Å; V255-F259 WeakPolarHBondContact O-CD2 3.39Å; P256-F259 PolarHBondContact O-N 3.33Å; F259-S261 VanDerWaalsContact C-N 3.31Å; F259-S261 PolarHBondContact O-N 3.38Å; F259-V262 PolarHBondContact O-N 3.37Å; F259-Y263 WeakPolarHBondContact O-CB 3.26Å; F259-Y263 PolarHBondContact O-N 3.44Å
260	V	89.8	Confident	88.8	Confident	26 Å²	26	27.9 Å²	27.9	16%	0.158	13%	0.132	C	C	.	.	H	α-helix	trans	-64.2	-36.5	172.3	175.6	0	0	0	0	111.5	A89 F90 S93 P256 P257 Y263 L264	A89-V260 HydrophobicContact CB-CG1 4.37Å; F90-V260 HydrophobicContact CD1-CB 4.11Å; F90-V260 HydrophobicContact CD1-CG1 3.9Å; F90-V260 HydrophobicContact CD2-CG1 4.43Å; F90-V260 HydrophobicContact CE1-CB 4.39Å; F90-V260 HydrophobicContact CE1-CG1 4.04Å; F90-V260 HydrophobicContact CG-CG1 4.11Å; F90-V260 HydrophobicContact CZ-CG1 4.36Å; S93-V260 WeakPolarHBondContact OG-CG2 3.48Å; P256-V260 PolarHBondContact O-N 3.34Å; P256-V260 VanDerWaalsContact O-N 3.12Å; P257-V260 PolarHBondContact O-N 3.47Å; V260-Y263 PolarHBondContact O-N 2.89Å; V260-L264 HydrophobicContact CG1-CD1 3.66Å; V260-L264 HydrophobicContact CG1-CG 4.14Å; V260-L264 WeakPolarHBondContact O-CB 3.25Å; V260-L264 WeakPolarHBondContact O-CG 3.31Å; V260-L264 PolarHBondContact O-N 3.25Å
261	S	86.9	Confident	88.8	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-60.7	-45.7	177.5	-166.4	0	0	0	0	112.3	P257 V258 F259 N265 R266	P257-S261 WeakPolarHBondContact O-CB 3.24Å; P257-S261 PolarHBondContact O-N 2.73Å; V258-S261 VanDerWaalsContact O-CB 3.27Å; V258-S261 WeakPolarHBondContact O-CB 3.3Å; V258-S261 PolarHBondContact O-N 3.17Å; F259-S261 VanDerWaalsContact C-N 3.31Å; F259-S261 PolarHBondContact O-N 3.38Å; S261-N265 WeakPolarHBondContact O-CA 3.35Å; S261-N265 PolarHBondContact O-N 2.81Å; S261-R266 VanDerWaalsContact CA-O 3.22Å; S261-R266 WeakPolarHBondContact CA-O 3.38Å; S261-R266 WeakPolarHBondContact CB-O 3.4Å; S261-R266 PolarHBondContact O-N 2.94Å; S261-R266 VanDerWaalsContact O-N 3.13Å; S261-R266 PolarHBondContact OG-O 3.37Å
262	V	87.3	Confident	88.8	Confident	28 Å²	28	29.8 Å²	29.8	17%	0.17	14%	0.141	C	C	.	.	H	α-helix	trans	-68.4	-41.3	175.9	177.7	0	0	0	0	111.2	F209 L215 M219 V258 F259 L264 N265	F209-V262 HydrophobicContact CD2-CB 4.37Å; F209-V262 HydrophobicContact CD2-CG1 3.83Å; F209-V262 HydrophobicContact CD2-CG2 3.76Å; F209-V262 HydrophobicContact CE2-CG1 4.12Å; F209-V262 HydrophobicContact CE2-CG2 3.86Å; F209-V262 HydrophobicContact CG-CG1 4.12Å; L215-V262 HydrophobicContact CD1-CG2 4.33Å; L215-V262 HydrophobicContact CG-CG2 4.35Å; M219-V262 HydrophobicContact CE-CB 4.23Å; M219-V262 HydrophobicContact CE-CG1 4.19Å; M219-V262 HydrophobicContact CE-CG2 3.98Å; M219-V262 HydrophobicContact CG-CG2 4.45Å; M219-V262 HydrophobicContact SD-CG2 3.95Å; V258-V262 PolarHBondContact O-N 3.3Å; V258-V262 VanDerWaalsContact O-N 3.08Å; F259-V262 PolarHBondContact O-N 3.37Å; V262-L264 PolarHBondContact O-N 3.08Å; V262-N265 PolarHBondContact O-N 3.35Å
263	Y	87.1	Confident	88.9	Confident	198 Å²	198	29.6 Å²	29.6	78%	0.776	14%	0.14	S	C	*	.	H	α-helix	trans	-62.5	-39.6	178	-178.5	-101.4	0	0	0	113	F259 V260	F259-Y263 WeakPolarHBondContact O-CB 3.26Å; F259-Y263 PolarHBondContact O-N 3.44Å; V260-Y263 PolarHBondContact O-N 2.89Å
264	L	84.1	Confident	88.9	Confident	55 Å²	55	29.7 Å²	29.7	29%	0.288	14%	0.142	S	C	.	.	H	α-helix	trans	-91.3	-3.6	-179.8	-62.6	-179.7	0	0	0	114.3	A89 F90 V260 V262 R266	A89-L264 HydrophobicContact CB-CD1 4.25Å; F90-L264 HydrophobicContact CE2-CD1 4.29Å; F90-L264 HydrophobicContact CZ-CD1 4.39Å; V260-L264 HydrophobicContact CG1-CD1 3.66Å; V260-L264 HydrophobicContact CG1-CG 4.14Å; V260-L264 WeakPolarHBondContact O-CB 3.25Å; V260-L264 WeakPolarHBondContact O-CG 3.31Å; V260-L264 PolarHBondContact O-N 3.25Å; V262-L264 PolarHBondContact O-N 3.08Å; L264-R266 HydrophobicContact CB-CB 4.29Å; L264-R266 PolarHBondContact O-N 2.94Å
265	N	82.8	Confident	89	Confident	62 Å²	62	29.7 Å²	29.7	33%	0.332	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.9	41.7	-169.2	-70.8	-80.1	0	0	0	113	Q207 F209 S261 V262	Q207-N265 PolarHBondContact N-O 3.2Å; Q207-N265 CarbonylContact O-C 3.27Å; Q207-N265 VanDerWaalsContact O-C 3.27Å; Q207-N265 VanDerWaalsContact O-O 3.06Å; F209-N265 PolarHBondContact N-OD1 2.98Å; S261-N265 WeakPolarHBondContact O-CA 3.35Å; S261-N265 PolarHBondContact O-N 2.81Å; V262-N265 PolarHBondContact O-N 3.35Å
266	R	83.2	Confident	89	Confident	25 Å²	25	29.3 Å²	29.3	9%	0.094	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	133.6	-175.5	-159.9	-173.9	-61.9	-166	0.4	109.1	C79 Q84 F90 E204 S205 S261 L264	C79-R266 VanDerWaalsContact CB-NH2 3.27Å; Q84-R266 PolarHBondContact O-NH1 3.01Å; Q84-R266 VanDerWaalsContact O-NH1 3.1Å; F90-R266 WeakPolarHBondContact CZ-O 3.15Å; E204-R266 HydrophobicContact CG-CG 4.19Å; E204-R266 WeakPolarHBondContact OE1-CD 3.26Å; E204-R266 IonicContact OE1-CZ 3.61Å; E204-R266 IonicContact OE1-NE 3.72Å; E204-R266 IonicContact OE1-NH1 2.73Å; E204-R266 PolarHBondContact OE1-NH1 3.24Å; S205-R266 CarbonylContact O-C 3.6Å; S205-R266 WeakPolarHBondContact O-CA 3.44Å; S205-R266 VanDerWaalsContact O-CG 3.28Å; S205-R266 WeakPolarHBondContact O-CG 3.18Å; S261-R266 VanDerWaalsContact CA-O 3.22Å; S261-R266 WeakPolarHBondContact CA-O 3.38Å; S261-R266 WeakPolarHBondContact CB-O 3.4Å; S261-R266 PolarHBondContact O-N 2.94Å; S261-R266 VanDerWaalsContact O-N 3.13Å; S261-R266 PolarHBondContact OG-O 3.37Å; L264-R266 HydrophobicContact CB-CB 4.29Å; L264-R266 PolarHBondContact O-N 2.94Å
267	S	84.1	Confident	89	Confident	7 Å²	7	29.8 Å²	29.8	5%	0.049	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	141.4	176	-171.4	0	0	0	0	110.8	E204 S205 Q207 R272	E204-S267 WeakPolarHBondContact CA-O 3.29Å; S205-S267 PolarHBondContact N-O 3.23Å; S205-S267 PolarHBondContact O-N 3.1Å; Q207-S267 PolarHBondContact OE1-OG 2.87Å; S267-R272 PolarHBondContact OG-NH2 2.98Å
268	W	87.8	Confident	88.9	Confident	21 Å²	21	30 Å²	30	8%	0.08	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	128.4	173.6	177.1	58.9	0	0	0	108.2	W87 F90 L91 I203 G270 R272	W87-W268 HydrophobicContact CB-CD2 4.33Å; W87-W268 HydrophobicContact CB-CG 4.29Å; W87-W268 HydrophobicContact CB-CZ2 4.42Å; W87-W268 HydrophobicContact CE3-CZ2 4.3Å; F90-W268 HydrophobicContact CB-CD2 4.23Å; F90-W268 HydrophobicContact CB-CE3 3.29Å; F90-W268 HydrophobicContact CB-CZ3 3.57Å; F90-W268 HydrophobicContact CD1-CB 4.21Å; F90-W268 HydrophobicContact CD1-CE3 4.32Å; F90-W268 HydrophobicContact CD2-CB 4.04Å; F90-W268 HydrophobicContact CD2-CD2 4.45Å; F90-W268 HydrophobicContact CD2-CE3 4.27Å; F90-W268 HydrophobicContact CD2-CG 4.41Å; F90-W268 HydrophobicContact CE1-CB 4.1Å; F90-W268 HydrophobicContact CE2-CB 3.95Å; F90-W268 HydrophobicContact CG-CB 4.18Å; F90-W268 HydrophobicContact CG-CD2 4.34Å; F90-W268 AromaticContact CG-CE3 3.76Å; F90-W268 HydrophobicContact CG-CE3 3.76Å; F90-W268 HydrophobicContact CZ-CB 3.99Å; L91-W268 HydrophobicContact CB-CH2 4.17Å; L91-W268 HydrophobicContact CB-CZ3 4.5Å; I203-W268 WeakPolarHBondContact O-CA 3.15Å; I203-W268 VanDerWaalsContact O-CD1 3.29Å; W268-G270 VanDerWaalsContact CZ2-CA 3.45Å; W268-R272 PolarHBondContact O-NE 3.3Å
269	L	86.5	Confident	88.9	Confident	8 Å²	8	31.4 Å²	31.4	4%	0.042	15%	0.147	C	C	.	.			trans	-67.9	-45.5	-177.9	-170.9	72.3	0	0	0	111	Y195 D198 I203 L271 R272	Y195-L269 HydrophobicContact CD2-CD1 3.89Å; Y195-L269 HydrophobicContact CE2-CD1 3.78Å; Y195-L269 HydrophobicContact CE2-CD2 4.41Å; Y195-L269 HydrophobicContact CE2-CG 4.05Å; D198-L269 HydrophobicContact CB-CD1 3.82Å; I203-L269 HydrophobicContact CD1-CD2 4.03Å; I203-L269 PolarHBondContact O-N 3.12Å; L269-L271 PolarHBondContact O-N 3.04Å; L269-R272 VanDerWaalsContact O-CB 3.23Å; L269-R272 WeakPolarHBondContact O-CB 3.47Å; L269-R272 WeakPolarHBondContact O-CD 3.35Å; L269-R272 WeakPolarHBondContact O-CG 3.47Å; L269-R272 PolarHBondContact O-N 3.28Å
270	G	87	Confident	88.8	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.01	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	42.1	-132.8	168.2	0	0	0	0	0	115.7	W268 R272 F273	W268-G270 VanDerWaalsContact CZ2-CA 3.45Å; G270-R272 VanDerWaalsContact C-N 3.27Å; G270-R272 PolarHBondContact O-N 3.18Å; G270-F273 WeakPolarHBondContact O-CD1 3.45Å; G270-F273 WeakPolarHBondContact O-CE1 3.2Å
271	L	92.2	Very high	88.7	Confident	33 Å²	33	30.3 Å²	30.3	17%	0.173	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-86.9	16.9	-177.5	-58.1	177.9	0	0	0	113.8	L91 F253 L269 F273 L274 L320	L91-L271 HydrophobicContact CD1-CD1 3.86Å; F253-L271 HydrophobicContact CB-CB 4.47Å; F253-L271 HydrophobicContact CB-CD1 4.26Å; F253-L271 HydrophobicContact CD1-CD1 3.57Å; F253-L271 HydrophobicContact CE1-CD1 4.22Å; F253-L271 HydrophobicContact CG-CD1 4.09Å; L269-L271 PolarHBondContact O-N 3.04Å; L271-F273 HydrophobicContact CD2-CE1 3.77Å; L271-F273 HydrophobicContact CD2-CZ 3.67Å; L271-F273 PolarHBondContact O-N 2.97Å; L271-F273 VanDerWaalsContact O-N 3.1Å; L271-L274 HydrophobicContact CB-CD1 3.94Å; L271-L274 HydrophobicContact CB-CG 4.39Å; L271-L274 HydrophobicContact CD1-CD1 4.5Å; L271-L274 WeakPolarHBondContact O-CB 3.46Å; L271-L274 WeakPolarHBondContact O-CG 3.25Å; L271-L274 PolarHBondContact O-N 3.15Å; L271-L320 HydrophobicContact CD2-CD2 4.14Å
272	R	92.4	Very high	88.6	Confident	14 Å²	14	33.4 Å²	33.4	5%	0.053	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-57.9	-25.3	179.3	-70.7	176.6	-171.2	-128.3	-12.3	112.8	Y195 D198 D218 S267 W268 L269 G270 L274 R275	Y195-R272 HydrophobicContact CD2-CB 3.55Å; Y195-R272 HydrophobicContact CE2-CB 4.24Å; Y195-R272 HydrophobicContact CG-CB 4.3Å; D198-R272 IonicContact OD2-CZ 3.72Å; D198-R272 IonicContact OD2-NH1 2.72Å; D198-R272 PolarHBondContact OD2-NH1 2.74Å; D218-R272 IonicContact OD2-CZ 2.79Å; D218-R272 IonicContact OD2-NH1 3.33Å; D218-R272 PolarHBondContact OD2-NH1 3.49Å; S267-R272 PolarHBondContact OG-NH2 2.98Å; W268-R272 PolarHBondContact O-NE 3.3Å; L269-R272 VanDerWaalsContact O-CB 3.23Å; L269-R272 WeakPolarHBondContact O-CB 3.47Å; L269-R272 WeakPolarHBondContact O-CD 3.35Å; L269-R272 WeakPolarHBondContact O-CG 3.47Å; L269-R272 PolarHBondContact O-N 3.28Å; G270-R272 VanDerWaalsContact C-N 3.27Å; G270-R272 PolarHBondContact O-N 3.18Å; R272-L274 PolarHBondContact O-N 3.3Å; R272-R275 VanDerWaalsContact O-CB 3.3Å; R272-R275 WeakPolarHBondContact O-CB 3.28Å; R272-R275 WeakPolarHBondContact O-CD 3.41Å; R272-R275 WeakPolarHBondContact O-CG 3.12Å; R272-R275 PolarHBondContact O-N 3.27Å; R272-R275 VanDerWaalsContact O-N 3.12Å
273	F	92.9	Very high	88.6	Confident	6 Å²	6	32.6 Å²	32.6	3%	0.026	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-60.6	-23.6	175.6	62.6	-97.2	0	0	0	114.2	Y195 G270 L271 R275 A276 T313 G316 F317 L320	Y195-F273 HydrophobicContact CE1-CB 3.9Å; Y195-F273 HydrophobicContact CE2-CB 4Å; G270-F273 WeakPolarHBondContact O-CD1 3.45Å; G270-F273 WeakPolarHBondContact O-CE1 3.2Å; L271-F273 HydrophobicContact CD2-CE1 3.77Å; L271-F273 HydrophobicContact CD2-CZ 3.67Å; L271-F273 PolarHBondContact O-N 2.97Å; L271-F273 VanDerWaalsContact O-N 3.1Å; F273-R275 PolarHBondContact O-N 2.92Å; F273-A276 WeakPolarHBondContact O-CB 3.39Å; F273-A276 PolarHBondContact O-N 3.06Å; F273-T313 HydrophobicContact CD2-CG2 3.91Å; F273-T313 WeakPolarHBondContact CD2-O 3.48Å; F273-T313 HydrophobicContact CE2-CG2 4.15Å; F273-G316 WeakPolarHBondContact CD1-O 3.34Å; F273-F317 HydrophobicContact CE2-CB 3.99Å; F273-F317 HydrophobicContact CE2-CD2 4.43Å; F273-F317 HydrophobicContact CZ-CB 4Å; F273-F317 AromaticContact CZ-CD2 3.94Å; F273-F317 HydrophobicContact CZ-CD2 3.94Å; F273-F317 HydrophobicContact CZ-CG 4.47Å; F273-L320 HydrophobicContact CE1-CB 4.28Å; F273-L320 HydrophobicContact CE1-CD2 3.98Å
274	L	93.5	Very high	88.5	Confident	27 Å²	27	27.5 Å²	27.5	14%	0.141	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-60.5	-17.9	175.5	-66	176.7	0	0	0	112.7	V250 F253 T254 L271 R272 A276 L277 T313	V250-L274 HydrophobicContact CG1-CB 4.47Å; V250-L274 WeakPolarHBondContact CG1-O 3.18Å; F253-L274 HydrophobicContact CB-CD1 3.57Å; F253-L274 HydrophobicContact CD2-CD1 4.35Å; F253-L274 HydrophobicContact CG-CD1 4.14Å; T254-L274 HydrophobicContact CG2-CB 4.26Å; L271-L274 HydrophobicContact CB-CD1 3.94Å; L271-L274 HydrophobicContact CB-CG 4.39Å; L271-L274 HydrophobicContact CD1-CD1 4.5Å; L271-L274 WeakPolarHBondContact O-CB 3.46Å; L271-L274 WeakPolarHBondContact O-CG 3.25Å; L271-L274 PolarHBondContact O-N 3.15Å; R272-L274 PolarHBondContact O-N 3.3Å; L274-A276 PolarHBondContact O-N 3.09Å; L274-A276 VanDerWaalsContact O-N 3.17Å; L274-L277 HydrophobicContact CD2-CD1 4.04Å; L274-L277 WeakPolarHBondContact O-CB 3.5Å; L274-L277 PolarHBondContact O-N 3.38Å; L274-T313 HydrophobicContact CD2-CG2 3.96Å
275	R	93.1	Very high	88.5	Confident	1 Å²	1	25.5 Å²	25.5	0%	0.004	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-54.6	-28.8	170.1	-66.9	172.5	-178.2	-168.8	0.1	112.5	A191 D218 N222 T254 R272 F273 L277 R278	A191-R275 VanDerWaalsContact O-CD 3.27Å; A191-R275 WeakPolarHBondContact O-CD 3.3Å; A191-R275 PolarHBondContact O-NH1 3.41Å; D218-R275 VanDerWaalsContact CG-NH2 3.28Å; D218-R275 IonicContact OD1-CZ 3.68Å; D218-R275 IonicContact OD1-NH1 3.6Å; D218-R275 PolarHBondContact OD1-NH1 3.05Å; D218-R275 IonicContact OD1-NH2 2.83Å; D218-R275 PolarHBondContact OD1-NH2 3.25Å; D218-R275 IonicContact OD2-CZ 2.66Å; D218-R275 IonicContact OD2-NH1 3.59Å; D218-R275 IonicContact OD2-NH2 3.54Å; D218-R275 PolarHBondContact OD2-NH2 2.87Å; N222-R275 PolarHBondContact ND2-NH2 3.46Å; T254-R275 HydrophobicContact CG2-CG 3.74Å; R272-R275 VanDerWaalsContact O-CB 3.3Å; R272-R275 WeakPolarHBondContact O-CB 3.28Å; R272-R275 WeakPolarHBondContact O-CD 3.41Å; R272-R275 WeakPolarHBondContact O-CG 3.12Å; R272-R275 PolarHBondContact O-N 3.27Å; R272-R275 VanDerWaalsContact O-N 3.12Å; F273-R275 PolarHBondContact O-N 2.92Å; R275-L277 VanDerWaalsContact C-N 3.26Å; R275-L277 PolarHBondContact O-N 3.13Å; R275-R278 WeakPolarHBondContact O-CB 3.07Å; R275-R278 PolarHBondContact O-N 3.01Å
276	A	92.9	Very high	88.7	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-64.5	-26.4	176.5	0	0	0	0	0	113.5	L192 F273 L274 R278 L279 S309 L312	L192-A276 HydrophobicContact CD1-CB 3.86Å; L192-A276 HydrophobicContact CD2-CB 4.42Å; F273-A276 WeakPolarHBondContact O-CB 3.39Å; F273-A276 PolarHBondContact O-N 3.06Å; L274-A276 PolarHBondContact O-N 3.09Å; L274-A276 VanDerWaalsContact O-N 3.17Å; A276-R278 PolarHBondContact O-N 3.45Å; A276-L279 WeakPolarHBondContact O-CB 3.41Å; A276-L279 WeakPolarHBondContact O-CG 3.29Å; A276-L279 PolarHBondContact O-N 3.39Å; A276-S309 WeakPolarHBondContact O-CB 3.31Å; A276-L312 HydrophobicContact CB-CB 3.88Å
277	L	92.7	Very high	88.8	Confident	31 Å²	31	27.2 Å²	27.2	16%	0.162	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-66.2	-21.9	175.4	-67.1	177.6	0	0	0	113	V246 V250 L274 R275 L279 I280 T313	V246-L277 HydrophobicContact CG1-CD1 4.47Å; V250-L277 HydrophobicContact CG2-CB 3.76Å; V250-L277 HydrophobicContact CG2-CD1 3.95Å; V250-L277 HydrophobicContact CG2-CG 4.47Å; L274-L277 HydrophobicContact CD2-CD1 4.04Å; L274-L277 WeakPolarHBondContact O-CB 3.5Å; L274-L277 PolarHBondContact O-N 3.38Å; R275-L277 VanDerWaalsContact C-N 3.26Å; R275-L277 PolarHBondContact O-N 3.13Å; L277-L279 PolarHBondContact O-N 2.99Å; L277-L279 VanDerWaalsContact O-N 3.15Å; L277-I280 HydrophobicContact CD2-CD1 4.22Å; L277-I280 WeakPolarHBondContact O-CB 3.48Å; L277-I280 VanDerWaalsContact O-CG1 3.3Å; L277-I280 WeakPolarHBondContact O-CG1 3.29Å; L277-I280 PolarHBondContact O-N 2.7Å; L277-I280 VanDerWaalsContact O-N 3.09Å; L277-T313 HydrophobicContact CD1-CG2 4.16Å; L277-T313 HydrophobicContact CD2-CG2 4.02Å; L277-T313 WeakPolarHBondContact CD2-OG1 3.33Å; L277-T313 HydrophobicContact CG-CG2 3.88Å; L277-T313 WeakPolarHBondContact CG-OG1 3.25Å
278	R	90.3	Very high	88.8	Confident	15 Å²	15	30.2 Å²	30.2	6%	0.057	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-64.3	-16.9	174.6	-63	-167.6	-178.9	144	-0.6	113.1	S188 V250 D251 T254 R275 A276 I280 Q281	S188-R278 WeakPolarHBondContact OG-CD 3.44Å; V250-R278 HydrophobicContact CG1-CG 3.92Å; D251-R278 IonicContact OD1-CZ 3.92Å; D251-R278 IonicContact OD1-NE 3.19Å; D251-R278 PolarHBondContact OD1-NE 3.31Å; D251-R278 IonicContact OD1-NH2 3.73Å; D251-R278 PolarHBondContact OD1-NH2 3.22Å; T254-R278 PolarHBondContact OG1-NH2 2.99Å; R275-R278 WeakPolarHBondContact O-CB 3.07Å; R275-R278 PolarHBondContact O-N 3.01Å; A276-R278 PolarHBondContact O-N 3.45Å; R278-I280 PolarHBondContact O-N 2.96Å; R278-Q281 PolarHBondContact O-N 3.44Å
279	L	89.4	Confident	88.4	Confident	32 Å²	32	31.6 Å²	31.6	17%	0.168	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-64.2	-20.4	173.2	-62.7	176.5	0	0	0	112.8	I189 L192 A276 L277 Q281 F282 S305 I308 L312	I189-L279 HydrophobicContact CG1-CD2 4.38Å; L192-L279 HydrophobicContact CD2-CD1 3.94Å; L192-L279 HydrophobicContact CD2-CG 4.37Å; A276-L279 WeakPolarHBondContact O-CB 3.41Å; A276-L279 WeakPolarHBondContact O-CG 3.29Å; A276-L279 PolarHBondContact O-N 3.39Å; L277-L279 PolarHBondContact O-N 2.99Å; L277-L279 VanDerWaalsContact O-N 3.15Å; L279-Q281 PolarHBondContact O-N 3.1Å; L279-F282 WeakPolarHBondContact O-CB 3.37Å; L279-F282 PolarHBondContact O-N 3.47Å; L279-S305 WeakPolarHBondContact O-CB 3.32Å; L279-I308 HydrophobicContact CD1-CG2 4.16Å; L279-L312 HydrophobicContact CD1-CD1 4.16Å
280	I	89.6	Confident	88.3	Confident	54 Å²	54	35.9 Å²	35.9	28%	0.277	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-58.7	-35.9	175.9	-63.7	171.6	0	0	0	111.2	L277 R278 F282 S283 S309	L277-I280 HydrophobicContact CD2-CD1 4.22Å; L277-I280 WeakPolarHBondContact O-CB 3.48Å; L277-I280 VanDerWaalsContact O-CG1 3.3Å; L277-I280 WeakPolarHBondContact O-CG1 3.29Å; L277-I280 PolarHBondContact O-N 2.7Å; L277-I280 VanDerWaalsContact O-N 3.09Å; R278-I280 PolarHBondContact O-N 2.96Å; I280-F282 PolarHBondContact O-N 3.42Å; I280-S283 PolarHBondContact O-OG 3.3Å; I280-S309 WeakPolarHBondContact CG1-OG 3.35Å
281	Q	86.1	Confident	88.3	Confident	19 Å²	19	41 Å²	41	9%	0.089	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-70.4	-6.8	178.8	-63.6	-173.7	-36.4	0	0	113.6	N247 R278 L279 S283 E284 I285	N247-Q281 PolarHBondContact ND2-NE2 3.07Å; N247-Q281 VanDerWaalsContact ND2-NE2 3.12Å; N247-Q281 PolarHBondContact OD1-NE2 2.9Å; R278-Q281 PolarHBondContact O-N 3.44Å; L279-Q281 PolarHBondContact O-N 3.1Å; Q281-S283 VanDerWaalsContact C-N 3.35Å; Q281-S283 PolarHBondContact O-N 2.87Å; Q281-E284 PolarHBondContact O-N 2.85Å; Q281-I285 HydrophobicContact CB-CD1 3.9Å; Q281-I285 HydrophobicContact CB-CG1 4.38Å; Q281-I285 WeakPolarHBondContact O-CB 3.45Å; Q281-I285 WeakPolarHBondContact O-CG1 3.24Å; Q281-I285 PolarHBondContact O-N 3Å
282	F	85.6	Confident	88.1	Confident	65 Å²	65	40.5 Å²	40.5	29%	0.285	20%	0.199	S	C	.	.	H	α-helix	trans	-61.7	-39.1	-174.5	-179.5	-137.9	0	0	0	113.4	F185 L279 I280 L286 V301	F185-F282 AromaticContact CD2-CD2 3.96Å; F185-F282 HydrophobicContact CD2-CD2 3.96Å; F185-F282 HydrophobicContact CE1-CD2 4.32Å; F185-F282 AromaticContact CE1-CE2 3.97Å; F185-F282 HydrophobicContact CE1-CE2 3.97Å; F185-F282 HydrophobicContact CE2-CB 4.27Å; F185-F282 AromaticContact CE2-CD2 3.13Å; F185-F282 HydrophobicContact CE2-CD2 3.13Å; F185-F282 AromaticContact CE2-CE2 3.56Å; F185-F282 HydrophobicContact CE2-CE2 3.56Å; F185-F282 AromaticContact CE2-CG 3.91Å; F185-F282 HydrophobicContact CE2-CG 3.91Å; F185-F282 AromaticContact CZ-CD2 3.35Å; F185-F282 HydrophobicContact CZ-CD2 3.35Å; F185-F282 AromaticContact CZ-CE2 3.18Å; F185-F282 HydrophobicContact CZ-CE2 3.18Å; F185-F282 HydrophobicContact CZ-CG 4.34Å; F185-F282 HydrophobicContact CZ-CZ 4.09Å; L279-F282 WeakPolarHBondContact O-CB 3.37Å; L279-F282 PolarHBondContact O-N 3.47Å; I280-F282 PolarHBondContact O-N 3.42Å; F282-L286 HydrophobicContact CD1-CD1 4.22Å; F282-L286 HydrophobicContact CD2-CD1 3.77Å; F282-L286 HydrophobicContact CD2-CG 3.93Å; F282-L286 HydrophobicContact CE1-CD1 3.87Å; F282-L286 HydrophobicContact CE2-CD1 3.39Å; F282-L286 HydrophobicContact CE2-CD2 4.13Å; F282-L286 HydrophobicContact CE2-CG 3.69Å; F282-L286 HydrophobicContact CG-CD1 4.2Å; F282-L286 HydrophobicContact CZ-CD1 3.46Å; F282-L286 VanDerWaalsContact CZ-CD1 3.46Å; F282-L286 HydrophobicContact CZ-CG 4.27Å; F282-L286 WeakPolarHBondContact O-CB 3.42Å; F282-L286 WeakPolarHBondContact O-CG 3.34Å; F282-L286 PolarHBondContact O-N 3.24Å; F282-V301 HydrophobicContact CD1-CG1 3.89Å; F282-V301 HydrophobicContact CE1-CG1 4.13Å
283	S	86.7	Confident	87.7	Confident	10 Å²	10	48 Å²	48	7%	0.07	23%	0.232	C	C	.	.	H	α-helix	trans	-62.7	-47	176.3	54.6	0	0	0	0	111.9	I280 Q281 L286 Q287 N302	I280-S283 PolarHBondContact O-OG 3.3Å; Q281-S283 VanDerWaalsContact C-N 3.35Å; Q281-S283 PolarHBondContact O-N 2.87Å; S283-L286 PolarHBondContact O-N 3.1Å; S283-Q287 PolarHBondContact O-N 3.39Å; S283-N302 PolarHBondContact OG-OD1 3.4Å
284	E	85.3	Confident	87.3	Confident	91 Å²	91	51.8 Å²	51.8	43%	0.425	26%	0.256	S	S	.	.	H	α-helix	trans	-64.5	-45.2	178.3	-172.5	179.7	-167.9	0	0	111.9	Q281 L286 Q287 F288	Q281-E284 PolarHBondContact O-N 2.85Å; E284-L286 PolarHBondContact O-N 3.1Å; E284-Q287 WeakPolarHBondContact O-CB 3.28Å; E284-Q287 PolarHBondContact O-N 2.68Å; E284-Q287 VanDerWaalsContact O-N 3.15Å; E284-F288 HydrophobicContact CG-CD2 4.28Å; E284-F288 HydrophobicContact CG-CE1 4.34Å; E284-F288 HydrophobicContact CG-CE2 3.6Å; E284-F288 HydrophobicContact CG-CZ 3.61Å; E284-F288 WeakPolarHBondContact O-CG 3.24Å; E284-F288 PolarHBondContact O-N 2.93Å; E284-F288 WeakPolarHBondContact OE1-CZ 3.12Å
285	I	85.4	Confident	87.1	Confident	13 Å²	13	54.8 Å²	54.8	7%	0.067	28%	0.279	C	S	.	.	H	α-helix	trans	-60.7	-45	177.1	-70.7	169.4	0	0	0	111.3	V181 F185 Q281 Q287 F288 L289	V181-I285 HydrophobicContact CG1-CB 4.22Å; V181-I285 HydrophobicContact CG1-CG1 3.98Å; V181-I285 HydrophobicContact CG1-CG2 3.7Å; F185-I285 HydrophobicContact CB-CD1 4.18Å; F185-I285 HydrophobicContact CB-CG2 4.2Å; F185-I285 HydrophobicContact CD2-CD1 4.34Å; F185-I285 HydrophobicContact CG-CG2 4.43Å; Q281-I285 HydrophobicContact CB-CD1 3.9Å; Q281-I285 HydrophobicContact CB-CG1 4.38Å; Q281-I285 WeakPolarHBondContact O-CB 3.45Å; Q281-I285 WeakPolarHBondContact O-CG1 3.24Å; Q281-I285 PolarHBondContact O-N 3Å; I285-Q287 VanDerWaalsContact C-N 3.29Å; I285-Q287 PolarHBondContact O-N 3.37Å; I285-F288 PolarHBondContact O-N 3.09Å; I285-L289 HydrophobicContact CG2-CD1 4.17Å; I285-L289 WeakPolarHBondContact O-CG 2.93Å; I285-L289 PolarHBondContact O-N 3.36Å; I285-L289 VanDerWaalsContact O-N 3.09Å
286	L	86	Confident	86.8	Confident	26 Å²	26	59 Å²	59	14%	0.136	30%	0.302	C	S	.	.	H	α-helix	trans	-67.1	-28.9	176.7	-77.5	172	0	0	0	113.2	F282 S283 E284 N290 I291 L292 V301	F282-L286 HydrophobicContact CD1-CD1 4.22Å; F282-L286 HydrophobicContact CD2-CD1 3.77Å; F282-L286 HydrophobicContact CD2-CG 3.93Å; F282-L286 HydrophobicContact CE1-CD1 3.87Å; F282-L286 HydrophobicContact CE2-CD1 3.39Å; F282-L286 HydrophobicContact CE2-CD2 4.13Å; F282-L286 HydrophobicContact CE2-CG 3.69Å; F282-L286 HydrophobicContact CG-CD1 4.2Å; F282-L286 HydrophobicContact CZ-CD1 3.46Å; F282-L286 VanDerWaalsContact CZ-CD1 3.46Å; F282-L286 HydrophobicContact CZ-CG 4.27Å; F282-L286 WeakPolarHBondContact O-CB 3.42Å; F282-L286 WeakPolarHBondContact O-CG 3.34Å; F282-L286 PolarHBondContact O-N 3.24Å; S283-L286 PolarHBondContact O-N 3.1Å; E284-L286 PolarHBondContact O-N 3.1Å; L286-N290 PolarHBondContact O-N 3.38Å; L286-I291 HydrophobicContact CD2-CB 4.11Å; L286-I291 HydrophobicContact CD2-CD1 3.75Å; L286-I291 HydrophobicContact CD2-CG2 4.09Å; L286-I291 PolarHBondContact O-N 2.94Å; L286-L292 HydrophobicContact CB-CD1 3.59Å; L286-L292 HydrophobicContact CB-CG 3.82Å; L286-L292 HydrophobicContact CD1-CD1 3.95Å; L286-L292 HydrophobicContact CD1-CG 4.36Å; L286-L292 HydrophobicContact CG-CD1 4.46Å; L286-L292 PolarHBondContact O-N 2.96Å; L286-V301 HydrophobicContact CD1-CG1 3.97Å
287	Q	86.3	Confident	86.5	Confident	97 Å²	97	60.4 Å²	60.4	45%	0.453	31%	0.312	S	S	.	.	H	α-helix	trans	-70.3	-45.2	173	-171.9	178.3	1.8	0	0	111	S283 E284 I285 L289 N290	S283-Q287 PolarHBondContact O-N 3.39Å; E284-Q287 WeakPolarHBondContact O-CB 3.28Å; E284-Q287 PolarHBondContact O-N 2.68Å; E284-Q287 VanDerWaalsContact O-N 3.15Å; I285-Q287 VanDerWaalsContact C-N 3.29Å; I285-Q287 PolarHBondContact O-N 3.37Å; Q287-L289 PolarHBondContact O-N 3.31Å; Q287-N290 WeakPolarHBondContact O-CA 3.42Å; Q287-N290 PolarHBondContact O-N 3.01Å
288	F	83.1	Confident	86.4	Confident	70 Å²	70	61 Å²	61	31%	0.307	32%	0.315	S	S	.	.	H	α-helix	trans	-59.3	-32.1	173.7	-68.8	-26.8	0	0	0	113.4	A172 E284 I285 N290	A172-F288 HydrophobicContact CB-CB 3.77Å; A172-F288 HydrophobicContact CB-CD2 4.47Å; A172-F288 HydrophobicContact CB-CG 4.16Å; E284-F288 HydrophobicContact CG-CD2 4.28Å; E284-F288 HydrophobicContact CG-CE1 4.34Å; E284-F288 HydrophobicContact CG-CE2 3.6Å; E284-F288 HydrophobicContact CG-CZ 3.61Å; E284-F288 WeakPolarHBondContact O-CG 3.24Å; E284-F288 PolarHBondContact O-N 2.93Å; E284-F288 WeakPolarHBondContact OE1-CZ 3.12Å; I285-F288 PolarHBondContact O-N 3.09Å; F288-N290 PolarHBondContact O-N 3.35Å
289	L	80	Confident	86.4	Confident	51 Å²	51	64.6 Å²	64.6	27%	0.267	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	1.9	174.4	-64	172	0	0	0	113.9	R178 V182 I285 Q287 I291	R178-L289 HydrophobicContact CB-CD2 4.36Å; V182-L289 HydrophobicContact CG2-CD1 3.8Å; V182-L289 HydrophobicContact CG2-CD2 3.75Å; V182-L289 HydrophobicContact CG2-CG 4.41Å; I285-L289 HydrophobicContact CG2-CD1 4.17Å; I285-L289 WeakPolarHBondContact O-CG 2.93Å; I285-L289 PolarHBondContact O-N 3.36Å; I285-L289 VanDerWaalsContact O-N 3.09Å; Q287-L289 PolarHBondContact O-N 3.31Å; L289-I291 HydrophobicContact CB-CD1 3.93Å; L289-I291 HydrophobicContact CB-CG1 4.1Å; L289-I291 HydrophobicContact CD1-CD1 4.35Å; L289-I291 PolarHBondContact O-N 3.29Å
290	N	82.9	Confident	86.6	Confident	97 Å²	97	64.9 Å²	64.9	52%	0.519	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.5	24.4	-176.1	-72.3	-75	0	0	0	114.6	L286 Q287 F288 K293	L286-N290 PolarHBondContact O-N 3.38Å; Q287-N290 WeakPolarHBondContact O-CA 3.42Å; Q287-N290 PolarHBondContact O-N 3.01Å; F288-N290 PolarHBondContact O-N 3.35Å; N290-K293 WeakPolarHBondContact O-CE 3.32Å
291	I	87	Confident	86.7	Confident	110 Å²	110	63.5 Å²	63.5	56%	0.564	33%	0.326	S	S	*	.			trans	-80.5	-45.2	176.9	-65.3	169.9	0	0	0	109.6	L286 L289	L286-I291 HydrophobicContact CD2-CB 4.11Å; L286-I291 HydrophobicContact CD2-CD1 3.75Å; L286-I291 HydrophobicContact CD2-CG2 4.09Å; L286-I291 PolarHBondContact O-N 2.94Å; L289-I291 HydrophobicContact CB-CD1 3.93Å; L289-I291 HydrophobicContact CB-CG1 4.1Å; L289-I291 HydrophobicContact CD1-CD1 4.35Å; L289-I291 PolarHBondContact O-N 3.29Å
292	L	88.3	Confident	87	Confident	22 Å²	22	65.6 Å²	65.6	12%	0.115	34%	0.338	C	S	.	.			trans	-89.8	117.6	173.9	-61.1	174	0	0	0	110	L286 I298 V301	L286-L292 HydrophobicContact CB-CD1 3.59Å; L286-L292 HydrophobicContact CB-CG 3.82Å; L286-L292 HydrophobicContact CD1-CD1 3.95Å; L286-L292 HydrophobicContact CD1-CG 4.36Å; L286-L292 HydrophobicContact CG-CD1 4.46Å; L286-L292 PolarHBondContact O-N 2.96Å; L292-I298 HydrophobicContact CB-CG1 3.72Å; L292-V301 HydrophobicContact CD1-CB 3.83Å; L292-V301 HydrophobicContact CD1-CG1 4.03Å; L292-V301 HydrophobicContact CD1-CG2 3.94Å; L292-V301 HydrophobicContact CD2-CG2 3.9Å
293	K	84.4	Confident	87.3	Confident	171 Å²	171	63.1 Å²	63.1	74%	0.743	33%	0.327	S	S	*	.			trans	-118.8	-25.8	-175.6	-63.2	-175.4	-178.6	179.9	0	114.4	N290	N290-K293 WeakPolarHBondContact O-CE 3.32Å
294	T	85.6	Confident	87.6	Confident	85 Å²	85	65.7 Å²	65.7	52%	0.521	34%	0.34	S	S	.	.	S	Bend	trans	-102.5	143.9	-177.2	68.4	0	0	0	0	110.7	N296 S297 I298	T294-N296 PolarHBondContact O-N 3.12Å; T294-S297 PolarHBondContact N-OG 2.94Å; T294-S297 PolarHBondContact O-N 3.18Å; T294-S297 PolarHBondContact O-OG 3.23Å; T294-S297 VanDerWaalsContact OG1-CB 3.3Å; T294-S297 WeakPolarHBondContact OG1-CB 3.47Å; T294-S297 PolarHBondContact OG1-N 3.34Å; T294-S297 PolarHBondContact OG1-OG 3.09Å; T294-I298 WeakPolarHBondContact O-CG1 3.33Å; T294-I298 PolarHBondContact O-N 2.95Å
295	S	88	Confident	87.9	Confident	91 Å²	91	61.7 Å²	61.7	64%	0.636	32%	0.322	S	S	*	.	H	α-helix	trans	-51	-45.4	177.5	-174.1	0	0	0	0	111.9	S297 I298 K299	S295-S297 PolarHBondContact O-N 2.92Å; S295-I298 PolarHBondContact O-N 3.03Å; S295-K299 VanDerWaalsContact O-CB 3.3Å; S295-K299 WeakPolarHBondContact O-CB 3.07Å; S295-K299 PolarHBondContact O-N 3.47Å
296	N	86.5	Confident	88.3	Confident	88 Å²	88	62.9 Å²	62.9	47%	0.471	33%	0.328	S	S	.	.	H	α-helix	trans	-60.5	-41.4	177.7	-63	10.8	0	0	0	112.5	T294 L300 L390	T294-N296 PolarHBondContact O-N 3.12Å; N296-L300 WeakPolarHBondContact O-CB 3.46Å; N296-L300 PolarHBondContact O-N 3.42Å; N296-L390 HydrophobicContact CB-CD2 4.03Å
297	S	88	Confident	88.6	Confident	30 Å²	30	62.8 Å²	62.8	21%	0.21	33%	0.327	C	S	.	.	H	α-helix	trans	-68.9	-40	177.8	69.4	0	0	0	0	112.7	T294 S295 V301	T294-S297 PolarHBondContact N-OG 2.94Å; T294-S297 PolarHBondContact O-N 3.18Å; T294-S297 PolarHBondContact O-OG 3.23Å; T294-S297 VanDerWaalsContact OG1-CB 3.3Å; T294-S297 WeakPolarHBondContact OG1-CB 3.47Å; T294-S297 PolarHBondContact OG1-N 3.34Å; T294-S297 PolarHBondContact OG1-OG 3.09Å; S295-S297 PolarHBondContact O-N 2.92Å; S297-V301 WeakPolarHBondContact O-CG2 3.34Å; S297-V301 PolarHBondContact O-N 3.46Å; S297-V301 VanDerWaalsContact O-N 3.07Å
298	I	90.3	Very high	88.9	Confident	44 Å²	44	61.4 Å²	61.4	23%	0.226	32%	0.322	C	S	.	.	H	α-helix	trans	-64.7	-48.2	176.6	-64.6	167.7	0	0	0	109.6	L292 T294 S295 V301 N302	L292-I298 HydrophobicContact CB-CG1 3.72Å; T294-I298 WeakPolarHBondContact O-CG1 3.33Å; T294-I298 PolarHBondContact O-N 2.95Å; S295-I298 PolarHBondContact O-N 3.03Å; I298-V301 PolarHBondContact O-N 2.9Å; I298-N302 VanDerWaalsContact O-CB 3.27Å; I298-N302 WeakPolarHBondContact O-CB 3.29Å; I298-N302 PolarHBondContact O-N 3.32Å
299	K	91	Very high	89.4	Confident	91 Å²	91	58.1 Å²	58.1	40%	0.396	31%	0.307	S	S	.	.	H	α-helix	trans	-61.1	-46.4	178.5	-169.1	176.4	-180	-172.1	0	112	S295 N302 L303 E386 L390	S295-K299 VanDerWaalsContact O-CB 3.3Å; S295-K299 WeakPolarHBondContact O-CB 3.07Å; S295-K299 PolarHBondContact O-N 3.47Å; K299-N302 PolarHBondContact O-N 2.99Å; K299-L303 HydrophobicContact CG-CD1 4.21Å; K299-L303 WeakPolarHBondContact O-CG 3.19Å; K299-L303 PolarHBondContact O-N 3.25Å; K299-E386 WeakPolarHBondContact CE-OE1 3.37Å; K299-E386 IonicContact NZ-OE1 3.28Å; K299-E386 PolarHBondContact NZ-OE1 2.89Å; K299-L390 HydrophobicContact CB-CD1 4.36Å; K299-L390 HydrophobicContact CD-CD1 4.26Å; K299-L390 HydrophobicContact CG-CD1 4.13Å
300	L	91.8	Very high	90	Very high	37 Å²	37	57.7 Å²	57.7	19%	0.194	31%	0.307	C	S	.	.	H	α-helix	trans	-59.4	-50.1	177.8	177.4	61.9	0	0	0	112.1	N296 N302 L303 L304 I387 L390 I391	N296-L300 WeakPolarHBondContact O-CB 3.46Å; N296-L300 PolarHBondContact O-N 3.42Å; L300-N302 VanDerWaalsContact C-N 3.31Å; L300-N302 PolarHBondContact O-N 3.48Å; L300-L303 PolarHBondContact O-N 3Å; L300-L304 HydrophobicContact CD1-CD1 4Å; L300-L304 HydrophobicContact CD1-CG 4.37Å; L300-L304 HydrophobicContact CG-CD1 4.05Å; L300-L304 WeakPolarHBondContact O-CB 3.46Å; L300-L304 WeakPolarHBondContact O-CG 3.31Å; L300-L304 PolarHBondContact O-N 3.37Å; L300-I387 HydrophobicContact CD1-CB 4.45Å; L300-I387 HydrophobicContact CD1-CG1 4.37Å; L300-I387 HydrophobicContact CD1-CG2 4.02Å; L300-L390 HydrophobicContact CB-CD1 4.19Å; L300-L390 HydrophobicContact CD1-CB 4.28Å; L300-I391 HydrophobicContact CD1-CD1 4.3Å; L300-I391 HydrophobicContact CD1-CG1 4.07Å; L300-I391 HydrophobicContact CD2-CG1 4.16Å
301	V	92.3	Very high	90.5	Very high	25 Å²	25	55.6 Å²	55.6	15%	0.152	29%	0.292	C	S	.	.	H	α-helix	trans	-66.3	-35.6	179	175.1	0	0	0	0	111.3	F282 L286 L292 S297 I298 S305	F282-V301 HydrophobicContact CD1-CG1 3.89Å; F282-V301 HydrophobicContact CE1-CG1 4.13Å; L286-V301 HydrophobicContact CD1-CG1 3.97Å; L292-V301 HydrophobicContact CD1-CB 3.83Å; L292-V301 HydrophobicContact CD1-CG1 4.03Å; L292-V301 HydrophobicContact CD1-CG2 3.94Å; L292-V301 HydrophobicContact CD2-CG2 3.9Å; S297-V301 WeakPolarHBondContact O-CG2 3.34Å; S297-V301 PolarHBondContact O-N 3.46Å; S297-V301 VanDerWaalsContact O-N 3.07Å; I298-V301 PolarHBondContact O-N 2.9Å; V301-S305 VanDerWaalsContact O-CB 3.26Å; V301-S305 WeakPolarHBondContact O-CB 3.47Å; V301-S305 PolarHBondContact O-N 3.4Å; V301-S305 PolarHBondContact O-OG 2.82Å
302	N	92.3	Very high	90.9	Very high	63 Å²	63	51.1 Å²	51.1	34%	0.337	27%	0.269	S	S	.	.	H	α-helix	trans	-64.2	-47.9	176.9	-162.5	43.8	0	0	0	112.2	S283 I298 K299 L300 L304 S305 I306	S283-N302 PolarHBondContact OG-OD1 3.4Å; I298-N302 VanDerWaalsContact O-CB 3.27Å; I298-N302 WeakPolarHBondContact O-CB 3.29Å; I298-N302 PolarHBondContact O-N 3.32Å; K299-N302 PolarHBondContact O-N 2.99Å; L300-N302 VanDerWaalsContact C-N 3.31Å; L300-N302 PolarHBondContact O-N 3.48Å; N302-L304 PolarHBondContact O-N 3.15Å; N302-S305 PolarHBondContact O-N 2.93Å; N302-I306 WeakPolarHBondContact O-CG1 3.25Å; N302-I306 PolarHBondContact O-N 2.88Å
303	L	92.9	Very high	91.2	Very high	13 Å²	13	50.9 Å²	50.9	7%	0.068	27%	0.269	C	S	.	.	H	α-helix	trans	-60.1	-46.2	176.3	-69.7	170	0	0	0	111.8	K299 L300 S305 F307 Y383 E386 I387 L390	K299-L303 HydrophobicContact CG-CD1 4.21Å; K299-L303 WeakPolarHBondContact O-CG 3.19Å; K299-L303 PolarHBondContact O-N 3.25Å; L300-L303 PolarHBondContact O-N 3Å; L303-S305 VanDerWaalsContact C-N 3.35Å; L303-S305 PolarHBondContact O-N 3.3Å; L303-F307 VanDerWaalsContact O-CB 3.25Å; L303-F307 WeakPolarHBondContact O-CB 3.39Å; L303-F307 PolarHBondContact O-N 3.43Å; L303-Y383 HydrophobicContact CD2-CD1 3.7Å; L303-Y383 HydrophobicContact CD2-CD2 4.42Å; L303-Y383 HydrophobicContact CD2-CE1 3.87Å; L303-Y383 HydrophobicContact CD2-CG 4Å; L303-E386 HydrophobicContact CD1-CB 4.26Å; L303-E386 HydrophobicContact CD1-CG 3.76Å; L303-E386 WeakPolarHBondContact CD1-OE2 3.38Å; L303-I387 HydrophobicContact CB-CD1 4.14Å; L303-I387 HydrophobicContact CB-CG1 3.97Å; L303-I387 HydrophobicContact CD1-CG1 4.28Å; L303-L390 HydrophobicContact CD1-CD1 4.1Å
304	L	92.3	Very high	91.7	Very high	64 Å²	64	43.2 Å²	43.2	34%	0.335	24%	0.237	S	C	.	.	H	α-helix	trans	-61.1	-42.1	175.8	-73.1	169	0	0	0	112.2	L300 N302 F307 I308 I387	L300-L304 HydrophobicContact CD1-CD1 4Å; L300-L304 HydrophobicContact CD1-CG 4.37Å; L300-L304 HydrophobicContact CG-CD1 4.05Å; L300-L304 WeakPolarHBondContact O-CB 3.46Å; L300-L304 WeakPolarHBondContact O-CG 3.31Å; L300-L304 PolarHBondContact O-N 3.37Å; N302-L304 PolarHBondContact O-N 3.15Å; L304-F307 PolarHBondContact O-N 3Å; L304-I308 WeakPolarHBondContact O-CB 3.44Å; L304-I308 WeakPolarHBondContact O-CD1 3.26Å; L304-I308 VanDerWaalsContact O-CG1 3.24Å; L304-I308 WeakPolarHBondContact O-CG1 3.43Å; L304-I308 PolarHBondContact O-N 3.5Å; L304-I387 HydrophobicContact CD2-CD1 4Å; L304-I387 HydrophobicContact CD2-CG2 4.33Å; L304-I387 HydrophobicContact CG-CD1 4.38Å
305	S	92.2	Very high	92.2	Very high	7 Å²	7	39.1 Å²	39.1	5%	0.049	21%	0.212	C	C	.	.	H	α-helix	trans	-63.5	-48.2	-179.5	-59.5	0	0	0	0	111.4	L279 V301 N302 L303 S309	L279-S305 WeakPolarHBondContact O-CB 3.32Å; V301-S305 VanDerWaalsContact O-CB 3.26Å; V301-S305 WeakPolarHBondContact O-CB 3.47Å; V301-S305 PolarHBondContact O-N 3.4Å; V301-S305 PolarHBondContact O-OG 2.82Å; N302-S305 PolarHBondContact O-N 2.93Å; L303-S305 VanDerWaalsContact C-N 3.35Å; L303-S305 PolarHBondContact O-N 3.3Å; S305-S309 WeakPolarHBondContact O-CB 3.34Å; S305-S309 PolarHBondContact O-N 3.49Å; S305-S309 PolarHBondContact O-OG 3.45Å; S305-S309 VanDerWaalsContact O-OG 3.05Å
306	I	92.2	Very high	92.5	Very high	38 Å²	38	34.8 Å²	34.8	20%	0.195	18%	0.182	C	C	.	.	H	α-helix	trans	-65.8	-41.9	178.8	-63.7	165.3	0	0	0	111.2	N302 S309 T310 Y383	N302-I306 WeakPolarHBondContact O-CG1 3.25Å; N302-I306 PolarHBondContact O-N 2.88Å; I306-S309 WeakPolarHBondContact CA-OG 3.32Å; I306-S309 PolarHBondContact O-OG 3.36Å; I306-S309 VanDerWaalsContact O-OG 3.06Å; I306-T310 VanDerWaalsContact O-CB 3.29Å; I306-T310 WeakPolarHBondContact O-CB 3.37Å; I306-T310 PolarHBondContact O-N 2.64Å; I306-T310 VanDerWaalsContact O-N 3.07Å; I306-T310 PolarHBondContact O-OG1 3.46Å; I306-Y383 HydrophobicContact CB-CE2 4.46Å; I306-Y383 HydrophobicContact CG2-CE2 3.91Å
307	F	92.8	Very high	92.9	Very high	24 Å²	24	34.3 Å²	34.3	11%	0.105	18%	0.176	C	C	.	.	H	α-helix	trans	-62.3	-52.2	178.4	-178.2	-98.3	0	0	0	111.5	L303 L304 T310 W311 M347 M350 F380 Y383 V384	L303-F307 VanDerWaalsContact O-CB 3.25Å; L303-F307 WeakPolarHBondContact O-CB 3.39Å; L303-F307 PolarHBondContact O-N 3.43Å; L304-F307 PolarHBondContact O-N 3Å; F307-T310 PolarHBondContact O-N 3.07Å; F307-W311 WeakPolarHBondContact O-CB 3.29Å; F307-W311 PolarHBondContact O-N 3.18Å; F307-M347 HydrophobicContact CE1-CE 4.24Å; F307-M347 HydrophobicContact CZ-CE 4.25Å; F307-M350 HydrophobicContact CZ-CE 4.45Å; F307-F380 HydrophobicContact CE2-CD2 4.32Å; F307-F380 HydrophobicContact CZ-CD2 4.42Å; F307-Y383 HydrophobicContact CB-CD2 4.45Å; F307-V384 HydrophobicContact CE2-CG2 4.48Å
308	I	93.3	Very high	93.2	Very high	69 Å²	69	32.9 Å²	32.9	35%	0.354	17%	0.166	S	C	.	.	H	α-helix	trans	-66	-44.5	-179	-65.7	167.4	0	0	0	110.9	L279 L304 T310 W311 L312	L279-I308 HydrophobicContact CD1-CG2 4.16Å; L304-I308 WeakPolarHBondContact O-CB 3.44Å; L304-I308 WeakPolarHBondContact O-CD1 3.26Å; L304-I308 VanDerWaalsContact O-CG1 3.24Å; L304-I308 WeakPolarHBondContact O-CG1 3.43Å; L304-I308 PolarHBondContact O-N 3.5Å; I308-T310 VanDerWaalsContact C-N 3.33Å; I308-T310 PolarHBondContact O-N 2.98Å; I308-W311 PolarHBondContact O-N 3.47Å; I308-L312 HydrophobicContact CG2-CD1 3.65Å; I308-L312 HydrophobicContact CG2-CG 4.22Å; I308-L312 WeakPolarHBondContact O-CB 3.22Å; I308-L312 VanDerWaalsContact O-CG 3.31Å; I308-L312 WeakPolarHBondContact O-CG 3.2Å; I308-L312 PolarHBondContact O-N 3.22Å
309	S	93.1	Very high	93.4	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60.7	-43.3	179.9	68.1	0	0	0	0	111.8	A276 I280 S305 I306 T313	A276-S309 WeakPolarHBondContact O-CB 3.31Å; I280-S309 WeakPolarHBondContact CG1-OG 3.35Å; S305-S309 WeakPolarHBondContact O-CB 3.34Å; S305-S309 PolarHBondContact O-N 3.49Å; S305-S309 PolarHBondContact O-OG 3.45Å; S305-S309 VanDerWaalsContact O-OG 3.05Å; I306-S309 WeakPolarHBondContact CA-OG 3.32Å; I306-S309 PolarHBondContact O-OG 3.36Å; I306-S309 VanDerWaalsContact O-OG 3.06Å; S309-T313 VanDerWaalsContact O-CB 3.25Å; S309-T313 WeakPolarHBondContact O-CB 3.35Å; S309-T313 PolarHBondContact O-N 2.79Å; S309-T313 PolarHBondContact O-OG1 3.36Å
310	T	92.6	Very high	93.4	Very high	43 Å²	43	27.8 Å²	27.8	26%	0.264	14%	0.143	S	C	.	.	H	α-helix	trans	-73.1	-41.2	-176.3	-49.6	0	0	0	0	111.2	I306 F307 I308 T313 A314 M379	I306-T310 VanDerWaalsContact O-CB 3.29Å; I306-T310 WeakPolarHBondContact O-CB 3.37Å; I306-T310 PolarHBondContact O-N 2.64Å; I306-T310 VanDerWaalsContact O-N 3.07Å; I306-T310 PolarHBondContact O-OG1 3.46Å; F307-T310 PolarHBondContact O-N 3.07Å; I308-T310 VanDerWaalsContact C-N 3.33Å; I308-T310 PolarHBondContact O-N 2.98Å; T310-T313 PolarHBondContact O-N 3.2Å; T310-A314 VanDerWaalsContact O-CB 3.26Å; T310-A314 WeakPolarHBondContact O-CB 3.46Å; T310-A314 PolarHBondContact O-N 3.28Å; T310-M379 HydrophobicContact CG2-CE 3.62Å; T310-M379 HydrophobicContact CG2-SD 4.29Å
311	W	94.4	Very high	93.4	Very high	52 Å²	52	26.9 Å²	26.9	20%	0.197	14%	0.139	C	C	.	.	H	α-helix	trans	-60	-50.7	174.6	174.4	36.4	0	0	0	112.4	F307 I308 T313 A314 A315 V343 M347 M350	F307-W311 WeakPolarHBondContact O-CB 3.29Å; F307-W311 PolarHBondContact O-N 3.18Å; I308-W311 PolarHBondContact O-N 3.47Å; W311-T313 PolarHBondContact O-N 3.12Å; W311-A314 PolarHBondContact O-N 3.27Å; W311-A315 WeakPolarHBondContact O-CB 3.44Å; W311-A315 PolarHBondContact O-N 2.78Å; W311-V343 HydrophobicContact CH2-CG1 3.84Å; W311-V343 HydrophobicContact CZ2-CG1 3.23Å; W311-V343 PolarHBondContact NE1-O 3.43Å; W311-M347 HydrophobicContact CD2-CE 3.9Å; W311-M347 HydrophobicContact CE3-CE 3.99Å; W311-M347 HydrophobicContact CH2-CE 3.55Å; W311-M347 HydrophobicContact CZ2-CB 3.83Å; W311-M347 HydrophobicContact CZ2-CE 3.43Å; W311-M347 VanDerWaalsContact CZ2-CE 3.43Å; W311-M347 HydrophobicContact CZ2-CG 4.37Å; W311-M347 HydrophobicContact CZ3-CE 3.83Å; W311-M350 HydrophobicContact CB-CE 4.05Å; W311-M350 HydrophobicContact CD2-CE 4.41Å; W311-M350 HydrophobicContact CG-CE 3.69Å
312	L	95.3	Very high	93.4	Very high	17 Å²	17	25.7 Å²	25.7	9%	0.089	13%	0.132	C	C	.	.	H	α-helix	trans	-66.1	-35.6	-179.9	-68.3	176.4	0	0	0	112.8	F196 A276 L279 I308 G316 Y339 V343	F196-L312 HydrophobicContact CZ-CD1 4.38Å; A276-L312 HydrophobicContact CB-CB 3.88Å; L279-L312 HydrophobicContact CD1-CD1 4.16Å; I308-L312 HydrophobicContact CG2-CD1 3.65Å; I308-L312 HydrophobicContact CG2-CG 4.22Å; I308-L312 WeakPolarHBondContact O-CB 3.22Å; I308-L312 VanDerWaalsContact O-CG 3.31Å; I308-L312 WeakPolarHBondContact O-CG 3.2Å; I308-L312 PolarHBondContact O-N 3.22Å; L312-G316 PolarHBondContact O-N 3.05Å; L312-Y339 WeakPolarHBondContact CA-OH 3.26Å; L312-Y339 WeakPolarHBondContact CB-OH 3.29Å; L312-Y339 HydrophobicContact CD2-CE1 4.45Å; L312-Y339 WeakPolarHBondContact CD2-OH 3.38Å; L312-Y339 PolarHBondContact O-OH 2.97Å; L312-V343 HydrophobicContact CD2-CG2 4.25Å
313	T	94.8	Very high	93.3	Very high	17 Å²	17	24.1 Å²	24.1	10%	0.104	12%	0.123	C	C	.	.	H	α-helix	trans	-69.4	-44.9	176.9	-56.5	0	0	0	0	111.1	F273 L274 L277 S309 T310 W311 A315 G316 F317	F273-T313 HydrophobicContact CD2-CG2 3.91Å; F273-T313 WeakPolarHBondContact CD2-O 3.48Å; F273-T313 HydrophobicContact CE2-CG2 4.15Å; L274-T313 HydrophobicContact CD2-CG2 3.96Å; L277-T313 HydrophobicContact CD1-CG2 4.16Å; L277-T313 HydrophobicContact CD2-CG2 4.02Å; L277-T313 WeakPolarHBondContact CD2-OG1 3.33Å; L277-T313 HydrophobicContact CG-CG2 3.88Å; L277-T313 WeakPolarHBondContact CG-OG1 3.25Å; S309-T313 VanDerWaalsContact O-CB 3.25Å; S309-T313 WeakPolarHBondContact O-CB 3.35Å; S309-T313 PolarHBondContact O-N 2.79Å; S309-T313 PolarHBondContact O-OG1 3.36Å; T310-T313 PolarHBondContact O-N 3.2Å; W311-T313 PolarHBondContact O-N 3.12Å; T313-A315 VanDerWaalsContact C-N 3.31Å; T313-A315 PolarHBondContact O-N 3.39Å; T313-G316 PolarHBondContact O-N 3.49Å; T313-F317 PolarHBondContact O-N 3.06Å
314	A	94.9	Very high	93	Very high	9 Å²	9	25.1 Å²	25.1	7%	0.074	13%	0.131	C	C	.	.	H	α-helix	trans	-62	-40.2	175.1	0	0	0	0	0	111.6	T310 W311 G316 F317 I318 L346 F368 F372	T310-A314 VanDerWaalsContact O-CB 3.26Å; T310-A314 WeakPolarHBondContact O-CB 3.46Å; T310-A314 PolarHBondContact O-N 3.28Å; W311-A314 PolarHBondContact O-N 3.27Å; A314-G316 VanDerWaalsContact C-N 3.31Å; A314-G316 PolarHBondContact O-N 2.96Å; A314-F317 PolarHBondContact O-N 3.43Å; A314-I318 PolarHBondContact O-N 3.46Å; A314-L346 HydrophobicContact CB-CD1 3.46Å; A314-L346 VanDerWaalsContact CB-CD1 3.46Å; A314-F368 HydrophobicContact CB-CE1 4.4Å; A314-F368 HydrophobicContact CB-CZ 3.87Å; A314-F372 HydrophobicContact CB-CD2 3.77Å; A314-F372 HydrophobicContact CB-CE2 3.41Å; A314-F372 VanDerWaalsContact CB-CE2 3.41Å; A314-F372 HydrophobicContact CB-CZ 4.22Å
315	A	95.3	Very high	92.7	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-62.8	-39	176.5	0	0	0	0	0	111.5	W311 T313 I318 H319 Y339 V343 L346	W311-A315 WeakPolarHBondContact O-CB 3.44Å; W311-A315 PolarHBondContact O-N 2.78Å; T313-A315 VanDerWaalsContact C-N 3.31Å; T313-A315 PolarHBondContact O-N 3.39Å; A315-I318 VanDerWaalsContact O-CG2 3.32Å; A315-I318 WeakPolarHBondContact O-CG2 3.21Å; A315-H319 WeakPolarHBondContact O-CB 3.33Å; A315-H319 PolarHBondContact O-N 2.78Å; A315-Y339 HydrophobicContact CB-CE2 4.1Å; A315-V343 HydrophobicContact CB-CB 4.31Å; A315-V343 HydrophobicContact CB-CG2 3.53Å; A315-L346 HydrophobicContact CB-CD1 4.1Å
316	G	94.1	Very high	92.4	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-69.7	-33.1	175.8	0	0	0	0	0	113.8	Y195 F273 L312 T313 A314 L320	Y195-G316 WeakPolarHBondContact OH-CA 3.39Å; F273-G316 WeakPolarHBondContact CD1-O 3.34Å; L312-G316 PolarHBondContact O-N 3.05Å; T313-G316 PolarHBondContact O-N 3.49Å; A314-G316 VanDerWaalsContact C-N 3.31Å; A314-G316 PolarHBondContact O-N 2.96Å; G316-L320 PolarHBondContact O-N 3.02Å
317	F	94.8	Very high	92	Very high	78 Å²	78	23 Å²	23	34%	0.342	13%	0.125	S	C	.	.	H	α-helix	trans	-65.9	-52.1	173.5	-175.6	-89.2	0	0	0	111.5	F273 T313 A314 H319 L320 V321 F368	F273-F317 HydrophobicContact CE2-CB 3.99Å; F273-F317 HydrophobicContact CE2-CD2 4.43Å; F273-F317 HydrophobicContact CZ-CB 4Å; F273-F317 AromaticContact CZ-CD2 3.94Å; F273-F317 HydrophobicContact CZ-CD2 3.94Å; F273-F317 HydrophobicContact CZ-CG 4.47Å; T313-F317 PolarHBondContact O-N 3.06Å; A314-F317 PolarHBondContact O-N 3.43Å; F317-H319 VanDerWaalsContact C-N 3.3Å; F317-H319 PolarHBondContact O-N 3.39Å; F317-L320 PolarHBondContact O-N 3.4Å; F317-V321 HydrophobicContact CD1-CG2 4.12Å; F317-V321 HydrophobicContact CE1-CG2 3.71Å; F317-V321 HydrophobicContact CZ-CG2 3.98Å; F317-V321 WeakPolarHBondContact O-CG2 3.32Å; F317-V321 PolarHBondContact O-N 3.42Å; F317-F368 HydrophobicContact CB-CE2 4.46Å; F317-F368 HydrophobicContact CB-CZ 4.32Å; F317-F368 HydrophobicContact CD1-CB 4.31Å; F317-F368 AromaticContact CD1-CD1 3.98Å; F317-F368 HydrophobicContact CD1-CD1 3.98Å; F317-F368 AromaticContact CD1-CD2 3.34Å; F317-F368 HydrophobicContact CD1-CD2 3.34Å; F317-F368 HydrophobicContact CD1-CE1 4.11Å; F317-F368 AromaticContact CD1-CE2 3.49Å; F317-F368 HydrophobicContact CD1-CE2 3.49Å; F317-F368 VanDerWaalsContact CD1-CE2 3.49Å; F317-F368 AromaticContact CD1-CG 3.59Å; F317-F368 HydrophobicContact CD1-CG 3.59Å; F317-F368 AromaticContact CD1-CZ 3.88Å; F317-F368 HydrophobicContact CD1-CZ 3.88Å; F317-F368 HydrophobicContact CE1-CB 3.91Å; F317-F368 HydrophobicContact CE1-CD1 4.44Å; F317-F368 AromaticContact CE1-CD2 3.38Å; F317-F368 HydrophobicContact CE1-CD2 3.38Å; F317-F368 AromaticContact CE1-CE2 3.98Å; F317-F368 HydrophobicContact CE1-CE2 3.98Å; F317-F368 AromaticContact CE1-CG 3.65Å; F317-F368 HydrophobicContact CE1-CG 3.65Å; F317-F368 HydrophobicContact CG-CD2 4.33Å; F317-F368 HydrophobicContact CG-CE2 4.1Å; F317-F368 HydrophobicContact CG-CZ 4.39Å; F317-F368 HydrophobicContact CZ-CD2 4.39Å
318	I	94.4	Very high	91.6	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-65.1	-35.1	178.4	-169.1	62.7	0	0	0	111.7	A314 A315 L320 V321 E322 C342 L346 A360 F368 M369	A314-I318 PolarHBondContact O-N 3.46Å; A315-I318 VanDerWaalsContact O-CG2 3.32Å; A315-I318 WeakPolarHBondContact O-CG2 3.21Å; I318-L320 PolarHBondContact O-N 2.96Å; I318-V321 PolarHBondContact O-N 2.9Å; I318-E322 HydrophobicContact CD1-CG 3.88Å; I318-E322 HydrophobicContact CG1-CG 4.04Å; I318-E322 PolarHBondContact O-N 3.14Å; I318-C342 HydrophobicContact CG2-CB 3.85Å; I318-L346 HydrophobicContact CG2-CD1 4.28Å; I318-L346 HydrophobicContact CG2-CD2 4.29Å; I318-L346 HydrophobicContact CG2-CG 4.3Å; I318-A360 HydrophobicContact CD1-CB 4.24Å; I318-F368 HydrophobicContact CB-CD1 4.14Å; I318-F368 HydrophobicContact CB-CE1 4.18Å; I318-F368 HydrophobicContact CD1-CD1 4.24Å; I318-M369 HydrophobicContact CD1-CG 4.49Å
319	H	94.3	Very high	91	Very high	4 Å²	4	31.5 Å²	31.5	2%	0.019	16%	0.156	C	C	.	.	H	α-helix	trans	-60.6	-41.5	172.3	-179.9	-102	0	0	0	112.7	A315 F317 N323 L337 T338 Y339 C342	A315-H319 WeakPolarHBondContact O-CB 3.33Å; A315-H319 PolarHBondContact O-N 2.78Å; F317-H319 VanDerWaalsContact C-N 3.3Å; F317-H319 PolarHBondContact O-N 3.39Å; H319-N323 PolarHBondContact CD2-ND2 2.94Å; H319-N323 PolarHBondContact NE2-ND2 2.89Å; H319-N323 WeakPolarHBondContact O-CB 3.29Å; H319-N323 PolarHBondContact O-N 3.3Å; H319-N323 PolarHBondContact O-ND2 3.49Å; H319-L337 PolarHBondContact CD2-O 3.25Å; H319-L337 PolarHBondContact NE2-O 3.22Å; H319-T338 VanDerWaalsContact CD2-C 3.42Å; H319-Y339 HydrophobicContact CB-CD2 4.26Å; H319-Y339 WeakPolarHBondContact CD2-CA 3.26Å; H319-Y339 PolarHBondContact CD2-N 2.72Å; H319-Y339 PolarHBondContact NE2-N 3.44Å; H319-Y339 VanDerWaalsContact NE2-N 3.16Å; H319-C342 HydrophobicContact CB-CB 4.15Å
320	L	91.6	Very high	90.4	Very high	23 Å²	23	37.7 Å²	37.7	12%	0.12	19%	0.189	C	C	.	.	H	α-helix	trans	-65.7	-43.9	174.7	179.3	66.1	0	0	0	111.2	L271 F273 G316 F317 I318 S324	L271-L320 HydrophobicContact CD2-CD2 4.14Å; F273-L320 HydrophobicContact CE1-CB 4.28Å; F273-L320 HydrophobicContact CE1-CD2 3.98Å; G316-L320 PolarHBondContact O-N 3.02Å; F317-L320 PolarHBondContact O-N 3.4Å; I318-L320 PolarHBondContact O-N 2.96Å; L320-S324 WeakPolarHBondContact O-CB 3.37Å; L320-S324 PolarHBondContact O-N 2.91Å; L320-S324 VanDerWaalsContact O-N 3.08Å; L320-S324 PolarHBondContact O-OG 3.42Å
321	V	92.2	Very high	89.9	Confident	18 Å²	18	38.9 Å²	38.9	11%	0.109	19%	0.191	C	C	.	.	H	α-helix	trans	-68	-52	-175.5	172.3	0	0	0	0	112	F317 I318 N323 S324 G325 T362 L364	F317-V321 HydrophobicContact CD1-CG2 4.12Å; F317-V321 HydrophobicContact CE1-CG2 3.71Å; F317-V321 HydrophobicContact CZ-CG2 3.98Å; F317-V321 WeakPolarHBondContact O-CG2 3.32Å; F317-V321 PolarHBondContact O-N 3.42Å; I318-V321 PolarHBondContact O-N 2.9Å; V321-N323 PolarHBondContact O-N 2.95Å; V321-S324 PolarHBondContact O-N 2.85Å; V321-G325 PolarHBondContact O-N 3.34Å; V321-T362 WeakPolarHBondContact CG1-OG1 3.28Å; V321-L364 HydrophobicContact CG1-CB 3.61Å
322	E	91.9	Very high	89.2	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-64.9	-41	-177.7	-69	-67.2	128.4	0	0	112.2	I318 N334 Q335 L337 A360 K361 T362	I318-E322 HydrophobicContact CD1-CG 3.88Å; I318-E322 HydrophobicContact CG1-CG 4.04Å; I318-E322 PolarHBondContact O-N 3.14Å; E322-N334 WeakPolarHBondContact O-CA 3.41Å; E322-Q335 CarbonylContact C-O 3.47Å; E322-Q335 HydrophobicContact CB-CB 4.41Å; E322-Q335 PolarHBondContact O-N 3.13Å; E322-L337 HydrophobicContact CB-CD1 4.25Å; E322-L337 HydrophobicContact CG-CD1 4.24Å; E322-A360 WeakPolarHBondContact OE1-CB 3.41Å; E322-K361 PolarHBondContact OE2-N 3Å; E322-T362 WeakPolarHBondContact OE1-CB 3.36Å; E322-T362 PolarHBondContact OE1-N 3.27Å; E322-T362 VanDerWaalsContact OE1-N 3.15Å; E322-T362 PolarHBondContact OE1-OG1 3Å; E322-T362 PolarHBondContact OE2-N 3.34Å
323	N	89.3	Confident	88.8	Confident	30 Å²	30	45.7 Å²	45.7	16%	0.16	23%	0.226	C	C	.	.	H	α-helix	trans	-73.4	-25.9	177.8	-75.2	-60.3	0	0	0	113.7	I203 H319 V321 Q335 A336 L337	I203-N323 HydrophobicContact CD1-CB 3.82Å; I203-N323 HydrophobicContact CG1-CB 4.04Å; H319-N323 PolarHBondContact CD2-ND2 2.94Å; H319-N323 PolarHBondContact NE2-ND2 2.89Å; H319-N323 WeakPolarHBondContact O-CB 3.29Å; H319-N323 PolarHBondContact O-N 3.3Å; H319-N323 PolarHBondContact O-ND2 3.49Å; V321-N323 PolarHBondContact O-N 2.95Å; N323-Q335 PolarHBondContact OD1-O 3.39Å; N323-A336 WeakPolarHBondContact OD1-CA 3.34Å; N323-L337 PolarHBondContact ND2-O 3.37Å; N323-L337 PolarHBondContact OD1-N 3.01Å; N323-L337 VanDerWaalsContact OD1-N 3.16Å; N323-L337 PolarHBondContact OD1-O 3.41Å
324	S	86.4	Confident	88.4	Confident	34 Å²	34	49.5 Å²	49.5	24%	0.238	25%	0.246	C	C	.	.	H	α-helix	trans	-79.2	-39.7	176.6	-60.4	0	0	0	0	112.1	L320 V321 F331	L320-S324 WeakPolarHBondContact O-CB 3.37Å; L320-S324 PolarHBondContact O-N 2.91Å; L320-S324 VanDerWaalsContact O-N 3.08Å; L320-S324 PolarHBondContact O-OG 3.42Å; V321-S324 PolarHBondContact O-N 2.85Å; S324-F331 WeakPolarHBondContact O-CB 3.47Å; S324-F331 VanDerWaalsContact O-CD1 3.25Å; S324-F331 WeakPolarHBondContact O-CD1 3.47Å
325	G	86.2	Confident	88.1	Confident	4 Å²	4	50.3 Å²	50.3	4%	0.041	25%	0.248	C	C	.	.			trans	84.9	167.9	-170.8	0	0	0	0	0	113.5	V321 F331	V321-G325 PolarHBondContact O-N 3.34Å; G325-F331 WeakPolarHBondContact O-CD1 3.25Å
326	D	86.9	Confident	87.7	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.284	C	S	.	.			trans	-76.9	133	178.6	-69.5	-44.2	0	0	0	110.9	W328 E329 F331 N333 T363 L364	D326-W328 HydrophobicContact CB-CE3 3.94Å; D326-W328 HydrophobicContact CB-CZ3 4.07Å; D326-W328 PolarHBondContact O-N 3.33Å; D326-E329 PolarHBondContact O-N 2.94Å; D326-F331 PolarHBondContact O-N 3.41Å; D326-F331 VanDerWaalsContact O-N 3.15Å; D326-N333 PolarHBondContact N-OD1 3.07Å; D326-N333 PolarHBondContact OD2-ND2 3.2Å; D326-T363 PolarHBondContact OD1-N 3.22Å; D326-T363 VanDerWaalsContact OD2-CB 3.28Å; D326-T363 WeakPolarHBondContact OD2-CB 3.49Å; D326-T363 PolarHBondContact OD2-N 3.27Å; D326-T363 PolarHBondContact OD2-OG1 3.21Å; D326-L364 WeakPolarHBondContact OD1-CB 3.48Å; D326-L364 VanDerWaalsContact OD1-CG 3.31Å; D326-L364 WeakPolarHBondContact OD1-CG 3.07Å; D326-L364 PolarHBondContact OD1-N 2.86Å
327	P	83.6	Confident	87.5	Confident	62 Å²	62	55.3 Å²	55.3	40%	0.403	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-61	-28.2	-179.3	-25.5	34	0	0	0	114.9	N330 F331	P327-N330 PolarHBondContact O-N 2.71Å; P327-F331 HydrophobicContact CB-CE1 4.09Å; P327-F331 HydrophobicContact CB-CZ 3.91Å; P327-F331 HydrophobicContact CG-CE1 3.87Å; P327-F331 HydrophobicContact CG-CZ 4.08Å
328	W	84.2	Confident	87.5	Confident	157 Å²	157	55 Å²	55	60%	0.595	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-81.2	-18.8	-175.5	-21.7	-67.2	0	0	0	112.8	D326 N330 T363 L364	D326-W328 HydrophobicContact CB-CE3 3.94Å; D326-W328 HydrophobicContact CB-CZ3 4.07Å; D326-W328 PolarHBondContact O-N 3.33Å; W328-N330 VanDerWaalsContact C-N 3.3Å; W328-T363 HydrophobicContact CH2-CG2 4.2Å; W328-T363 HydrophobicContact CZ3-CG2 3.88Å; W328-L364 HydrophobicContact CH2-CD2 3.93Å; W328-L364 HydrophobicContact CH2-CG 3.84Å; W328-L364 HydrophobicContact CZ2-CD1 4.45Å; W328-L364 HydrophobicContact CZ2-CD2 3.94Å; W328-L364 HydrophobicContact CZ2-CG 4.08Å
329	E	80.6	Confident	87.5	Confident	113 Å²	113	55.1 Å²	55.1	53%	0.528	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-95.9	23.2	173.4	-65.6	-64.3	165.8	0	0	111.5	D326 F331 Q332	D326-E329 PolarHBondContact O-N 2.94Å; E329-F331 PolarHBondContact O-N 3.03Å; E329-Q332 WeakPolarHBondContact O-CB 3.46Å; E329-Q332 PolarHBondContact O-N 3.33Å
330	N	81.5	Confident	87.5	Confident	130 Å²	130	61.4 Å²	61.4	70%	0.695	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	32.2	-173.9	-62.3	-60.6	0	0	0	113.7	P327 W328 Q332	P327-N330 PolarHBondContact O-N 2.71Å; W328-N330 VanDerWaalsContact C-N 3.3Å; N330-Q332 PolarHBondContact O-N 3.45Å
331	F	81.2	Confident	87.7	Confident	68 Å²	68	64 Å²	64	30%	0.298	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.9	21.2	-176.6	-52.4	-79.4	0	0	0	115.1	S324 G325 D326 P327 E329	S324-F331 WeakPolarHBondContact O-CB 3.47Å; S324-F331 VanDerWaalsContact O-CD1 3.25Å; S324-F331 WeakPolarHBondContact O-CD1 3.47Å; G325-F331 WeakPolarHBondContact O-CD1 3.25Å; D326-F331 PolarHBondContact O-N 3.41Å; D326-F331 VanDerWaalsContact O-N 3.15Å; P327-F331 HydrophobicContact CB-CE1 4.09Å; P327-F331 HydrophobicContact CB-CZ 3.91Å; P327-F331 HydrophobicContact CG-CE1 3.87Å; P327-F331 HydrophobicContact CG-CZ 4.08Å; E329-F331 PolarHBondContact O-N 3.03Å
332	Q	79.7	Confident	87.8	Confident	163 Å²	163	63.1 Å²	63.1	76%	0.762	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-21.8	179.8	-66.2	-164.1	-0.9	0	0	114.3	E329 N330 N334	E329-Q332 WeakPolarHBondContact O-CB 3.46Å; E329-Q332 PolarHBondContact O-N 3.33Å; N330-Q332 PolarHBondContact O-N 3.45Å; Q332-N334 PolarHBondContact O-N 3.05Å
333	N	87.2	Confident	88	Confident	50 Å²	50	63.7 Å²	63.7	27%	0.267	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	31	-177.7	70.9	-18.6	0	0	0	113.3	D326	D326-N333 PolarHBondContact N-OD1 3.07Å; D326-N333 PolarHBondContact OD2-ND2 3.2Å
334	N	86.1	Confident	88.3	Confident	97 Å²	97	66.5 Å²	66.5	52%	0.519	34%	0.335	S	S	.	.			trans	-70.5	145.4	-180	68.1	-20.1	0	0	0	112	E322 Q332	E322-N334 WeakPolarHBondContact O-CA 3.41Å; Q332-N334 PolarHBondContact O-N 3.05Å
335	Q	87.6	Confident	88.7	Confident	25 Å²	25	65.3 Å²	65.3	12%	0.117	33%	0.326	C	S	.	.			trans	-119.5	112.6	174.1	-172.7	176.8	-48.8	0	0	108.2	E322 N323 L337 Y359 K361	E322-Q335 CarbonylContact C-O 3.47Å; E322-Q335 HydrophobicContact CB-CB 4.41Å; E322-Q335 PolarHBondContact O-N 3.13Å; N323-Q335 PolarHBondContact OD1-O 3.39Å; Q335-L337 VanDerWaalsContact C-N 3.29Å; Q335-L337 HydrophobicContact CG-CD2 4.32Å; Q335-L337 HydrophobicContact CG-CG 3.99Å; Q335-L337 PolarHBondContact O-N 3.16Å; Q335-Y359 PolarHBondContact NE2-O 3.1Å; Q335-Y359 VanDerWaalsContact NE2-O 3.13Å; Q335-Y359 PolarHBondContact OE1-O 3.17Å; Q335-K361 VanDerWaalsContact OE1-CB 3.3Å
336	A	87.2	Confident	89.1	Confident	92 Å²	92	65.1 Å²	65.1	76%	0.76	32%	0.324	S	S	*	.			trans	-67.7	85	175.8	0	0	0	0	0	110.4	N323	N323-A336 WeakPolarHBondContact OD1-CA 3.34Å
337	L	91.1	Very high	89.5	Confident	13 Å²	13	67.8 Å²	67.8	7%	0.068	34%	0.338	C	S	.	.			trans	-103.7	135	172.6	-72.2	-177.7	0	0	0	109.5	H319 E322 N323 Q335 E341 V358	H319-L337 PolarHBondContact CD2-O 3.25Å; H319-L337 PolarHBondContact NE2-O 3.22Å; E322-L337 HydrophobicContact CB-CD1 4.25Å; E322-L337 HydrophobicContact CG-CD1 4.24Å; N323-L337 PolarHBondContact ND2-O 3.37Å; N323-L337 PolarHBondContact OD1-N 3.01Å; N323-L337 VanDerWaalsContact OD1-N 3.16Å; N323-L337 PolarHBondContact OD1-O 3.41Å; Q335-L337 VanDerWaalsContact C-N 3.29Å; Q335-L337 HydrophobicContact CG-CD2 4.32Å; Q335-L337 HydrophobicContact CG-CG 3.99Å; Q335-L337 PolarHBondContact O-N 3.16Å; L337-E341 HydrophobicContact CD2-CB 4.3Å; L337-V358 HydrophobicContact CD1-CG1 4.25Å; L337-V358 HydrophobicContact CD2-CG1 3.97Å
338	T	94.1	Very high	90	Very high	72 Å²	72	65.5 Å²	65.5	44%	0.442	32%	0.322	S	S	.	.			trans	-72.1	155.1	166.9	65.5	0	0	0	0	110.9	H319 W340 E341 C342	H319-T338 VanDerWaalsContact CD2-C 3.42Å; T338-W340 PolarHBondContact O-N 2.86Å; T338-E341 WeakPolarHBondContact CB-OE2 3.44Å; T338-E341 WeakPolarHBondContact CG2-OE2 3.48Å; T338-E341 PolarHBondContact N-OE2 3.32Å; T338-E341 PolarHBondContact O-N 3.01Å; T338-E341 VanDerWaalsContact O-N 3.14Å; T338-E341 VanDerWaalsContact OG1-CD 3.32Å; T338-E341 WeakPolarHBondContact OG1-CG 3.35Å; T338-E341 PolarHBondContact OG1-N 2.78Å; T338-E341 PolarHBondContact OG1-OE2 3.13Å; T338-C342 PolarHBondContact O-N 2.8Å; T338-C342 VanDerWaalsContact O-N 3.16Å
339	Y	94.5	Very high	90.4	Very high	2 Å²	2	59.2 Å²	59.2	1%	0.008	30%	0.301	C	S	.	.	H	α-helix	trans	-54.7	-37.9	176.5	178.7	-103.3	0	0	0	112.4	Y195 F196 S199 L312 A315 H319 C342 V343	Y195-Y339 HydrophobicContact CE1-CD2 4.03Å; Y195-Y339 AromaticContact CE1-CE2 3.67Å; Y195-Y339 HydrophobicContact CE1-CE2 3.67Å; Y195-Y339 AromaticContact CE1-CZ 3.97Å; Y195-Y339 AromaticContact CZ-CE2 3.97Å; Y195-Y339 VanDerWaalsContact OH-CD2 3.25Å; Y195-Y339 WeakPolarHBondContact OH-CD2 3.42Å; Y195-Y339 WeakPolarHBondContact OH-CE2 3.39Å; F196-Y339 HydrophobicContact CD1-CD1 4Å; F196-Y339 AromaticContact CD1-CE1 3.63Å; F196-Y339 HydrophobicContact CD1-CE1 3.63Å; F196-Y339 HydrophobicContact CE1-CD1 4.22Å; F196-Y339 AromaticContact CE1-CE1 3.37Å; F196-Y339 HydrophobicContact CE1-CE1 3.37Å; F196-Y339 AromaticContact CE1-CZ 3.75Å; F196-Y339 HydrophobicContact CZ-CE1 4.35Å; S199-Y339 WeakPolarHBondContact OG-CB 3.15Å; L312-Y339 WeakPolarHBondContact CA-OH 3.26Å; L312-Y339 WeakPolarHBondContact CB-OH 3.29Å; L312-Y339 HydrophobicContact CD2-CE1 4.45Å; L312-Y339 WeakPolarHBondContact CD2-OH 3.38Å; L312-Y339 PolarHBondContact O-OH 2.97Å; A315-Y339 HydrophobicContact CB-CE2 4.1Å; H319-Y339 HydrophobicContact CB-CD2 4.26Å; H319-Y339 WeakPolarHBondContact CD2-CA 3.26Å; H319-Y339 PolarHBondContact CD2-N 2.72Å; H319-Y339 PolarHBondContact NE2-N 3.44Å; H319-Y339 VanDerWaalsContact NE2-N 3.16Å; Y339-C342 WeakPolarHBondContact O-CB 3.08Å; Y339-C342 PolarHBondContact O-N 2.81Å; Y339-V343 HydrophobicContact CD1-CG2 3.94Å; Y339-V343 HydrophobicContact CE1-CG2 3.49Å; Y339-V343 VanDerWaalsContact CE1-CG2 3.49Å; Y339-V343 HydrophobicContact CE2-CG2 4.31Å; Y339-V343 WeakPolarHBondContact O-CG2 3.34Å; Y339-V343 PolarHBondContact O-N 2.95Å
340	W	95.1	Very high	90.9	Very high	136 Å²	136	54 Å²	54	52%	0.515	28%	0.277	S	S	.	.	H	α-helix	trans	-71.7	-32.4	-179	-57	115.7	0	0	0	113.3	F196 T338 C342 V343 Y344	F196-W340 HydrophobicContact CB-CZ2 4.12Å; F196-W340 HydrophobicContact CD1-CH2 4.17Å; F196-W340 HydrophobicContact CD1-CZ2 4.33Å; F196-W340 HydrophobicContact CD2-CH2 4.04Å; F196-W340 HydrophobicContact CD2-CZ2 4.28Å; F196-W340 HydrophobicContact CE1-CH2 4.3Å; F196-W340 HydrophobicContact CE2-CH2 4.15Å; F196-W340 HydrophobicContact CG-CH2 4.06Å; F196-W340 HydrophobicContact CG-CZ2 4.01Å; F196-W340 HydrophobicContact CZ-CH2 4.28Å; T338-W340 PolarHBondContact O-N 2.86Å; W340-C342 VanDerWaalsContact C-N 3.34Å; W340-V343 HydrophobicContact CE3-CB 4.4Å; W340-V343 HydrophobicContact CE3-CG1 4.48Å; W340-V343 HydrophobicContact CE3-CG2 4.19Å; W340-V343 HydrophobicContact CZ3-CG2 4.48Å; W340-V343 PolarHBondContact O-N 3.24Å; W340-Y344 WeakPolarHBondContact O-CB 3.39Å; W340-Y344 PolarHBondContact O-N 3.2Å
341	E	94.9	Very high	91.3	Very high	77 Å²	77	49.4 Å²	49.4	36%	0.36	26%	0.255	S	S	.	.	H	α-helix	trans	-66.7	-36.4	169.8	-72.2	162.3	127.8	0	0	111.5	L337 T338 Y344 L345	L337-E341 HydrophobicContact CD2-CB 4.3Å; T338-E341 WeakPolarHBondContact CB-OE2 3.44Å; T338-E341 WeakPolarHBondContact CG2-OE2 3.48Å; T338-E341 PolarHBondContact N-OE2 3.32Å; T338-E341 PolarHBondContact O-N 3.01Å; T338-E341 VanDerWaalsContact O-N 3.14Å; T338-E341 VanDerWaalsContact OG1-CD 3.32Å; T338-E341 WeakPolarHBondContact OG1-CG 3.35Å; T338-E341 PolarHBondContact OG1-N 2.78Å; T338-E341 PolarHBondContact OG1-OE2 3.13Å; E341-Y344 PolarHBondContact O-N 3.29Å; E341-L345 VanDerWaalsContact O-CB 3.3Å; E341-L345 WeakPolarHBondContact O-CB 3.2Å; E341-L345 PolarHBondContact O-N 3.1Å
342	C	95	Very high	91.9	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-66.4	-40.8	171.9	-65.8	0	0	0	0	112.4	I318 H319 T338 Y339 W340 L345 L346	I318-C342 HydrophobicContact CG2-CB 3.85Å; H319-C342 HydrophobicContact CB-CB 4.15Å; T338-C342 PolarHBondContact O-N 2.8Å; T338-C342 VanDerWaalsContact O-N 3.16Å; Y339-C342 WeakPolarHBondContact O-CB 3.08Å; Y339-C342 PolarHBondContact O-N 2.81Å; W340-C342 VanDerWaalsContact C-N 3.34Å; C342-L345 PolarHBondContact O-N 3.48Å; C342-L346 WeakPolarHBondContact O-CG 3.01Å; C342-L346 PolarHBondContact O-N 2.93Å
343	V	95.9	Very high	92.5	Very high	13 Å²	13	47 Å²	47	8%	0.079	26%	0.257	C	S	.	.	H	α-helix	trans	-60.1	-45	173.9	168.1	0	0	0	0	110.9	W311 L312 A315 Y339 W340 M347	W311-V343 HydrophobicContact CH2-CG1 3.84Å; W311-V343 HydrophobicContact CZ2-CG1 3.23Å; W311-V343 PolarHBondContact NE1-O 3.43Å; L312-V343 HydrophobicContact CD2-CG2 4.25Å; A315-V343 HydrophobicContact CB-CB 4.31Å; A315-V343 HydrophobicContact CB-CG2 3.53Å; Y339-V343 HydrophobicContact CD1-CG2 3.94Å; Y339-V343 HydrophobicContact CE1-CG2 3.49Å; Y339-V343 VanDerWaalsContact CE1-CG2 3.49Å; Y339-V343 HydrophobicContact CE2-CG2 4.31Å; Y339-V343 WeakPolarHBondContact O-CG2 3.34Å; Y339-V343 PolarHBondContact O-N 2.95Å; W340-V343 HydrophobicContact CE3-CB 4.4Å; W340-V343 HydrophobicContact CE3-CG1 4.48Å; W340-V343 HydrophobicContact CE3-CG2 4.19Å; W340-V343 HydrophobicContact CZ3-CG2 4.48Å; W340-V343 PolarHBondContact O-N 3.24Å; V343-M347 PolarHBondContact O-N 2.83Å; V343-M347 VanDerWaalsContact O-N 3.12Å
344	Y	96	Very high	92.7	Very high	88 Å²	88	47.2 Å²	47.2	35%	0.345	27%	0.271	S	S	.	.	H	α-helix	trans	-60.8	-52.1	174	168	-104.5	0	0	0	112.3	W340 E341 L346 M347 V348 Y355 D357 V358	W340-Y344 WeakPolarHBondContact O-CB 3.39Å; W340-Y344 PolarHBondContact O-N 3.2Å; E341-Y344 PolarHBondContact O-N 3.29Å; Y344-L346 VanDerWaalsContact C-N 3.29Å; Y344-L346 PolarHBondContact O-N 2.92Å; Y344-M347 PolarHBondContact O-N 3.41Å; Y344-M347 VanDerWaalsContact O-N 3.08Å; Y344-V348 HydrophobicContact CD2-CG2 3.91Å; Y344-V348 HydrophobicContact CE1-CG2 4.26Å; Y344-V348 HydrophobicContact CE2-CG2 3.53Å; Y344-V348 HydrophobicContact CG-CG2 4.43Å; Y344-V348 WeakPolarHBondContact O-CG2 3.49Å; Y344-V348 PolarHBondContact O-N 3.41Å; Y344-Y355 WeakPolarHBondContact OH-CD2 3.35Å; Y344-D357 VanDerWaalsContact CE1-OD2 3.3Å; Y344-D357 WeakPolarHBondContact CE1-OD2 3.49Å; Y344-D357 PolarHBondContact OH-OD2 3.49Å; Y344-V358 HydrophobicContact CD1-CG2 4.28Å; Y344-V358 HydrophobicContact CE1-CG2 4.24Å
345	L	95.1	Very high	93	Very high	10 Å²	10	50.2 Å²	50.2	5%	0.052	28%	0.276	C	S	.	.	H	α-helix	trans	-49.6	-48.6	176.8	169.1	62.6	0	0	0	111.7	E341 C342 T349 V358 M369	E341-L345 VanDerWaalsContact O-CB 3.3Å; E341-L345 WeakPolarHBondContact O-CB 3.2Å; E341-L345 PolarHBondContact O-N 3.1Å; C342-L345 PolarHBondContact O-N 3.48Å; L345-T349 VanDerWaalsContact O-CB 3.29Å; L345-T349 WeakPolarHBondContact O-CB 3.41Å; L345-T349 PolarHBondContact O-N 3.07Å; L345-T349 PolarHBondContact O-OG1 2.94Å; L345-V358 HydrophobicContact CB-CG1 4.18Å; L345-V358 WeakPolarHBondContact CD1-O 3.47Å; L345-V358 HydrophobicContact CD2-CG1 4.4Å; L345-M369 HydrophobicContact CD1-CE 4.06Å; L345-M369 HydrophobicContact CD2-CE 4.36Å; L345-M369 HydrophobicContact CG-CE 4.08Å
346	L	94.9	Very high	93.2	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-71.2	-33.9	-178.8	-64	-161.3	0	0	0	113.1	A314 A315 I318 C342 Y344 T349 M350 M369 F372	A314-L346 HydrophobicContact CB-CD1 3.46Å; A314-L346 VanDerWaalsContact CB-CD1 3.46Å; A315-L346 HydrophobicContact CB-CD1 4.1Å; I318-L346 HydrophobicContact CG2-CD1 4.28Å; I318-L346 HydrophobicContact CG2-CD2 4.29Å; I318-L346 HydrophobicContact CG2-CG 4.3Å; C342-L346 WeakPolarHBondContact O-CG 3.01Å; C342-L346 PolarHBondContact O-N 2.93Å; Y344-L346 VanDerWaalsContact C-N 3.29Å; Y344-L346 PolarHBondContact O-N 2.92Å; L346-T349 PolarHBondContact O-N 2.79Å; L346-M350 WeakPolarHBondContact O-CB 3.35Å; L346-M350 WeakPolarHBondContact O-CG 3.06Å; L346-M350 PolarHBondContact O-N 3.02Å; L346-M369 HydrophobicContact CD2-CE 3.93Å; L346-M369 HydrophobicContact CD2-SD 3.46Å; L346-M369 WeakPolarHBondContact CD2-SD 3.27Å; L346-F372 HydrophobicContact CB-CE1 3.79Å; L346-F372 HydrophobicContact CB-CZ 3.91Å; L346-F372 HydrophobicContact CD1-CE1 3.99Å; L346-F372 HydrophobicContact CD1-CE2 4.09Å; L346-F372 HydrophobicContact CD1-CZ 3.75Å; L346-F372 HydrophobicContact CD2-CD1 3.82Å; L346-F372 HydrophobicContact CD2-CE1 3.67Å; L346-F372 HydrophobicContact CD2-CZ 4.3Å; L346-F372 HydrophobicContact CG-CE1 4.01Å; L346-F372 HydrophobicContact CG-CZ 4.2Å
347	M	93.3	Very high	93.4	Very high	56 Å²	56	51.4 Å²	51.4	28%	0.276	28%	0.282	S	S	.	.	H	α-helix	trans	-65.1	-49.5	174.5	-178.3	57.4	68.1	0	0	111	F307 W311 V343 Y344 T349 M350 S351	F307-M347 HydrophobicContact CE1-CE 4.24Å; F307-M347 HydrophobicContact CZ-CE 4.25Å; W311-M347 HydrophobicContact CD2-CE 3.9Å; W311-M347 HydrophobicContact CE3-CE 3.99Å; W311-M347 HydrophobicContact CH2-CE 3.55Å; W311-M347 HydrophobicContact CZ2-CB 3.83Å; W311-M347 HydrophobicContact CZ2-CE 3.43Å; W311-M347 VanDerWaalsContact CZ2-CE 3.43Å; W311-M347 HydrophobicContact CZ2-CG 4.37Å; W311-M347 HydrophobicContact CZ3-CE 3.83Å; V343-M347 PolarHBondContact O-N 2.83Å; V343-M347 VanDerWaalsContact O-N 3.12Å; Y344-M347 PolarHBondContact O-N 3.41Å; Y344-M347 VanDerWaalsContact O-N 3.08Å; M347-T349 PolarHBondContact O-N 3.22Å; M347-M350 HydrophobicContact CE-CE 4.4Å; M347-M350 PolarHBondContact O-N 3.05Å; M347-S351 WeakPolarHBondContact O-CB 3.09Å; M347-S351 PolarHBondContact O-N 2.93Å; M347-S351 PolarHBondContact O-OG 3.46Å
348	V	94.1	Very high	93.5	Very high	13 Å²	13	52 Å²	52	8%	0.079	29%	0.286	C	S	.	.	H	α-helix	trans	-59.2	-32.5	176.3	170.1	0	0	0	0	112.2	Y344 S351 V353 G354 Y355	Y344-V348 HydrophobicContact CD2-CG2 3.91Å; Y344-V348 HydrophobicContact CE1-CG2 4.26Å; Y344-V348 HydrophobicContact CE2-CG2 3.53Å; Y344-V348 HydrophobicContact CG-CG2 4.43Å; Y344-V348 WeakPolarHBondContact O-CG2 3.49Å; Y344-V348 PolarHBondContact O-N 3.41Å; V348-S351 PolarHBondContact O-OG 3.28Å; V348-V353 HydrophobicContact CG1-CB 4.25Å; V348-V353 HydrophobicContact CG1-CG1 4.46Å; V348-V353 PolarHBondContact O-N 3.46Å; V348-G354 PolarHBondContact O-N 3.48Å; V348-Y355 HydrophobicContact CG1-CD2 3.75Å; V348-Y355 HydrophobicContact CG1-CE2 4.42Å; V348-Y355 HydrophobicContact CG1-CG 4.41Å; V348-Y355 HydrophobicContact CG2-CD2 4.02Å; V348-Y355 HydrophobicContact CG2-CE2 4.21Å
349	T	93.4	Very high	93.4	Very high	25 Å²	25	53.9 Å²	53.9	15%	0.153	29%	0.286	C	S	.	.	H	α-helix	trans	-77.2	-47.3	177.2	-57.9	0	0	0	0	112.3	L345 L346 M347 S351 T352 M369 I373	L345-T349 VanDerWaalsContact O-CB 3.29Å; L345-T349 WeakPolarHBondContact O-CB 3.41Å; L345-T349 PolarHBondContact O-N 3.07Å; L345-T349 PolarHBondContact O-OG1 2.94Å; L346-T349 PolarHBondContact O-N 2.79Å; M347-T349 PolarHBondContact O-N 3.22Å; T349-S351 VanDerWaalsContact C-N 3.3Å; T349-S351 PolarHBondContact O-N 3.02Å; T349-T352 PolarHBondContact O-N 3.29Å; T349-T352 VanDerWaalsContact O-N 3.1Å; T349-M369 HydrophobicContact CG2-CE 3.76Å; T349-M369 WeakPolarHBondContact OG1-CE 3.44Å; T349-I373 HydrophobicContact CG2-CD1 4.07Å; T349-I373 HydrophobicContact CG2-CG1 3.45Å; T349-I373 VanDerWaalsContact CG2-CG1 3.45Å
350	M	91.3	Very high	93.3	Very high	5 Å²	5	54.1 Å²	54.1	3%	0.025	29%	0.288	C	S	.	.	H	α-helix	trans	-62.7	-36.7	178.4	-75.4	-173	-64.9	0	0	112.5	F307 W311 L346 M347 T352 F372 F380	F307-M350 HydrophobicContact CZ-CE 4.45Å; W311-M350 HydrophobicContact CB-CE 4.05Å; W311-M350 HydrophobicContact CD2-CE 4.41Å; W311-M350 HydrophobicContact CG-CE 3.69Å; L346-M350 WeakPolarHBondContact O-CB 3.35Å; L346-M350 WeakPolarHBondContact O-CG 3.06Å; L346-M350 PolarHBondContact O-N 3.02Å; M347-M350 HydrophobicContact CE-CE 4.4Å; M347-M350 PolarHBondContact O-N 3.05Å; M350-T352 PolarHBondContact O-N 3.21Å; M350-F372 HydrophobicContact CE-CZ 4.25Å; M350-F372 HydrophobicContact CG-CE1 3.54Å; M350-F372 HydrophobicContact CG-CZ 3.52Å; M350-F372 HydrophobicContact SD-CE1 4.22Å; M350-F372 HydrophobicContact SD-CE2 4.38Å; M350-F372 HydrophobicContact SD-CZ 3.54Å; M350-F372 VanDerWaalsContact SD-CZ 3.54Å; M350-F380 HydrophobicContact CB-CB 4.49Å; M350-F380 HydrophobicContact CB-CD2 4.17Å
351	S	90.7	Very high	93.1	Very high	33 Å²	33	52.7 Å²	52.7	23%	0.231	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	7.7	176.7	70.4	0	0	0	0	113.9	M347 V348 T349 V353	M347-S351 WeakPolarHBondContact O-CB 3.09Å; M347-S351 PolarHBondContact O-N 2.93Å; M347-S351 PolarHBondContact O-OG 3.46Å; V348-S351 PolarHBondContact O-OG 3.28Å; T349-S351 VanDerWaalsContact C-N 3.3Å; T349-S351 PolarHBondContact O-N 3.02Å; S351-V353 PolarHBondContact O-N 3.09Å; S351-V353 VanDerWaalsContact O-N 3.11Å; S351-V353 WeakPolarHBondContact OG-CG2 3.43Å
352	T	92.1	Very high	93	Very high	105 Å²	105	49 Å²	49	64%	0.644	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	26.3	-178.3	67.1	0	0	0	0	115.9	T349 M350 L377	T349-T352 PolarHBondContact O-N 3.29Å; T349-T352 VanDerWaalsContact O-N 3.1Å; M350-T352 PolarHBondContact O-N 3.21Å; T352-L377 HydrophobicContact CG2-CD1 3.46Å; T352-L377 VanDerWaalsContact CG2-CD1 3.46Å
353	V	94.1	Very high	92.9	Very high	74 Å²	74	52.7 Å²	52.7	45%	0.448	29%	0.291	S	S	.	.			trans	-81.8	-46.1	179.7	174.1	0	0	0	0	111.4	V348 S351 Y355	V348-V353 HydrophobicContact CG1-CB 4.25Å; V348-V353 HydrophobicContact CG1-CG1 4.46Å; V348-V353 PolarHBondContact O-N 3.46Å; S351-V353 PolarHBondContact O-N 3.09Å; S351-V353 VanDerWaalsContact O-N 3.11Å; S351-V353 WeakPolarHBondContact OG-CG2 3.43Å; V353-Y355 HydrophobicContact CG1-CD1 4.01Å; V353-Y355 HydrophobicContact CG1-CD2 3.97Å; V353-Y355 HydrophobicContact CG1-CE1 3.64Å; V353-Y355 HydrophobicContact CG1-CE2 3.58Å; V353-Y355 HydrophobicContact CG1-CG 4.16Å; V353-Y355 VanDerWaalsContact CG1-CZ 3.41Å; V353-Y355 PolarHBondContact O-N 3.33Å
354	G	90.9	Very high	92.6	Very high	55 Å²	55	55.1 Å²	55.1	57%	0.567	30%	0.303	S	S	*	.			trans	57.7	49.1	167.2	0	0	0	0	0	116.9	V348 G356	V348-G354 PolarHBondContact O-N 3.48Å; G354-G356 VanDerWaalsContact C-N 3.25Å; G354-G356 PolarHBondContact O-N 3.5Å; G354-G356 VanDerWaalsContact O-N 3.16Å
355	Y	92.1	Very high	92.5	Very high	161 Å²	161	50.9 Å²	50.9	63%	0.631	29%	0.287	S	S	*	.			trans	-54.2	-33.5	-177.8	-66.8	-61.4	0	0	0	115.3	Y344 V348 V353 D357	Y344-Y355 WeakPolarHBondContact OH-CD2 3.35Å; V348-Y355 HydrophobicContact CG1-CD2 3.75Å; V348-Y355 HydrophobicContact CG1-CE2 4.42Å; V348-Y355 HydrophobicContact CG1-CG 4.41Å; V348-Y355 HydrophobicContact CG2-CD2 4.02Å; V348-Y355 HydrophobicContact CG2-CE2 4.21Å; V353-Y355 HydrophobicContact CG1-CD1 4.01Å; V353-Y355 HydrophobicContact CG1-CD2 3.97Å; V353-Y355 HydrophobicContact CG1-CE1 3.64Å; V353-Y355 HydrophobicContact CG1-CE2 3.58Å; V353-Y355 HydrophobicContact CG1-CG 4.16Å; V353-Y355 VanDerWaalsContact CG1-CZ 3.41Å; V353-Y355 PolarHBondContact O-N 3.33Å; Y355-D357 VanDerWaalsContact C-N 3.29Å; Y355-D357 PolarHBondContact O-N 3.03Å
356	G	90.6	Very high	92.4	Very high	48 Å²	48	57.1 Å²	57.1	50%	0.495	31%	0.309	S	S	.	.	S	Bend	trans	78.3	9	-179.8	0	0	0	0	0	115.1	G354 Y359	G354-G356 VanDerWaalsContact C-N 3.25Å; G354-G356 PolarHBondContact O-N 3.5Å; G354-G356 VanDerWaalsContact O-N 3.16Å; G356-Y359 WeakPolarHBondContact O-CD1 3.47Å
357	D	92.3	Very high	92.4	Very high	93 Å²	93	61.7 Å²	61.7	50%	0.497	33%	0.334	S	S	.	.	S	Bend	trans	-67.9	-44.8	171.4	54.6	-14.2	0	0	0	112.1	Y344 Y355	Y344-D357 VanDerWaalsContact CE1-OD2 3.3Å; Y344-D357 WeakPolarHBondContact CE1-OD2 3.49Å; Y344-D357 PolarHBondContact OH-OD2 3.49Å; Y355-D357 VanDerWaalsContact C-N 3.29Å; Y355-D357 PolarHBondContact O-N 3.03Å
358	V	92.4	Very high	92.5	Very high	26 Å²	26	61.1 Å²	61.1	16%	0.158	33%	0.33	C	S	.	.	S	Bend	trans	-114.8	135.5	169.1	-175.9	0	0	0	0	108.2	L337 Y344 L345	L337-V358 HydrophobicContact CD1-CG1 4.25Å; L337-V358 HydrophobicContact CD2-CG1 3.97Å; Y344-V358 HydrophobicContact CD1-CG2 4.28Å; Y344-V358 HydrophobicContact CE1-CG2 4.24Å; L345-V358 HydrophobicContact CB-CG1 4.18Å; L345-V358 WeakPolarHBondContact CD1-O 3.47Å; L345-V358 HydrophobicContact CD2-CG1 4.4Å
359	Y	92.8	Very high	92.5	Very high	111 Å²	111	61.5 Å²	61.5	44%	0.435	33%	0.331	S	S	.	.			trans	-156.2	159.7	176.2	60.7	-86.9	0	0	0	111.4	Q335 G356 K361	Q335-Y359 PolarHBondContact NE2-O 3.1Å; Q335-Y359 VanDerWaalsContact NE2-O 3.13Å; Q335-Y359 PolarHBondContact OE1-O 3.17Å; G356-Y359 WeakPolarHBondContact O-CD1 3.47Å; Y359-K361 HydrophobicContact CD2-CG 4.2Å; Y359-K361 HydrophobicContact CE2-CD 4.46Å; Y359-K361 HydrophobicContact CE2-CG 3.72Å
360	A	93.4	Very high	92.5	Very high	8 Å²	8	64.4 Å²	64.4	7%	0.066	35%	0.348	C	S	.	.			trans	-75	122.5	176.9	0	0	0	0	0	111.6	I318 E322 R366 M369	I318-A360 HydrophobicContact CD1-CB 4.24Å; E322-A360 WeakPolarHBondContact OE1-CB 3.41Å; A360-R366 HydrophobicContact CB-CG 4.31Å; A360-R366 WeakPolarHBondContact O-CG 3.47Å; A360-R366 PolarHBondContact O-NE 3.48Å; A360-R366 VanDerWaalsContact O-NE 3.12Å; A360-M369 HydrophobicContact CB-CG 4.03Å
361	K	90.7	Very high	92.6	Very high	106 Å²	106	70.7 Å²	70.7	46%	0.461	38%	0.376	S	S	.	.			trans	-94.3	-32.3	175	-76.1	176.6	-154.9	166.2	0	112.3	E322 Q335 Y359	E322-K361 PolarHBondContact OE2-N 3Å; Q335-K361 VanDerWaalsContact OE1-CB 3.3Å; Y359-K361 HydrophobicContact CD2-CG 4.2Å; Y359-K361 HydrophobicContact CE2-CD 4.46Å; Y359-K361 HydrophobicContact CE2-CG 3.72Å
362	T	92.9	Very high	92.8	Very high	0 Å²	0	70 Å²	70	0%	0	37%	0.368	C	S	.	.	S	Bend	trans	-67.6	153.1	180	71.6	0	0	0	0	111.6	V321 E322 G365 R366	V321-T362 WeakPolarHBondContact CG1-OG1 3.28Å; E322-T362 WeakPolarHBondContact OE1-CB 3.36Å; E322-T362 PolarHBondContact OE1-N 3.27Å; E322-T362 VanDerWaalsContact OE1-N 3.15Å; E322-T362 PolarHBondContact OE1-OG1 3Å; E322-T362 PolarHBondContact OE2-N 3.34Å; T362-G365 PolarHBondContact O-N 3.35Å; T362-G365 WeakPolarHBondContact OG1-CA 3.3Å; T362-G365 PolarHBondContact OG1-N 3.04Å; T362-R366 VanDerWaalsContact O-CG 3.3Å; T362-R366 WeakPolarHBondContact O-CG 3.39Å; T362-R366 PolarHBondContact O-N 3.16Å
363	T	91.6	Very high	92.9	Very high	77 Å²	77	68.9 Å²	68.9	47%	0.472	36%	0.358	S	S	.	.	H	α-helix	trans	-69.9	-43.1	179.1	-44	0	0	0	0	110.5	D326 W328 G365 R366 L367	D326-T363 PolarHBondContact OD1-N 3.22Å; D326-T363 VanDerWaalsContact OD2-CB 3.28Å; D326-T363 WeakPolarHBondContact OD2-CB 3.49Å; D326-T363 PolarHBondContact OD2-N 3.27Å; D326-T363 PolarHBondContact OD2-OG1 3.21Å; W328-T363 HydrophobicContact CH2-CG2 4.2Å; W328-T363 HydrophobicContact CZ3-CG2 3.88Å; T363-G365 VanDerWaalsContact C-N 3.33Å; T363-R366 PolarHBondContact O-N 3.03Å; T363-L367 WeakPolarHBondContact O-CB 3.42Å; T363-L367 PolarHBondContact O-N 3.27Å
364	L	90.7	Very high	92.8	Very high	63 Å²	63	71.2 Å²	71.2	33%	0.33	37%	0.367	S	S	.	.	H	α-helix	trans	-62.6	-39.7	173.8	-71.4	173.5	0	0	0	111.7	V321 D326 W328 L367 F368	V321-L364 HydrophobicContact CG1-CB 3.61Å; D326-L364 WeakPolarHBondContact OD1-CB 3.48Å; D326-L364 VanDerWaalsContact OD1-CG 3.31Å; D326-L364 WeakPolarHBondContact OD1-CG 3.07Å; D326-L364 PolarHBondContact OD1-N 2.86Å; W328-L364 HydrophobicContact CH2-CD2 3.93Å; W328-L364 HydrophobicContact CH2-CG 3.84Å; W328-L364 HydrophobicContact CZ2-CD1 4.45Å; W328-L364 HydrophobicContact CZ2-CD2 3.94Å; W328-L364 HydrophobicContact CZ2-CG 4.08Å; L364-L367 PolarHBondContact O-N 2.99Å; L364-F368 PolarHBondContact O-N 3Å
365	G	93.2	Very high	92.8	Very high	0 Å²	0	70.4 Å²	70.4	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-65.3	-45.5	176.7	0	0	0	0	0	112.2	T362 T363 L367 F368 M369	T362-G365 PolarHBondContact O-N 3.35Å; T362-G365 WeakPolarHBondContact OG1-CA 3.3Å; T362-G365 PolarHBondContact OG1-N 3.04Å; T363-G365 VanDerWaalsContact C-N 3.33Å; G365-L367 PolarHBondContact O-N 3.24Å; G365-F368 WeakPolarHBondContact O-CB 3.47Å; G365-F368 PolarHBondContact O-N 3.06Å; G365-M369 VanDerWaalsContact O-CG 3.27Å; G365-M369 WeakPolarHBondContact O-CG 3.35Å; G365-M369 PolarHBondContact O-N 2.97Å
366	R	93.5	Very high	92.6	Very high	140 Å²	140	62.8 Å²	62.8	53%	0.528	33%	0.329	S	S	.	.	H	α-helix	trans	-60.7	-42.3	173.7	-73	172.9	-177.9	-177.4	3.2	112.8	A360 T362 T363 F368 M369 V370	A360-R366 HydrophobicContact CB-CG 4.31Å; A360-R366 WeakPolarHBondContact O-CG 3.47Å; A360-R366 PolarHBondContact O-NE 3.48Å; A360-R366 VanDerWaalsContact O-NE 3.12Å; T362-R366 VanDerWaalsContact O-CG 3.3Å; T362-R366 WeakPolarHBondContact O-CG 3.39Å; T362-R366 PolarHBondContact O-N 3.16Å; T363-R366 PolarHBondContact O-N 3.03Å; R366-F368 VanDerWaalsContact C-N 3.35Å; R366-M369 PolarHBondContact O-N 3.36Å; R366-V370 PolarHBondContact O-N 2.74Å; R366-V370 VanDerWaalsContact O-N 3.08Å
367	L	94.5	Very high	92.6	Very high	97 Å²	97	64.4 Å²	64.4	51%	0.508	33%	0.326	S	S	.	.	H	α-helix	trans	-61.1	-44.6	175.8	-178.7	63.2	0	0	0	111.1	T363 L364 G365 V370 F371	T363-L367 WeakPolarHBondContact O-CB 3.42Å; T363-L367 PolarHBondContact O-N 3.27Å; L364-L367 PolarHBondContact O-N 2.99Å; G365-L367 PolarHBondContact O-N 3.24Å; L367-V370 PolarHBondContact O-N 3.27Å; L367-F371 HydrophobicContact CD1-CD2 4.4Å; L367-F371 HydrophobicContact CD1-CE2 3.77Å; L367-F371 HydrophobicContact CG-CD2 4.37Å; L367-F371 HydrophobicContact CG-CE2 3.99Å; L367-F371 VanDerWaalsContact O-CD2 3.26Å; L367-F371 WeakPolarHBondContact O-CD2 3.43Å; L367-F371 PolarHBondContact O-N 3.4Å
368	F	95.4	Very high	92.5	Very high	44 Å²	44	62.9 Å²	62.9	19%	0.193	33%	0.327	C	S	.	.	H	α-helix	trans	-60.6	-45	173.7	176.5	-101.4	0	0	0	112.1	A314 F317 I318 L364 G365 R366 V370 F371 F372	A314-F368 HydrophobicContact CB-CE1 4.4Å; A314-F368 HydrophobicContact CB-CZ 3.87Å; F317-F368 HydrophobicContact CB-CE2 4.46Å; F317-F368 HydrophobicContact CB-CZ 4.32Å; F317-F368 HydrophobicContact CD1-CB 4.31Å; F317-F368 AromaticContact CD1-CD1 3.98Å; F317-F368 HydrophobicContact CD1-CD1 3.98Å; F317-F368 AromaticContact CD1-CD2 3.34Å; F317-F368 HydrophobicContact CD1-CD2 3.34Å; F317-F368 HydrophobicContact CD1-CE1 4.11Å; F317-F368 AromaticContact CD1-CE2 3.49Å; F317-F368 HydrophobicContact CD1-CE2 3.49Å; F317-F368 VanDerWaalsContact CD1-CE2 3.49Å; F317-F368 AromaticContact CD1-CG 3.59Å; F317-F368 HydrophobicContact CD1-CG 3.59Å; F317-F368 AromaticContact CD1-CZ 3.88Å; F317-F368 HydrophobicContact CD1-CZ 3.88Å; F317-F368 HydrophobicContact CE1-CB 3.91Å; F317-F368 HydrophobicContact CE1-CD1 4.44Å; F317-F368 AromaticContact CE1-CD2 3.38Å; F317-F368 HydrophobicContact CE1-CD2 3.38Å; F317-F368 AromaticContact CE1-CE2 3.98Å; F317-F368 HydrophobicContact CE1-CE2 3.98Å; F317-F368 AromaticContact CE1-CG 3.65Å; F317-F368 HydrophobicContact CE1-CG 3.65Å; F317-F368 HydrophobicContact CG-CD2 4.33Å; F317-F368 HydrophobicContact CG-CE2 4.1Å; F317-F368 HydrophobicContact CG-CZ 4.39Å; F317-F368 HydrophobicContact CZ-CD2 4.39Å; I318-F368 HydrophobicContact CB-CD1 4.14Å; I318-F368 HydrophobicContact CB-CE1 4.18Å; I318-F368 HydrophobicContact CD1-CD1 4.24Å; L364-F368 PolarHBondContact O-N 3Å; G365-F368 WeakPolarHBondContact O-CB 3.47Å; G365-F368 PolarHBondContact O-N 3.06Å; R366-F368 VanDerWaalsContact C-N 3.35Å; F368-V370 VanDerWaalsContact C-N 3.27Å; F368-V370 PolarHBondContact O-N 3.15Å; F368-F371 PolarHBondContact O-N 2.93Å; F368-F371 VanDerWaalsContact O-N 3.17Å; F368-F372 HydrophobicContact CD1-CB 4.4Å; F368-F372 HydrophobicContact CE1-CB 4.06Å; F368-F372 HydrophobicContact CE1-CD2 4.4Å; F368-F372 HydrophobicContact CE1-CG 4.27Å; F368-F372 HydrophobicContact CZ-CB 4.25Å; F368-F372 HydrophobicContact CZ-CD2 4.19Å; F368-F372 HydrophobicContact CZ-CG 4.44Å; F368-F372 VanDerWaalsContact O-CB 3.31Å; F368-F372 WeakPolarHBondContact O-CB 3.46Å; F368-F372 PolarHBondContact O-N 2.8Å
369	M	93.8	Very high	92.3	Very high	21 Å²	21	63.5 Å²	63.5	10%	0.103	33%	0.328	C	S	.	.	H	α-helix	trans	-59.3	-36.1	178.5	-70.3	-62.2	-74.4	0	0	112.3	I318 L345 L346 T349 A360 G365 R366 F372 I373	I318-M369 HydrophobicContact CD1-CG 4.49Å; L345-M369 HydrophobicContact CD1-CE 4.06Å; L345-M369 HydrophobicContact CD2-CE 4.36Å; L345-M369 HydrophobicContact CG-CE 4.08Å; L346-M369 HydrophobicContact CD2-CE 3.93Å; L346-M369 HydrophobicContact CD2-SD 3.46Å; L346-M369 WeakPolarHBondContact CD2-SD 3.27Å; T349-M369 HydrophobicContact CG2-CE 3.76Å; T349-M369 WeakPolarHBondContact OG1-CE 3.44Å; A360-M369 HydrophobicContact CB-CG 4.03Å; G365-M369 VanDerWaalsContact O-CG 3.27Å; G365-M369 WeakPolarHBondContact O-CG 3.35Å; G365-M369 PolarHBondContact O-N 2.97Å; R366-M369 PolarHBondContact O-N 3.36Å; M369-F372 PolarHBondContact O-N 2.71Å; M369-I373 WeakPolarHBondContact O-CB 3.27Å; M369-I373 WeakPolarHBondContact O-CD1 3.44Å; M369-I373 WeakPolarHBondContact O-CG1 3.3Å; M369-I373 PolarHBondContact O-N 3.16Å
370	V	94.4	Very high	92.2	Very high	85 Å²	85	60.8 Å²	60.8	52%	0.515	32%	0.319	S	S	.	.	H	α-helix	trans	-62.3	-48.6	174.3	171.9	0	0	0	0	111.7	R366 L367 F368 F372 I373 L374	R366-V370 PolarHBondContact O-N 2.74Å; R366-V370 VanDerWaalsContact O-N 3.08Å; L367-V370 PolarHBondContact O-N 3.27Å; F368-V370 VanDerWaalsContact C-N 3.27Å; F368-V370 PolarHBondContact O-N 3.15Å; V370-F372 VanDerWaalsContact C-N 3.35Å; V370-I373 PolarHBondContact O-N 3.36Å; V370-L374 PolarHBondContact O-N 3.01Å
371	F	93.6	Very high	91.9	Very high	138 Å²	138	63.6 Å²	63.6	61%	0.605	34%	0.342	S	S	*	.	H	α-helix	trans	-65.2	-39.3	176.3	-71.3	-66.7	0	0	0	112.3	L367 F368 L374 G375	L367-F371 HydrophobicContact CD1-CD2 4.4Å; L367-F371 HydrophobicContact CD1-CE2 3.77Å; L367-F371 HydrophobicContact CG-CD2 4.37Å; L367-F371 HydrophobicContact CG-CE2 3.99Å; L367-F371 VanDerWaalsContact O-CD2 3.26Å; L367-F371 WeakPolarHBondContact O-CD2 3.43Å; L367-F371 PolarHBondContact O-N 3.4Å; F368-F371 PolarHBondContact O-N 2.93Å; F368-F371 VanDerWaalsContact O-N 3.17Å; F371-L374 PolarHBondContact O-N 3.32Å; F371-G375 PolarHBondContact O-N 3.45Å; F371-G375 VanDerWaalsContact O-N 3.09Å
372	F	94.3	Very high	91.9	Very high	17 Å²	17	61.3 Å²	61.3	8%	0.075	34%	0.339	C	S	.	.	H	α-helix	trans	-68.9	-34.8	179.3	-177.4	-99.3	0	0	0	112.6	A314 L346 M350 F368 M369 V370 G376	A314-F372 HydrophobicContact CB-CD2 3.77Å; A314-F372 HydrophobicContact CB-CE2 3.41Å; A314-F372 VanDerWaalsContact CB-CE2 3.41Å; A314-F372 HydrophobicContact CB-CZ 4.22Å; L346-F372 HydrophobicContact CB-CE1 3.79Å; L346-F372 HydrophobicContact CB-CZ 3.91Å; L346-F372 HydrophobicContact CD1-CE1 3.99Å; L346-F372 HydrophobicContact CD1-CE2 4.09Å; L346-F372 HydrophobicContact CD1-CZ 3.75Å; L346-F372 HydrophobicContact CD2-CD1 3.82Å; L346-F372 HydrophobicContact CD2-CE1 3.67Å; L346-F372 HydrophobicContact CD2-CZ 4.3Å; L346-F372 HydrophobicContact CG-CE1 4.01Å; L346-F372 HydrophobicContact CG-CZ 4.2Å; M350-F372 HydrophobicContact CE-CZ 4.25Å; M350-F372 HydrophobicContact CG-CE1 3.54Å; M350-F372 HydrophobicContact CG-CZ 3.52Å; M350-F372 HydrophobicContact SD-CE1 4.22Å; M350-F372 HydrophobicContact SD-CE2 4.38Å; M350-F372 HydrophobicContact SD-CZ 3.54Å; M350-F372 VanDerWaalsContact SD-CZ 3.54Å; F368-F372 HydrophobicContact CD1-CB 4.4Å; F368-F372 HydrophobicContact CE1-CB 4.06Å; F368-F372 HydrophobicContact CE1-CD2 4.4Å; F368-F372 HydrophobicContact CE1-CG 4.27Å; F368-F372 HydrophobicContact CZ-CB 4.25Å; F368-F372 HydrophobicContact CZ-CD2 4.19Å; F368-F372 HydrophobicContact CZ-CG 4.44Å; F368-F372 VanDerWaalsContact O-CB 3.31Å; F368-F372 WeakPolarHBondContact O-CB 3.46Å; F368-F372 PolarHBondContact O-N 2.8Å; M369-F372 PolarHBondContact O-N 2.71Å; V370-F372 VanDerWaalsContact C-N 3.35Å; F372-G376 VanDerWaalsContact O-CA 3.25Å; F372-G376 WeakPolarHBondContact O-CA 3.29Å; F372-G376 PolarHBondContact O-N 3.49Å
373	I	93.7	Very high	91.8	Very high	82 Å²	82	64 Å²	64	42%	0.421	35%	0.35	S	S	.	.	H	α-helix	trans	-62.3	-46.1	172.8	-74.1	160.7	0	0	0	110.1	T349 M369 V370 L377	T349-I373 HydrophobicContact CG2-CD1 4.07Å; T349-I373 HydrophobicContact CG2-CG1 3.45Å; T349-I373 VanDerWaalsContact CG2-CG1 3.45Å; M369-I373 WeakPolarHBondContact O-CB 3.27Å; M369-I373 WeakPolarHBondContact O-CD1 3.44Å; M369-I373 WeakPolarHBondContact O-CG1 3.3Å; M369-I373 PolarHBondContact O-N 3.16Å; V370-I373 PolarHBondContact O-N 3.36Å; I373-L377 WeakPolarHBondContact O-CB 3.48Å; I373-L377 PolarHBondContact O-N 3.34Å
374	L	91.7	Very high	91.7	Very high	123 Å²	123	62.1 Å²	62.1	64%	0.644	34%	0.338	S	S	*	.	H	α-helix	trans	-62.2	-47	179.5	-68.1	172.6	0	0	0	112.5	V370 F371	V370-L374 PolarHBondContact O-N 3.01Å; F371-L374 PolarHBondContact O-N 3.32Å
375	G	90.9	Very high	91.7	Very high	38 Å²	38	62.6 Å²	62.6	39%	0.392	35%	0.345	S	S	.	.	H	α-helix	trans	-76.1	-41.9	179.3	0	0	0	0	0	113.8	F371 A378 M379	F371-G375 PolarHBondContact O-N 3.45Å; F371-G375 VanDerWaalsContact O-N 3.09Å; G375-A378 PolarHBondContact O-N 3.01Å; G375-M379 PolarHBondContact O-N 2.93Å
376	G	89.2	Confident	91.6	Very high	1 Å²	1	65.5 Å²	65.5	1%	0.01	36%	0.359	C	S	.	.	H	α-helix	trans	-67.4	-39.2	-177.7	0	0	0	0	0	112.9	F372 M379 F380	F372-G376 VanDerWaalsContact O-CA 3.25Å; F372-G376 WeakPolarHBondContact O-CA 3.29Å; F372-G376 PolarHBondContact O-N 3.49Å; G376-M379 PolarHBondContact O-N 3.46Å; G376-F380 VanDerWaalsContact O-CB 3.28Å; G376-F380 WeakPolarHBondContact O-CB 3.48Å; G376-F380 PolarHBondContact O-N 3.05Å
377	L	89.7	Confident	91.4	Very high	82 Å²	82	59.8 Å²	59.8	43%	0.429	34%	0.338	S	S	.	.	H	α-helix	trans	-61.8	-44.4	173.8	-177.5	63.9	0	0	0	111.5	T352 I373 F380 A381	T352-L377 HydrophobicContact CG2-CD1 3.46Å; T352-L377 VanDerWaalsContact CG2-CD1 3.46Å; I373-L377 WeakPolarHBondContact O-CB 3.48Å; I373-L377 PolarHBondContact O-N 3.34Å; L377-F380 PolarHBondContact O-N 2.93Å; L377-A381 VanDerWaalsContact O-CB 3.24Å; L377-A381 WeakPolarHBondContact O-CB 3.37Å; L377-A381 PolarHBondContact O-N 3.39Å
378	A	89.8	Confident	91	Very high	62 Å²	62	60.3 Å²	60.3	51%	0.512	34%	0.34	S	S	.	.	H	α-helix	trans	-64.7	-40.8	178.6	0	0	0	0	0	112.3	G375 S382	G375-A378 PolarHBondContact O-N 3.01Å; A378-S382 WeakPolarHBondContact O-CB 3.48Å; A378-S382 PolarHBondContact O-N 2.93Å; A378-S382 PolarHBondContact O-OG 3.28Å
379	M	89.5	Confident	90.6	Very high	38 Å²	38	64.6 Å²	64.6	19%	0.187	36%	0.361	C	S	.	.	H	α-helix	trans	-66.8	-45.4	173	-73.7	-161.5	-61.7	0	0	112.6	T310 G375 G376 S382 Y383	T310-M379 HydrophobicContact CG2-CE 3.62Å; T310-M379 HydrophobicContact CG2-SD 4.29Å; G375-M379 PolarHBondContact O-N 2.93Å; G376-M379 PolarHBondContact O-N 3.46Å; M379-S382 PolarHBondContact O-N 2.85Å; M379-S382 PolarHBondContact O-OG 2.72Å; M379-Y383 HydrophobicContact CG-CE2 4.41Å; M379-Y383 WeakPolarHBondContact O-CB 3.44Å; M379-Y383 PolarHBondContact O-N 2.9Å; M379-Y383 HydrophobicContact SD-CE2 4.28Å
380	F	89.3	Confident	90.2	Very high	55 Å²	55	65.4 Å²	65.4	24%	0.241	37%	0.365	C	S	.	.	H	α-helix	trans	-63.5	-45.8	-178.3	-169.9	-87.2	0	0	0	111.3	F307 M350 G376 L377 S382 V384	F307-F380 HydrophobicContact CE2-CD2 4.32Å; F307-F380 HydrophobicContact CZ-CD2 4.42Å; M350-F380 HydrophobicContact CB-CB 4.49Å; M350-F380 HydrophobicContact CB-CD2 4.17Å; G376-F380 VanDerWaalsContact O-CB 3.28Å; G376-F380 WeakPolarHBondContact O-CB 3.48Å; G376-F380 PolarHBondContact O-N 3.05Å; L377-F380 PolarHBondContact O-N 2.93Å; F380-S382 VanDerWaalsContact C-N 3.26Å; F380-S382 PolarHBondContact O-N 2.79Å; F380-V384 HydrophobicContact CD1-CG2 4.37Å; F380-V384 HydrophobicContact CD2-CG2 3.79Å; F380-V384 HydrophobicContact CE1-CG2 4.4Å; F380-V384 HydrophobicContact CE2-CG2 3.84Å; F380-V384 HydrophobicContact CG-CG2 4.07Å; F380-V384 HydrophobicContact CZ-CG2 4.14Å; F380-V384 WeakPolarHBondContact O-CB 3.27Å; F380-V384 WeakPolarHBondContact O-CG2 3.45Å; F380-V384 PolarHBondContact O-N 3.05Å
381	A	88.3	Confident	89.7	Confident	66 Å²	66	65.8 Å²	65.8	55%	0.545	36%	0.364	S	S	.	.	H	α-helix	trans	-67.3	-21.2	179.8	0	0	0	0	0	114.3	L377 P385	L377-A381 VanDerWaalsContact O-CB 3.24Å; L377-A381 WeakPolarHBondContact O-CB 3.37Å; L377-A381 PolarHBondContact O-N 3.39Å; A381-P385 WeakPolarHBondContact O-CG 3.32Å
382	S	90.4	Very high	88.8	Confident	59 Å²	59	62 Å²	62	41%	0.413	36%	0.363	S	S	.	.	H	α-helix	trans	-98.6	-50.1	178.5	53.3	0	0	0	0	112.9	A378 M379 F380	A378-S382 WeakPolarHBondContact O-CB 3.48Å; A378-S382 PolarHBondContact O-N 2.93Å; A378-S382 PolarHBondContact O-OG 3.28Å; M379-S382 PolarHBondContact O-N 2.85Å; M379-S382 PolarHBondContact O-OG 2.72Å; F380-S382 VanDerWaalsContact C-N 3.26Å; F380-S382 PolarHBondContact O-N 2.79Å
383	Y	90.8	Very high	87.7	Confident	57 Å²	57	66.7 Å²	66.7	22%	0.224	39%	0.389	C	S	.	.	H	α-helix	trans	-77.4	-35.5	-172.2	-66.3	-4.1	0	0	0	113.1	L303 I306 F307 M379 E386 I387	L303-Y383 HydrophobicContact CD2-CD1 3.7Å; L303-Y383 HydrophobicContact CD2-CD2 4.42Å; L303-Y383 HydrophobicContact CD2-CE1 3.87Å; L303-Y383 HydrophobicContact CD2-CG 4Å; I306-Y383 HydrophobicContact CB-CE2 4.46Å; I306-Y383 HydrophobicContact CG2-CE2 3.91Å; F307-Y383 HydrophobicContact CB-CD2 4.45Å; M379-Y383 HydrophobicContact CG-CE2 4.41Å; M379-Y383 WeakPolarHBondContact O-CB 3.44Å; M379-Y383 PolarHBondContact O-N 2.9Å; M379-Y383 HydrophobicContact SD-CE2 4.28Å; Y383-E386 PolarHBondContact O-N 3.04Å; Y383-I387 WeakPolarHBondContact O-CB 3.01Å; Y383-I387 WeakPolarHBondContact O-CD1 3.4Å; Y383-I387 WeakPolarHBondContact O-CG1 3.49Å; Y383-I387 PolarHBondContact O-N 3.47Å
384	V	89.3	Confident	86.6	Confident	37 Å²	37	73 Å²	73	22%	0.224	41%	0.408	C	S	.	.	H	α-helix	trans	-66.5	-47.4	-176.6	178.2	0	0	0	0	112.2	F307 F380 E386 I387 I388	F307-V384 HydrophobicContact CE2-CG2 4.48Å; F380-V384 HydrophobicContact CD1-CG2 4.37Å; F380-V384 HydrophobicContact CD2-CG2 3.79Å; F380-V384 HydrophobicContact CE1-CG2 4.4Å; F380-V384 HydrophobicContact CE2-CG2 3.84Å; F380-V384 HydrophobicContact CG-CG2 4.07Å; F380-V384 HydrophobicContact CZ-CG2 4.14Å; F380-V384 WeakPolarHBondContact O-CB 3.27Å; F380-V384 WeakPolarHBondContact O-CG2 3.45Å; F380-V384 PolarHBondContact O-N 3.05Å; V384-E386 VanDerWaalsContact C-N 3.33Å; V384-E386 PolarHBondContact O-N 2.69Å; V384-I387 PolarHBondContact O-N 2.62Å; V384-I388 HydrophobicContact CG1-CD1 3.84Å; V384-I388 VanDerWaalsContact O-CG1 3.29Å; V384-I388 WeakPolarHBondContact O-CG1 3.44Å; V384-I388 PolarHBondContact O-N 3.06Å
385	P	91.3	Very high	85.7	Confident	73 Å²	73	74 Å²	74	47%	0.474	41%	0.407	S	S	.	.	H	α-helix	trans	-59.6	-41.5	174.4	-25	36.1	0	0	0	113	A381 I388 E389	A381-P385 WeakPolarHBondContact O-CG 3.32Å; P385-I388 PolarHBondContact O-N 3.11Å; P385-E389 PolarHBondContact O-N 3.39Å
386	E	89.7	Confident	85.2	Confident	61 Å²	61	78.6 Å²	78.6	29%	0.285	42%	0.416	S	S	.	.	H	α-helix	trans	-67.9	-37.7	-179	-170.6	168.6	-134.3	0	0	112.5	K299 L303 Y383 V384 L390	K299-E386 WeakPolarHBondContact CE-OE1 3.37Å; K299-E386 IonicContact NZ-OE1 3.28Å; K299-E386 PolarHBondContact NZ-OE1 2.89Å; L303-E386 HydrophobicContact CD1-CB 4.26Å; L303-E386 HydrophobicContact CD1-CG 3.76Å; L303-E386 WeakPolarHBondContact CD1-OE2 3.38Å; Y383-E386 PolarHBondContact O-N 3.04Å; V384-E386 VanDerWaalsContact C-N 3.33Å; V384-E386 PolarHBondContact O-N 2.69Å; E386-L390 HydrophobicContact CG-CD1 4.4Å; E386-L390 WeakPolarHBondContact O-CB 3.38Å; E386-L390 VanDerWaalsContact O-CG 3.27Å; E386-L390 WeakPolarHBondContact O-CG 3.26Å; E386-L390 PolarHBondContact O-N 3.2Å
387	I	89.9	Confident	85.2	Confident	20 Å²	20	80.5 Å²	80.5	10%	0.103	42%	0.423	C	S	.	.	H	α-helix	trans	-63.4	-43.8	171	-72.3	164.1	0	0	0	110.6	L300 L303 L304 Y383 V384 L390 I391	L300-I387 HydrophobicContact CD1-CB 4.45Å; L300-I387 HydrophobicContact CD1-CG1 4.37Å; L300-I387 HydrophobicContact CD1-CG2 4.02Å; L303-I387 HydrophobicContact CB-CD1 4.14Å; L303-I387 HydrophobicContact CB-CG1 3.97Å; L303-I387 HydrophobicContact CD1-CG1 4.28Å; L304-I387 HydrophobicContact CD2-CD1 4Å; L304-I387 HydrophobicContact CD2-CG2 4.33Å; L304-I387 HydrophobicContact CG-CD1 4.38Å; Y383-I387 WeakPolarHBondContact O-CB 3.01Å; Y383-I387 WeakPolarHBondContact O-CD1 3.4Å; Y383-I387 WeakPolarHBondContact O-CG1 3.49Å; Y383-I387 PolarHBondContact O-N 3.47Å; V384-I387 PolarHBondContact O-N 2.62Å; I387-L390 PolarHBondContact O-N 3Å; I387-I391 HydrophobicContact CG2-CD1 3.73Å; I387-I391 VanDerWaalsContact O-CG1 3.29Å; I387-I391 WeakPolarHBondContact O-CG1 3.33Å; I387-I391 PolarHBondContact O-N 3.15Å
388	I	86.9	Confident	84.9	Confident	107 Å²	107	78 Å²	78	55%	0.549	42%	0.418	S	S	.	.	H	α-helix	trans	-63.4	-43.2	178.6	-70	167.2	0	0	0	110.9	V384 P385 I391 G392	V384-I388 HydrophobicContact CG1-CD1 3.84Å; V384-I388 VanDerWaalsContact O-CG1 3.29Å; V384-I388 WeakPolarHBondContact O-CG1 3.44Å; V384-I388 PolarHBondContact O-N 3.06Å; P385-I388 PolarHBondContact O-N 3.11Å; I388-I391 PolarHBondContact O-N 3.15Å; I388-G392 WeakPolarHBondContact O-CA 3.47Å; I388-G392 PolarHBondContact O-N 2.94Å
389	E	85.8	Confident	84.9	Confident	134 Å²	134	77.7 Å²	77.7	63%	0.626	42%	0.42	S	S	*	.	H	α-helix	trans	-62.4	-46.5	177.3	-169.2	-173.6	162.7	0	0	111.7	P385 I391 G392 N393	P385-E389 PolarHBondContact O-N 3.39Å; E389-I391 VanDerWaalsContact C-N 3.3Å; E389-I391 PolarHBondContact O-N 3.2Å; E389-G392 PolarHBondContact O-N 2.76Å; E389-N393 WeakPolarHBondContact O-CB 3.21Å; E389-N393 PolarHBondContact O-N 2.84Å
390	L	85.9	Confident	85	Confident	38 Å²	38	79.2 Å²	79.2	20%	0.199	43%	0.434	C	S	.	.	H	α-helix	trans	-63.7	-32.6	179	-72.6	170.8	0	0	0	113.2	N296 K299 L300 L303 E386 I387	N296-L390 HydrophobicContact CB-CD2 4.03Å; K299-L390 HydrophobicContact CB-CD1 4.36Å; K299-L390 HydrophobicContact CD-CD1 4.26Å; K299-L390 HydrophobicContact CG-CD1 4.13Å; L300-L390 HydrophobicContact CB-CD1 4.19Å; L300-L390 HydrophobicContact CD1-CB 4.28Å; L303-L390 HydrophobicContact CD1-CD1 4.1Å; E386-L390 HydrophobicContact CG-CD1 4.4Å; E386-L390 WeakPolarHBondContact O-CB 3.38Å; E386-L390 VanDerWaalsContact O-CG 3.27Å; E386-L390 WeakPolarHBondContact O-CG 3.26Å; E386-L390 PolarHBondContact O-N 3.2Å; I387-L390 PolarHBondContact O-N 3Å
391	I	84.6	Confident	85.3	Confident	94 Å²	94	76.8 Å²	76.8	48%	0.482	42%	0.424	S	S	.	.	H	α-helix	trans	-79.3	-37.3	174.1	-66.3	169	0	0	0	111.2	L300 I387 I388 E389	L300-I391 HydrophobicContact CD1-CD1 4.3Å; L300-I391 HydrophobicContact CD1-CG1 4.07Å; L300-I391 HydrophobicContact CD2-CG1 4.16Å; I387-I391 HydrophobicContact CG2-CD1 3.73Å; I387-I391 VanDerWaalsContact O-CG1 3.29Å; I387-I391 WeakPolarHBondContact O-CG1 3.33Å; I387-I391 PolarHBondContact O-N 3.15Å; I388-I391 PolarHBondContact O-N 3.15Å; E389-I391 VanDerWaalsContact C-N 3.3Å; E389-I391 PolarHBondContact O-N 3.2Å
392	G	74.1	Confident	85.3	Confident	58 Å²	58	78 Å²	78	60%	0.598	43%	0.428	S	S	*	.	H	α-helix	trans	-73.8	-21.5	-176	0	0	0	0	0	114.5	I388 E389 R394	I388-G392 WeakPolarHBondContact O-CA 3.47Å; I388-G392 PolarHBondContact O-N 2.94Å; E389-G392 PolarHBondContact O-N 2.76Å; G392-R394 PolarHBondContact O-N 2.59Å
393	N	71.9	Confident	85	Confident	116 Å²	116	78 Å²	78	62%	0.62	43%	0.432	S	S	*	.			trans	-74.7	44.2	-179.7	-154.2	-15.1	0	0	0	113.8	E389	E389-N393 WeakPolarHBondContact O-CB 3.21Å; E389-N393 PolarHBondContact O-N 2.84Å
394	R	70.6	Confident	84.7	Confident	214 Å²	214	78.5 Å²	78.5	81%	0.808	44%	0.441	S	S	*	.			trans	-81.3	121.8	167.6	-71.7	-176.6	173	-166.5	-2.8	108.7	G392 K396	G392-R394 PolarHBondContact O-N 2.59Å; R394-K396 PolarHBondContact O-N 2.79Å
395	K	72.1	Confident	84.3	Confident	144 Å²	144	82.9 Å²	82.9	63%	0.626	47%	0.473	S	S	*	.			trans	-61.2	103.8	172.4	-71.1	-169.7	174.4	-169.7	0	110.3	Y397 G398	K395-Y397 PolarHBondContact O-N 3.23Å; K395-G398 PolarHBondContact O-N 3Å
396	K	81.1	Confident	83.8	Confident	135 Å²	135	83.3 Å²	83.3	59%	0.587	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	-39.7	178.2	179.1	178.3	172.1	-172.3	0	113	R394 E453	R394-K396 PolarHBondContact O-N 2.79Å; K396-E453 IonicContact NZ-OE1 2.7Å; K396-E453 PolarHBondContact NZ-OE1 2.86Å; K396-E453 IonicContact NZ-OE2 3.69Å; K396-E453 PolarHBondContact NZ-OE2 2.9Å
397	Y	87.8	Confident	83.6	Confident	41 Å²	41	85.9 Å²	85.9	16%	0.161	50%	0.497	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	31.7	-179.3	-60.4	-69.7	0	0	0	113.1	K395 P448 E453 F465 Q467	K395-Y397 PolarHBondContact O-N 3.23Å; Y397-P448 HydrophobicContact CD2-CG 4.19Å; Y397-P448 HydrophobicContact CE2-CG 3.57Å; Y397-E453 VanDerWaalsContact OH-CG 3.29Å; Y397-E453 WeakPolarHBondContact OH-CG 3.22Å; Y397-E453 PolarHBondContact OH-OE1 3.38Å; Y397-E453 VanDerWaalsContact OH-OE1 3.05Å; Y397-E453 PolarHBondContact OH-OE2 2.94Å; Y397-F465 HydrophobicContact CD1-CB 4.43Å; Y397-F465 AromaticContact CD1-CD1 3.63Å; Y397-F465 HydrophobicContact CD1-CD1 3.63Å; Y397-F465 HydrophobicContact CD1-CE1 4.46Å; Y397-F465 HydrophobicContact CD1-CG 4.49Å; Y397-F465 WeakPolarHBondContact CD1-O 3.36Å; Y397-F465 HydrophobicContact CD2-CD1 4.2Å; Y397-F465 HydrophobicContact CD2-CE1 4.29Å; Y397-F465 HydrophobicContact CE1-CD1 4.24Å; Y397-F465 AromaticContact CG-CD1 3.6Å; Y397-F465 HydrophobicContact CG-CD1 3.6Å; Y397-F465 AromaticContact CG-CE1 3.99Å; Y397-F465 HydrophobicContact CG-CE1 3.99Å; Y397-Q467 PolarHBondContact O-N 3.23Å
398	G	84.4	Confident	83.6	Confident	30 Å²	30	90.2 Å²	90.2	31%	0.309	52%	0.515	S	S	.	.			trans	-78.8	-157.7	167.2	0	0	0	0	0	112.2	K395 Y466	K395-G398 PolarHBondContact O-N 3Å; G398-Y466 WeakPolarHBondContact O-CD1 3.44Å; G398-Y466 WeakPolarHBondContact O-CE1 3.32Å
399	G	90	Very high	84	Confident	54 Å²	54	85.3 Å²	85.3	56%	0.557	49%	0.49	S	S	*	.	S	Bend	trans	73.9	-176.8	-177.6	0	0	0	0	0	113.3	R478	G399-R478 WeakPolarHBondContact O-CD 3.39Å; G399-R478 WeakPolarHBondContact O-CG 3.42Å; G399-R478 PolarHBondContact O-NH1 3.44Å
400	S	91.9	Very high	84.5	Confident	70 Å²	70	78.9 Å²	78.9	49%	0.49	46%	0.46	S	S	.	.			trans	-127.2	148.2	-177.6	57	0	0	0	0	111.5	Y466 R478	S400-Y466 VanDerWaalsContact C-OH 3.24Å; S400-Y466 PolarHBondContact O-OH 3.49Å; S400-R478 CarbonylContact C-O 3.48Å; S400-R478 VanDerWaalsContact CA-O 3.29Å; S400-R478 WeakPolarHBondContact CA-O 3.42Å; S400-R478 WeakPolarHBondContact CB-O 3.37Å
401	Y	94.5	Very high	85.1	Confident	5 Å²	5	77.1 Å²	77.1	2%	0.02	45%	0.451	C	S	.	.			trans	-61.7	136.6	173	176.9	-113.5	0	0	0	111.1	A403 H409 E439 V441 E464 Y466 R478 K480	Y401-A403 HydrophobicContact CD1-CB 4.43Å; Y401-A403 HydrophobicContact CE1-CB 3.96Å; Y401-H409 AromaticContact CD1-CD2 3.85Å; Y401-H409 AromaticContact CD1-CE1 3.98Å; Y401-H409 AromaticContact CD1-NE2 3.71Å; Y401-H409 HydrophobicContact CE1-CB 4.02Å; Y401-H409 AromaticContact CE1-CD2 3.57Å; Y401-H409 AromaticContact CE1-CE1 3.59Å; Y401-H409 AromaticContact CE1-CG 3.41Å; Y401-H409 VanDerWaalsContact CE1-CG 3.41Å; Y401-H409 AromaticContact CE1-ND1 3.43Å; Y401-H409 WeakPolarHBondContact CE1-ND1 3.13Å; Y401-H409 AromaticContact CE1-NE2 3.65Å; Y401-H409 AromaticContact CZ-CG 3.82Å; Y401-E439 PolarHBondContact OH-OE2 3.45Å; Y401-V441 HydrophobicContact CD1-CG2 4.45Å; Y401-V441 HydrophobicContact CD2-CG2 3.76Å; Y401-V441 HydrophobicContact CE2-CG2 3.91Å; Y401-V441 HydrophobicContact CG-CG2 4.06Å; Y401-E464 WeakPolarHBondContact CD2-OE2 3.32Å; Y401-Y466 VanDerWaalsContact CA-OH 3.26Å; Y401-Y466 WeakPolarHBondContact CA-OH 3.35Å; Y401-Y466 PolarHBondContact N-OH 3.29Å; Y401-R478 PolarHBondContact N-O 3.01Å; Y401-K480 HydrophobicContact CD1-CB 4.03Å; Y401-K480 HydrophobicContact CD1-CG 3.99Å
402	S	89.3	Confident	85.7	Confident	92 Å²	92	72.6 Å²	72.6	64%	0.643	43%	0.428	S	S	*	.			trans	-106.6	84.3	-177.7	176.9	0	0	0	0	110.1	V404	S402-V404 PolarHBondContact O-N 3.16Å; S402-V404 VanDerWaalsContact O-N 3.1Å
403	A	82.9	Confident	86.8	Confident	58 Å²	58	69.9 Å²	69.9	48%	0.479	40%	0.4	S	S	.	.			trans	-50.3	115.6	-177.6	0	0	0	0	0	113	Y401	Y401-A403 HydrophobicContact CD1-CB 4.43Å; Y401-A403 HydrophobicContact CE1-CB 3.96Å
404	V	85.3	Confident	88	Confident	68 Å²	68	64.8 Å²	64.8	41%	0.412	37%	0.374	S	S	.	.			trans	-83.9	123.2	179	-178.5	0	0	0	0	109.8	S402 G406 R407	S402-V404 PolarHBondContact O-N 3.16Å; S402-V404 VanDerWaalsContact O-N 3.1Å; V404-G406 PolarHBondContact O-N 3.5Å; V404-R407 HydrophobicContact CB-CB 4.34Å; V404-R407 HydrophobicContact CB-CG 4.48Å; V404-R407 HydrophobicContact CG1-CG 4.31Å; V404-R407 PolarHBondContact O-N 3.26Å; V404-R407 VanDerWaalsContact O-N 3.1Å
405	S	79.5	Confident	89.1	Confident	129 Å²	129	57.1 Å²	57.1	90%	0.902	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	124.6	-179.5	-165.1	0	0	0	0	111.5
406	G	81.3	Confident	90.2	Very high	81 Å²	81	50.6 Å²	50.6	84%	0.835	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.2	-6.6	-178.8	0	0	0	0	0	115.3	V404	V404-G406 PolarHBondContact O-N 3.5Å
407	R	85.1	Confident	90.8	Very high	115 Å²	115	46.5 Å²	46.5	43%	0.434	31%	0.305	S	S	.	.			trans	-102.4	144.9	166.6	-65.5	-172.3	172.7	-177.1	-6.6	110.2	V404 N437 E439	V404-R407 HydrophobicContact CB-CB 4.34Å; V404-R407 HydrophobicContact CB-CG 4.48Å; V404-R407 HydrophobicContact CG1-CG 4.31Å; V404-R407 PolarHBondContact O-N 3.26Å; V404-R407 VanDerWaalsContact O-N 3.1Å; R407-N437 HydrophobicContact CG-CB 4.47Å; R407-E439 WeakPolarHBondContact CD-OE1 3.25Å; R407-E439 IonicContact CZ-OE1 2.91Å; R407-E439 IonicContact NE-OE1 2.7Å; R407-E439 IonicContact NH1-OE1 3.21Å; R407-E439 PolarHBondContact NH1-OE1 3.24Å
408	K	91.8	Very high	90.9	Very high	111 Å²	111	47.7 Å²	47.7	48%	0.483	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	156.4	168.7	-73.6	178.7	166.2	-153.5	0	108.7	N437 V438 E439 D485	K408-N437 PolarHBondContact N-O 3.02Å; K408-V438 HydrophobicContact CB-CG2 4.35Å; K408-V438 WeakPolarHBondContact O-CA 3.41Å; K408-E439 PolarHBondContact O-N 3.3Å; K408-D485 HydrophobicContact CB-CB 4.32Å; K408-D485 HydrophobicContact CD-CB 4.18Å; K408-D485 VanDerWaalsContact CE-OD1 3.3Å; K408-D485 WeakPolarHBondContact CE-OD1 3.1Å; K408-D485 IonicContact NZ-OD1 3.27Å; K408-D485 PolarHBondContact NZ-OD1 3.25Å; K408-D485 IonicContact NZ-OD2 2.68Å; K408-D485 PolarHBondContact NZ-OD2 3.41Å
409	H	95.1	Very high	90.9	Very high	4 Å²	4	50.6 Å²	50.6	2%	0.019	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	152.4	167.9	73.3	-69.9	0	0	0	111.5	Y401 E439 V441 V479 K480 A484 D485	Y401-H409 AromaticContact CD1-CD2 3.85Å; Y401-H409 AromaticContact CD1-CE1 3.98Å; Y401-H409 AromaticContact CD1-NE2 3.71Å; Y401-H409 HydrophobicContact CE1-CB 4.02Å; Y401-H409 AromaticContact CE1-CD2 3.57Å; Y401-H409 AromaticContact CE1-CE1 3.59Å; Y401-H409 AromaticContact CE1-CG 3.41Å; Y401-H409 VanDerWaalsContact CE1-CG 3.41Å; Y401-H409 AromaticContact CE1-ND1 3.43Å; Y401-H409 WeakPolarHBondContact CE1-ND1 3.13Å; Y401-H409 AromaticContact CE1-NE2 3.65Å; Y401-H409 AromaticContact CZ-CG 3.82Å; H409-E439 CarbonylContact C-O 3.36Å; H409-E439 WeakPolarHBondContact CA-O 3.28Å; H409-E439 HydrophobicContact CB-CB 4.17Å; H409-E439 WeakPolarHBondContact CB-O 3.2Å; H409-V441 HydrophobicContact CB-CG2 4.26Å; H409-V479 PolarHBondContact NE2-O 3.24Å; H409-K480 PolarHBondContact CE1-O 3.08Å; H409-K480 VanDerWaalsContact CE1-O 3.31Å; H409-K480 PolarHBondContact NE2-O 3.17Å; H409-A484 WeakPolarHBondContact O-CA 3.33Å; H409-D485 PolarHBondContact O-N 2.97Å
410	I	96.5	Very high	90.9	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	149.2	169.1	57.7	161.9	0	0	0	109.8	V412 F424 F428 V438 E439 I440 V441 A486 L488 Y993	I410-V412 HydrophobicContact CD1-CG2 3.99Å; I410-V412 HydrophobicContact CG1-CG2 4.49Å; I410-F424 HydrophobicContact CD1-CE1 4.35Å; I410-F424 HydrophobicContact CD1-CZ 3.85Å; I410-F428 HydrophobicContact CD1-CD2 4.3Å; I410-F428 HydrophobicContact CD1-CE1 4.16Å; I410-F428 HydrophobicContact CD1-CE2 3.56Å; I410-F428 HydrophobicContact CD1-CZ 3.48Å; I410-F428 VanDerWaalsContact CD1-CZ 3.48Å; I410-F428 HydrophobicContact CG1-CZ 4.25Å; I410-V438 HydrophobicContact CG1-CG1 4.15Å; I410-V438 HydrophobicContact CG2-CG1 3.97Å; I410-E439 PolarHBondContact N-O 3.16Å; I410-I440 HydrophobicContact CD1-CG1 4.24Å; I410-I440 HydrophobicContact CD1-CG2 4.2Å; I410-I440 HydrophobicContact CG1-CB 4.39Å; I410-I440 HydrophobicContact CG1-CG1 4.22Å; I410-I440 HydrophobicContact CG1-CG2 4.27Å; I410-V441 PolarHBondContact O-N 2.69Å; I410-A486 WeakPolarHBondContact CA-O 3.3Å; I410-A486 HydrophobicContact CG2-CB 4.34Å; I410-L488 HydrophobicContact CB-CD1 4.21Å; I410-L488 HydrophobicContact CD1-CD1 4.08Å; I410-L488 HydrophobicContact CG2-CD1 4.35Å; I410-Y993 HydrophobicContact CG2-CD2 4.24Å; I410-Y993 HydrophobicContact CG2-CE1 4.34Å; I410-Y993 HydrophobicContact CG2-CE2 3.58Å
411	V	97.8	Very high	90.9	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	124	172	177.9	0	0	0	0	108.8	V441 L443 V479 I481 A484 A486 C487 L488	V411-V441 CarbonylContact C-O 3.53Å; V411-V441 WeakPolarHBondContact CA-O 3.15Å; V411-L443 HydrophobicContact CG1-CB 4.33Å; V411-V479 HydrophobicContact CG1-CG2 4.02Å; V411-V479 HydrophobicContact CG2-CB 4.23Å; V411-V479 HydrophobicContact CG2-CG2 3.93Å; V411-I481 HydrophobicContact CB-CD1 3.67Å; V411-I481 HydrophobicContact CG1-CD1 4.06Å; V411-I481 HydrophobicContact CG2-CD1 3.64Å; V411-A484 HydrophobicContact CG2-CB 4.04Å; V411-A486 PolarHBondContact N-O 3.28Å; V411-A486 VanDerWaalsContact N-O 3.08Å; V411-C487 CarbonylContact O-C 3.52Å; V411-C487 VanDerWaalsContact O-CA 3.29Å; V411-C487 WeakPolarHBondContact O-CA 3.3Å; V411-L488 PolarHBondContact O-N 3.06Å
412	V	98	Very high	90.6	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	125.9	176.7	-173.1	0	0	0	0	108.9	I410 F424 I440 V441 F442 L443 L488 L490	I410-V412 HydrophobicContact CD1-CG2 3.99Å; I410-V412 HydrophobicContact CG1-CG2 4.49Å; V412-F424 HydrophobicContact CG2-CE1 3.91Å; V412-F424 HydrophobicContact CG2-CZ 4.12Å; V412-I440 HydrophobicContact CG2-CG2 3.73Å; V412-V441 PolarHBondContact N-O 2.89Å; V412-F442 HydrophobicContact CB-CD1 3.7Å; V412-F442 HydrophobicContact CB-CE1 3.73Å; V412-F442 HydrophobicContact CB-CG 4.43Å; V412-F442 HydrophobicContact CB-CZ 4.48Å; V412-F442 HydrophobicContact CG1-CD1 3.86Å; V412-F442 HydrophobicContact CG1-CE1 3.61Å; V412-F442 HydrophobicContact CG2-CE1 4.23Å; V412-F442 WeakPolarHBondContact O-CA 3.44Å; V412-L443 PolarHBondContact O-N 3.26Å; V412-L488 WeakPolarHBondContact CA-O 3.32Å; V412-L488 HydrophobicContact CG2-CB 4.39Å; V412-L490 HydrophobicContact CG1-CD1 3.88Å; V412-L490 HydrophobicContact CG1-CG 4.13Å
413	C	97.1	Very high	90.5	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.007	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	-173.4	178.6	74.9	0	0	0	0	111.6	L443 V470 L488 I489 L490	C413-L443 HydrophobicContact CB-CB 4.45Å; C413-L443 WeakPolarHBondContact CB-O 3.43Å; C413-V470 HydrophobicContact CB-CB 4.47Å; C413-L488 PolarHBondContact N-O 3.42Å; C413-I489 WeakPolarHBondContact O-CA 3.29Å; C413-L490 PolarHBondContact O-N 2.86Å
414	G	95.4	Very high	90.8	Very high	8 Å²	8	41.4 Å²	41.4	8%	0.082	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	91.9	-137.6	-172.7	0	0	0	0	0	111.6	I416 H444 L490	G414-I416 PolarHBondContact O-N 3.27Å; G414-H444 PolarHBondContact O-CD2 3.37Å; G414-H444 VanDerWaalsContact O-CD2 3.23Å; G414-L490 CarbonylContact C-O 3.53Å; G414-L490 WeakPolarHBondContact CA-O 3.34Å
415	H	95	Very high	91	Very high	53 Å²	53	38.4 Å²	38.4	25%	0.245	22%	0.222	C	C	.	.	S	Bend	trans	-83.5	96.3	-176.7	-171.6	74.5	0	0	0	112.4	T417 S420 L490 N492	H415-T417 VanDerWaalsContact NE2-CG2 3.27Å; H415-T417 WeakPolarHBondContact NE2-CG2 3.27Å; H415-S420 PolarHBondContact O-OG 3.46Å; H415-L490 PolarHBondContact N-O 3.4Å; H415-N492 HydrophobicContact CB-CB 4.11Å
416	I	95.4	Very high	91.3	Very high	8 Å²	8	37.4 Å²	37.4	4%	0.041	20%	0.202	C	C	.	.			trans	-103.7	106.6	-176	-70.4	165	0	0	0	109.8	G414 V421 F442 H444 L452 F465	G414-I416 PolarHBondContact O-N 3.27Å; I416-V421 HydrophobicContact CG2-CG2 3.77Å; I416-F442 HydrophobicContact CD1-CB 4.38Å; I416-F442 HydrophobicContact CD1-CD1 3.87Å; I416-F442 HydrophobicContact CG1-CD1 4.16Å; I416-F442 HydrophobicContact CG2-CD1 4.32Å; I416-H444 HydrophobicContact CB-CB 4.23Å; I416-H444 HydrophobicContact CD1-CB 3.83Å; I416-H444 HydrophobicContact CG2-CB 4.5Å; I416-L452 HydrophobicContact CG2-CD2 4.14Å; I416-F465 HydrophobicContact CG2-CE2 4.47Å
417	T	92.1	Very high	91.5	Very high	48 Å²	48	34.3 Å²	34.3	29%	0.294	17%	0.166	S	C	.	.			trans	-131.7	173.5	177.3	58.9	0	0	0	0	110.6	H415 E419 S420 V421	H415-T417 VanDerWaalsContact NE2-CG2 3.27Å; H415-T417 WeakPolarHBondContact NE2-CG2 3.27Å; T417-E419 VanDerWaalsContact C-N 3.31Å; T417-E419 PolarHBondContact O-N 2.89Å; T417-S420 PolarHBondContact N-OG 3.3Å; T417-S420 VanDerWaalsContact N-OG 3.13Å; T417-S420 PolarHBondContact OG1-OG 2.92Å; T417-V421 VanDerWaalsContact O-CB 3.29Å; T417-V421 WeakPolarHBondContact O-CB 3.41Å; T417-V421 WeakPolarHBondContact O-CG2 3.45Å; T417-V421 PolarHBondContact O-N 3.19Å; T417-V421 VanDerWaalsContact O-N 3.1Å
418	L	89.8	Confident	91.6	Very high	66 Å²	66	29.3 Å²	29.3	35%	0.346	15%	0.148	S	C	.	.	H	α-helix	trans	-57.3	-45.7	177.9	-179.6	65.2	0	0	0	111.8	S422 E451 L455	L418-S422 WeakPolarHBondContact O-CB 3.16Å; L418-S422 PolarHBondContact O-N 2.93Å; L418-E451 HydrophobicContact CD1-CB 4.11Å; L418-E451 HydrophobicContact CD2-CB 3.87Å; L418-E451 HydrophobicContact CD2-CG 4.5Å; L418-L455 HydrophobicContact CD1-CD2 4.14Å
419	E	85.1	Confident	91.4	Very high	91 Å²	91	26.3 Å²	26.3	43%	0.425	14%	0.137	S	C	.	.	H	α-helix	trans	-65.9	-53.5	-178.1	-171.6	-170.6	163.3	0	0	112	T417 V421 S422 N423	T417-E419 VanDerWaalsContact C-N 3.31Å; T417-E419 PolarHBondContact O-N 2.89Å; E419-V421 VanDerWaalsContact C-N 3.3Å; E419-V421 PolarHBondContact O-N 3.26Å; E419-S422 PolarHBondContact O-N 3.39Å; E419-N423 PolarHBondContact O-N 3.22Å
420	S	89.6	Confident	90.9	Very high	11 Å²	11	27.9 Å²	27.9	8%	0.077	14%	0.144	C	C	.	.	H	α-helix	trans	-63	-37.1	-177.6	70.2	0	0	0	0	112.2	H415 T417 F424	H415-S420 PolarHBondContact O-OG 3.46Å; T417-S420 PolarHBondContact N-OG 3.3Å; T417-S420 VanDerWaalsContact N-OG 3.13Å; T417-S420 PolarHBondContact OG1-OG 2.92Å; S420-F424 VanDerWaalsContact O-CB 3.22Å; S420-F424 WeakPolarHBondContact O-CB 3.44Å; S420-F424 PolarHBondContact O-N 2.66Å
421	V	91.8	Very high	90	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-74.1	-39.2	175.5	176.6	0	0	0	0	112	I416 T417 E419 F424 L425 F442 L452 L455 F456	I416-V421 HydrophobicContact CG2-CG2 3.77Å; T417-V421 VanDerWaalsContact O-CB 3.29Å; T417-V421 WeakPolarHBondContact O-CB 3.41Å; T417-V421 WeakPolarHBondContact O-CG2 3.45Å; T417-V421 PolarHBondContact O-N 3.19Å; T417-V421 VanDerWaalsContact O-N 3.1Å; E419-V421 VanDerWaalsContact C-N 3.3Å; E419-V421 PolarHBondContact O-N 3.26Å; V421-F424 PolarHBondContact O-N 2.96Å; V421-L425 HydrophobicContact CG1-CD1 3.6Å; V421-L425 HydrophobicContact CG1-CG 3.91Å; V421-L425 VanDerWaalsContact O-CB 3.32Å; V421-L425 WeakPolarHBondContact O-CB 3.26Å; V421-L425 VanDerWaalsContact O-CG 3.26Å; V421-L425 WeakPolarHBondContact O-CG 3.32Å; V421-L425 PolarHBondContact O-N 2.66Å; V421-F442 HydrophobicContact CG1-CE1 4.2Å; V421-F442 HydrophobicContact CG1-CE2 4.34Å; V421-F442 HydrophobicContact CG1-CZ 3.78Å; V421-F442 HydrophobicContact CG2-CD1 4.31Å; V421-F442 HydrophobicContact CG2-CE1 3.74Å; V421-F442 HydrophobicContact CG2-CZ 4.19Å; V421-L452 HydrophobicContact CB-CD1 3.86Å; V421-L452 HydrophobicContact CG1-CD1 3.84Å; V421-L452 HydrophobicContact CG2-CD1 4.03Å; V421-L455 HydrophobicContact CB-CD2 4.41Å; V421-L455 HydrophobicContact CG1-CD2 3.85Å; V421-F456 HydrophobicContact CG1-CE1 3.9Å
422	S	88.9	Confident	88.7	Confident	36 Å²	36	37.8 Å²	37.8	25%	0.252	19%	0.19	S	C	.	.	H	α-helix	trans	-60.3	-51.9	178.4	177.9	0	0	0	0	111.2	L418 E419 F424 L425 K426	L418-S422 WeakPolarHBondContact O-CB 3.16Å; L418-S422 PolarHBondContact O-N 2.93Å; E419-S422 PolarHBondContact O-N 3.39Å; S422-F424 PolarHBondContact O-N 3.18Å; S422-L425 PolarHBondContact O-N 2.73Å; S422-K426 WeakPolarHBondContact O-CB 3.33Å; S422-K426 WeakPolarHBondContact O-CG 3.5Å; S422-K426 PolarHBondContact O-N 2.71Å
423	N	86.3	Confident	87.6	Confident	34 Å²	34	39.8 Å²	39.8	18%	0.182	20%	0.198	C	C	.	.	H	α-helix	trans	-61.6	-46.8	179	-66.2	-6.9	0	0	0	110.8	E419 L425 K426 D427 D986	E419-N423 PolarHBondContact O-N 3.22Å; N423-L425 PolarHBondContact O-N 3.37Å; N423-K426 PolarHBondContact O-N 2.79Å; N423-D427 PolarHBondContact O-N 3.01Å; N423-D986 HydrophobicContact CB-CB 4.34Å
424	F	90.3	Very high	86.3	Confident	5 Å²	5	43.6 Å²	43.6	2%	0.022	22%	0.218	C	C	.	.	H	α-helix	trans	-59.7	-46.2	177.2	178.5	-103.2	0	0	0	113.1	I410 V412 S420 V421 S422 F428 I440 F442 L488	I410-F424 HydrophobicContact CD1-CE1 4.35Å; I410-F424 HydrophobicContact CD1-CZ 3.85Å; V412-F424 HydrophobicContact CG2-CE1 3.91Å; V412-F424 HydrophobicContact CG2-CZ 4.12Å; S420-F424 VanDerWaalsContact O-CB 3.22Å; S420-F424 WeakPolarHBondContact O-CB 3.44Å; S420-F424 PolarHBondContact O-N 2.66Å; V421-F424 PolarHBondContact O-N 2.96Å; S422-F424 PolarHBondContact O-N 3.18Å; F424-F428 HydrophobicContact CE1-CB 4.2Å; F424-F428 HydrophobicContact CE1-CD2 4.22Å; F424-F428 HydrophobicContact CE1-CG 4.22Å; F424-F428 HydrophobicContact CE2-CB 4.34Å; F424-F428 AromaticContact CE2-CD2 3.75Å; F424-F428 HydrophobicContact CE2-CD2 3.75Å; F424-F428 HydrophobicContact CE2-CG 4.37Å; F424-F428 HydrophobicContact CZ-CB 4.08Å; F424-F428 AromaticContact CZ-CD2 3.4Å; F424-F428 HydrophobicContact CZ-CD2 3.4Å; F424-F428 VanDerWaalsContact CZ-CD2 3.4Å; F424-F428 AromaticContact CZ-CE2 4Å; F424-F428 HydrophobicContact CZ-CE2 4Å; F424-F428 AromaticContact CZ-CG 3.85Å; F424-F428 HydrophobicContact CZ-CG 3.85Å; F424-F428 WeakPolarHBondContact O-CB 3.12Å; F424-F428 PolarHBondContact O-N 3.03Å; F424-I440 HydrophobicContact CE1-CD1 4.25Å; F424-I440 HydrophobicContact CE1-CG2 4.1Å; F424-F442 HydrophobicContact CD1-CZ 4.21Å; F424-F442 HydrophobicContact CE1-CZ 4.48Å; F424-L488 HydrophobicContact CE2-CD2 3.51Å; F424-L488 HydrophobicContact CZ-CD2 3.78Å
425	L	90.3	Very high	84.7	Confident	5 Å²	5	51 Å²	51	3%	0.026	26%	0.256	C	S	.	.	H	α-helix	trans	-70.6	-35.3	-179.1	-70	-178.3	0	0	0	112.7	V421 S422 N423 D427 L429 I440 F442 L455 V463	V421-L425 HydrophobicContact CG1-CD1 3.6Å; V421-L425 HydrophobicContact CG1-CG 3.91Å; V421-L425 VanDerWaalsContact O-CB 3.32Å; V421-L425 WeakPolarHBondContact O-CB 3.26Å; V421-L425 VanDerWaalsContact O-CG 3.26Å; V421-L425 WeakPolarHBondContact O-CG 3.32Å; V421-L425 PolarHBondContact O-N 2.66Å; S422-L425 PolarHBondContact O-N 2.73Å; N423-L425 PolarHBondContact O-N 3.37Å; L425-D427 PolarHBondContact O-N 2.77Å; L425-L429 HydrophobicContact CD2-CD1 4Å; L425-L429 HydrophobicContact CD2-CG 4.47Å; L425-L429 WeakPolarHBondContact O-CB 3.43Å; L425-L429 PolarHBondContact O-N 2.88Å; L425-I440 HydrophobicContact CD2-CD1 3.5Å; L425-I440 VanDerWaalsContact CD2-CD1 3.5Å; L425-F442 HydrophobicContact CD2-CE2 4.3Å; L425-F442 HydrophobicContact CD2-CZ 4.24Å; L425-L455 HydrophobicContact CD1-CD2 4.24Å; L425-L455 HydrophobicContact CD1-CG 4.14Å; L425-V463 HydrophobicContact CD1-CG2 4.28Å; L425-V463 HydrophobicContact CD2-CG2 3.85Å
426	K	85.3	Confident	83.3	Confident	108 Å²	108	52.4 Å²	52.4	47%	0.47	27%	0.268	S	S	.	.	H	α-helix	trans	-55.2	-50	174.1	-82.5	-176.3	176.4	-169	0	111.2	S422 N423 H430 E967	S422-K426 WeakPolarHBondContact O-CB 3.33Å; S422-K426 WeakPolarHBondContact O-CG 3.5Å; S422-K426 PolarHBondContact O-N 2.71Å; N423-K426 PolarHBondContact O-N 2.79Å; K426-H430 WeakPolarHBondContact O-CB 3.34Å; K426-E967 IonicContact NZ-OE1 3.78Å; K426-E967 PolarHBondContact NZ-OE1 2.99Å
427	D	84.1	Confident	82.5	Confident	16 Å²	16	57.1 Å²	57.1	9%	0.086	29%	0.293	C	S	.	.	H	α-helix	trans	-76.6	-41.8	-180	-79.2	-56	0	0	0	112.9	N423 L425 R433 M578 S987	N423-D427 PolarHBondContact O-N 3.01Å; L425-D427 PolarHBondContact O-N 2.77Å; D427-R433 PolarHBondContact O-NH1 3.44Å; D427-M578 PolarHBondContact OD1-N 3.1Å; D427-M578 VanDerWaalsContact OD1-N 3.11Å; D427-S987 PolarHBondContact OD1-OG 3.28Å; D427-S987 WeakPolarHBondContact OD2-CA 3.41Å; D427-S987 WeakPolarHBondContact OD2-CB 3.28Å; D427-S987 PolarHBondContact OD2-OG 3.43Å
428	F	88.3	Confident	82.4	Confident	10 Å²	10	55.2 Å²	55.2	4%	0.044	28%	0.281	C	S	.	.	H	α-helix	trans	-70.4	-43.6	-173.8	-163.7	-80	0	0	0	112.5	I410 F424 H430 V438 I440 Y993 F994	I410-F428 HydrophobicContact CD1-CD2 4.3Å; I410-F428 HydrophobicContact CD1-CE1 4.16Å; I410-F428 HydrophobicContact CD1-CE2 3.56Å; I410-F428 HydrophobicContact CD1-CZ 3.48Å; I410-F428 VanDerWaalsContact CD1-CZ 3.48Å; I410-F428 HydrophobicContact CG1-CZ 4.25Å; F424-F428 HydrophobicContact CE1-CB 4.2Å; F424-F428 HydrophobicContact CE1-CD2 4.22Å; F424-F428 HydrophobicContact CE1-CG 4.22Å; F424-F428 HydrophobicContact CE2-CB 4.34Å; F424-F428 AromaticContact CE2-CD2 3.75Å; F424-F428 HydrophobicContact CE2-CD2 3.75Å; F424-F428 HydrophobicContact CE2-CG 4.37Å; F424-F428 HydrophobicContact CZ-CB 4.08Å; F424-F428 AromaticContact CZ-CD2 3.4Å; F424-F428 HydrophobicContact CZ-CD2 3.4Å; F424-F428 VanDerWaalsContact CZ-CD2 3.4Å; F424-F428 AromaticContact CZ-CE2 4Å; F424-F428 HydrophobicContact CZ-CE2 4Å; F424-F428 AromaticContact CZ-CG 3.85Å; F424-F428 HydrophobicContact CZ-CG 3.85Å; F424-F428 WeakPolarHBondContact O-CB 3.12Å; F424-F428 PolarHBondContact O-N 3.03Å; F428-H430 VanDerWaalsContact C-N 3.34Å; F428-V438 HydrophobicContact CE1-CB 4.36Å; F428-V438 HydrophobicContact CE1-CG1 4.13Å; F428-V438 HydrophobicContact CZ-CG1 4.01Å; F428-I440 HydrophobicContact CD1-CD1 3.57Å; F428-I440 HydrophobicContact CD1-CG1 4.2Å; F428-I440 HydrophobicContact CE1-CD1 3.98Å; F428-I440 HydrophobicContact CE1-CG1 4.08Å; F428-I440 HydrophobicContact CG-CD1 4.22Å; F428-Y993 AromaticContact CE2-CD1 3.4Å; F428-Y993 HydrophobicContact CE2-CD1 3.4Å; F428-Y993 AromaticContact CE2-CE1 3.83Å; F428-Y993 HydrophobicContact CE2-CE1 3.83Å; F428-Y993 HydrophobicContact CE2-CG 4.11Å; F428-Y993 AromaticContact CZ-CD1 3.71Å; F428-Y993 HydrophobicContact CZ-CD1 3.71Å; F428-Y993 AromaticContact CZ-CE1 3.6Å; F428-Y993 HydrophobicContact CZ-CE1 3.6Å; F428-F994 HydrophobicContact CD2-CE2 4.01Å; F428-F994 HydrophobicContact CE1-CE2 4.48Å; F428-F994 HydrophobicContact CE1-CZ 4.1Å; F428-F994 AromaticContact CE2-CE2 3.85Å; F428-F994 HydrophobicContact CE2-CE2 3.85Å; F428-F994 HydrophobicContact CE2-CZ 4.07Å; F428-F994 HydrophobicContact CG-CE2 4.4Å; F428-F994 HydrophobicContact CZ-CE2 4.1Å; F428-F994 AromaticContact CZ-CZ 3.84Å; F428-F994 HydrophobicContact CZ-CZ 3.84Å
429	L	87.9	Confident	82.6	Confident	49 Å²	49	53.1 Å²	53.1	26%	0.257	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	25.2	-179.7	-60.3	177.5	0	0	0	112.5	L425 I440 H459 Q462 V463	L425-L429 HydrophobicContact CD2-CD1 4Å; L425-L429 HydrophobicContact CD2-CG 4.47Å; L425-L429 WeakPolarHBondContact O-CB 3.43Å; L425-L429 PolarHBondContact O-N 2.88Å; L429-I440 HydrophobicContact CD1-CD1 4.15Å; L429-I440 HydrophobicContact CD2-CD1 3.96Å; L429-I440 HydrophobicContact CG-CD1 3.98Å; L429-H459 HydrophobicContact CD1-CB 4.42Å; L429-Q462 HydrophobicContact CD1-CB 4.1Å; L429-Q462 HydrophobicContact CD2-CB 4.22Å; L429-Q462 HydrophobicContact CD2-CG 4.32Å; L429-V463 HydrophobicContact CD1-CG2 4.23Å
430	H	83.8	Confident	83.1	Confident	36 Å²	36	48.8 Å²	48.8	17%	0.167	25%	0.249	C	C	.	.			trans	-67.7	135.1	-178.2	-161.9	-110.1	0	0	0	112.3	K426 F428 D432 R433 M578	K426-H430 WeakPolarHBondContact O-CB 3.34Å; F428-H430 VanDerWaalsContact C-N 3.34Å; H430-D432 IonicContact CE1-OD2 3.79Å; H430-D432 PolarHBondContact CE1-OD2 3.15Å; H430-D432 PolarHBondContact ND1-N 2.88Å; H430-D432 IonicContact ND1-OD2 2.76Å; H430-D432 PolarHBondContact O-N 2.69Å; H430-D432 VanDerWaalsContact O-N 3.1Å; H430-R433 PolarHBondContact O-N 3.31Å; H430-R433 VanDerWaalsContact O-N 3.14Å; H430-M578 HydrophobicContact CB-CB 3.82Å; H430-M578 HydrophobicContact CB-CG 4.32Å
431	K	76.9	Confident	83.4	Confident	146 Å²	146	48.3 Å²	48.3	64%	0.635	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57	-23.3	-178.3	54.7	165	-173.6	-170.9	0	115.6	R433 S580	K431-R433 VanDerWaalsContact C-N 3.35Å; K431-S580 PolarHBondContact NZ-OG 3.13Å; K431-S580 VanDerWaalsContact NZ-OG 3.16Å
432	D	72.5	Confident	83.7	Confident	63 Å²	63	48.3 Å²	48.3	34%	0.337	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-1.3	-175.1	-58.6	-28.4	0	0	0	111.9	H430 M578 S580	H430-D432 IonicContact CE1-OD2 3.79Å; H430-D432 PolarHBondContact CE1-OD2 3.15Å; H430-D432 PolarHBondContact ND1-N 2.88Å; H430-D432 IonicContact ND1-OD2 2.76Å; H430-D432 PolarHBondContact O-N 2.69Å; H430-D432 VanDerWaalsContact O-N 3.1Å; D432-M578 HydrophobicContact CB-CE 4.31Å; D432-S580 VanDerWaalsContact OD2-CA 3.25Å; D432-S580 WeakPolarHBondContact OD2-CA 3.2Å; D432-S580 WeakPolarHBondContact OD2-CB 3.45Å
433	R	74.7	Confident	84.1	Confident	41 Å²	41	46.7 Å²	46.7	16%	0.155	24%	0.235	C	C	.	.	S	Bend	trans	-79.6	141.9	162.5	-66.9	-167.1	164.4	147.6	-0.6	109.5	D427 H430 K431 M578 S990 F994	D427-R433 PolarHBondContact O-NH1 3.44Å; H430-R433 PolarHBondContact O-N 3.31Å; H430-R433 VanDerWaalsContact O-N 3.14Å; K431-R433 VanDerWaalsContact C-N 3.35Å; R433-M578 HydrophobicContact CG-CE 3.78Å; R433-M578 HydrophobicContact CG-CG 4.21Å; R433-M578 HydrophobicContact CG-SD 3.93Å; R433-M578 PolarHBondContact NE-SD 2.86Å; R433-M578 VanDerWaalsContact NH2-CG 3.28Å; R433-S990 PolarHBondContact NH1-OG 3.11Å; R433-S990 PolarHBondContact NH2-OG 3.37Å; R433-F994 VanDerWaalsContact NH1-CE2 3.26Å
434	D	69.4	Low	84.6	Confident	82 Å²	82	46.5 Å²	46.5	44%	0.439	23%	0.233	S	C	.	.			trans	-55.7	149.9	169.7	-71.1	-35	0	0	0	110.1	V436 K668	D434-V436 VanDerWaalsContact C-N 3.34Å; D434-V436 WeakPolarHBondContact O-CG2 3.32Å; D434-V436 PolarHBondContact O-N 3.03Å; D434-K668 VanDerWaalsContact OD1-CE 3.26Å; D434-K668 WeakPolarHBondContact OD1-CE 3.26Å; D434-K668 IonicContact OD1-NZ 3.3Å; D434-K668 PolarHBondContact OD1-NZ 3.27Å
435	D	60.9	Low	84.8	Confident	164 Å²	164	50.7 Å²	50.7	88%	0.877	26%	0.255	S	S	*	.			trans	-59.1	82.3	-173.7	-75.1	-52.8	0	0	0	113.8	N437	D435-N437 PolarHBondContact O-N 3.31Å
436	V	66.8	Low	84.9	Confident	81 Å²	81	55.6 Å²	55.6	49%	0.491	28%	0.281	S	S	.	.			trans	-86.9	110.7	176.5	-147.8	0	0	0	0	109.4	D434 V438 F994	D434-V436 VanDerWaalsContact C-N 3.34Å; D434-V436 WeakPolarHBondContact O-CG2 3.32Å; D434-V436 PolarHBondContact O-N 3.03Å; V436-V438 HydrophobicContact CB-CG2 4.32Å; V436-V438 HydrophobicContact CG1-CG2 3.72Å; V436-V438 PolarHBondContact O-N 3.2Å; V436-F994 HydrophobicContact CB-CE1 4.1Å; V436-F994 HydrophobicContact CG1-CE1 4.14Å; V436-F994 HydrophobicContact CG2-CD1 4.42Å; V436-F994 HydrophobicContact CG2-CE1 3.69Å; V436-F994 HydrophobicContact CG2-CZ 4.35Å
437	N	78.8	Confident	85.1	Confident	107 Å²	107	53.7 Å²	53.7	57%	0.572	28%	0.281	S	S	*	.			trans	-73.1	68.6	176.5	-72.7	-69.8	0	0	0	111.6	R407 K408 D435	R407-N437 HydrophobicContact CG-CB 4.47Å; K408-N437 PolarHBondContact N-O 3.02Å; D435-N437 PolarHBondContact O-N 3.31Å
438	V	89	Confident	85.6	Confident	9 Å²	9	53.6 Å²	53.6	6%	0.055	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	124.5	176.7	-179.9	0	0	0	0	109.9	K408 I410 F428 V436	K408-V438 HydrophobicContact CB-CG2 4.35Å; K408-V438 WeakPolarHBondContact O-CA 3.41Å; I410-V438 HydrophobicContact CG1-CG1 4.15Å; I410-V438 HydrophobicContact CG2-CG1 3.97Å; F428-V438 HydrophobicContact CE1-CB 4.36Å; F428-V438 HydrophobicContact CE1-CG1 4.13Å; F428-V438 HydrophobicContact CZ-CG1 4.01Å; V436-V438 HydrophobicContact CB-CG2 4.32Å; V436-V438 HydrophobicContact CG1-CG2 3.72Å; V436-V438 PolarHBondContact O-N 3.2Å
439	E	93.1	Very high	85.8	Confident	21 Å²	21	56.8 Å²	56.8	10%	0.098	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	147.8	172.8	-68.8	173.7	-167.9	0	0	110.9	Y401 R407 K408 H409 I410	Y401-E439 PolarHBondContact OH-OE2 3.45Å; R407-E439 WeakPolarHBondContact CD-OE1 3.25Å; R407-E439 IonicContact CZ-OE1 2.91Å; R407-E439 IonicContact NE-OE1 2.7Å; R407-E439 IonicContact NH1-OE1 3.21Å; R407-E439 PolarHBondContact NH1-OE1 3.24Å; K408-E439 PolarHBondContact O-N 3.3Å; H409-E439 CarbonylContact C-O 3.36Å; H409-E439 WeakPolarHBondContact CA-O 3.28Å; H409-E439 HydrophobicContact CB-CB 4.17Å; H409-E439 WeakPolarHBondContact CB-O 3.2Å; I410-E439 PolarHBondContact N-O 3.16Å
440	I	95.6	Very high	86.1	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	114.3	-173.4	-50.2	176.3	0	0	0	108.9	I410 V412 F424 L425 F428 L429 F442 Q462 V463 E464	I410-I440 HydrophobicContact CD1-CG1 4.24Å; I410-I440 HydrophobicContact CD1-CG2 4.2Å; I410-I440 HydrophobicContact CG1-CB 4.39Å; I410-I440 HydrophobicContact CG1-CG1 4.22Å; I410-I440 HydrophobicContact CG1-CG2 4.27Å; V412-I440 HydrophobicContact CG2-CG2 3.73Å; F424-I440 HydrophobicContact CE1-CD1 4.25Å; F424-I440 HydrophobicContact CE1-CG2 4.1Å; L425-I440 HydrophobicContact CD2-CD1 3.5Å; L425-I440 VanDerWaalsContact CD2-CD1 3.5Å; F428-I440 HydrophobicContact CD1-CD1 3.57Å; F428-I440 HydrophobicContact CD1-CG1 4.2Å; F428-I440 HydrophobicContact CE1-CD1 3.98Å; F428-I440 HydrophobicContact CE1-CG1 4.08Å; F428-I440 HydrophobicContact CG-CD1 4.22Å; L429-I440 HydrophobicContact CD1-CD1 4.15Å; L429-I440 HydrophobicContact CD2-CD1 3.96Å; L429-I440 HydrophobicContact CG-CD1 3.98Å; I440-F442 HydrophobicContact CB-CE2 4.4Å; I440-F442 HydrophobicContact CG2-CD2 4.06Å; I440-F442 HydrophobicContact CG2-CE2 3.49Å; I440-F442 VanDerWaalsContact CG2-CE2 3.49Å; I440-F442 HydrophobicContact CG2-CZ 3.82Å; I440-Q462 PolarHBondContact N-O 2.95Å; I440-V463 HydrophobicContact CB-CG2 4.32Å; I440-V463 HydrophobicContact CD1-CG2 4.36Å; I440-V463 WeakPolarHBondContact O-CA 3.44Å; I440-E464 PolarHBondContact O-N 3.29Å
441	V	97.1	Very high	86.5	Confident	1 Å²	1	65 Å²	65	1%	0.006	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	105.2	-177.5	-175.3	0	0	0	0	109.6	Y401 H409 I410 V411 V412 Y466 V479	Y401-V441 HydrophobicContact CD1-CG2 4.45Å; Y401-V441 HydrophobicContact CD2-CG2 3.76Å; Y401-V441 HydrophobicContact CE2-CG2 3.91Å; Y401-V441 HydrophobicContact CG-CG2 4.06Å; H409-V441 HydrophobicContact CB-CG2 4.26Å; I410-V441 PolarHBondContact O-N 2.69Å; V411-V441 CarbonylContact C-O 3.53Å; V411-V441 WeakPolarHBondContact CA-O 3.15Å; V412-V441 PolarHBondContact N-O 2.89Å; V441-Y466 HydrophobicContact CG1-CD2 3.63Å; V441-Y466 HydrophobicContact CG1-CE2 3.93Å; V441-V479 HydrophobicContact CG1-CB 4.01Å; V441-V479 HydrophobicContact CG1-CG1 4.01Å
442	F	97.7	Very high	87.3	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	132.3	176.6	-71.5	-85.8	0	0	0	111.4	V412 I416 V421 F424 L425 I440 F456 V463 E464 F465 Y466	V412-F442 HydrophobicContact CB-CD1 3.7Å; V412-F442 HydrophobicContact CB-CE1 3.73Å; V412-F442 HydrophobicContact CB-CG 4.43Å; V412-F442 HydrophobicContact CB-CZ 4.48Å; V412-F442 HydrophobicContact CG1-CD1 3.86Å; V412-F442 HydrophobicContact CG1-CE1 3.61Å; V412-F442 HydrophobicContact CG2-CE1 4.23Å; V412-F442 WeakPolarHBondContact O-CA 3.44Å; I416-F442 HydrophobicContact CD1-CB 4.38Å; I416-F442 HydrophobicContact CD1-CD1 3.87Å; I416-F442 HydrophobicContact CG1-CD1 4.16Å; I416-F442 HydrophobicContact CG2-CD1 4.32Å; V421-F442 HydrophobicContact CG1-CE1 4.2Å; V421-F442 HydrophobicContact CG1-CE2 4.34Å; V421-F442 HydrophobicContact CG1-CZ 3.78Å; V421-F442 HydrophobicContact CG2-CD1 4.31Å; V421-F442 HydrophobicContact CG2-CE1 3.74Å; V421-F442 HydrophobicContact CG2-CZ 4.19Å; F424-F442 HydrophobicContact CD1-CZ 4.21Å; F424-F442 HydrophobicContact CE1-CZ 4.48Å; L425-F442 HydrophobicContact CD2-CE2 4.3Å; L425-F442 HydrophobicContact CD2-CZ 4.24Å; I440-F442 HydrophobicContact CB-CE2 4.4Å; I440-F442 HydrophobicContact CG2-CD2 4.06Å; I440-F442 HydrophobicContact CG2-CE2 3.49Å; I440-F442 VanDerWaalsContact CG2-CE2 3.49Å; I440-F442 HydrophobicContact CG2-CZ 3.82Å; F442-F456 HydrophobicContact CB-CZ 4.44Å; F442-F456 AromaticContact CD2-CE1 3.66Å; F442-F456 HydrophobicContact CD2-CE1 3.66Å; F442-F456 HydrophobicContact CD2-CZ 4.08Å; F442-F456 AromaticContact CE2-CE1 3.81Å; F442-F456 HydrophobicContact CE2-CE1 3.81Å; F442-F456 HydrophobicContact CG-CE1 4.2Å; F442-F456 HydrophobicContact CG-CZ 4.18Å; F442-F456 HydrophobicContact CZ-CE1 4.46Å; F442-V463 HydrophobicContact CD2-CG1 3.61Å; F442-V463 HydrophobicContact CE2-CG1 3.53Å; F442-E464 PolarHBondContact N-O 2.89Å; F442-F465 HydrophobicContact CB-CB 4.45Å; F442-F465 HydrophobicContact CB-CD2 3.67Å; F442-F465 HydrophobicContact CB-CE2 4.4Å; F442-F465 HydrophobicContact CB-CG 4.45Å; F442-Y466 PolarHBondContact O-N 3.01Å
443	L	97.6	Very high	88.2	Confident	3 Å²	3	56.4 Å²	56.4	2%	0.016	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	109	175.6	-179	60.4	0	0	0	110.8	V411 V412 C413 V470 D475 V479	V411-L443 HydrophobicContact CG1-CB 4.33Å; V412-L443 PolarHBondContact O-N 3.26Å; C413-L443 HydrophobicContact CB-CB 4.45Å; C413-L443 WeakPolarHBondContact CB-O 3.43Å; L443-V470 HydrophobicContact CD2-CB 4.32Å; L443-D475 HydrophobicContact CD1-CB 4.35Å; L443-D475 HydrophobicContact CD2-CB 4.42Å; L443-V479 HydrophobicContact CB-CG1 4.26Å; L443-V479 HydrophobicContact CD1-CG1 4Å; L443-V479 HydrophobicContact CD2-CG1 4.2Å; L443-V479 HydrophobicContact CD2-CG2 4.09Å; L443-V479 HydrophobicContact CG-CG1 4.38Å
444	H	96.8	Very high	89.1	Confident	29 Å²	29	57.2 Å²	57.2	13%	0.134	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	148.5	-178.8	-163.6	-127.1	0	0	0	112.5	G414 I416 I446 F465 Y466 Q467 G468	G414-H444 PolarHBondContact O-CD2 3.37Å; G414-H444 VanDerWaalsContact O-CD2 3.23Å; I416-H444 HydrophobicContact CB-CB 4.23Å; I416-H444 HydrophobicContact CD1-CB 3.83Å; I416-H444 HydrophobicContact CG2-CB 4.5Å; H444-I446 PolarHBondContact ND1-O 3.08Å; H444-I446 VanDerWaalsContact ND1-O 3.15Å; H444-F465 HydrophobicContact CB-CE2 3.75Å; H444-F465 HydrophobicContact CB-CZ 3.84Å; H444-Y466 PolarHBondContact N-O 2.87Å; H444-Q467 CarbonylContact O-C 3.47Å; H444-Q467 WeakPolarHBondContact O-CA 3.45Å; H444-G468 CarbonylContact C-O 3.58Å; H444-G468 PolarHBondContact O-N 3.39Å; H444-G468 VanDerWaalsContact O-O 3.12Å
445	N	93.5	Very high	90.2	Very high	94 Å²	94	54.6 Å²	54.6	50%	0.503	30%	0.301	S	S	.	.	S	Bend	trans	-79.1	-35.2	-176.2	59.4	-12.1	0	0	0	112.6	Q467 G468	N445-Q467 VanDerWaalsContact O-CG 3.32Å; N445-Q467 WeakPolarHBondContact O-CG 3.17Å; N445-Q467 PolarHBondContact O-NE2 3.42Å; N445-G468 WeakPolarHBondContact CA-O 3.16Å; N445-G468 PolarHBondContact N-O 3.28Å
446	I	92.8	Very high	91.7	Very high	108 Å²	108	47.5 Å²	47.5	55%	0.554	26%	0.262	S	S	*	.	S	Bend	trans	-84.5	135.4	176.2	-59.5	160.5	0	0	0	109.1	H444	H444-I446 PolarHBondContact ND1-O 3.08Å; H444-I446 VanDerWaalsContact ND1-O 3.15Å
447	S	91.1	Very high	92.9	Very high	68 Å²	68	49.8 Å²	49.8	48%	0.476	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-65.9	143.9	174.6	49.2	0	0	0	0	111.8
448	P	93.9	Very high	93.5	Very high	14 Å²	14	54.5 Å²	54.5	9%	0.091	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-62.5	148.4	-179.7	27.9	-35.7	0	0	0	111.5	Y397 L452 E453 F456 F465	Y397-P448 HydrophobicContact CD2-CG 4.19Å; Y397-P448 HydrophobicContact CE2-CG 3.57Å; P448-L452 HydrophobicContact CB-CB 4.05Å; P448-L452 HydrophobicContact CB-CD2 3.83Å; P448-L452 HydrophobicContact CB-CG 3.95Å; P448-E453 HydrophobicContact CB-CG 4.24Å; P448-E453 HydrophobicContact CG-CG 3.89Å; P448-F456 HydrophobicContact CB-CE2 4.09Å; P448-F456 HydrophobicContact CG-CE2 4.46Å; P448-F465 HydrophobicContact CG-CD1 4.32Å; P448-F465 HydrophobicContact CG-CE1 4.29Å
449	N	93.2	Very high	93.4	Very high	76 Å²	76	56 Å²	56	41%	0.406	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-74.1	169.6	168	77.6	-14.8	0	0	0	110.4	E451 L452 E453	N449-E451 PolarHBondContact ND2-OE2 3.19Å; N449-E451 PolarHBondContact O-N 3.26Å; N449-L452 PolarHBondContact O-N 3.08Å; N449-L452 WeakPolarHBondContact OD1-CB 3.26Å; N449-L452 PolarHBondContact OD1-N 3.03Å; N449-E453 WeakPolarHBondContact O-CG 3.46Å; N449-E453 PolarHBondContact O-N 2.84Å
450	L	93.3	Very high	92.9	Very high	145 Å²	145	62.8 Å²	62.8	76%	0.759	31%	0.311	S	S	*	.	H	α-helix	trans	-61.7	-29.6	-175.5	-65.3	175.3	0	0	0	113.5	A454	L450-A454 PolarHBondContact O-N 2.72Å
451	E	92.3	Very high	92.5	Very high	114 Å²	114	67.5 Å²	67.5	53%	0.533	34%	0.34	S	S	.	.	H	α-helix	trans	-72.1	-46.5	178	-62.1	157.8	165.1	0	0	111	L418 N449 E453 A454 L455	L418-E451 HydrophobicContact CD1-CB 4.11Å; L418-E451 HydrophobicContact CD2-CB 3.87Å; L418-E451 HydrophobicContact CD2-CG 4.5Å; N449-E451 PolarHBondContact ND2-OE2 3.19Å; N449-E451 PolarHBondContact O-N 3.26Å; E451-E453 VanDerWaalsContact C-N 3.31Å; E451-E453 PolarHBondContact O-N 2.96Å; E451-A454 WeakPolarHBondContact O-CA 3.17Å; E451-A454 WeakPolarHBondContact O-CB 3.37Å; E451-A454 PolarHBondContact O-N 2.72Å; E451-L455 PolarHBondContact O-N 2.91Å
452	L	92.5	Very high	92	Very high	6 Å²	6	71.1 Å²	71.1	3%	0.031	36%	0.357	C	S	.	.	H	α-helix	trans	-66.5	-34.2	175	-174.4	60.3	0	0	0	111.2	I416 V421 P448 N449 A454 L455 F456	I416-L452 HydrophobicContact CG2-CD2 4.14Å; V421-L452 HydrophobicContact CB-CD1 3.86Å; V421-L452 HydrophobicContact CG1-CD1 3.84Å; V421-L452 HydrophobicContact CG2-CD1 4.03Å; P448-L452 HydrophobicContact CB-CB 4.05Å; P448-L452 HydrophobicContact CB-CD2 3.83Å; P448-L452 HydrophobicContact CB-CG 3.95Å; N449-L452 PolarHBondContact O-N 3.08Å; N449-L452 WeakPolarHBondContact OD1-CB 3.26Å; N449-L452 PolarHBondContact OD1-N 3.03Å; L452-A454 VanDerWaalsContact C-N 3.32Å; L452-A454 PolarHBondContact O-N 3.14Å; L452-L455 HydrophobicContact CD1-CD2 4.22Å; L452-L455 PolarHBondContact O-N 3.02Å; L452-F456 HydrophobicContact CD1-CD1 4.41Å; L452-F456 HydrophobicContact CD1-CE1 3.84Å; L452-F456 HydrophobicContact CD1-CE2 4.08Å; L452-F456 HydrophobicContact CD1-CZ 3.65Å; L452-F456 HydrophobicContact CD2-CE2 4.06Å; L452-F456 HydrophobicContact CD2-CZ 4.02Å; L452-F456 HydrophobicContact CG-CD2 4.21Å; L452-F456 HydrophobicContact CG-CE1 4.31Å; L452-F456 HydrophobicContact CG-CE2 3.61Å; L452-F456 HydrophobicContact CG-CZ 3.67Å; L452-F456 WeakPolarHBondContact O-CD2 3.32Å; L452-F456 VanDerWaalsContact O-CG 3.27Å; L452-F456 WeakPolarHBondContact O-CG 3.46Å; L452-F456 PolarHBondContact O-N 3.2Å
453	E	92.5	Very high	91.8	Very high	22 Å²	22	71.4 Å²	71.4	10%	0.103	36%	0.359	C	S	.	.	H	α-helix	trans	-60.7	-38.9	167.4	-74.1	-154.7	-169.9	0	0	113	K396 Y397 P448 N449 E451 K457	K396-E453 IonicContact NZ-OE1 2.7Å; K396-E453 PolarHBondContact NZ-OE1 2.86Å; K396-E453 IonicContact NZ-OE2 3.69Å; K396-E453 PolarHBondContact NZ-OE2 2.9Å; Y397-E453 VanDerWaalsContact OH-CG 3.29Å; Y397-E453 WeakPolarHBondContact OH-CG 3.22Å; Y397-E453 PolarHBondContact OH-OE1 3.38Å; Y397-E453 VanDerWaalsContact OH-OE1 3.05Å; Y397-E453 PolarHBondContact OH-OE2 2.94Å; P448-E453 HydrophobicContact CB-CG 4.24Å; P448-E453 HydrophobicContact CG-CG 3.89Å; N449-E453 WeakPolarHBondContact O-CG 3.46Å; N449-E453 PolarHBondContact O-N 2.84Å; E451-E453 VanDerWaalsContact C-N 3.31Å; E451-E453 PolarHBondContact O-N 2.96Å; E453-K457 WeakPolarHBondContact O-CB 3.32Å; E453-K457 WeakPolarHBondContact O-CD 3.2Å; E453-K457 VanDerWaalsContact O-CG 3.25Å; E453-K457 WeakPolarHBondContact O-CG 3.32Å; E453-K457 PolarHBondContact O-N 2.91Å; E453-K457 IonicContact OE2-NZ 3.36Å; E453-K457 PolarHBondContact OE2-NZ 3.05Å
454	A	92.8	Very high	91.6	Very high	57 Å²	57	75 Å²	75	47%	0.471	38%	0.376	S	S	.	.	H	α-helix	trans	-69	-39.7	177.2	0	0	0	0	0	111.2	L450 E451 L452 K457 R458	L450-A454 PolarHBondContact O-N 2.72Å; E451-A454 WeakPolarHBondContact O-CA 3.17Å; E451-A454 WeakPolarHBondContact O-CB 3.37Å; E451-A454 PolarHBondContact O-N 2.72Å; L452-A454 VanDerWaalsContact C-N 3.32Å; L452-A454 PolarHBondContact O-N 3.14Å; A454-K457 PolarHBondContact O-N 3.25Å; A454-R458 PolarHBondContact O-N 3.34Å
455	L	92.9	Very high	91.6	Very high	27 Å²	27	74.3 Å²	74.3	14%	0.141	37%	0.372	C	S	.	.	H	α-helix	trans	-61.9	-46.9	174	-175.1	59.7	0	0	0	111.6	L418 V421 L425 E451 L452 K457 R458 H459	L418-L455 HydrophobicContact CD1-CD2 4.14Å; V421-L455 HydrophobicContact CB-CD2 4.41Å; V421-L455 HydrophobicContact CG1-CD2 3.85Å; L425-L455 HydrophobicContact CD1-CD2 4.24Å; L425-L455 HydrophobicContact CD1-CG 4.14Å; E451-L455 PolarHBondContact O-N 2.91Å; L452-L455 HydrophobicContact CD1-CD2 4.22Å; L452-L455 PolarHBondContact O-N 3.02Å; L455-K457 PolarHBondContact O-N 2.83Å; L455-R458 WeakPolarHBondContact O-CB 3.12Å; L455-R458 PolarHBondContact O-N 3.3Å; L455-R458 VanDerWaalsContact O-N 3.15Å; L455-H459 PolarHBondContact O-CD2 3.48Å; L455-H459 PolarHBondContact O-N 2.92Å
456	F	93.6	Very high	91.7	Very high	15 Å²	15	71 Å²	71	7%	0.066	35%	0.353	C	S	.	.	H	α-helix	trans	-62.3	-40.1	175.1	-64.7	-30.6	0	0	0	112.6	V421 F442 P448 L452 R458 H459 F460 V463 F465	V421-F456 HydrophobicContact CG1-CE1 3.9Å; F442-F456 HydrophobicContact CB-CZ 4.44Å; F442-F456 AromaticContact CD2-CE1 3.66Å; F442-F456 HydrophobicContact CD2-CE1 3.66Å; F442-F456 HydrophobicContact CD2-CZ 4.08Å; F442-F456 AromaticContact CE2-CE1 3.81Å; F442-F456 HydrophobicContact CE2-CE1 3.81Å; F442-F456 HydrophobicContact CG-CE1 4.2Å; F442-F456 HydrophobicContact CG-CZ 4.18Å; F442-F456 HydrophobicContact CZ-CE1 4.46Å; P448-F456 HydrophobicContact CB-CE2 4.09Å; P448-F456 HydrophobicContact CG-CE2 4.46Å; L452-F456 HydrophobicContact CD1-CD1 4.41Å; L452-F456 HydrophobicContact CD1-CE1 3.84Å; L452-F456 HydrophobicContact CD1-CE2 4.08Å; L452-F456 HydrophobicContact CD1-CZ 3.65Å; L452-F456 HydrophobicContact CD2-CE2 4.06Å; L452-F456 HydrophobicContact CD2-CZ 4.02Å; L452-F456 HydrophobicContact CG-CD2 4.21Å; L452-F456 HydrophobicContact CG-CE1 4.31Å; L452-F456 HydrophobicContact CG-CE2 3.61Å; L452-F456 HydrophobicContact CG-CZ 3.67Å; L452-F456 WeakPolarHBondContact O-CD2 3.32Å; L452-F456 VanDerWaalsContact O-CG 3.27Å; L452-F456 WeakPolarHBondContact O-CG 3.46Å; L452-F456 PolarHBondContact O-N 3.2Å; F456-R458 VanDerWaalsContact C-N 3.28Å; F456-R458 PolarHBondContact O-N 2.98Å; F456-H459 CarbonylContact O-C 3.6Å; F456-H459 PolarHBondContact O-N 3.35Å; F456-H459 VanDerWaalsContact O-N 3.16Å; F456-F460 PolarHBondContact O-N 3.04Å; F456-V463 HydrophobicContact CD1-CG1 3.46Å; F456-V463 VanDerWaalsContact CD1-CG1 3.46Å; F456-V463 HydrophobicContact CE1-CG1 3.86Å; F456-V463 HydrophobicContact CG-CG1 4.28Å; F456-F465 HydrophobicContact CD2-CB 3.91Å; F456-F465 HydrophobicContact CD2-CD2 4.44Å; F456-F465 HydrophobicContact CD2-CG 4.32Å; F456-F465 HydrophobicContact CE2-CB 3.65Å; F456-F465 AromaticContact CE2-CD2 3.39Å; F456-F465 HydrophobicContact CE2-CD2 3.39Å; F456-F465 HydrophobicContact CE2-CE2 4.27Å; F456-F465 AromaticContact CE2-CG 3.67Å; F456-F465 HydrophobicContact CE2-CG 3.67Å; F456-F465 HydrophobicContact CZ-CB 4.22Å; F456-F465 AromaticContact CZ-CD2 3.65Å; F456-F465 HydrophobicContact CZ-CD2 3.65Å; F456-F465 HydrophobicContact CZ-CG 4.28Å
457	K	91.2	Very high	91.8	Very high	130 Å²	130	68 Å²	68	57%	0.565	34%	0.336	S	S	*	.	H	α-helix	trans	-64.3	-29.8	174.5	-75.1	166.3	-172.4	156.8	0	113.1	E453 A454 L455 H459	E453-K457 WeakPolarHBondContact O-CB 3.32Å; E453-K457 WeakPolarHBondContact O-CD 3.2Å; E453-K457 VanDerWaalsContact O-CG 3.25Å; E453-K457 WeakPolarHBondContact O-CG 3.32Å; E453-K457 PolarHBondContact O-N 2.91Å; E453-K457 IonicContact OE2-NZ 3.36Å; E453-K457 PolarHBondContact OE2-NZ 3.05Å; A454-K457 PolarHBondContact O-N 3.25Å; L455-K457 PolarHBondContact O-N 2.83Å; K457-H459 VanDerWaalsContact C-N 3.29Å; K457-H459 PolarHBondContact O-N 2.85Å
458	R	91	Very high	92	Very high	205 Å²	205	65.2 Å²	65.2	77%	0.774	32%	0.319	S	S	*	.	H	α-helix	trans	-66.5	-31.5	174.6	-170.1	179.1	-177.9	172.7	-0.8	112.2	A454 L455 F456	A454-R458 PolarHBondContact O-N 3.34Å; L455-R458 WeakPolarHBondContact O-CB 3.12Å; L455-R458 PolarHBondContact O-N 3.3Å; L455-R458 VanDerWaalsContact O-N 3.15Å; F456-R458 VanDerWaalsContact C-N 3.28Å; F456-R458 PolarHBondContact O-N 2.98Å
459	H	87.9	Confident	92.1	Very high	42 Å²	42	66.4 Å²	66.4	19%	0.194	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	33.9	-179.5	-63.6	-81.5	0	0	0	112.9	L429 L455 F456 K457 T461 Q462 V463	L429-H459 HydrophobicContact CD1-CB 4.42Å; L455-H459 PolarHBondContact O-CD2 3.48Å; L455-H459 PolarHBondContact O-N 2.92Å; F456-H459 CarbonylContact O-C 3.6Å; F456-H459 PolarHBondContact O-N 3.35Å; F456-H459 VanDerWaalsContact O-N 3.16Å; K457-H459 VanDerWaalsContact C-N 3.29Å; K457-H459 PolarHBondContact O-N 2.85Å; H459-T461 PolarHBondContact O-N 2.87Å; H459-Q462 PolarHBondContact O-N 3.4Å; H459-V463 HydrophobicContact CB-CB 4.1Å; H459-V463 HydrophobicContact CB-CG2 3.63Å; H459-V463 PolarHBondContact O-N 3.49Å
460	F	82.7	Confident	92.3	Very high	162 Å²	162	63.1 Å²	63.1	71%	0.711	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-23.5	-170.3	-176.7	-98.8	0	0	0	116	F456	F456-F460 PolarHBondContact O-N 3.04Å
461	T	85.3	Confident	92.5	Very high	100 Å²	100	60.8 Å²	60.8	61%	0.613	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-9.2	-179.9	58.5	0	0	0	0	114.5	H459	H459-T461 PolarHBondContact O-N 2.87Å
462	Q	87.1	Confident	92.7	Very high	76 Å²	76	58 Å²	58	36%	0.355	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.5	-20.2	179.4	-60.6	108.8	-15.1	0	0	113.2	L429 I440 H459	L429-Q462 HydrophobicContact CD1-CB 4.1Å; L429-Q462 HydrophobicContact CD2-CB 4.22Å; L429-Q462 HydrophobicContact CD2-CG 4.32Å; I440-Q462 PolarHBondContact N-O 2.95Å; H459-Q462 PolarHBondContact O-N 3.4Å
463	V	93.3	Very high	92.9	Very high	7 Å²	7	61 Å²	61	4%	0.042	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	122.4	-169.3	-178.9	0	0	0	0	111.7	L425 L429 I440 F442 F456 H459	L425-V463 HydrophobicContact CD1-CG2 4.28Å; L425-V463 HydrophobicContact CD2-CG2 3.85Å; L429-V463 HydrophobicContact CD1-CG2 4.23Å; I440-V463 HydrophobicContact CB-CG2 4.32Å; I440-V463 HydrophobicContact CD1-CG2 4.36Å; I440-V463 WeakPolarHBondContact O-CA 3.44Å; F442-V463 HydrophobicContact CD2-CG1 3.61Å; F442-V463 HydrophobicContact CE2-CG1 3.53Å; F456-V463 HydrophobicContact CD1-CG1 3.46Å; F456-V463 VanDerWaalsContact CD1-CG1 3.46Å; F456-V463 HydrophobicContact CE1-CG1 3.86Å; F456-V463 HydrophobicContact CG-CG1 4.28Å; H459-V463 HydrophobicContact CB-CB 4.1Å; H459-V463 HydrophobicContact CB-CG2 3.63Å; H459-V463 PolarHBondContact O-N 3.49Å
464	E	94.1	Very high	93.1	Very high	78 Å²	78	67 Å²	67	36%	0.364	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	149.8	170.9	-64.3	-165.4	168	0	0	111.1	Y401 I440 F442 Y466	Y401-E464 WeakPolarHBondContact CD2-OE2 3.32Å; I440-E464 PolarHBondContact O-N 3.29Å; F442-E464 PolarHBondContact N-O 2.89Å; E464-Y466 HydrophobicContact CB-CE2 4.22Å; E464-Y466 PolarHBondContact OE2-OH 2.85Å
465	F	96.1	Very high	93.3	Very high	14 Å²	14	65.3 Å²	65.3	6%	0.061	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	131.1	179.3	177.8	-81.1	0	0	0	111.4	Y397 I416 F442 H444 P448 F456 Q467	Y397-F465 HydrophobicContact CD1-CB 4.43Å; Y397-F465 AromaticContact CD1-CD1 3.63Å; Y397-F465 HydrophobicContact CD1-CD1 3.63Å; Y397-F465 HydrophobicContact CD1-CE1 4.46Å; Y397-F465 HydrophobicContact CD1-CG 4.49Å; Y397-F465 WeakPolarHBondContact CD1-O 3.36Å; Y397-F465 HydrophobicContact CD2-CD1 4.2Å; Y397-F465 HydrophobicContact CD2-CE1 4.29Å; Y397-F465 HydrophobicContact CE1-CD1 4.24Å; Y397-F465 AromaticContact CG-CD1 3.6Å; Y397-F465 HydrophobicContact CG-CD1 3.6Å; Y397-F465 AromaticContact CG-CE1 3.99Å; Y397-F465 HydrophobicContact CG-CE1 3.99Å; I416-F465 HydrophobicContact CG2-CE2 4.47Å; F442-F465 HydrophobicContact CB-CB 4.45Å; F442-F465 HydrophobicContact CB-CD2 3.67Å; F442-F465 HydrophobicContact CB-CE2 4.4Å; F442-F465 HydrophobicContact CB-CG 4.45Å; H444-F465 HydrophobicContact CB-CE2 3.75Å; H444-F465 HydrophobicContact CB-CZ 3.84Å; P448-F465 HydrophobicContact CG-CD1 4.32Å; P448-F465 HydrophobicContact CG-CE1 4.29Å; F456-F465 HydrophobicContact CD2-CB 3.91Å; F456-F465 HydrophobicContact CD2-CD2 4.44Å; F456-F465 HydrophobicContact CD2-CG 4.32Å; F456-F465 HydrophobicContact CE2-CB 3.65Å; F456-F465 AromaticContact CE2-CD2 3.39Å; F456-F465 HydrophobicContact CE2-CD2 3.39Å; F456-F465 HydrophobicContact CE2-CE2 4.27Å; F456-F465 AromaticContact CE2-CG 3.67Å; F456-F465 HydrophobicContact CE2-CG 3.67Å; F456-F465 HydrophobicContact CZ-CB 4.22Å; F456-F465 AromaticContact CZ-CD2 3.65Å; F456-F465 HydrophobicContact CZ-CD2 3.65Å; F456-F465 HydrophobicContact CZ-CG 4.28Å; F465-Q467 HydrophobicContact CE1-CB 4.24Å
466	Y	96.3	Very high	93.5	Very high	24 Å²	24	64 Å²	64	9%	0.094	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	130	176.7	-70.8	-72.5	0	0	0	111.9	G398 S400 Y401 V441 F442 H444 E464 G468 V479	G398-Y466 WeakPolarHBondContact O-CD1 3.44Å; G398-Y466 WeakPolarHBondContact O-CE1 3.32Å; S400-Y466 VanDerWaalsContact C-OH 3.24Å; S400-Y466 PolarHBondContact O-OH 3.49Å; Y401-Y466 VanDerWaalsContact CA-OH 3.26Å; Y401-Y466 WeakPolarHBondContact CA-OH 3.35Å; Y401-Y466 PolarHBondContact N-OH 3.29Å; V441-Y466 HydrophobicContact CG1-CD2 3.63Å; V441-Y466 HydrophobicContact CG1-CE2 3.93Å; F442-Y466 PolarHBondContact O-N 3.01Å; H444-Y466 PolarHBondContact N-O 2.87Å; E464-Y466 HydrophobicContact CB-CE2 4.22Å; E464-Y466 PolarHBondContact OE2-OH 2.85Å; Y466-G468 PolarHBondContact O-N 3.38Å; Y466-V479 HydrophobicContact CD2-CG1 4.11Å; Y466-V479 HydrophobicContact CG-CG1 4.37Å
467	Q	95.3	Very high	93.6	Very high	45 Å²	45	64.6 Å²	64.6	21%	0.21	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	108.6	177.1	-172.1	-171	19.7	0	0	110.7	Y397 H444 N445 F465 R478	Y397-Q467 PolarHBondContact O-N 3.23Å; H444-Q467 CarbonylContact O-C 3.47Å; H444-Q467 WeakPolarHBondContact O-CA 3.45Å; N445-Q467 VanDerWaalsContact O-CG 3.32Å; N445-Q467 WeakPolarHBondContact O-CG 3.17Å; N445-Q467 PolarHBondContact O-NE2 3.42Å; F465-Q467 HydrophobicContact CE1-CB 4.24Å; Q467-R478 VanDerWaalsContact C-NH2 3.3Å; Q467-R478 PolarHBondContact O-NH2 2.81Å
468	G	94.9	Very high	93.9	Very high	10 Å²	10	60.3 Å²	60.3	10%	0.103	30%	0.298	C	S	.	.			trans	-173.5	178.4	-178.5	0	0	0	0	0	112.7	H444 N445 Y466 D475	H444-G468 CarbonylContact C-O 3.58Å; H444-G468 PolarHBondContact O-N 3.39Å; H444-G468 VanDerWaalsContact O-O 3.12Å; N445-G468 WeakPolarHBondContact CA-O 3.16Å; N445-G468 PolarHBondContact N-O 3.28Å; Y466-G468 PolarHBondContact O-N 3.38Å; G468-D475 WeakPolarHBondContact CA-OD2 3.29Å
469	S	96.3	Very high	94.1	Very high	39 Å²	39	50.6 Å²	50.6	27%	0.273	26%	0.262	S	S	.	.			trans	-116.9	132.4	176.6	-177.5	0	0	0	0	111.2	L471 N472 D475	S469-L471 PolarHBondContact O-N 2.98Å; S469-L471 VanDerWaalsContact O-N 3.12Å; S469-L471 PolarHBondContact OG-N 2.75Å; S469-N472 WeakPolarHBondContact O-CB 3Å; S469-N472 PolarHBondContact O-N 3.05Å; S469-D475 PolarHBondContact N-OD2 2.74Å; S469-D475 WeakPolarHBondContact O-CB 3.41Å
470	V	96.9	Very high	94.5	Very high	8 Å²	8	51.5 Å²	51.5	5%	0.048	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-20.7	173.9	73.6	0	0	0	0	112.8	C413 L443 N472 L476 R508 S511 I512	C413-V470 HydrophobicContact CB-CB 4.47Å; L443-V470 HydrophobicContact CD2-CB 4.32Å; V470-N472 PolarHBondContact O-N 3.36Å; V470-L476 HydrophobicContact CB-CD2 4.48Å; V470-L476 HydrophobicContact CG2-CD2 3.64Å; V470-R508 HydrophobicContact CG1-CB 3.75Å; V470-R508 HydrophobicContact CG1-CG 3.54Å; V470-S511 PolarHBondContact O-OG 3.48Å; V470-S511 VanDerWaalsContact O-OG 3.05Å; V470-I512 HydrophobicContact CG2-CD1 3.77Å; V470-I512 HydrophobicContact CG2-CG1 3.48Å; V470-I512 VanDerWaalsContact CG2-CG1 3.48Å
471	L	97.1	Very high	95.2	Very high	95 Å²	95	43.9 Å²	43.9	50%	0.497	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-10.9	174.1	-56.8	178.9	0	0	0	113.6	S469 M507 S511	S469-L471 PolarHBondContact O-N 2.98Å; S469-L471 VanDerWaalsContact O-N 3.12Å; S469-L471 PolarHBondContact OG-N 2.75Å; L471-M507 HydrophobicContact CD2-CB 4.42Å; L471-S511 WeakPolarHBondContact CA-OG 3.37Å
472	N	97.3	Very high	95.7	Very high	57 Å²	57	42.4 Å²	42.4	31%	0.305	22%	0.218	S	C	.	.	S	Bend	trans	-102.9	116.3	-179.9	173.7	19.4	0	0	0	110.2	S469 V470 H474 D475 L476	S469-N472 WeakPolarHBondContact O-CB 3Å; S469-N472 PolarHBondContact O-N 3.05Å; V470-N472 PolarHBondContact O-N 3.36Å; N472-H474 PolarHBondContact O-N 2.87Å; N472-H474 VanDerWaalsContact O-N 3.11Å; N472-H474 PolarHBondContact OD1-N 3.26Å; N472-H474 VanDerWaalsContact OD1-N 3.16Å; N472-D475 HydrophobicContact CB-CB 4.29Å; N472-D475 PolarHBondContact ND2-OD2 2.87Å; N472-D475 PolarHBondContact O-N 3.22Å; N472-L476 PolarHBondContact O-N 2.95Å
473	P	96.3	Very high	96	Very high	69 Å²	69	42 Å²	42	45%	0.448	22%	0.224	S	C	.	.	H	α-helix	trans	-64	-20.8	-178	26.7	-35.4	0	0	0	113.6	A477 Y515	P473-A477 PolarHBondContact O-N 2.8Å; P473-A477 VanDerWaalsContact O-N 3.14Å; P473-Y515 HydrophobicContact CB-CD2 3.91Å; P473-Y515 HydrophobicContact CB-CE2 4.21Å
474	H	96.2	Very high	96.1	Very high	147 Å²	147	42.4 Å²	42.4	68%	0.681	23%	0.228	S	C	*	.	H	α-helix	trans	-71.8	-31.9	172.6	-65.5	-64.5	0	0	0	112.9	N472 R478	N472-H474 PolarHBondContact O-N 2.87Å; N472-H474 VanDerWaalsContact O-N 3.11Å; N472-H474 PolarHBondContact OD1-N 3.26Å; N472-H474 VanDerWaalsContact OD1-N 3.16Å; H474-R478 VanDerWaalsContact O-CB 3.26Å; H474-R478 WeakPolarHBondContact O-CB 3.43Å; H474-R478 PolarHBondContact O-N 3.27Å
475	D	96.9	Very high	96.2	Very high	21 Å²	21	41.3 Å²	41.3	11%	0.112	22%	0.224	C	C	.	.	H	α-helix	trans	-75.8	-36.1	175.7	-75.5	-45.8	0	0	0	111.1	L443 G468 S469 N472 R478 V479	L443-D475 HydrophobicContact CD1-CB 4.35Å; L443-D475 HydrophobicContact CD2-CB 4.42Å; G468-D475 WeakPolarHBondContact CA-OD2 3.29Å; S469-D475 PolarHBondContact N-OD2 2.74Å; S469-D475 WeakPolarHBondContact O-CB 3.41Å; N472-D475 HydrophobicContact CB-CB 4.29Å; N472-D475 PolarHBondContact ND2-OD2 2.87Å; N472-D475 PolarHBondContact O-N 3.22Å; D475-R478 VanDerWaalsContact O-CB 3.32Å; D475-R478 WeakPolarHBondContact O-CB 3.47Å; D475-R478 PolarHBondContact O-N 3.22Å; D475-R478 VanDerWaalsContact O-N 3.08Å; D475-R478 IonicContact OD1-CZ 2.69Å; D475-R478 VanDerWaalsContact OD1-CZ 3.26Å; D475-R478 IonicContact OD1-NE 2.59Å; D475-R478 PolarHBondContact OD1-NE 3.22Å; D475-R478 IonicContact OD1-NH2 2.62Å; D475-R478 PolarHBondContact OD1-NH2 3.44Å; D475-V479 PolarHBondContact O-N 3.18Å; D475-V479 VanDerWaalsContact O-N 3.08Å
476	L	97.4	Very high	96.2	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-56.8	-49.8	170.4	-68.9	-176.6	0	0	0	112.4	V470 N472 R478 V479 K480 I481 I512 Y515	V470-L476 HydrophobicContact CB-CD2 4.48Å; V470-L476 HydrophobicContact CG2-CD2 3.64Å; N472-L476 PolarHBondContact O-N 2.95Å; L476-R478 PolarHBondContact O-N 2.85Å; L476-V479 WeakPolarHBondContact O-CG2 3.47Å; L476-V479 PolarHBondContact O-N 3.46Å; L476-K480 PolarHBondContact O-N 3.45Å; L476-I481 HydrophobicContact CB-CG2 3.83Å; L476-I481 HydrophobicContact CD2-CB 4.47Å; L476-I481 HydrophobicContact CD2-CG1 4.38Å; L476-I481 HydrophobicContact CD2-CG2 4.38Å; L476-I481 PolarHBondContact O-N 2.89Å; L476-I512 HydrophobicContact CD2-CG1 4.38Å; L476-Y515 HydrophobicContact CB-CD1 4.23Å; L476-Y515 HydrophobicContact CB-CD2 4.17Å; L476-Y515 HydrophobicContact CB-CE1 4.38Å; L476-Y515 HydrophobicContact CB-CE2 4.32Å; L476-Y515 HydrophobicContact CB-CG 4.14Å; L476-Y515 HydrophobicContact CD1-CD1 4.39Å; L476-Y515 HydrophobicContact CD1-CD2 4.07Å; L476-Y515 HydrophobicContact CD1-CG 3.74Å
477	A	96.8	Very high	96.3	Very high	27 Å²	27	39.5 Å²	39.5	22%	0.223	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-21.1	175.2	0	0	0	0	0	113.7	P473 K480 Y515	P473-A477 PolarHBondContact O-N 2.8Å; P473-A477 VanDerWaalsContact O-N 3.14Å; A477-K480 WeakPolarHBondContact O-CE 3.44Å; A477-K480 PolarHBondContact O-NZ 2.6Å; A477-Y515 WeakPolarHBondContact CA-OH 3.42Å; A477-Y515 HydrophobicContact CB-CE2 4.49Å; A477-Y515 VanDerWaalsContact CB-OH 3.27Å; A477-Y515 WeakPolarHBondContact CB-OH 3.34Å
478	R	96.1	Very high	96.4	Very high	40 Å²	40	37.4 Å²	37.4	15%	0.151	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-30.9	-176.5	-171.9	169.4	70.1	87.1	-2.5	112.2	G399 S400 Y401 Q467 H474 D475 L476	G399-R478 WeakPolarHBondContact O-CD 3.39Å; G399-R478 WeakPolarHBondContact O-CG 3.42Å; G399-R478 PolarHBondContact O-NH1 3.44Å; S400-R478 CarbonylContact C-O 3.48Å; S400-R478 VanDerWaalsContact CA-O 3.29Å; S400-R478 WeakPolarHBondContact CA-O 3.42Å; S400-R478 WeakPolarHBondContact CB-O 3.37Å; Y401-R478 PolarHBondContact N-O 3.01Å; Q467-R478 VanDerWaalsContact C-NH2 3.3Å; Q467-R478 PolarHBondContact O-NH2 2.81Å; H474-R478 VanDerWaalsContact O-CB 3.26Å; H474-R478 WeakPolarHBondContact O-CB 3.43Å; H474-R478 PolarHBondContact O-N 3.27Å; D475-R478 VanDerWaalsContact O-CB 3.32Å; D475-R478 WeakPolarHBondContact O-CB 3.47Å; D475-R478 PolarHBondContact O-N 3.22Å; D475-R478 VanDerWaalsContact O-N 3.08Å; D475-R478 IonicContact OD1-CZ 2.69Å; D475-R478 VanDerWaalsContact OD1-CZ 3.26Å; D475-R478 IonicContact OD1-NE 2.59Å; D475-R478 PolarHBondContact OD1-NE 3.22Å; D475-R478 IonicContact OD1-NH2 2.62Å; D475-R478 PolarHBondContact OD1-NH2 3.44Å; L476-R478 PolarHBondContact O-N 2.85Å
479	V	96.8	Very high	96.6	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	5.1	170.9	-58.4	0	0	0	0	113.8	H409 V411 V441 L443 Y466 D475 L476 I481	H409-V479 PolarHBondContact NE2-O 3.24Å; V411-V479 HydrophobicContact CG1-CG2 4.02Å; V411-V479 HydrophobicContact CG2-CB 4.23Å; V411-V479 HydrophobicContact CG2-CG2 3.93Å; V441-V479 HydrophobicContact CG1-CB 4.01Å; V441-V479 HydrophobicContact CG1-CG1 4.01Å; L443-V479 HydrophobicContact CB-CG1 4.26Å; L443-V479 HydrophobicContact CD1-CG1 4Å; L443-V479 HydrophobicContact CD2-CG1 4.2Å; L443-V479 HydrophobicContact CD2-CG2 4.09Å; L443-V479 HydrophobicContact CG-CG1 4.38Å; Y466-V479 HydrophobicContact CD2-CG1 4.11Å; Y466-V479 HydrophobicContact CG-CG1 4.37Å; D475-V479 PolarHBondContact O-N 3.18Å; D475-V479 VanDerWaalsContact O-N 3.08Å; L476-V479 WeakPolarHBondContact O-CG2 3.47Å; L476-V479 PolarHBondContact O-N 3.46Å; V479-I481 HydrophobicContact CG2-CB 4.47Å; V479-I481 PolarHBondContact O-N 3.4Å
480	K	96.5	Very high	96.6	Very high	62 Å²	62	35.3 Å²	35.3	27%	0.27	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	45.7	179	-54.7	-68.5	161.3	-145.3	0	113.3	Y401 H409 L476 A477 E482 S483 A484	Y401-K480 HydrophobicContact CD1-CB 4.03Å; Y401-K480 HydrophobicContact CD1-CG 3.99Å; H409-K480 PolarHBondContact CE1-O 3.08Å; H409-K480 VanDerWaalsContact CE1-O 3.31Å; H409-K480 PolarHBondContact NE2-O 3.17Å; L476-K480 PolarHBondContact O-N 3.45Å; A477-K480 WeakPolarHBondContact O-CE 3.44Å; A477-K480 PolarHBondContact O-NZ 2.6Å; K480-E482 VanDerWaalsContact C-OE2 3.31Å; K480-E482 WeakPolarHBondContact CA-OE2 3.28Å; K480-E482 WeakPolarHBondContact CD-OE1 3.38Å; K480-E482 IonicContact NZ-OE1 2.68Å; K480-E482 PolarHBondContact NZ-OE1 3.12Å; K480-E482 PolarHBondContact O-N 3.46Å; K480-E482 VanDerWaalsContact O-N 3.16Å; K480-S483 PolarHBondContact O-N 3.47Å; K480-S483 PolarHBondContact O-OG 2.94Å; K480-A484 PolarHBondContact O-N 3.44Å; K480-A484 VanDerWaalsContact O-N 3.15Å
481	I	97	Very high	96.5	Very high	1 Å²	1	35 Å²	35	1%	0.005	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-57.5	-29.2	177.9	-157.9	67.2	0	0	0	111.5	V411 L476 V479 S483 A484 C487 I512 Y515 I519	V411-I481 HydrophobicContact CB-CD1 3.67Å; V411-I481 HydrophobicContact CG1-CD1 4.06Å; V411-I481 HydrophobicContact CG2-CD1 3.64Å; L476-I481 HydrophobicContact CB-CG2 3.83Å; L476-I481 HydrophobicContact CD2-CB 4.47Å; L476-I481 HydrophobicContact CD2-CG1 4.38Å; L476-I481 HydrophobicContact CD2-CG2 4.38Å; L476-I481 PolarHBondContact O-N 2.89Å; V479-I481 HydrophobicContact CG2-CB 4.47Å; V479-I481 PolarHBondContact O-N 3.4Å; I481-S483 PolarHBondContact O-N 3.32Å; I481-A484 HydrophobicContact CD1-CB 4.36Å; I481-A484 PolarHBondContact O-N 3.06Å; I481-C487 HydrophobicContact CD1-CB 4.07Å; I481-I512 HydrophobicContact CG1-CG2 4.21Å; I481-Y515 HydrophobicContact CG2-CD1 3.27Å; I481-Y515 HydrophobicContact CG2-CE1 3.36Å; I481-Y515 HydrophobicContact CG2-CG 4.32Å; I481-I519 HydrophobicContact CD1-CD1 3.48Å; I481-I519 VanDerWaalsContact CD1-CD1 3.48Å; I481-I519 HydrophobicContact CG1-CD1 3.6Å
482	E	94.8	Very high	96.2	Very high	70 Å²	70	32.1 Å²	32.1	33%	0.327	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-65	-14.9	177.2	67	-86.9	-160.9	0	0	114.8	K480 Y515	K480-E482 VanDerWaalsContact C-OE2 3.31Å; K480-E482 WeakPolarHBondContact CA-OE2 3.28Å; K480-E482 WeakPolarHBondContact CD-OE1 3.38Å; K480-E482 IonicContact NZ-OE1 2.68Å; K480-E482 PolarHBondContact NZ-OE1 3.12Å; K480-E482 PolarHBondContact O-N 3.46Å; K480-E482 VanDerWaalsContact O-N 3.16Å; E482-Y515 HydrophobicContact CB-CE1 4.37Å
483	S	94.3	Very high	95.8	Very high	68 Å²	68	30.7 Å²	30.7	48%	0.476	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-127.8	8.6	176.9	70.6	0	0	0	0	113.2	K480 I481	K480-S483 PolarHBondContact O-N 3.47Å; K480-S483 PolarHBondContact O-OG 2.94Å; I481-S483 PolarHBondContact O-N 3.32Å
484	A	95.9	Very high	95.2	Very high	15 Å²	15	30.2 Å²	30.2	12%	0.124	16%	0.155	C	C	.	.			trans	-74.5	148.2	174.4	0	0	0	0	0	110.5	H409 V411 K480 I481 I519	H409-A484 WeakPolarHBondContact O-CA 3.33Å; V411-A484 HydrophobicContact CG2-CB 4.04Å; K480-A484 PolarHBondContact O-N 3.44Å; K480-A484 VanDerWaalsContact O-N 3.15Å; I481-A484 HydrophobicContact CD1-CB 4.36Å; I481-A484 PolarHBondContact O-N 3.06Å; A484-I519 HydrophobicContact CB-CD1 4.14Å
485	D	95	Very high	94.7	Very high	55 Å²	55	23.8 Å²	23.8	29%	0.294	13%	0.126	S	C	.	.	S	Bend	trans	-76.8	-39	-179.4	-161.3	51.7	0	0	0	111.8	K408 H409 Y993	K408-D485 HydrophobicContact CB-CB 4.32Å; K408-D485 HydrophobicContact CD-CB 4.18Å; K408-D485 VanDerWaalsContact CE-OD1 3.3Å; K408-D485 WeakPolarHBondContact CE-OD1 3.1Å; K408-D485 IonicContact NZ-OD1 3.27Å; K408-D485 PolarHBondContact NZ-OD1 3.25Å; K408-D485 IonicContact NZ-OD2 2.68Å; K408-D485 PolarHBondContact NZ-OD2 3.41Å; H409-D485 PolarHBondContact O-N 2.97Å; D485-Y993 PolarHBondContact OD2-OH 2.93Å
486	A	96.3	Very high	93.9	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	159.5	173.6	0	0	0	0	0	111.4	I410 V411 L488 R520 Y993	I410-A486 WeakPolarHBondContact CA-O 3.3Å; I410-A486 HydrophobicContact CG2-CB 4.34Å; V411-A486 PolarHBondContact N-O 3.28Å; V411-A486 VanDerWaalsContact N-O 3.08Å; A486-L488 HydrophobicContact CB-CD1 4.1Å; A486-R520 CarbonylContact C-O 3.45Å; A486-R520 VanDerWaalsContact CA-O 3.29Å; A486-R520 WeakPolarHBondContact CA-O 3.26Å; A486-R520 HydrophobicContact CB-CB 4.2Å; A486-Y993 HydrophobicContact CB-CD2 3.77Å; A486-Y993 HydrophobicContact CB-CE2 3.74Å
487	C	97.8	Very high	93.4	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	125.4	166.6	-167	0	0	0	0	110.1	V411 I481 I512 I519 R520 I521 I522	V411-C487 CarbonylContact O-C 3.52Å; V411-C487 VanDerWaalsContact O-CA 3.29Å; V411-C487 WeakPolarHBondContact O-CA 3.3Å; I481-C487 HydrophobicContact CD1-CB 4.07Å; C487-I512 HydrophobicContact CB-CD1 4.33Å; C487-I512 VanDerWaalsContact SG-CD1 3.58Å; C487-I519 HydrophobicContact CB-CD1 3.97Å; C487-R520 PolarHBondContact N-O 2.67Å; C487-I521 HydrophobicContact CB-CG1 4.41Å; C487-I521 WeakPolarHBondContact O-CA 3.27Å; C487-I522 PolarHBondContact O-N 2.85Å
488	L	98.1	Very high	93.2	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	130.4	177.4	-72.8	75.8	0	0	0	109.4	I410 V411 V412 C413 F424 A486 I522 M989 Y993	I410-L488 HydrophobicContact CB-CD1 4.21Å; I410-L488 HydrophobicContact CD1-CD1 4.08Å; I410-L488 HydrophobicContact CG2-CD1 4.35Å; V411-L488 PolarHBondContact O-N 3.06Å; V412-L488 WeakPolarHBondContact CA-O 3.32Å; V412-L488 HydrophobicContact CG2-CB 4.39Å; C413-L488 PolarHBondContact N-O 3.42Å; F424-L488 HydrophobicContact CE2-CD2 3.51Å; F424-L488 HydrophobicContact CZ-CD2 3.78Å; A486-L488 HydrophobicContact CB-CD1 4.1Å; L488-I522 CarbonylContact C-O 3.56Å; L488-I522 WeakPolarHBondContact CA-O 3.5Å; L488-I522 HydrophobicContact CG-CB 4.39Å; L488-M989 HydrophobicContact CB-CE 3.87Å; L488-M989 HydrophobicContact CD2-CE 4.13Å; L488-M989 HydrophobicContact CG-CE 4.11Å; L488-Y993 HydrophobicContact CD1-CD2 4.44Å
489	I	98.1	Very high	92.9	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	112.2	-179.3	-45.5	-177.1	0	0	0	109.1	C413 N505 R508 V509 I512 I521 I522 Q524	C413-I489 WeakPolarHBondContact O-CA 3.29Å; I489-N505 WeakPolarHBondContact CG2-OD1 3.5Å; I489-R508 HydrophobicContact CD1-CB 4.13Å; I489-V509 HydrophobicContact CD1-CG2 3.58Å; I489-I512 HydrophobicContact CD1-CD1 3.85Å; I489-I512 HydrophobicContact CG1-CD1 4.43Å; I489-I521 HydrophobicContact CD1-CG2 3.85Å; I489-I521 HydrophobicContact CG1-CG2 4.19Å; I489-I522 PolarHBondContact N-O 3.34Å; I489-Q524 PolarHBondContact O-N 3.18Å
490	L	96.2	Very high	92.8	Very high	6 Å²	6	33.7 Å²	33.7	3%	0.031	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	139.2	177.7	-57.6	177.1	0	0	0	110.4	V412 C413 G414 H415 M989	V412-L490 HydrophobicContact CG1-CD1 3.88Å; V412-L490 HydrophobicContact CG1-CG 4.13Å; C413-L490 PolarHBondContact O-N 2.86Å; G414-L490 CarbonylContact C-O 3.53Å; G414-L490 WeakPolarHBondContact CA-O 3.34Å; H415-L490 PolarHBondContact N-O 3.4Å; L490-M989 HydrophobicContact CD2-CE 4.16Å; L490-M989 HydrophobicContact CD2-CG 4.29Å
491	A	95.1	Very high	92.7	Very high	2 Å²	2	32.1 Å²	32.1	2%	0.017	19%	0.191	C	C	.	.			trans	-102.7	151.3	177.4	0	0	0	0	0	111.4	K493 N505 Q524 L526	A491-K493 PolarHBondContact O-N 3.18Å; A491-N505 WeakPolarHBondContact CB-ND2 3.36Å; A491-Q524 HydrophobicContact CB-CB 3.73Å; A491-L526 HydrophobicContact CB-CD2 4.09Å; A491-L526 HydrophobicContact CB-CG 4.44Å
492	N	91.9	Very high	92.7	Very high	34 Å²	34	32 Å²	32	18%	0.182	19%	0.191	C	C	.	.			trans	-75.7	105.9	166	-176.8	3.9	0	0	0	109.3	H415 Y494 C495 E501 L526	H415-N492 HydrophobicContact CB-CB 4.11Å; N492-Y494 PolarHBondContact O-N 3.22Å; N492-Y494 PolarHBondContact OD1-N 3.07Å; N492-C495 HydrophobicContact CB-CB 4.14Å; N492-C495 PolarHBondContact O-SG 3.41Å; N492-C495 VanDerWaalsContact O-SG 3.4Å; N492-E501 HydrophobicContact CB-CG 4.26Å; N492-L526 WeakPolarHBondContact O-CD1 3.5Å
493	K	88.1	Confident	92.8	Very high	26 Å²	26	31 Å²	31	11%	0.113	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-23.9	178.5	-62.5	-171.4	-74.4	-79.3	0	113.5	A491 L551 V982 D986	A491-K493 PolarHBondContact O-N 3.18Å; K493-L551 HydrophobicContact CD-CD1 3.92Å; K493-L551 HydrophobicContact CG-CD1 3.74Å; K493-V982 HydrophobicContact CD-CG1 4.12Å; K493-V982 HydrophobicContact CD-CG2 4.04Å; K493-D986 IonicContact NZ-OD1 3.75Å; K493-D986 PolarHBondContact NZ-OD1 3.04Å; K493-D986 IonicContact NZ-OD2 3.33Å; K493-D986 PolarHBondContact NZ-OD2 3.12Å
494	Y	83.4	Confident	92.9	Very high	60 Å²	60	30.1 Å²	30.1	24%	0.235	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.6	31	-169.2	-43.9	-60.1	0	0	0	111.6	N492 V948 V982	N492-Y494 PolarHBondContact O-N 3.22Å; N492-Y494 PolarHBondContact OD1-N 3.07Å; Y494-V948 HydrophobicContact CD1-CG1 3.54Å; Y494-V948 HydrophobicContact CE1-CG1 3.34Å; Y494-V948 PolarHBondContact OH-O 3.14Å; Y494-V948 VanDerWaalsContact OH-O 3.1Å; Y494-V982 HydrophobicContact CE1-CG1 4.07Å
495	C	85.4	Confident	93	Very high	12 Å²	12	29.4 Å²	29.4	8%	0.081	18%	0.182	C	C	.	.			trans	-77.8	148	178.5	61.1	0	0	0	0	112.4	N492 D497 E501 L526 N873	N492-C495 HydrophobicContact CB-CB 4.14Å; N492-C495 PolarHBondContact O-SG 3.41Å; N492-C495 VanDerWaalsContact O-SG 3.4Å; C495-D497 VanDerWaalsContact C-N 3.34Å; C495-D497 PolarHBondContact O-N 3.44Å; C495-E501 HydrophobicContact CB-CB 4.3Å; C495-L526 WeakPolarHBondContact SG-CD1 3.34Å; C495-N873 VanDerWaalsContact O-CG 3.23Å; C495-N873 PolarHBondContact O-ND2 3.25Å
496	A	81.3	Confident	93.1	Very high	86 Å²	86	27.6 Å²	27.6	71%	0.711	17%	0.172	S	C	*	.	S	Bend	trans	-54.8	-45.7	178.7	0	0	0	0	0	113.5	N873	A496-N873 PolarHBondContact O-ND2 3.13Å
497	D	87.2	Confident	93.2	Very high	84 Å²	84	32.6 Å²	32.6	45%	0.449	20%	0.197	S	C	.	.			trans	-122	105.4	179.3	179	-2.5	0	0	0	110.1	C495 D499 A500 E501	C495-D497 VanDerWaalsContact C-N 3.34Å; C495-D497 PolarHBondContact O-N 3.44Å; D497-D499 VanDerWaalsContact C-N 3.3Å; D497-D499 PolarHBondContact O-N 3.08Å; D497-D499 PolarHBondContact OD1-N 3.14Å; D497-A500 HydrophobicContact CB-CB 4.03Å; D497-A500 PolarHBondContact O-N 3.23Å; D497-A500 PolarHBondContact OD1-N 2.95Å; D497-E501 PolarHBondContact O-N 3.11Å
498	P	91.3	Very high	93.2	Very high	15 Å²	15	34.9 Å²	34.9	10%	0.097	21%	0.206	C	C	.	.	H	α-helix	trans	-60.8	-32.4	177.7	-27.5	37.4	0	0	0	114.9	A500 D502 L526 Q527 A795	P498-A500 VanDerWaalsContact C-N 3.34Å; P498-D502 WeakPolarHBondContact O-CB 3.44Å; P498-D502 PolarHBondContact O-N 3.27Å; P498-L526 HydrophobicContact CB-CB 3.97Å; P498-L526 HydrophobicContact CB-CD1 3.85Å; P498-Q527 HydrophobicContact CB-CG 4.1Å; P498-A795 HydrophobicContact CG-CB 3.9Å
499	D	91.6	Very high	93.2	Very high	62 Å²	62	34.9 Å²	34.9	33%	0.332	21%	0.206	S	C	.	.	H	α-helix	trans	-71.8	-32.5	-178.6	-70.6	-50.2	0	0	0	111.1	D497 A503 H529 N530	D497-D499 VanDerWaalsContact C-N 3.3Å; D497-D499 PolarHBondContact O-N 3.08Å; D497-D499 PolarHBondContact OD1-N 3.14Å; D499-A503 VanDerWaalsContact O-CB 3.27Å; D499-A503 WeakPolarHBondContact O-CB 3.49Å; D499-A503 PolarHBondContact O-N 3.48Å; D499-H529 IonicContact OD1-CD2 2.71Å; D499-H529 IonicContact OD1-CE1 2.68Å; D499-H529 IonicContact OD1-NE2 2.65Å; D499-H529 PolarHBondContact OD1-NE2 3.47Å; D499-H529 IonicContact OD2-NE2 3.5Å; D499-N530 PolarHBondContact OD1-ND2 3.28Å
500	A	93.4	Very high	93.2	Very high	49 Å²	49	38.1 Å²	38.1	41%	0.405	22%	0.222	S	C	.	.	H	α-helix	trans	-71.6	-37.2	175.7	0	0	0	0	0	113.7	D497 P498 S504	D497-A500 HydrophobicContact CB-CB 4.03Å; D497-A500 PolarHBondContact O-N 3.23Å; D497-A500 PolarHBondContact OD1-N 2.95Å; P498-A500 VanDerWaalsContact C-N 3.34Å; A500-S504 WeakPolarHBondContact O-CB 3.47Å; A500-S504 PolarHBondContact O-N 3.07Å; A500-S504 PolarHBondContact O-OG 3.36Å
501	E	95.2	Very high	93.3	Very high	29 Å²	29	38.9 Å²	38.9	14%	0.136	23%	0.228	C	C	.	.	H	α-helix	trans	-71.5	-39.6	174.3	-175.5	59.5	-151.4	0	0	111	N492 C495 D497 S504 N505 R508 L526	N492-E501 HydrophobicContact CB-CG 4.26Å; C495-E501 HydrophobicContact CB-CB 4.3Å; D497-E501 PolarHBondContact O-N 3.11Å; E501-S504 CarbonylContact O-C 3.48Å; E501-S504 WeakPolarHBondContact O-CA 3.25Å; E501-S504 WeakPolarHBondContact O-CB 3.33Å; E501-S504 PolarHBondContact O-N 3.16Å; E501-N505 PolarHBondContact O-N 3.07Å; E501-N505 PolarHBondContact O-ND2 2.88Å; E501-R508 IonicContact OE1-CZ 3.85Å; E501-R508 IonicContact OE1-NH1 2.71Å; E501-R508 PolarHBondContact OE1-NH1 2.82Å; E501-R508 IonicContact OE1-NH2 3.82Å; E501-R508 PolarHBondContact OE1-NH2 3.33Å; E501-L526 HydrophobicContact CB-CD1 4.15Å; E501-L526 HydrophobicContact CG-CD1 4.38Å
502	D	96.6	Very high	93.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-62.1	-45.3	173	-84.8	-9.8	0	0	0	112.4	P498 S504 N505 I506 M525 L526 Q527 N530	P498-D502 WeakPolarHBondContact O-CB 3.44Å; P498-D502 PolarHBondContact O-N 3.27Å; D502-S504 PolarHBondContact O-N 2.88Å; D502-N505 WeakPolarHBondContact O-CB 3.11Å; D502-N505 PolarHBondContact O-N 3.32Å; D502-N505 VanDerWaalsContact O-N 3.11Å; D502-I506 WeakPolarHBondContact O-CD1 3.47Å; D502-I506 VanDerWaalsContact O-CG1 3.31Å; D502-I506 WeakPolarHBondContact O-CG1 3.41Å; D502-I506 PolarHBondContact O-N 2.87Å; D502-M525 HydrophobicContact CB-CE 3.7Å; D502-M525 WeakPolarHBondContact OD1-CA 3.22Å; D502-L526 PolarHBondContact OD1-N 2.86Å; D502-L526 PolarHBondContact OD2-N 3.33Å; D502-Q527 PolarHBondContact OD2-N 3.1Å; D502-N530 HydrophobicContact CB-CB 3.85Å; D502-N530 VanDerWaalsContact CB-ND2 3.27Å; D502-N530 WeakPolarHBondContact CB-ND2 3.22Å; D502-N530 PolarHBondContact OD2-ND2 3.3Å
503	A	96.5	Very high	93.7	Very high	49 Å²	49	37.4 Å²	37.4	41%	0.405	22%	0.22	S	C	.	.	H	α-helix	trans	-59.1	-38.4	173.4	0	0	0	0	0	111.6	D499 I506 M507	D499-A503 VanDerWaalsContact O-CB 3.27Å; D499-A503 WeakPolarHBondContact O-CB 3.49Å; D499-A503 PolarHBondContact O-N 3.48Å; A503-I506 PolarHBondContact O-N 2.9Å; A503-M507 WeakPolarHBondContact O-CG 3.41Å; A503-M507 PolarHBondContact O-N 2.83Å
504	S	96.6	Very high	94.1	Very high	49 Å²	49	42.9 Å²	42.9	34%	0.343	25%	0.251	S	S	.	.	H	α-helix	trans	-64.1	-43.2	173.7	-61.4	0	0	0	0	111.7	A500 E501 D502 M507 R508	A500-S504 WeakPolarHBondContact O-CB 3.47Å; A500-S504 PolarHBondContact O-N 3.07Å; A500-S504 PolarHBondContact O-OG 3.36Å; E501-S504 CarbonylContact O-C 3.48Å; E501-S504 WeakPolarHBondContact O-CA 3.25Å; E501-S504 WeakPolarHBondContact O-CB 3.33Å; E501-S504 PolarHBondContact O-N 3.16Å; D502-S504 PolarHBondContact O-N 2.88Å; S504-M507 PolarHBondContact O-N 3.08Å; S504-R508 VanDerWaalsContact O-CG 3.27Å; S504-R508 WeakPolarHBondContact O-CG 3.38Å; S504-R508 PolarHBondContact O-N 3.36Å
505	N	97.6	Very high	94.8	Very high	0 Å²	0	44 Å²	44	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62.2	-45.5	174.3	-76.6	-37.7	0	0	0	112.7	I489 A491 E501 D502 M507 R508 V509 M525	I489-N505 WeakPolarHBondContact CG2-OD1 3.5Å; A491-N505 WeakPolarHBondContact CB-ND2 3.36Å; E501-N505 PolarHBondContact O-N 3.07Å; E501-N505 PolarHBondContact O-ND2 2.88Å; D502-N505 WeakPolarHBondContact O-CB 3.11Å; D502-N505 PolarHBondContact O-N 3.32Å; D502-N505 VanDerWaalsContact O-N 3.11Å; N505-M507 VanDerWaalsContact C-N 3.28Å; N505-M507 PolarHBondContact O-N 3Å; N505-R508 WeakPolarHBondContact O-CA 3.2Å; N505-R508 WeakPolarHBondContact O-CB 3.45Å; N505-R508 PolarHBondContact O-N 3.04Å; N505-R508 PolarHBondContact OD1-NH1 2.87Å; N505-V509 WeakPolarHBondContact O-CG2 3.17Å; N505-V509 PolarHBondContact O-N 2.84Å; N505-M525 HydrophobicContact CB-SD 4.49Å
506	I	98.1	Very high	95.3	Very high	16 Å²	16	46.3 Å²	46.3	8%	0.082	26%	0.264	C	S	.	.	H	α-helix	trans	-57.8	-41.9	175.7	-67.1	157.4	0	0	0	110.6	D502 A503 R508 V509 I510 M525 N530 H533 L534	D502-I506 WeakPolarHBondContact O-CD1 3.47Å; D502-I506 VanDerWaalsContact O-CG1 3.31Å; D502-I506 WeakPolarHBondContact O-CG1 3.41Å; D502-I506 PolarHBondContact O-N 2.87Å; A503-I506 PolarHBondContact O-N 2.9Å; I506-R508 VanDerWaalsContact C-N 3.35Å; I506-R508 PolarHBondContact O-N 2.98Å; I506-V509 WeakPolarHBondContact O-CB 3.21Å; I506-V509 PolarHBondContact O-N 3.43Å; I506-I510 HydrophobicContact CG2-CD1 3.89Å; I506-I510 HydrophobicContact CG2-CG1 4.48Å; I506-I510 VanDerWaalsContact O-CG1 3.31Å; I506-I510 WeakPolarHBondContact O-CG1 3.22Å; I506-I510 PolarHBondContact O-N 3.07Å; I506-M525 HydrophobicContact CD1-CE 3.83Å; I506-M525 HydrophobicContact CG1-CE 3.88Å; I506-N530 HydrophobicContact CD1-CB 4.28Å; I506-H533 HydrophobicContact CD1-CB 3.91Å; I506-L534 HydrophobicContact CB-CD2 4.43Å; I506-L534 HydrophobicContact CG1-CD2 3.86Å; I506-L534 HydrophobicContact CG1-CG 4.35Å; I506-L534 HydrophobicContact CG2-CD2 4.47Å
507	M	97.6	Very high	96	Very high	106 Å²	106	45.4 Å²	45.4	52%	0.522	25%	0.251	S	S	.	.	H	α-helix	trans	-65.6	-33.9	174.9	-71.1	-57.9	-58.7	0	0	113.3	L471 A503 S504 N505 I510 S511	L471-M507 HydrophobicContact CD2-CB 4.42Å; A503-M507 WeakPolarHBondContact O-CG 3.41Å; A503-M507 PolarHBondContact O-N 2.83Å; S504-M507 PolarHBondContact O-N 3.08Å; N505-M507 VanDerWaalsContact C-N 3.28Å; N505-M507 PolarHBondContact O-N 3Å; M507-I510 HydrophobicContact SD-CD1 4.07Å; M507-S511 PolarHBondContact O-N 3.19Å; M507-S511 VanDerWaalsContact O-N 3.07Å
508	R	98.1	Very high	96.4	Very high	47 Å²	47	49.3 Å²	49.3	18%	0.177	26%	0.264	C	S	.	.	H	α-helix	trans	-63.6	-47.2	171.6	-62.4	166.4	-170	147	4.1	110.2	V470 I489 E501 S504 N505 I506 I510 S511 I512	V470-R508 HydrophobicContact CG1-CB 3.75Å; V470-R508 HydrophobicContact CG1-CG 3.54Å; I489-R508 HydrophobicContact CD1-CB 4.13Å; E501-R508 IonicContact OE1-CZ 3.85Å; E501-R508 IonicContact OE1-NH1 2.71Å; E501-R508 PolarHBondContact OE1-NH1 2.82Å; E501-R508 IonicContact OE1-NH2 3.82Å; E501-R508 PolarHBondContact OE1-NH2 3.33Å; S504-R508 VanDerWaalsContact O-CG 3.27Å; S504-R508 WeakPolarHBondContact O-CG 3.38Å; S504-R508 PolarHBondContact O-N 3.36Å; N505-R508 WeakPolarHBondContact O-CA 3.2Å; N505-R508 WeakPolarHBondContact O-CB 3.45Å; N505-R508 PolarHBondContact O-N 3.04Å; N505-R508 PolarHBondContact OD1-NH1 2.87Å; I506-R508 VanDerWaalsContact C-N 3.35Å; I506-R508 PolarHBondContact O-N 2.98Å; R508-I510 PolarHBondContact O-N 3.24Å; R508-S511 PolarHBondContact O-N 3.41Å; R508-I512 WeakPolarHBondContact O-CD1 3.34Å; R508-I512 WeakPolarHBondContact O-CG1 3.39Å; R508-I512 PolarHBondContact O-N 3.11Å; R508-I512 VanDerWaalsContact O-N 3.12Å
509	V	98.3	Very high	96.7	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-57	-49.4	174.9	177.2	0	0	0	0	111.5	I489 N505 I506 S511 I512 K513 I521 T523 L534 I537 W540	I489-V509 HydrophobicContact CD1-CG2 3.58Å; N505-V509 WeakPolarHBondContact O-CG2 3.17Å; N505-V509 PolarHBondContact O-N 2.84Å; I506-V509 WeakPolarHBondContact O-CB 3.21Å; I506-V509 PolarHBondContact O-N 3.43Å; V509-S511 VanDerWaalsContact C-N 3.31Å; V509-S511 PolarHBondContact O-N 2.97Å; V509-I512 PolarHBondContact O-N 3.49Å; V509-K513 HydrophobicContact CG1-CG 4.25Å; V509-K513 WeakPolarHBondContact O-CB 3.31Å; V509-K513 PolarHBondContact O-N 3.29Å; V509-I521 HydrophobicContact CG1-CD1 4.13Å; V509-I521 HydrophobicContact CG2-CG2 4.22Å; V509-T523 HydrophobicContact CG2-CG2 4.33Å; V509-L534 HydrophobicContact CB-CD2 4.15Å; V509-L534 HydrophobicContact CG1-CD2 4.1Å; V509-L534 HydrophobicContact CG2-CD2 3.96Å; V509-I537 HydrophobicContact CB-CD1 4.45Å; V509-I537 HydrophobicContact CG1-CD1 3.83Å; V509-W540 HydrophobicContact CG1-CE3 3.82Å; V509-W540 HydrophobicContact CG1-CZ3 3.85Å
510	I	98	Very high	96.9	Very high	68 Å²	68	47.2 Å²	47.2	35%	0.349	25%	0.25	S	S	.	.	H	α-helix	trans	-58.4	-43.6	179.3	-69.7	166.2	0	0	0	110.8	I506 M507 R508 N514 I537	I506-I510 HydrophobicContact CG2-CD1 3.89Å; I506-I510 HydrophobicContact CG2-CG1 4.48Å; I506-I510 VanDerWaalsContact O-CG1 3.31Å; I506-I510 WeakPolarHBondContact O-CG1 3.22Å; I506-I510 PolarHBondContact O-N 3.07Å; M507-I510 HydrophobicContact SD-CD1 4.07Å; R508-I510 PolarHBondContact O-N 3.24Å; I510-N514 WeakPolarHBondContact O-CB 3.33Å; I510-N514 PolarHBondContact O-N 3.45Å; I510-I537 HydrophobicContact CD1-CD1 4.44Å; I510-I537 HydrophobicContact CG1-CD1 3.66Å; I510-I537 HydrophobicContact CG1-CG1 4.15Å
511	S	98.1	Very high	97.2	Very high	23 Å²	23	44.9 Å²	44.9	16%	0.161	23%	0.231	C	C	.	.	H	α-helix	trans	-62.1	-45.9	179	-165.4	0	0	0	0	112.4	V470 L471 M507 R508 V509 N514 Y515	V470-S511 PolarHBondContact O-OG 3.48Å; V470-S511 VanDerWaalsContact O-OG 3.05Å; L471-S511 WeakPolarHBondContact CA-OG 3.37Å; M507-S511 PolarHBondContact O-N 3.19Å; M507-S511 VanDerWaalsContact O-N 3.07Å; R508-S511 PolarHBondContact O-N 3.41Å; V509-S511 VanDerWaalsContact C-N 3.31Å; V509-S511 PolarHBondContact O-N 2.97Å; S511-N514 PolarHBondContact O-N 3.35Å; S511-Y515 PolarHBondContact O-N 2.85Å; S511-Y515 VanDerWaalsContact O-N 3.15Å
512	I	98.1	Very high	97.3	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64	-51	178.3	-60.3	156.2	0	0	0	110.8	V470 L476 I481 C487 I489 R508 V509 N514 Y515 H516 I519 I521	V470-I512 HydrophobicContact CG2-CD1 3.77Å; V470-I512 HydrophobicContact CG2-CG1 3.48Å; V470-I512 VanDerWaalsContact CG2-CG1 3.48Å; L476-I512 HydrophobicContact CD2-CG1 4.38Å; I481-I512 HydrophobicContact CG1-CG2 4.21Å; C487-I512 HydrophobicContact CB-CD1 4.33Å; C487-I512 VanDerWaalsContact SG-CD1 3.58Å; I489-I512 HydrophobicContact CD1-CD1 3.85Å; I489-I512 HydrophobicContact CG1-CD1 4.43Å; R508-I512 WeakPolarHBondContact O-CD1 3.34Å; R508-I512 WeakPolarHBondContact O-CG1 3.39Å; R508-I512 PolarHBondContact O-N 3.11Å; R508-I512 VanDerWaalsContact O-N 3.12Å; V509-I512 PolarHBondContact O-N 3.49Å; I512-N514 VanDerWaalsContact C-N 3.28Å; I512-N514 PolarHBondContact O-N 2.58Å; I512-Y515 PolarHBondContact O-N 3.36Å; I512-H516 PolarHBondContact O-N 3.47Å; I512-I519 HydrophobicContact CG2-CG2 3.53Å; I512-I521 HydrophobicContact CB-CD1 3.79Å; I512-I521 HydrophobicContact CD1-CD1 4.2Å; I512-I521 HydrophobicContact CG2-CD1 3.6Å; I512-I521 HydrophobicContact CG2-CG1 4.24Å
513	K	97.3	Very high	97.3	Very high	4 Å²	4	43.5 Å²	43.5	2%	0.017	22%	0.224	C	C	.	.	H	α-helix	trans	-63.9	-31.5	-179.4	-74.1	-59.7	-165.6	173.9	0	112.9	V509 Y515 H516 P517 I519 I521 S539 D546	V509-K513 HydrophobicContact CG1-CG 4.25Å; V509-K513 WeakPolarHBondContact O-CB 3.31Å; V509-K513 PolarHBondContact O-N 3.29Å; K513-Y515 VanDerWaalsContact C-N 3.35Å; K513-H516 CarbonylContact O-C 3.43Å; K513-P517 WeakPolarHBondContact CD-O 3.21Å; K513-P517 PolarHBondContact NZ-O 3.49Å; K513-P517 VanDerWaalsContact NZ-O 3.09Å; K513-P517 VanDerWaalsContact O-CA 3.29Å; K513-P517 WeakPolarHBondContact O-CA 3.06Å; K513-P517 WeakPolarHBondContact O-CD 3.45Å; K513-P517 WeakPolarHBondContact O-CG 3.29Å; K513-I519 PolarHBondContact NZ-O 2.7Å; K513-I521 HydrophobicContact CD-CD1 3.78Å; K513-I521 HydrophobicContact CD-CG1 4.49Å; K513-I521 HydrophobicContact CG-CD1 3.68Å; K513-S539 WeakPolarHBondContact CD-O 3.34Å; K513-S539 WeakPolarHBondContact CE-O 3.31Å; K513-S539 PolarHBondContact NZ-O 3.36Å; K513-S539 VanDerWaalsContact NZ-O 3.13Å; K513-D546 WeakPolarHBondContact CE-OD1 3.16Å; K513-D546 VanDerWaalsContact CE-OD2 3.26Å; K513-D546 WeakPolarHBondContact CE-OD2 3.24Å; K513-D546 IonicContact NZ-OD1 3.46Å; K513-D546 PolarHBondContact NZ-OD1 3.04Å; K513-D546 IonicContact NZ-OD2 3.69Å; K513-D546 PolarHBondContact NZ-OD2 3.23Å
514	N	97.2	Very high	97.3	Very high	142 Å²	142	41.3 Å²	41.3	76%	0.759	21%	0.206	S	C	*	.	H	α-helix	trans	-70.5	-30.8	173.6	-171.9	40.1	0	0	0	112.4	I510 S511 I512	I510-N514 WeakPolarHBondContact O-CB 3.33Å; I510-N514 PolarHBondContact O-N 3.45Å; S511-N514 PolarHBondContact O-N 3.35Å; I512-N514 VanDerWaalsContact C-N 3.28Å; I512-N514 PolarHBondContact O-N 2.58Å
515	Y	97.4	Very high	97.3	Very high	84 Å²	84	39 Å²	39	33%	0.329	19%	0.189	S	C	.	.	H	α-helix	trans	-79.1	-46.9	175.4	-173.5	-87.8	0	0	0	112.6	P473 L476 A477 I481 E482 S511 I512 K513	P473-Y515 HydrophobicContact CB-CD2 3.91Å; P473-Y515 HydrophobicContact CB-CE2 4.21Å; L476-Y515 HydrophobicContact CB-CD1 4.23Å; L476-Y515 HydrophobicContact CB-CD2 4.17Å; L476-Y515 HydrophobicContact CB-CE1 4.38Å; L476-Y515 HydrophobicContact CB-CE2 4.32Å; L476-Y515 HydrophobicContact CB-CG 4.14Å; L476-Y515 HydrophobicContact CD1-CD1 4.39Å; L476-Y515 HydrophobicContact CD1-CD2 4.07Å; L476-Y515 HydrophobicContact CD1-CG 3.74Å; A477-Y515 WeakPolarHBondContact CA-OH 3.42Å; A477-Y515 HydrophobicContact CB-CE2 4.49Å; A477-Y515 VanDerWaalsContact CB-OH 3.27Å; A477-Y515 WeakPolarHBondContact CB-OH 3.34Å; I481-Y515 HydrophobicContact CG2-CD1 3.27Å; I481-Y515 HydrophobicContact CG2-CE1 3.36Å; I481-Y515 HydrophobicContact CG2-CG 4.32Å; E482-Y515 HydrophobicContact CB-CE1 4.37Å; S511-Y515 PolarHBondContact O-N 2.85Å; S511-Y515 VanDerWaalsContact O-N 3.15Å; I512-Y515 PolarHBondContact O-N 3.36Å; K513-Y515 VanDerWaalsContact C-N 3.35Å
516	H	96.8	Very high	97.1	Very high	59 Å²	59	39.6 Å²	39.6	27%	0.273	19%	0.193	S	C	.	.			trans	-142.4	95.7	177.9	-166.2	89.6	0	0	0	111.2	I512 K513 K518 I519	I512-H516 PolarHBondContact O-N 3.47Å; K513-H516 CarbonylContact O-C 3.43Å; H516-K518 VanDerWaalsContact C-N 3.27Å; H516-K518 PolarHBondContact O-N 3.06Å; H516-K518 VanDerWaalsContact O-N 3.15Å; H516-I519 PolarHBondContact CD2-N 3.2Å; H516-I519 VanDerWaalsContact O-CG2 3.24Å; H516-I519 WeakPolarHBondContact O-CG2 3.17Å; H516-I519 PolarHBondContact O-N 2.86Å
517	P	95.9	Very high	96.8	Very high	67 Å²	67	39.4 Å²	39.4	44%	0.435	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-29.7	-172.7	-28.5	34.6	0	0	0	115.9	K513	K513-P517 WeakPolarHBondContact CD-O 3.21Å; K513-P517 PolarHBondContact NZ-O 3.49Å; K513-P517 VanDerWaalsContact NZ-O 3.09Å; K513-P517 VanDerWaalsContact O-CA 3.29Å; K513-P517 WeakPolarHBondContact O-CA 3.06Å; K513-P517 WeakPolarHBondContact O-CD 3.45Å; K513-P517 WeakPolarHBondContact O-CG 3.29Å
518	K	95.4	Very high	96.5	Very high	166 Å²	166	35 Å²	35	72%	0.722	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-0.2	-172.4	-63.9	-170.8	174.6	-168.9	0	115.1	H516	H516-K518 VanDerWaalsContact C-N 3.27Å; H516-K518 PolarHBondContact O-N 3.06Å; H516-K518 VanDerWaalsContact O-N 3.15Å
519	I	96.3	Very high	96	Very high	6 Å²	6	35.3 Å²	35.3	3%	0.031	17%	0.172	C	C	.	.	S	Bend	trans	-74.3	138	179	-170.7	173.2	0	0	0	109.2	I481 A484 C487 I512 K513 H516 I521	I481-I519 HydrophobicContact CD1-CD1 3.48Å; I481-I519 VanDerWaalsContact CD1-CD1 3.48Å; I481-I519 HydrophobicContact CG1-CD1 3.6Å; A484-I519 HydrophobicContact CB-CD1 4.14Å; C487-I519 HydrophobicContact CB-CD1 3.97Å; I512-I519 HydrophobicContact CG2-CG2 3.53Å; K513-I519 PolarHBondContact NZ-O 2.7Å; H516-I519 PolarHBondContact CD2-N 3.2Å; H516-I519 VanDerWaalsContact O-CG2 3.24Å; H516-I519 WeakPolarHBondContact O-CG2 3.17Å; H516-I519 PolarHBondContact O-N 2.86Å; I519-I521 HydrophobicContact CG2-CD1 4.26Å; I519-I521 HydrophobicContact CG2-CG1 4.01Å
520	R	97.3	Very high	95.7	Very high	28 Å²	28	36 Å²	36	11%	0.106	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	126.7	170.5	-172.8	-177.3	174.7	-171.2	4	110.3	A486 C487 G545 D547 T992 Y993 D996	A486-R520 CarbonylContact C-O 3.45Å; A486-R520 VanDerWaalsContact CA-O 3.29Å; A486-R520 WeakPolarHBondContact CA-O 3.26Å; A486-R520 HydrophobicContact CB-CB 4.2Å; C487-R520 PolarHBondContact N-O 2.67Å; R520-G545 WeakPolarHBondContact CD-O 3.31Å; R520-G545 WeakPolarHBondContact CG-O 3.12Å; R520-G545 PolarHBondContact NE-O 2.66Å; R520-D547 IonicContact CZ-OD2 2.96Å; R520-D547 IonicContact NH2-OD2 3.18Å; R520-D547 PolarHBondContact NH2-OD2 3.47Å; R520-T992 PolarHBondContact NH1-O 3.32Å; R520-T992 PolarHBondContact NH2-O 3.37Å; R520-Y993 PolarHBondContact NH1-O 3.23Å; R520-D996 IonicContact CZ-OD1 3.63Å; R520-D996 IonicContact CZ-OD2 2.69Å; R520-D996 VanDerWaalsContact NH1-CG 3.33Å; R520-D996 IonicContact NH1-OD1 2.71Å; R520-D996 PolarHBondContact NH1-OD1 3.45Å; R520-D996 IonicContact NH1-OD2 2.77Å; R520-D996 VanDerWaalsContact NH2-CG 3.27Å; R520-D996 IonicContact NH2-OD1 3.06Å; R520-D996 PolarHBondContact NH2-OD1 3.31Å; R520-D996 IonicContact NH2-OD2 3.98Å
521	I	97.9	Very high	95.4	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	128.5	176.3	-55.9	-178.1	0	0	0	110.4	C487 I489 V509 I512 K513 I519 W540 D546 D547	C487-I521 HydrophobicContact CB-CG1 4.41Å; C487-I521 WeakPolarHBondContact O-CA 3.27Å; I489-I521 HydrophobicContact CD1-CG2 3.85Å; I489-I521 HydrophobicContact CG1-CG2 4.19Å; V509-I521 HydrophobicContact CG1-CD1 4.13Å; V509-I521 HydrophobicContact CG2-CG2 4.22Å; I512-I521 HydrophobicContact CB-CD1 3.79Å; I512-I521 HydrophobicContact CD1-CD1 4.2Å; I512-I521 HydrophobicContact CG2-CD1 3.6Å; I512-I521 HydrophobicContact CG2-CG1 4.24Å; K513-I521 HydrophobicContact CD-CD1 3.78Å; K513-I521 HydrophobicContact CD-CG1 4.49Å; K513-I521 HydrophobicContact CG-CD1 3.68Å; I519-I521 HydrophobicContact CG2-CD1 4.26Å; I519-I521 HydrophobicContact CG2-CG1 4.01Å; I521-W540 HydrophobicContact CB-CZ3 4.21Å; I521-W540 HydrophobicContact CG2-CZ3 4.33Å; I521-D546 PolarHBondContact N-OD1 3.43Å; I521-D546 CarbonylContact O-C 3.55Å; I521-D546 WeakPolarHBondContact O-CA 3.49Å; I521-D547 PolarHBondContact O-N 3.19Å
522	I	97.8	Very high	94.9	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	119.2	171.4	-51.8	174.6	0	0	0	107.3	C487 L488 I489 D547 I549 M989 T992	C487-I522 PolarHBondContact O-N 2.85Å; L488-I522 CarbonylContact C-O 3.56Å; L488-I522 WeakPolarHBondContact CA-O 3.5Å; L488-I522 HydrophobicContact CG-CB 4.39Å; I489-I522 PolarHBondContact N-O 3.34Å; I522-D547 WeakPolarHBondContact CA-O 3.43Å; I522-D547 HydrophobicContact CG1-CB 4.39Å; I522-D547 HydrophobicContact CG2-CB 4.28Å; I522-I549 HydrophobicContact CG2-CD1 4.12Å; I522-I549 HydrophobicContact CG2-CG1 4.43Å; I522-M989 HydrophobicContact CB-CE 4.3Å; I522-M989 HydrophobicContact CG2-CE 3.86Å; I522-M989 HydrophobicContact CG2-SD 3.86Å; I522-T992 HydrophobicContact CD1-CG2 4.19Å; I522-T992 HydrophobicContact CG2-CG2 4.26Å
523	T	97.6	Very high	94.6	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	140.3	-177.7	-169.4	0	0	0	0	111.6	V509 M525 L534 W540 D547 A548 I549	V509-T523 HydrophobicContact CG2-CG2 4.33Å; T523-M525 HydrophobicContact CG2-CG 4.31Å; T523-M525 HydrophobicContact CG2-SD 4.15Å; T523-L534 HydrophobicContact CG2-CD1 3.68Å; T523-W540 HydrophobicContact CG2-CH2 4.12Å; T523-D547 PolarHBondContact N-O 3.08Å; T523-A548 HydrophobicContact CG2-CB 4.22Å; T523-I549 PolarHBondContact O-N 3.02Å
524	Q	96.3	Very high	94.4	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.009	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	139.5	163.2	-65	-179.4	-40.4	0	0	109.4	I489 A491 I549 D986 M989	I489-Q524 PolarHBondContact O-N 3.18Å; A491-Q524 HydrophobicContact CB-CB 3.73Å; Q524-I549 WeakPolarHBondContact CA-O 3.07Å; Q524-D986 PolarHBondContact NE2-OD1 2.76Å; Q524-M989 HydrophobicContact CG-CE 4.4Å; Q524-M989 HydrophobicContact CG-CG 4.04Å; Q524-M989 HydrophobicContact CG-SD 3.49Å; Q524-M989 WeakPolarHBondContact CG-SD 3.39Å
525	M	95.4	Very high	94	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	137.7	169.9	-61	-59.2	-63.8	0	0	108.1	D502 N505 I506 T523 N530 L534 A548 I549 C550 L551	D502-M525 HydrophobicContact CB-CE 3.7Å; D502-M525 WeakPolarHBondContact OD1-CA 3.22Å; N505-M525 HydrophobicContact CB-SD 4.49Å; I506-M525 HydrophobicContact CD1-CE 3.83Å; I506-M525 HydrophobicContact CG1-CE 3.88Å; T523-M525 HydrophobicContact CG2-CG 4.31Å; T523-M525 HydrophobicContact CG2-SD 4.15Å; M525-N530 HydrophobicContact CE-CB 3.61Å; M525-L534 HydrophobicContact CG-CD1 4.06Å; M525-L534 HydrophobicContact SD-CD1 3.92Å; M525-A548 HydrophobicContact CG-CB 4.39Å; M525-I549 PolarHBondContact N-O 3.49Å; M525-C550 HydrophobicContact CB-CB 4.47Å; M525-C550 CarbonylContact O-C 3.56Å; M525-C550 VanDerWaalsContact O-CA 3.29Å; M525-C550 WeakPolarHBondContact O-CA 3.46Å; M525-L551 PolarHBondContact O-N 3.45Å
526	L	93.7	Very high	93.6	Very high	14 Å²	14	35.2 Å²	35.2	7%	0.073	18%	0.175	C	C	.	.	S	Bend	trans	-81.6	-47.8	179.4	-56.5	178.9	0	0	0	110	A491 N492 C495 P498 E501 D502 L551 A552	A491-L526 HydrophobicContact CB-CD2 4.09Å; A491-L526 HydrophobicContact CB-CG 4.44Å; N492-L526 WeakPolarHBondContact O-CD1 3.5Å; C495-L526 WeakPolarHBondContact SG-CD1 3.34Å; P498-L526 HydrophobicContact CB-CB 3.97Å; P498-L526 HydrophobicContact CB-CD1 3.85Å; E501-L526 HydrophobicContact CB-CD1 4.15Å; E501-L526 HydrophobicContact CG-CD1 4.38Å; D502-L526 PolarHBondContact OD1-N 2.86Å; D502-L526 PolarHBondContact OD2-N 3.33Å; L526-L551 HydrophobicContact CD2-CD1 3.93Å; L526-A552 WeakPolarHBondContact O-CB 3.49Å; L526-A552 PolarHBondContact O-N 2.81Å
527	Q	92	Very high	93.4	Very high	11 Å²	11	33.3 Å²	33.3	5%	0.051	17%	0.167	C	C	.	.	S	Bend	trans	-104.9	150	-177.4	-62.2	-64.8	-20.2	0	0	113.3	P498 D502 H529 C550 L796	P498-Q527 HydrophobicContact CB-CG 4.1Å; D502-Q527 PolarHBondContact OD2-N 3.1Å; Q527-H529 VanDerWaalsContact CB-CE1 3.46Å; Q527-H529 WeakPolarHBondContact CB-CE1 3.36Å; Q527-C550 VanDerWaalsContact C-SG 3.54Å; Q527-L796 PolarHBondContact NE2-O 3.42Å
528	Y	90.9	Very high	93.3	Very high	15 Å²	15	36.4 Å²	36.4	6%	0.059	19%	0.187	C	C	.	.	H	α-helix	trans	-77.2	-35.1	-178	-178.1	-88.2	0	0	0	113.3	N530 K531 E553 I1018	Y528-N530 VanDerWaalsContact C-N 3.35Å; Y528-N530 PolarHBondContact O-N 3.13Å; Y528-K531 HydrophobicContact CD2-CD 4.44Å; Y528-K531 HydrophobicContact CE2-CD 4.46Å; Y528-K531 WeakPolarHBondContact O-CB 3.45Å; Y528-K531 PolarHBondContact O-N 3.15Å; Y528-E553 HydrophobicContact CD2-CB 3.97Å; Y528-E553 HydrophobicContact CD2-CG 3.9Å; Y528-E553 HydrophobicContact CE2-CG 4.07Å; Y528-I1018 HydrophobicContact CE1-CD1 4.21Å; Y528-I1018 HydrophobicContact CE1-CG2 4.08Å
529	H	88.3	Confident	93.3	Very high	53 Å²	53	30.5 Å²	30.5	25%	0.245	17%	0.166	C	C	.	.	H	α-helix	trans	-65.5	-37.9	178.1	49.2	-87.4	0	0	0	112.1	D499 Q527 K531 A532	D499-H529 IonicContact OD1-CD2 2.71Å; D499-H529 IonicContact OD1-CE1 2.68Å; D499-H529 IonicContact OD1-NE2 2.65Å; D499-H529 PolarHBondContact OD1-NE2 3.47Å; D499-H529 IonicContact OD2-NE2 3.5Å; Q527-H529 VanDerWaalsContact CB-CE1 3.46Å; Q527-H529 WeakPolarHBondContact CB-CE1 3.36Å; H529-K531 PolarHBondContact O-N 3.39Å; H529-A532 VanDerWaalsContact O-CB 3.31Å; H529-A532 WeakPolarHBondContact O-CB 3.47Å; H529-A532 PolarHBondContact O-N 3.16Å; H529-A532 VanDerWaalsContact O-N 3.09Å
530	N	92.3	Very high	93.2	Very high	13 Å²	13	31.4 Å²	31.4	7%	0.07	17%	0.169	C	C	.	.	H	α-helix	trans	-62.6	-29.4	178.5	-66.5	-29.2	0	0	0	113	D499 D502 I506 M525 Y528 A532 H533	D499-N530 PolarHBondContact OD1-ND2 3.28Å; D502-N530 HydrophobicContact CB-CB 3.85Å; D502-N530 VanDerWaalsContact CB-ND2 3.27Å; D502-N530 WeakPolarHBondContact CB-ND2 3.22Å; D502-N530 PolarHBondContact OD2-ND2 3.3Å; I506-N530 HydrophobicContact CD1-CB 4.28Å; M525-N530 HydrophobicContact CE-CB 3.61Å; Y528-N530 VanDerWaalsContact C-N 3.35Å; Y528-N530 PolarHBondContact O-N 3.13Å; N530-A532 PolarHBondContact O-N 3.2Å; N530-H533 WeakPolarHBondContact O-CB 3.29Å; N530-H533 PolarHBondContact O-N 3.35Å
531	K	90.9	Very high	92.9	Very high	13 Å²	13	32.4 Å²	32.4	6%	0.057	18%	0.177	C	C	.	.	H	α-helix	trans	-55.8	-34.1	174.5	-164	-169.3	-173.3	-172.9	0	112.8	Y528 H529 H533 L534 A548 C550 E553 E1015	Y528-K531 HydrophobicContact CD2-CD 4.44Å; Y528-K531 HydrophobicContact CE2-CD 4.46Å; Y528-K531 WeakPolarHBondContact O-CB 3.45Å; Y528-K531 PolarHBondContact O-N 3.15Å; H529-K531 PolarHBondContact O-N 3.39Å; K531-H533 PolarHBondContact O-N 3.04Å; K531-L534 WeakPolarHBondContact O-CB 3.43Å; K531-L534 PolarHBondContact O-N 3.42Å; K531-L534 VanDerWaalsContact O-N 3.14Å; K531-A548 WeakPolarHBondContact CE-O 3.43Å; K531-A548 HydrophobicContact CG-CB 3.92Å; K531-C550 HydrophobicContact CD-CB 4.3Å; K531-E553 IonicContact NZ-OE1 3.31Å; K531-E553 IonicContact NZ-OE2 3.2Å; K531-E553 PolarHBondContact NZ-OE2 2.68Å; K531-E1015 WeakPolarHBondContact CE-OE1 3.45Å; K531-E1015 IonicContact NZ-OE1 3.52Å; K531-E1015 PolarHBondContact NZ-OE1 2.88Å
532	A	88.3	Confident	92.3	Very high	19 Å²	19	39 Å²	39	16%	0.157	20%	0.202	C	C	.	.	H	α-helix	trans	-62.3	-29.5	178.4	0	0	0	0	0	112.6	H529 N530 L534 L535 A1019	H529-A532 VanDerWaalsContact O-CB 3.31Å; H529-A532 WeakPolarHBondContact O-CB 3.47Å; H529-A532 PolarHBondContact O-N 3.16Å; H529-A532 VanDerWaalsContact O-N 3.09Å; N530-A532 PolarHBondContact O-N 3.2Å; A532-L534 PolarHBondContact O-N 3.48Å; A532-L535 PolarHBondContact O-N 2.74Å; A532-A1019 HydrophobicContact CB-CB 3.76Å
533	H	91.4	Very high	91.7	Very high	94 Å²	94	46.1 Å²	46.1	44%	0.435	23%	0.233	S	C	.	.	H	α-helix	trans	-66.1	-26.3	177.2	-60	-45.6	0	0	0	113	I506 N530 K531 N536	I506-H533 HydrophobicContact CD1-CB 3.91Å; N530-H533 WeakPolarHBondContact O-CB 3.29Å; N530-H533 PolarHBondContact O-N 3.35Å; K531-H533 PolarHBondContact O-N 3.04Å; H533-N536 PolarHBondContact O-N 2.97Å
534	L	93.4	Very high	91.2	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-69	-38.2	174.7	-61.2	174.2	0	0	0	111.7	I506 V509 T523 M525 K531 A532 N536 I537 W540 A548	I506-L534 HydrophobicContact CB-CD2 4.43Å; I506-L534 HydrophobicContact CG1-CD2 3.86Å; I506-L534 HydrophobicContact CG1-CG 4.35Å; I506-L534 HydrophobicContact CG2-CD2 4.47Å; V509-L534 HydrophobicContact CB-CD2 4.15Å; V509-L534 HydrophobicContact CG1-CD2 4.1Å; V509-L534 HydrophobicContact CG2-CD2 3.96Å; T523-L534 HydrophobicContact CG2-CD1 3.68Å; M525-L534 HydrophobicContact CG-CD1 4.06Å; M525-L534 HydrophobicContact SD-CD1 3.92Å; K531-L534 WeakPolarHBondContact O-CB 3.43Å; K531-L534 PolarHBondContact O-N 3.42Å; K531-L534 VanDerWaalsContact O-N 3.14Å; A532-L534 PolarHBondContact O-N 3.48Å; L534-N536 PolarHBondContact O-N 2.86Å; L534-I537 HydrophobicContact CD2-CD1 4.01Å; L534-I537 WeakPolarHBondContact O-CB 3.28Å; L534-I537 PolarHBondContact O-N 3.06Å; L534-W540 HydrophobicContact CB-CD2 4.18Å; L534-W540 HydrophobicContact CB-CE3 4.43Å; L534-W540 HydrophobicContact CD1-CH2 4.19Å; L534-W540 HydrophobicContact CD1-CZ2 4.34Å; L534-W540 WeakPolarHBondContact O-CB 3.47Å; L534-A548 HydrophobicContact CD1-CB 3.59Å
535	L	88	Confident	90.8	Very high	67 Å²	67	51.7 Å²	51.7	35%	0.351	26%	0.26	S	S	.	.	H	α-helix	trans	-64.8	-22.1	176.8	-60.4	177.6	0	0	0	112.9	A532 I537 E1015	A532-L535 PolarHBondContact O-N 2.74Å; L535-I537 VanDerWaalsContact C-N 3.31Å; L535-E1015 HydrophobicContact CD1-CB 4.11Å
536	N	89.8	Confident	90.8	Very high	111 Å²	111	51.9 Å²	51.9	59%	0.594	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-8.8	175.5	-63.9	-23.8	0	0	0	113.2	H533 L534	H533-N536 PolarHBondContact O-N 2.97Å; L534-N536 PolarHBondContact O-N 2.86Å
537	I	93.6	Very high	90.8	Very high	20 Å²	20	51.9 Å²	51.9	10%	0.103	26%	0.261	C	S	.	.	S	Bend	trans	-79.1	120.6	176.9	-59.7	172.8	0	0	0	108.4	V509 I510 L534 L535 S539 W540	V509-I537 HydrophobicContact CB-CD1 4.45Å; V509-I537 HydrophobicContact CG1-CD1 3.83Å; I510-I537 HydrophobicContact CD1-CD1 4.44Å; I510-I537 HydrophobicContact CG1-CD1 3.66Å; I510-I537 HydrophobicContact CG1-CG1 4.15Å; L534-I537 HydrophobicContact CD2-CD1 4.01Å; L534-I537 WeakPolarHBondContact O-CB 3.28Å; L534-I537 PolarHBondContact O-N 3.06Å; L535-I537 VanDerWaalsContact C-N 3.31Å; I537-S539 PolarHBondContact O-N 2.93Å; I537-W540 HydrophobicContact CB-CB 4Å; I537-W540 HydrophobicContact CG2-CB 4.39Å; I537-W540 WeakPolarHBondContact O-CB 3.37Å; I537-W540 PolarHBondContact O-N 3.4Å
538	P	93.2	Very high	90.9	Very high	132 Å²	132	51.9 Å²	51.9	86%	0.857	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-14.5	-171.8	27.7	-36.8	0	0	0	114.4
539	S	95.1	Very high	91.1	Very high	41 Å²	41	51.2 Å²	51.2	29%	0.287	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	6.9	176.5	-53.3	0	0	0	0	113.4	K513 I537	K513-S539 WeakPolarHBondContact CD-O 3.34Å; K513-S539 WeakPolarHBondContact CE-O 3.31Å; K513-S539 PolarHBondContact NZ-O 3.36Å; K513-S539 VanDerWaalsContact NZ-O 3.13Å; I537-S539 PolarHBondContact O-N 2.93Å
540	W	94.3	Very high	91.5	Very high	26 Å²	26	48.7 Å²	48.7	10%	0.098	25%	0.248	C	C	.	.			trans	-86.7	117.4	173.4	-177.2	-87.9	0	0	0	109.7	V509 I521 T523 L534 I537 D546 A548	V509-W540 HydrophobicContact CG1-CE3 3.82Å; V509-W540 HydrophobicContact CG1-CZ3 3.85Å; I521-W540 HydrophobicContact CB-CZ3 4.21Å; I521-W540 HydrophobicContact CG2-CZ3 4.33Å; T523-W540 HydrophobicContact CG2-CH2 4.12Å; L534-W540 HydrophobicContact CB-CD2 4.18Å; L534-W540 HydrophobicContact CB-CE3 4.43Å; L534-W540 HydrophobicContact CD1-CH2 4.19Å; L534-W540 HydrophobicContact CD1-CZ2 4.34Å; L534-W540 WeakPolarHBondContact O-CB 3.47Å; I537-W540 HydrophobicContact CB-CB 4Å; I537-W540 HydrophobicContact CG2-CB 4.39Å; I537-W540 WeakPolarHBondContact O-CB 3.37Å; I537-W540 PolarHBondContact O-N 3.4Å; W540-D546 HydrophobicContact CD2-CB 3.79Å; W540-D546 HydrophobicContact CE3-CB 4Å; W540-D546 HydrophobicContact CG-CB 4.36Å; W540-D546 HydrophobicContact CH2-CB 3.98Å; W540-D546 VanDerWaalsContact CZ2-C 3.47Å; W540-D546 HydrophobicContact CZ2-CB 3.78Å; W540-D546 WeakPolarHBondContact CZ2-O 3.5Å; W540-D546 HydrophobicContact CZ3-CB 4.09Å; W540-A548 HydrophobicContact CH2-CB 4.33Å; W540-A548 HydrophobicContact CZ2-CB 3.99Å
541	N	90.8	Very high	91.5	Very high	48 Å²	48	48.5 Å²	48.5	26%	0.257	25%	0.247	S	C	.	.			trans	-131.9	92.8	-173.6	-174.3	11	0	0	0	111.4	K543 E544 D546	N541-K543 PolarHBondContact O-N 2.75Å; N541-K543 WeakPolarHBondContact OD1-CB 3.44Å; N541-K543 PolarHBondContact OD1-N 3.4Å; N541-K543 VanDerWaalsContact OD1-N 3.14Å; N541-E544 HydrophobicContact CB-CB 4.34Å; N541-E544 VanDerWaalsContact ND2-CG 3.28Å; N541-E544 WeakPolarHBondContact ND2-CG 3.29Å; N541-E544 PolarHBondContact ND2-OE2 3.23Å; N541-E544 PolarHBondContact O-N 2.98Å; N541-D546 PolarHBondContact N-OD2 2.99Å; N541-D546 PolarHBondContact O-N 2.82Å
542	W	86	Confident	91.6	Very high	139 Å²	139	48.3 Å²	48.3	53%	0.527	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-57.4	-16.9	175.1	63.6	-94.5	0	0	0	114.1	P1012	W542-P1012 HydrophobicContact CH2-CG 4.45Å; W542-P1012 HydrophobicContact CZ2-CB 4.48Å
543	K	84.6	Confident	91.9	Very high	150 Å²	150	47.7 Å²	47.7	65%	0.652	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-83.7	-15.7	175.1	-58.5	-177.6	179.5	-179.5	0	113.8	N541	N541-K543 PolarHBondContact O-N 2.75Å; N541-K543 WeakPolarHBondContact OD1-CB 3.44Å; N541-K543 PolarHBondContact OD1-N 3.4Å; N541-K543 VanDerWaalsContact OD1-N 3.14Å
544	E	86.8	Confident	92	Very high	116 Å²	116	43.3 Å²	43.3	54%	0.542	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-100.9	12.7	171.8	-78.3	174.5	149	0	0	111.6	N541	N541-E544 HydrophobicContact CB-CB 4.34Å; N541-E544 VanDerWaalsContact ND2-CG 3.28Å; N541-E544 WeakPolarHBondContact ND2-CG 3.29Å; N541-E544 PolarHBondContact ND2-OE2 3.23Å; N541-E544 PolarHBondContact O-N 2.98Å
545	G	88.3	Confident	92.1	Very high	3 Å²	3	44 Å²	44	3%	0.031	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.9	16.3	176	0	0	0	0	0	115.1	R520 D547	R520-G545 WeakPolarHBondContact CD-O 3.31Å; R520-G545 WeakPolarHBondContact CG-O 3.12Å; R520-G545 PolarHBondContact NE-O 2.66Å; G545-D547 PolarHBondContact O-N 2.99Å; G545-D547 VanDerWaalsContact O-N 3.16Å; G545-D547 VanDerWaalsContact O-OD2 3.1Å
546	D	94.9	Very high	92.4	Very high	3 Å²	3	40.9 Å²	40.9	2%	0.016	21%	0.208	C	C	.	.			trans	-69.6	108.9	169.6	-71.5	-36.3	0	0	0	110.1	K513 I521 W540 N541	K513-D546 WeakPolarHBondContact CE-OD1 3.16Å; K513-D546 VanDerWaalsContact CE-OD2 3.26Å; K513-D546 WeakPolarHBondContact CE-OD2 3.24Å; K513-D546 IonicContact NZ-OD1 3.46Å; K513-D546 PolarHBondContact NZ-OD1 3.04Å; K513-D546 IonicContact NZ-OD2 3.69Å; K513-D546 PolarHBondContact NZ-OD2 3.23Å; I521-D546 PolarHBondContact N-OD1 3.43Å; I521-D546 CarbonylContact O-C 3.55Å; I521-D546 WeakPolarHBondContact O-CA 3.49Å; W540-D546 HydrophobicContact CD2-CB 3.79Å; W540-D546 HydrophobicContact CE3-CB 4Å; W540-D546 HydrophobicContact CG-CB 4.36Å; W540-D546 HydrophobicContact CH2-CB 3.98Å; W540-D546 VanDerWaalsContact CZ2-C 3.47Å; W540-D546 HydrophobicContact CZ2-CB 3.78Å; W540-D546 WeakPolarHBondContact CZ2-O 3.5Å; W540-D546 HydrophobicContact CZ3-CB 4.09Å; N541-D546 PolarHBondContact N-OD2 2.99Å; N541-D546 PolarHBondContact O-N 2.82Å
547	D	94.3	Very high	92.7	Very high	15 Å²	15	35.6 Å²	35.6	8%	0.08	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	129.6	-168.1	-75.9	-55.7	0	0	0	111.7	R520 I521 I522 T523 G545 T992 L999	R520-D547 IonicContact CZ-OD2 2.96Å; R520-D547 IonicContact NH2-OD2 3.18Å; R520-D547 PolarHBondContact NH2-OD2 3.47Å; I521-D547 PolarHBondContact O-N 3.19Å; I522-D547 WeakPolarHBondContact CA-O 3.43Å; I522-D547 HydrophobicContact CG1-CB 4.39Å; I522-D547 HydrophobicContact CG2-CB 4.28Å; T523-D547 PolarHBondContact N-O 3.08Å; G545-D547 PolarHBondContact O-N 2.99Å; G545-D547 VanDerWaalsContact O-N 3.16Å; G545-D547 VanDerWaalsContact O-OD2 3.1Å; D547-T992 HydrophobicContact CB-CG2 3.72Å; D547-T992 VanDerWaalsContact OD2-CG2 3.23Å; D547-T992 WeakPolarHBondContact OD2-CG2 3.29Å; D547-L999 HydrophobicContact CB-CD2 3.84Å
548	A	94.6	Very high	92.8	Very high	11 Å²	11	34.7 Å²	34.7	9%	0.091	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	103.1	175.9	0	0	0	0	0	110.1	T523 M525 K531 L534 W540 C550	T523-A548 HydrophobicContact CG2-CB 4.22Å; M525-A548 HydrophobicContact CG-CB 4.39Å; K531-A548 WeakPolarHBondContact CE-O 3.43Å; K531-A548 HydrophobicContact CG-CB 3.92Å; L534-A548 HydrophobicContact CD1-CB 3.59Å; W540-A548 HydrophobicContact CH2-CB 4.33Å; W540-A548 HydrophobicContact CZ2-CB 3.99Å; A548-C550 PolarHBondContact O-N 2.84Å
549	I	95.4	Very high	93	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	97.7	179.5	-59.4	-175	0	0	0	108.3	I522 T523 Q524 M525 L551 L554 L988 M989 L999	I522-I549 HydrophobicContact CG2-CD1 4.12Å; I522-I549 HydrophobicContact CG2-CG1 4.43Å; T523-I549 PolarHBondContact O-N 3.02Å; Q524-I549 WeakPolarHBondContact CA-O 3.07Å; M525-I549 PolarHBondContact N-O 3.49Å; I549-L551 HydrophobicContact CG2-CD2 4.28Å; I549-L551 PolarHBondContact O-N 3.43Å; I549-L554 HydrophobicContact CG2-CD1 3.73Å; I549-L988 HydrophobicContact CD1-CB 4.42Å; I549-L988 HydrophobicContact CD1-CD2 4.45Å; I549-L988 HydrophobicContact CD1-CG 4.13Å; I549-L988 HydrophobicContact CG2-CD2 4.07Å; I549-M989 HydrophobicContact CD1-CG 4.39Å; I549-M989 HydrophobicContact CD1-SD 3.74Å; I549-L999 HydrophobicContact CG1-CD1 4.14Å; I549-L999 HydrophobicContact CG1-CD2 3.82Å
550	C	94.8	Very high	93.1	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.007	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	114.9	175.5	-178.1	0	0	0	0	110.8	M525 Q527 K531 A548 E553 L554	M525-C550 HydrophobicContact CB-CB 4.47Å; M525-C550 CarbonylContact O-C 3.56Å; M525-C550 VanDerWaalsContact O-CA 3.29Å; M525-C550 WeakPolarHBondContact O-CA 3.46Å; Q527-C550 VanDerWaalsContact C-SG 3.54Å; K531-C550 HydrophobicContact CD-CB 4.3Å; A548-C550 PolarHBondContact O-N 2.84Å; C550-E553 HydrophobicContact CB-CB 3.63Å; C550-E553 PolarHBondContact O-N 2.93Å; C550-E553 PolarHBondContact SG-N 3.21Å; C550-L554 WeakPolarHBondContact O-CG 3.24Å; C550-L554 PolarHBondContact O-N 3.26Å; C550-L554 VanDerWaalsContact O-N 3.11Å
551	L	93.6	Very high	93.1	Very high	9 Å²	9	25.7 Å²	25.7	5%	0.047	12%	0.118	C	C	.	.	H	α-helix	trans	-67.8	-43.2	-177.5	-60.5	-173.7	0	0	0	111.6	K493 M525 L526 I549 E553 L554 K555 V982 L985	K493-L551 HydrophobicContact CD-CD1 3.92Å; K493-L551 HydrophobicContact CG-CD1 3.74Å; M525-L551 PolarHBondContact O-N 3.45Å; L526-L551 HydrophobicContact CD2-CD1 3.93Å; I549-L551 HydrophobicContact CG2-CD2 4.28Å; I549-L551 PolarHBondContact O-N 3.43Å; L551-E553 VanDerWaalsContact C-N 3.35Å; L551-E553 PolarHBondContact O-N 3.29Å; L551-L554 PolarHBondContact O-N 3.03Å; L551-K555 WeakPolarHBondContact O-CB 3.47Å; L551-K555 PolarHBondContact O-N 2.89Å; L551-V982 HydrophobicContact CD1-CG2 4.43Å; L551-L985 HydrophobicContact CD2-CB 3.88Å; L551-L985 HydrophobicContact CD2-CD1 3.98Å
552	A	92.8	Very high	93.4	Very high	9 Å²	9	23.4 Å²	23.4	7%	0.074	11%	0.107	C	C	.	.	H	α-helix	trans	-64.5	-36.2	175.2	0	0	0	0	0	113.1	L526 L556	L526-A552 WeakPolarHBondContact O-CB 3.49Å; L526-A552 PolarHBondContact O-N 2.81Å; A552-L556 VanDerWaalsContact O-CB 3.32Å; A552-L556 WeakPolarHBondContact O-CB 3.33Å; A552-L556 WeakPolarHBondContact O-CD1 3.46Å; A552-L556 WeakPolarHBondContact O-CG 3.43Å; A552-L556 PolarHBondContact O-N 2.9Å
553	E	94.3	Very high	93.8	Very high	6 Å²	6	16.9 Å²	16.9	3%	0.028	8%	0.082	C	C	.	.	H	α-helix	trans	-60.3	-52	175.2	-172.9	-174.2	163	0	0	110.9	Y528 K531 C550 L551 G557 R1003 T1007	Y528-E553 HydrophobicContact CD2-CB 3.97Å; Y528-E553 HydrophobicContact CD2-CG 3.9Å; Y528-E553 HydrophobicContact CE2-CG 4.07Å; K531-E553 IonicContact NZ-OE1 3.31Å; K531-E553 IonicContact NZ-OE2 3.2Å; K531-E553 PolarHBondContact NZ-OE2 2.68Å; C550-E553 HydrophobicContact CB-CB 3.63Å; C550-E553 PolarHBondContact O-N 2.93Å; C550-E553 PolarHBondContact SG-N 3.21Å; L551-E553 VanDerWaalsContact C-N 3.35Å; L551-E553 PolarHBondContact O-N 3.29Å; E553-G557 PolarHBondContact O-N 3.39Å; E553-R1003 IonicContact OE1-CZ 2.66Å; E553-R1003 IonicContact OE1-NE 3.6Å; E553-R1003 PolarHBondContact OE1-NE 2.89Å; E553-R1003 IonicContact OE1-NH2 3.61Å; E553-R1003 PolarHBondContact OE1-NH2 3.47Å; E553-R1003 IonicContact OE2-NE 3.64Å; E553-R1003 IonicContact OE2-NH2 3.81Å; E553-T1007 HydrophobicContact CG-CG2 4.05Å; E553-T1007 WeakPolarHBondContact OE1-CG2 3.39Å
554	L	94.5	Very high	94.3	Very high	1 Å²	1	11.2 Å²	11.2	1%	0.005	6%	0.059	C	C	.	.	H	α-helix	trans	-74.3	-48.2	-174.7	-68.3	173.9	0	0	0	112	I549 C550 L551 L556 G557 F558 L985 L988 L999 I1002 R1003	I549-L554 HydrophobicContact CG2-CD1 3.73Å; C550-L554 WeakPolarHBondContact O-CG 3.24Å; C550-L554 PolarHBondContact O-N 3.26Å; C550-L554 VanDerWaalsContact O-N 3.11Å; L551-L554 PolarHBondContact O-N 3.03Å; L554-L556 PolarHBondContact O-N 3.15Å; L554-G557 PolarHBondContact O-N 2.9Å; L554-F558 HydrophobicContact CB-CD2 4.31Å; L554-F558 HydrophobicContact CB-CE2 4.03Å; L554-F558 WeakPolarHBondContact O-CD2 3.42Å; L554-F558 WeakPolarHBondContact O-CG 3.49Å; L554-F558 PolarHBondContact O-N 3.36Å; L554-L985 HydrophobicContact CB-CD1 4.23Å; L554-L985 HydrophobicContact CB-CD2 4.35Å; L554-L988 HydrophobicContact CD1-CD2 3.39Å; L554-L999 HydrophobicContact CD1-CD1 4.21Å; L554-I1002 HydrophobicContact CD2-CG2 4.09Å; L554-R1003 HydrophobicContact CD2-CG 4.14Å
555	K	94.2	Very high	94.6	Very high	17 Å²	17	5.7 Å²	5.7	7%	0.074	3%	0.033	C	C	.	.	H	α-helix	trans	-52.1	-56.5	178.2	177.1	-176.8	71.2	157.3	0	111.5	L551 G557 F558 I559 E946 F980 L985	L551-K555 WeakPolarHBondContact O-CB 3.47Å; L551-K555 PolarHBondContact O-N 2.89Å; K555-G557 VanDerWaalsContact C-N 3.31Å; K555-G557 PolarHBondContact O-N 3.2Å; K555-F558 PolarHBondContact O-N 3.36Å; K555-I559 HydrophobicContact CG-CD1 4.25Å; K555-I559 WeakPolarHBondContact O-CG1 3.34Å; K555-I559 PolarHBondContact O-N 2.87Å; K555-I559 VanDerWaalsContact O-N 3.16Å; K555-E946 HydrophobicContact CD-CG 4.2Å; K555-E946 VanDerWaalsContact CD-OE1 3.3Å; K555-E946 WeakPolarHBondContact CD-OE1 3.39Å; K555-E946 WeakPolarHBondContact CE-OE1 3.29Å; K555-E946 WeakPolarHBondContact CE-OE2 3.42Å; K555-E946 IonicContact NZ-OE1 3.88Å; K555-E946 PolarHBondContact NZ-OE1 3.26Å; K555-E946 IonicContact NZ-OE2 2.7Å; K555-E946 PolarHBondContact NZ-OE2 3.5Å; K555-F980 HydrophobicContact CB-CE1 4.2Å; K555-F980 HydrophobicContact CG-CD1 4.14Å; K555-F980 HydrophobicContact CG-CE1 3.89Å; K555-L985 HydrophobicContact CB-CD1 4.26Å
556	L	95.8	Very high	95	Very high	0 Å²	0	7.6 Å²	7.6	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-70.7	-31.4	-177.3	-62.2	170.7	0	0	0	111.5	A552 L554 A560 I797 G798 N801 L802 L868	A552-L556 VanDerWaalsContact O-CB 3.32Å; A552-L556 WeakPolarHBondContact O-CB 3.33Å; A552-L556 WeakPolarHBondContact O-CD1 3.46Å; A552-L556 WeakPolarHBondContact O-CG 3.43Å; A552-L556 PolarHBondContact O-N 2.9Å; L554-L556 PolarHBondContact O-N 3.15Å; L556-A560 VanDerWaalsContact O-CB 3.25Å; L556-A560 WeakPolarHBondContact O-CB 3.43Å; L556-A560 PolarHBondContact O-N 3.49Å; L556-I797 HydrophobicContact CD1-CG2 3.61Å; L556-I797 WeakPolarHBondContact CD1-O 3.43Å; L556-I797 HydrophobicContact CD2-CG2 3.9Å; L556-I797 HydrophobicContact CG-CG2 4.33Å; L556-G798 WeakPolarHBondContact CD1-O 3.43Å; L556-N801 HydrophobicContact CB-CB 4Å; L556-N801 HydrophobicContact CD1-CB 3.99Å; L556-L802 HydrophobicContact CB-CB 4.15Å; L556-L802 WeakPolarHBondContact O-CD1 3.17Å; L556-L868 HydrophobicContact CD2-CD1 3.89Å; L556-L868 HydrophobicContact CD2-CD2 4.23Å
557	G	95.8	Very high	94.9	Very high	1 Å²	1	7.5 Å²	7.5	1%	0.01	4%	0.04	C	C	.	.	H	α-helix	trans	-64.9	-45	172.1	0	0	0	0	0	113.5	E553 L554 K555 I559 A560 Q561 V1006	E553-G557 PolarHBondContact O-N 3.39Å; L554-G557 PolarHBondContact O-N 2.9Å; K555-G557 VanDerWaalsContact C-N 3.31Å; K555-G557 PolarHBondContact O-N 3.2Å; G557-I559 VanDerWaalsContact C-N 3.33Å; G557-I559 PolarHBondContact O-N 2.7Å; G557-A560 WeakPolarHBondContact O-CB 3.45Å; G557-A560 PolarHBondContact O-N 2.76Å; G557-Q561 WeakPolarHBondContact O-CG 3.4Å; G557-Q561 PolarHBondContact O-N 2.87Å; G557-V1006 VanDerWaalsContact CA-CG1 3.47Å
558	F	95.8	Very high	95	Very high	1 Å²	1	6.8 Å²	6.8	0%	0.004	4%	0.037	C	C	.	.	H	α-helix	trans	-61.3	-43.9	176.7	-76.9	-59.9	0	0	0	110.9	L554 K555 Q561 S562 L572 F576 F980 L985 I1002 V1006	L554-F558 HydrophobicContact CB-CD2 4.31Å; L554-F558 HydrophobicContact CB-CE2 4.03Å; L554-F558 WeakPolarHBondContact O-CD2 3.42Å; L554-F558 WeakPolarHBondContact O-CG 3.49Å; L554-F558 PolarHBondContact O-N 3.36Å; K555-F558 PolarHBondContact O-N 3.36Å; F558-Q561 PolarHBondContact O-N 2.76Å; F558-S562 PolarHBondContact O-N 3.34Å; F558-L572 HydrophobicContact CD1-CB 4.07Å; F558-L572 HydrophobicContact CD1-CD1 3.93Å; F558-L572 HydrophobicContact CE1-CB 3.52Å; F558-L572 HydrophobicContact CE1-CD1 3.7Å; F558-L572 HydrophobicContact CE1-CG 4.26Å; F558-L572 HydrophobicContact CZ-CB 4.49Å; F558-F576 HydrophobicContact CE1-CE1 4.35Å; F558-F576 HydrophobicContact CE2-CE1 4.34Å; F558-F576 HydrophobicContact CE2-CZ 4.3Å; F558-F576 AromaticContact CZ-CE1 3.68Å; F558-F576 HydrophobicContact CZ-CE1 3.68Å; F558-F576 HydrophobicContact CZ-CZ 4.08Å; F558-F980 HydrophobicContact CB-CE2 3.9Å; F558-F980 HydrophobicContact CB-CZ 4.04Å; F558-F980 HydrophobicContact CD2-CE2 4.16Å; F558-F980 AromaticContact CD2-CZ 3.78Å; F558-F980 HydrophobicContact CD2-CZ 3.78Å; F558-F980 HydrophobicContact CG-CE2 4.16Å; F558-F980 HydrophobicContact CG-CZ 4.19Å; F558-L985 HydrophobicContact CD2-CD2 4.05Å; F558-L985 HydrophobicContact CE2-CD2 3.61Å; F558-I1002 HydrophobicContact CE1-CG2 4.22Å; F558-I1002 HydrophobicContact CZ-CG2 3.69Å; F558-V1006 HydrophobicContact CD1-CG1 4.37Å; F558-V1006 HydrophobicContact CD1-CG2 3.88Å; F558-V1006 HydrophobicContact CE1-CG2 3.57Å; F558-V1006 HydrophobicContact CG-CG1 4.48Å; F558-V1006 HydrophobicContact CZ-CG2 4.19Å
559	I	96.8	Very high	95	Very high	1 Å²	1	6.2 Å²	6.2	1%	0.005	3%	0.032	C	C	.	.	H	α-helix	trans	-62.2	-43.4	174	-67.1	170.7	0	0	0	111	K555 G557 Q561 S562 C563 L802 V866 L868 I944 F980	K555-I559 HydrophobicContact CG-CD1 4.25Å; K555-I559 WeakPolarHBondContact O-CG1 3.34Å; K555-I559 PolarHBondContact O-N 2.87Å; K555-I559 VanDerWaalsContact O-N 3.16Å; G557-I559 VanDerWaalsContact C-N 3.33Å; G557-I559 PolarHBondContact O-N 2.7Å; I559-Q561 PolarHBondContact O-N 2.87Å; I559-S562 PolarHBondContact O-N 3.48Å; I559-C563 PolarHBondContact O-N 2.62Å; I559-C563 PolarHBondContact O-SG 2.79Å; I559-L802 HydrophobicContact CB-CD1 4.27Å; I559-L802 HydrophobicContact CG2-CD1 3.79Å; I559-V866 HydrophobicContact CG2-CB 4.35Å; I559-V866 HydrophobicContact CG2-CG1 3.46Å; I559-V866 VanDerWaalsContact CG2-CG1 3.46Å; I559-V866 HydrophobicContact CG2-CG2 3.92Å; I559-L868 HydrophobicContact CD1-CD2 4.01Å; I559-I944 HydrophobicContact CG1-CD1 4.13Å; I559-I944 HydrophobicContact CG2-CG2 3.97Å; I559-F980 HydrophobicContact CD1-CD1 4.38Å; I559-F980 HydrophobicContact CG1-CB 4.45Å; I559-F980 HydrophobicContact CG1-CD1 4.44Å; I559-F980 HydrophobicContact CG1-CG 4.44Å
560	A	96.3	Very high	95	Very high	0 Å²	0	6.2 Å²	6.2	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-60.3	-42.9	176.4	0	0	0	0	0	112.6	L556 G557 C563 L802 P805 L806	L556-A560 VanDerWaalsContact O-CB 3.25Å; L556-A560 WeakPolarHBondContact O-CB 3.43Å; L556-A560 PolarHBondContact O-N 3.49Å; G557-A560 WeakPolarHBondContact O-CB 3.45Å; G557-A560 PolarHBondContact O-N 2.76Å; A560-C563 WeakPolarHBondContact O-CB 3.45Å; A560-C563 PolarHBondContact O-N 2.85Å; A560-L802 HydrophobicContact CB-CD1 4.11Å; A560-L802 WeakPolarHBondContact CB-O 3.36Å; A560-P805 HydrophobicContact CB-CB 3.97Å; A560-P805 HydrophobicContact CB-CG 4Å; A560-L806 HydrophobicContact CB-CG 4.15Å; A560-L806 WeakPolarHBondContact O-CD2 3.29Å
561	Q	94.6	Very high	95	Very high	8 Å²	8	6.2 Å²	6.2	4%	0.037	3%	0.032	C	C	.	.	H	α-helix	trans	-69	-35.1	175.4	-63.3	-60.9	-37.2	0	0	112	G557 F558 I559 C563 L564 A565 L568 V1006	G557-Q561 WeakPolarHBondContact O-CG 3.4Å; G557-Q561 PolarHBondContact O-N 2.87Å; F558-Q561 PolarHBondContact O-N 2.76Å; I559-Q561 PolarHBondContact O-N 2.87Å; Q561-C563 PolarHBondContact O-N 3.05Å; Q561-L564 WeakPolarHBondContact O-CA 3.47Å; Q561-L564 WeakPolarHBondContact O-CB 3.39Å; Q561-L564 PolarHBondContact O-N 3.15Å; Q561-A565 PolarHBondContact O-N 2.85Å; Q561-L568 HydrophobicContact CB-CD2 3.58Å; Q561-L568 HydrophobicContact CG-CD2 4.33Å; Q561-V1006 HydrophobicContact CG-CG1 4.5Å; Q561-V1006 PolarHBondContact NE2-O 3.43Å
562	S	96.4	Very high	95	Very high	1 Å²	1	6 Å²	6	1%	0.007	3%	0.031	C	C	.	.	H	α-helix	trans	-63.4	-27.7	171.5	-78.1	0	0	0	0	113.2	F558 I559 L564 A565 Q566 S569 M864	F558-S562 PolarHBondContact O-N 3.34Å; I559-S562 PolarHBondContact O-N 3.48Å; S562-L564 PolarHBondContact O-N 3.29Å; S562-A565 WeakPolarHBondContact CA-O 3.34Å; S562-A565 CarbonylContact O-C 3.52Å; S562-A565 VanDerWaalsContact O-C 3.31Å; S562-A565 PolarHBondContact O-N 2.86Å; S562-Q566 WeakPolarHBondContact O-CA 3.49Å; S562-Q566 PolarHBondContact O-N 3.49Å; S562-S569 WeakPolarHBondContact OG-CB 3.5Å; S562-S569 PolarHBondContact OG-N 2.84Å; S562-S569 PolarHBondContact OG-OG 3.12Å; S562-M864 WeakPolarHBondContact O-CE 3.4Å
563	C	96	Very high	95	Very high	2 Å²	2	5.7 Å²	5.7	1%	0.014	3%	0.028	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-17	170.1	-59.8	0	0	0	0	113.5	I559 A560 Q561 V784 L806 K817 M864 V866	I559-C563 PolarHBondContact O-N 2.62Å; I559-C563 PolarHBondContact O-SG 2.79Å; A560-C563 WeakPolarHBondContact O-CB 3.45Å; A560-C563 PolarHBondContact O-N 2.85Å; Q561-C563 PolarHBondContact O-N 3.05Å; C563-V784 HydrophobicContact CB-CG2 4.11Å; C563-L806 HydrophobicContact CB-CD1 4.49Å; C563-L806 HydrophobicContact CB-CD2 4.11Å; C563-K817 PolarHBondContact O-NZ 2.85Å; C563-M864 HydrophobicContact CB-CB 4.09Å; C563-M864 HydrophobicContact CB-CG 4.32Å; C563-V866 WeakPolarHBondContact SG-CG2 3.33Å
564	L	93.6	Very high	94.9	Very high	31 Å²	31	5.4 Å²	5.4	16%	0.162	3%	0.027	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-40.9	173.9	-60	171.1	0	0	0	111.4	Q561 S562 L806 F811	Q561-L564 WeakPolarHBondContact O-CA 3.47Å; Q561-L564 WeakPolarHBondContact O-CB 3.39Å; Q561-L564 PolarHBondContact O-N 3.15Å; S562-L564 PolarHBondContact O-N 3.29Å; L564-L806 HydrophobicContact CD1-CD2 4.36Å; L564-L806 HydrophobicContact CD2-CD2 3.79Å; L564-L806 HydrophobicContact CG-CD2 3.84Å; L564-F811 HydrophobicContact CD1-CE2 3.97Å; L564-F811 HydrophobicContact CD1-CZ 3.77Å; L564-F811 HydrophobicContact CD2-CE1 4.33Å; L564-F811 HydrophobicContact CD2-CE2 4.3Å; L564-F811 HydrophobicContact CD2-CZ 3.8Å; L564-F811 HydrophobicContact CG-CZ 4.37Å
565	A	95	Very high	94.7	Very high	0 Å²	0	5.6 Å²	5.6	0%	0	3%	0.028	C	C	.	.	S	Bend	trans	-142.7	99.6	-179.9	0	0	0	0	0	110.1	Q561 S562 G567 L568 V1042 Q1044 F1115	Q561-A565 PolarHBondContact O-N 2.85Å; S562-A565 WeakPolarHBondContact CA-O 3.34Å; S562-A565 CarbonylContact O-C 3.52Å; S562-A565 VanDerWaalsContact O-C 3.31Å; S562-A565 PolarHBondContact O-N 2.86Å; A565-G567 PolarHBondContact O-N 3.03Å; A565-L568 WeakPolarHBondContact O-CB 3.37Å; A565-L568 PolarHBondContact O-N 2.91Å; A565-V1042 HydrophobicContact CB-CG1 3.89Å; A565-Q1044 HydrophobicContact CB-CG 3.85Å; A565-F1115 HydrophobicContact CB-CD1 4.13Å; A565-F1115 HydrophobicContact CB-CE1 4.09Å
566	Q	95.3	Very high	94.2	Very high	43 Å²	43	5.1 Å²	5.1	20%	0.201	3%	0.026	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	134.1	-173.2	-174.3	179.4	12.9	0	0	111.7	S562 M864 Q1044 Y1080 F1115	S562-Q566 WeakPolarHBondContact O-CA 3.49Å; S562-Q566 PolarHBondContact O-N 3.49Å; Q566-M864 HydrophobicContact CB-CE 3.89Å; Q566-M864 HydrophobicContact CG-CE 3.75Å; Q566-Q1044 PolarHBondContact O-NE2 2.93Å; Q566-Y1080 HydrophobicContact CB-CE1 4.05Å; Q566-Y1080 VanDerWaalsContact CD-OH 3.26Å; Q566-Y1080 HydrophobicContact CG-CE1 4.17Å; Q566-Y1080 WeakPolarHBondContact CG-OH 3.39Å; Q566-F1115 WeakPolarHBondContact O-CE1 3.48Å; Q566-F1115 VanDerWaalsContact O-CZ 3.22Å; Q566-F1115 WeakPolarHBondContact O-CZ 3.5Å
567	G	94.1	Very high	93.7	Very high	0 Å²	0	5.3 Å²	5.3	0%	0	3%	0.027	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.6	-7.5	-176.8	0	0	0	0	0	115.2	A565 S569 T570 M571 V1098	A565-G567 PolarHBondContact O-N 3.03Å; G567-S569 VanDerWaalsContact C-N 3.29Å; G567-S569 PolarHBondContact O-N 2.92Å; G567-T570 PolarHBondContact O-N 3.24Å; G567-M571 PolarHBondContact O-N 3.05Å; G567-M571 VanDerWaalsContact O-N 3.11Å; G567-V1098 WeakPolarHBondContact O-CG2 3.37Å
568	L	95.2	Very high	92.9	Very high	0 Å²	0	6.2 Å²	6.2	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-62.8	-35.6	178.9	-165.9	78.8	0	0	0	112.7	Q561 A565 T570 M571 L572 V1042 F1077 F1115	Q561-L568 HydrophobicContact CB-CD2 3.58Å; Q561-L568 HydrophobicContact CG-CD2 4.33Å; A565-L568 WeakPolarHBondContact O-CB 3.37Å; A565-L568 PolarHBondContact O-N 2.91Å; L568-T570 VanDerWaalsContact C-N 3.32Å; L568-T570 PolarHBondContact O-N 2.94Å; L568-M571 HydrophobicContact CD1-SD 4.44Å; L568-M571 WeakPolarHBondContact O-CB 3.46Å; L568-M571 PolarHBondContact O-N 3.13Å; L568-L572 HydrophobicContact CD2-CD1 3.9Å; L568-L572 HydrophobicContact CG-CD1 3.94Å; L568-L572 HydrophobicContact CG-CG 4.13Å; L568-L572 WeakPolarHBondContact O-CG 3.47Å; L568-L572 PolarHBondContact O-N 3.26Å; L568-V1042 HydrophobicContact CD1-CG1 3.98Å; L568-V1042 HydrophobicContact CD2-CB 4.33Å; L568-V1042 HydrophobicContact CD2-CG1 3.84Å; L568-V1042 HydrophobicContact CD2-CG2 4.08Å; L568-V1042 HydrophobicContact CG-CG1 4.48Å; L568-F1077 HydrophobicContact CD1-CE2 3.6Å; L568-F1077 HydrophobicContact CD1-CZ 3.7Å; L568-F1115 HydrophobicContact CB-CE1 4.18Å; L568-F1115 HydrophobicContact CD1-CD1 3.97Å; L568-F1115 HydrophobicContact CD1-CE1 4.21Å
569	S	95.2	Very high	92.1	Very high	0 Å²	0	7.3 Å²	7.3	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-54.9	-46	175.6	49.9	0	0	0	0	112.3	S562 G567 A573	S562-S569 WeakPolarHBondContact OG-CB 3.5Å; S562-S569 PolarHBondContact OG-N 2.84Å; S562-S569 PolarHBondContact OG-OG 3.12Å; G567-S569 VanDerWaalsContact C-N 3.29Å; G567-S569 PolarHBondContact O-N 2.92Å; S569-A573 VanDerWaalsContact O-CB 3.26Å; S569-A573 WeakPolarHBondContact O-CB 3.27Å; S569-A573 PolarHBondContact O-N 2.96Å
570	T	95.2	Very high	90.9	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-64.8	-45.6	175.4	-56.1	0	0	0	0	111.5	G567 L568 L572 A573 N574 Y593 F974 G977 V1098	G567-T570 PolarHBondContact O-N 3.24Å; L568-T570 VanDerWaalsContact C-N 3.32Å; L568-T570 PolarHBondContact O-N 2.94Å; T570-L572 VanDerWaalsContact C-N 3.35Å; T570-L572 PolarHBondContact O-N 3.07Å; T570-A573 PolarHBondContact O-N 3.23Å; T570-N574 WeakPolarHBondContact O-CB 3.36Å; T570-N574 PolarHBondContact O-N 3.36Å; T570-N574 PolarHBondContact O-OD1 3.28Å; T570-Y593 HydrophobicContact CG2-CE2 4.32Å; T570-F974 WeakPolarHBondContact CB-O 3.47Å; T570-F974 HydrophobicContact CG2-CD1 3.87Å; T570-F974 HydrophobicContact CG2-CE1 3.7Å; T570-F974 HydrophobicContact CG2-CZ 4.36Å; T570-F974 WeakPolarHBondContact CG2-O 3.39Å; T570-F974 PolarHBondContact OG1-O 3.39Å; T570-G977 VanDerWaalsContact OG1-CA 3.25Å; T570-G977 WeakPolarHBondContact OG1-CA 3.46Å; T570-V1098 HydrophobicContact CG2-CG2 4.35Å
571	M	95.1	Very high	90	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-56.2	-50.2	177.8	-173.1	175.7	-72.1	0	0	111.5	G567 L568 N574 L575 F1077 V1098 T1100 F1115	G567-M571 PolarHBondContact O-N 3.05Å; G567-M571 VanDerWaalsContact O-N 3.11Å; L568-M571 HydrophobicContact CD1-SD 4.44Å; L568-M571 WeakPolarHBondContact O-CB 3.46Å; L568-M571 PolarHBondContact O-N 3.13Å; M571-N574 PolarHBondContact O-N 3.46Å; M571-L575 WeakPolarHBondContact O-CG 3.44Å; M571-L575 PolarHBondContact O-N 3.49Å; M571-F1077 HydrophobicContact CE-CD2 4.49Å; M571-F1077 HydrophobicContact SD-CD2 3.42Å; M571-F1077 WeakPolarHBondContact SD-CD2 3.08Å; M571-F1077 HydrophobicContact SD-CE2 3.41Å; M571-F1077 WeakPolarHBondContact SD-CE2 3.3Å; M571-V1098 HydrophobicContact CB-CG1 3.73Å; M571-V1098 HydrophobicContact CE-CG1 3.59Å; M571-V1098 HydrophobicContact CG-CG1 4.13Å; M571-T1100 HydrophobicContact CG-CG2 3.79Å; M571-T1100 HydrophobicContact SD-CG2 4.17Å; M571-F1115 HydrophobicContact CE-CB 4.31Å; M571-F1115 HydrophobicContact CE-CD2 3.27Å; M571-F1115 HydrophobicContact CE-CE2 3.52Å; M571-F1115 HydrophobicContact CE-CG 3.85Å; M571-F1115 HydrophobicContact CE-CZ 4.32Å
572	L	93	Very high	89.5	Confident	6 Å²	6	17.4 Å²	17.4	3%	0.031	9%	0.086	C	C	.	.	H	α-helix	trans	-70.6	-38.8	-177.6	-63.7	176.5	0	0	0	111.6	F558 L568 T570 N574 L575 F576 L1005 V1006	F558-L572 HydrophobicContact CD1-CB 4.07Å; F558-L572 HydrophobicContact CD1-CD1 3.93Å; F558-L572 HydrophobicContact CE1-CB 3.52Å; F558-L572 HydrophobicContact CE1-CD1 3.7Å; F558-L572 HydrophobicContact CE1-CG 4.26Å; F558-L572 HydrophobicContact CZ-CB 4.49Å; L568-L572 HydrophobicContact CD2-CD1 3.9Å; L568-L572 HydrophobicContact CG-CD1 3.94Å; L568-L572 HydrophobicContact CG-CG 4.13Å; L568-L572 WeakPolarHBondContact O-CG 3.47Å; L568-L572 PolarHBondContact O-N 3.26Å; T570-L572 VanDerWaalsContact C-N 3.35Å; T570-L572 PolarHBondContact O-N 3.07Å; L572-N574 VanDerWaalsContact C-N 3.27Å; L572-N574 PolarHBondContact O-N 3.09Å; L572-L575 HydrophobicContact CD2-CD1 4.13Å; L572-L575 PolarHBondContact O-N 3.04Å; L572-L575 VanDerWaalsContact O-N 3.12Å; L572-F576 WeakPolarHBondContact O-CD1 3.49Å; L572-F576 WeakPolarHBondContact O-CE1 3.38Å; L572-L1005 HydrophobicContact CD1-CD2 4.07Å; L572-L1005 HydrophobicContact CD2-CD2 3.84Å; L572-V1006 HydrophobicContact CD1-CG2 3.92Å
573	A	92.4	Very high	88.9	Confident	1 Å²	1	24.2 Å²	24.2	1%	0.008	12%	0.115	C	C	.	.	H	α-helix	trans	-58.1	-39.4	174.3	0	0	0	0	0	112.5	S569 T570 L575 F576 S577 F974 V984	S569-A573 VanDerWaalsContact O-CB 3.26Å; S569-A573 WeakPolarHBondContact O-CB 3.27Å; S569-A573 PolarHBondContact O-N 2.96Å; T570-A573 PolarHBondContact O-N 3.23Å; A573-L575 VanDerWaalsContact C-N 3.31Å; A573-L575 PolarHBondContact O-N 3.32Å; A573-F576 HydrophobicContact CB-CZ 4.33Å; A573-S577 PolarHBondContact O-N 3.04Å; A573-F974 HydrophobicContact CB-CZ 3.98Å; A573-V984 HydrophobicContact CB-CB 4.38Å; A573-V984 HydrophobicContact CB-CG2 4.15Å
574	N	92.5	Very high	88.4	Confident	1 Å²	1	26.1 Å²	26.1	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-68.1	-28.8	177.7	-66.1	-6.8	0	0	0	112.7	T570 M571 L572 F576 R579 Y593 F974	T570-N574 WeakPolarHBondContact O-CB 3.36Å; T570-N574 PolarHBondContact O-N 3.36Å; T570-N574 PolarHBondContact O-OD1 3.28Å; M571-N574 PolarHBondContact O-N 3.46Å; L572-N574 VanDerWaalsContact C-N 3.27Å; L572-N574 PolarHBondContact O-N 3.09Å; N574-F576 VanDerWaalsContact C-N 3.32Å; N574-F576 PolarHBondContact O-N 3.1Å; N574-R579 VanDerWaalsContact CG-NH1 3.35Å; N574-R579 PolarHBondContact OD1-NH1 3.32Å; N574-R579 PolarHBondContact OD1-NH2 3.12Å; N574-Y593 PolarHBondContact ND2-OH 2.82Å; N574-Y593 VanDerWaalsContact ND2-OH 3.1Å; N574-F974 WeakPolarHBondContact OD1-CE1 3.27Å
575	L	90.7	Very high	88	Confident	4 Å²	4	32 Å²	32	2%	0.021	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-10.3	-177.3	-73.7	172.7	0	0	0	115.5	M571 L572 A573 N599 E600 M601 I663 T1100	M571-L575 WeakPolarHBondContact O-CG 3.44Å; M571-L575 PolarHBondContact O-N 3.49Å; L572-L575 HydrophobicContact CD2-CD1 4.13Å; L572-L575 PolarHBondContact O-N 3.04Å; L572-L575 VanDerWaalsContact O-N 3.12Å; A573-L575 VanDerWaalsContact C-N 3.31Å; A573-L575 PolarHBondContact O-N 3.32Å; L575-N599 HydrophobicContact CD2-CB 4.16Å; L575-N599 WeakPolarHBondContact CD2-O 3.03Å; L575-E600 WeakPolarHBondContact O-CA 3.46Å; L575-M601 HydrophobicContact CB-CE 4.38Å; L575-M601 HydrophobicContact CD1-CE 4.28Å; L575-M601 PolarHBondContact O-N 3.28Å; L575-I663 HydrophobicContact CD1-CD1 3.54Å; L575-I663 HydrophobicContact CD1-CG1 4.25Å; L575-I663 HydrophobicContact CD2-CB 4.43Å; L575-I663 HydrophobicContact CD2-CD1 3.78Å; L575-I663 HydrophobicContact CD2-CG1 3.94Å; L575-I663 HydrophobicContact CD2-CG2 3.66Å; L575-I663 HydrophobicContact CG-CD1 4.34Å; L575-T1100 HydrophobicContact CD1-CG2 4.38Å; L575-T1100 HydrophobicContact CD2-CG2 3.84Å; L575-T1100 HydrophobicContact CG-CG2 4.2Å
576	F	84.1	Confident	87.6	Confident	7 Å²	7	39.1 Å²	39.1	3%	0.031	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.7	-8.1	-179.6	60.9	-109.3	0	0	0	115.5	F558 L572 A573 N574 V984 L985 L988 A991 I1002	F558-F576 HydrophobicContact CE1-CE1 4.35Å; F558-F576 HydrophobicContact CE2-CE1 4.34Å; F558-F576 HydrophobicContact CE2-CZ 4.3Å; F558-F576 AromaticContact CZ-CE1 3.68Å; F558-F576 HydrophobicContact CZ-CE1 3.68Å; F558-F576 HydrophobicContact CZ-CZ 4.08Å; L572-F576 WeakPolarHBondContact O-CD1 3.49Å; L572-F576 WeakPolarHBondContact O-CE1 3.38Å; A573-F576 HydrophobicContact CB-CZ 4.33Å; N574-F576 VanDerWaalsContact C-N 3.32Å; N574-F576 PolarHBondContact O-N 3.1Å; F576-V984 WeakPolarHBondContact CE2-O 3.38Å; F576-L985 HydrophobicContact CZ-CD2 4.19Å; F576-L988 HydrophobicContact CB-CD1 4.29Å; F576-L988 HydrophobicContact CD1-CD1 4.37Å; F576-L988 HydrophobicContact CD2-CB 4.27Å; F576-L988 HydrophobicContact CD2-CD1 4.19Å; F576-L988 HydrophobicContact CE2-CB 4.32Å; F576-L988 HydrophobicContact CG-CD1 4.05Å; F576-A991 HydrophobicContact CB-CB 4.27Å; F576-I1002 HydrophobicContact CD1-CD1 3.64Å; F576-I1002 HydrophobicContact CE1-CD1 4.22Å; F576-I1002 HydrophobicContact CG-CD1 4.34Å
577	S	84.1	Confident	87	Confident	5 Å²	5	40.8 Å²	40.8	4%	0.035	20%	0.195	C	C	.	.	S	Bend	trans	-81	133.5	162.4	-64.7	0	0	0	0	109.8	A573 R579 S987	A573-S577 PolarHBondContact O-N 3.04Å; S577-R579 PolarHBondContact O-N 2.95Å; S577-R579 PolarHBondContact OG-NH2 3.25Å; S577-S987 PolarHBondContact OG-OG 3.04Å
578	M	78.8	Confident	86.8	Confident	19 Å²	19	42.6 Å²	42.6	9%	0.094	21%	0.206	C	C	.	.			trans	-78.3	115.1	173.4	-64.6	-62.1	-45.4	0	0	108.6	D427 H430 D432 R433 E600	D427-M578 PolarHBondContact OD1-N 3.1Å; D427-M578 VanDerWaalsContact OD1-N 3.11Å; H430-M578 HydrophobicContact CB-CB 3.82Å; H430-M578 HydrophobicContact CB-CG 4.32Å; D432-M578 HydrophobicContact CB-CE 4.31Å; R433-M578 HydrophobicContact CG-CE 3.78Å; R433-M578 HydrophobicContact CG-CG 4.21Å; R433-M578 HydrophobicContact CG-SD 3.93Å; R433-M578 PolarHBondContact NE-SD 2.86Å; R433-M578 VanDerWaalsContact NH2-CG 3.28Å; M578-E600 HydrophobicContact CE-CG 4.44Å; M578-E600 VanDerWaalsContact CE-OE1 3.28Å; M578-E600 WeakPolarHBondContact CE-OE1 3.49Å; M578-E600 HydrophobicContact SD-CG 4.37Å
579	R	80.6	Confident	86.6	Confident	25 Å²	25	43.8 Å²	43.8	9%	0.094	21%	0.211	C	C	.	.			trans	-134.6	128.4	-178.4	-57.6	-159.8	-160.4	124.7	8.8	112.4	N574 S577 V597 Y969	N574-R579 VanDerWaalsContact CG-NH1 3.35Å; N574-R579 PolarHBondContact OD1-NH1 3.32Å; N574-R579 PolarHBondContact OD1-NH2 3.12Å; S577-R579 PolarHBondContact O-N 2.95Å; S577-R579 PolarHBondContact OG-NH2 3.25Å; R579-V597 HydrophobicContact CB-CG1 3.92Å; R579-V597 HydrophobicContact CG-CG1 4.44Å; R579-Y969 VanDerWaalsContact NH1-CD2 3.34Å
580	S	69.8	Low	86.4	Confident	30 Å²	30	47.1 Å²	47.1	21%	0.21	23%	0.226	C	C	.	.			trans	-75.1	132.1	-178.6	72.4	0	0	0	0	112.3	K431 D432 I582	K431-S580 PolarHBondContact NZ-OG 3.13Å; K431-S580 VanDerWaalsContact NZ-OG 3.16Å; D432-S580 VanDerWaalsContact OD2-CA 3.25Å; D432-S580 WeakPolarHBondContact OD2-CA 3.2Å; D432-S580 WeakPolarHBondContact OD2-CB 3.45Å; S580-I582 PolarHBondContact O-N 2.74Å
581	F	79.1	Confident	86.2	Confident	115 Å²	115	50.3 Å²	50.3	50%	0.504	24%	0.24	S	C	.	.			trans	-56.4	123.5	174.7	180	-103.4	0	0	0	111.9	K583	F581-K583 HydrophobicContact CE1-CB 3.91Å; F581-K583 HydrophobicContact CE1-CG 4.37Å
582	I	83.3	Confident	86.1	Confident	76 Å²	76	52.4 Å²	52.4	39%	0.39	25%	0.249	S	C	.	.			trans	-105.6	120.6	173.4	-60.2	173.2	0	0	0	107.7	S580 I584 L594	S580-I582 PolarHBondContact O-N 2.74Å; I582-I584 PolarHBondContact O-N 2.95Å; I582-L594 HydrophobicContact CB-CD1 4.2Å
583	K	83.5	Confident	86.2	Confident	143 Å²	143	52.2 Å²	52.2	62%	0.622	25%	0.247	S	C	*	.			trans	-82.9	109.8	178.7	-170.3	-162.7	175.1	-150.2	0	110.3	F581 E585	F581-K583 HydrophobicContact CE1-CB 3.91Å; F581-K583 HydrophobicContact CE1-CG 4.37Å; K583-E585 IonicContact NZ-OE1 2.74Å; K583-E585 PolarHBondContact NZ-OE1 3.44Å
584	I	86.9	Confident	86.2	Confident	42 Å²	42	52.4 Å²	52.4	22%	0.215	25%	0.248	C	C	.	.			trans	-91.9	132	167.6	-59.9	-176.5	0	0	0	108.8	I582 E586 Q590 K591 L594	I582-I584 PolarHBondContact O-N 2.95Å; I584-E586 HydrophobicContact CG2-CB 4.29Å; I584-Q590 HydrophobicContact CD1-CB 3.59Å; I584-K591 HydrophobicContact CB-CB 4.14Å; I584-K591 HydrophobicContact CG2-CB 4.29Å; I584-L594 HydrophobicContact CD1-CD1 3.55Å; I584-L594 HydrophobicContact CG1-CD1 3.95Å
585	E	84.5	Confident	86.1	Confident	156 Å²	156	55.8 Å²	55.8	73%	0.729	26%	0.264	S	S	*	.			trans	-92.8	-27.7	178.7	-54.6	-155.5	139.4	0	0	112.8	K583	K583-E585 IonicContact NZ-OE1 2.74Å; K583-E585 PolarHBondContact NZ-OE1 3.44Å
586	E	86.1	Confident	86.1	Confident	148 Å²	148	55.6 Å²	55.6	69%	0.692	26%	0.263	S	S	*	.	S	Bend	trans	-71.2	147.2	175.2	-60.6	-173.9	173.2	0	0	111.4	I584 T588 K591	I584-E586 HydrophobicContact CG2-CB 4.29Å; E586-T588 VanDerWaalsContact C-N 3.33Å; E586-T588 HydrophobicContact CB-CG2 4.13Å; E586-T588 PolarHBondContact O-N 3.12Å; E586-K591 WeakPolarHBondContact O-CD 3.38Å
587	D	83.6	Confident	86.5	Confident	79 Å²	79	55.5 Å²	55.5	42%	0.422	26%	0.263	S	S	.	.			trans	-86.4	75.8	-178.6	-156.9	44.3	0	0	0	110.8	K591 Y592 H1086	D587-K591 IonicContact OD1-NZ 2.66Å; D587-K591 PolarHBondContact OD1-NZ 3.36Å; D587-Y592 WeakPolarHBondContact OD1-CE2 3.32Å; D587-Y592 VanDerWaalsContact OD1-CZ 3.32Å; D587-Y592 PolarHBondContact OD1-OH 2.96Å; D587-H1086 PolarHBondContact O-CD2 3.35Å; D587-H1086 PolarHBondContact O-NE2 3.37Å
588	T	89.3	Confident	86.7	Confident	37 Å²	37	56.1 Å²	56.1	23%	0.227	27%	0.267	C	S	.	.	S	Bend	trans	-111.8	167	178.2	67.8	0	0	0	0	111.3	E586 Q590 K591 Y592	E586-T588 VanDerWaalsContact C-N 3.33Å; E586-T588 HydrophobicContact CB-CG2 4.13Å; E586-T588 PolarHBondContact O-N 3.12Å; T588-Q590 PolarHBondContact O-N 3.01Å; T588-Q590 PolarHBondContact OG1-N 3.44Å; T588-K591 WeakPolarHBondContact O-CB 3.38Å; T588-K591 PolarHBondContact O-N 3.4Å; T588-Y592 WeakPolarHBondContact O-CD2 3.36Å
589	W	90.8	Very high	87.3	Confident	26 Å²	26	55.6 Å²	55.6	10%	0.098	27%	0.265	C	S	.	.	H	α-helix	trans	-59.4	-32.8	173.1	69.5	-95.9	0	0	0	112.5	K591 Y592 Y593 L970 Q972 A975 R1083 Y1097	W589-K591 VanDerWaalsContact C-N 3.33Å; W589-K591 PolarHBondContact O-N 3.45Å; W589-Y592 PolarHBondContact O-N 3.29Å; W589-Y593 HydrophobicContact CZ3-CD1 4.12Å; W589-Y593 HydrophobicContact CZ3-CG 4.1Å; W589-Y593 WeakPolarHBondContact O-CB 3.25Å; W589-Y593 PolarHBondContact O-N 3.25Å; W589-L970 WeakPolarHBondContact CH2-O 2.98Å; W589-Q972 HydrophobicContact CH2-CB 4.44Å; W589-Q972 HydrophobicContact CZ2-CB 4.09Å; W589-A975 HydrophobicContact CH2-CB 3.82Å; W589-A975 HydrophobicContact CZ3-CB 3.48Å; W589-A975 VanDerWaalsContact CZ3-CB 3.48Å; W589-R1083 HydrophobicContact CB-CG 4.02Å; W589-R1083 HydrophobicContact CD2-CG 4.49Å; W589-R1083 HydrophobicContact CG-CG 3.78Å; W589-Y1097 HydrophobicContact CB-CD1 3.99Å; W589-Y1097 HydrophobicContact CB-CE1 3.71Å; W589-Y1097 HydrophobicContact CB-CE2 4.49Å; W589-Y1097 HydrophobicContact CE3-CD2 4.41Å; W589-Y1097 HydrophobicContact CE3-CG 4.26Å; W589-Y1097 WeakPolarHBondContact O-CE2 3.03Å
590	Q	91.1	Very high	87.8	Confident	69 Å²	69	55 Å²	55	32%	0.322	26%	0.264	S	S	.	.	H	α-helix	trans	-62.8	-36.3	-179.6	-67.1	177.9	-20.9	0	0	112.5	I584 T588 Y592 Y593 L594	I584-Q590 HydrophobicContact CD1-CB 3.59Å; T588-Q590 PolarHBondContact O-N 3.01Å; T588-Q590 PolarHBondContact OG1-N 3.44Å; Q590-Y592 PolarHBondContact O-N 3.49Å; Q590-Y593 PolarHBondContact O-N 2.92Å; Q590-L594 VanDerWaalsContact O-CB 3.31Å; Q590-L594 WeakPolarHBondContact O-CB 3.15Å; Q590-L594 WeakPolarHBondContact O-CG 3.01Å; Q590-L594 PolarHBondContact O-N 3.23Å
591	K	92.1	Very high	88.7	Confident	68 Å²	68	54.6 Å²	54.6	30%	0.296	26%	0.258	S	S	.	.	H	α-helix	trans	-56.9	-48.7	176.5	170.7	-174.3	155.7	-162.9	0	111.7	I584 E586 D587 T588 W589 E595	I584-K591 HydrophobicContact CB-CB 4.14Å; I584-K591 HydrophobicContact CG2-CB 4.29Å; E586-K591 WeakPolarHBondContact O-CD 3.38Å; D587-K591 IonicContact OD1-NZ 2.66Å; D587-K591 PolarHBondContact OD1-NZ 3.36Å; T588-K591 WeakPolarHBondContact O-CB 3.38Å; T588-K591 PolarHBondContact O-N 3.4Å; W589-K591 VanDerWaalsContact C-N 3.33Å; W589-K591 PolarHBondContact O-N 3.45Å; K591-E595 PolarHBondContact O-N 3.01Å
592	Y	92.4	Very high	89.2	Confident	44 Å²	44	50.5 Å²	50.5	17%	0.173	24%	0.24	C	C	.	.	H	α-helix	trans	-73.3	-35	179.4	-61.5	-69.1	0	0	0	112.5	D587 T588 W589 Q590 Y1097 F1106	D587-Y592 WeakPolarHBondContact OD1-CE2 3.32Å; D587-Y592 VanDerWaalsContact OD1-CZ 3.32Å; D587-Y592 PolarHBondContact OD1-OH 2.96Å; T588-Y592 WeakPolarHBondContact O-CD2 3.36Å; W589-Y592 PolarHBondContact O-N 3.29Å; Q590-Y592 PolarHBondContact O-N 3.49Å; Y592-Y1097 WeakPolarHBondContact CB-OH 3.45Å; Y592-F1106 AromaticContact CD1-CE2 3.83Å; Y592-F1106 HydrophobicContact CD1-CE2 3.83Å; Y592-F1106 HydrophobicContact CD1-CZ 4.01Å; Y592-F1106 HydrophobicContact CE1-CE2 4.32Å
593	Y	94.4	Very high	89.5	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.008	23%	0.229	C	C	.	.	H	α-helix	trans	-62.1	-46.7	172.9	174.2	-109.8	0	0	0	111.9	T570 N574 W589 Q590 E595 G596 V597 Y969 A975 V1098	T570-Y593 HydrophobicContact CG2-CE2 4.32Å; N574-Y593 PolarHBondContact ND2-OH 2.82Å; N574-Y593 VanDerWaalsContact ND2-OH 3.1Å; W589-Y593 HydrophobicContact CZ3-CD1 4.12Å; W589-Y593 HydrophobicContact CZ3-CG 4.1Å; W589-Y593 WeakPolarHBondContact O-CB 3.25Å; W589-Y593 PolarHBondContact O-N 3.25Å; Q590-Y593 PolarHBondContact O-N 2.92Å; Y593-E595 PolarHBondContact O-N 3.1Å; Y593-G596 CarbonylContact O-C 3.58Å; Y593-G596 WeakPolarHBondContact O-CA 2.85Å; Y593-G596 PolarHBondContact O-N 3.32Å; Y593-V597 HydrophobicContact CD1-CG2 3.83Å; Y593-V597 HydrophobicContact CD2-CG2 4.38Å; Y593-V597 HydrophobicContact CE1-CG2 3.44Å; Y593-V597 VanDerWaalsContact CE1-CG2 3.44Å; Y593-V597 HydrophobicContact CE2-CG2 4.02Å; Y593-V597 HydrophobicContact CG-CG2 4.29Å; Y593-V597 WeakPolarHBondContact O-CG2 3Å; Y593-V597 PolarHBondContact O-N 2.67Å; Y593-Y969 HydrophobicContact CE1-CD2 4.36Å; Y593-Y969 WeakPolarHBondContact CE1-O 3.49Å; Y593-Y969 VanDerWaalsContact CZ-O 3.23Å; Y593-Y969 PolarHBondContact OH-O 2.94Å; Y593-A975 HydrophobicContact CD1-CB 4.39Å; Y593-A975 HydrophobicContact CD2-CB 3.97Å; Y593-A975 HydrophobicContact CE1-CB 4.1Å; Y593-A975 HydrophobicContact CE2-CB 3.69Å; Y593-A975 HydrophobicContact CG-CB 4.33Å; Y593-V1098 VanDerWaalsContact CD2-O 3.3Å; Y593-V1098 WeakPolarHBondContact CD2-O 3.48Å
594	L	92.6	Very high	89.9	Confident	4 Å²	4	42.3 Å²	42.3	2%	0.021	20%	0.204	C	C	.	.	H	α-helix	trans	-67.7	-30.6	-176.7	-79.2	167.9	0	0	0	114.2	I582 I584 Q590 G596 V597 S598 Y969 L970	I582-L594 HydrophobicContact CB-CD1 4.2Å; I584-L594 HydrophobicContact CD1-CD1 3.55Å; I584-L594 HydrophobicContact CG1-CD1 3.95Å; Q590-L594 VanDerWaalsContact O-CB 3.31Å; Q590-L594 WeakPolarHBondContact O-CB 3.15Å; Q590-L594 WeakPolarHBondContact O-CG 3.01Å; Q590-L594 PolarHBondContact O-N 3.23Å; L594-G596 PolarHBondContact O-N 2.71Å; L594-V597 HydrophobicContact CD2-CB 4.31Å; L594-V597 HydrophobicContact CD2-CG2 4.39Å; L594-V597 PolarHBondContact O-N 2.84Å; L594-S598 PolarHBondContact O-N 3.29Å; L594-Y969 HydrophobicContact CD2-CE2 4.12Å; L594-L970 HydrophobicContact CD1-CD2 4.42Å; L594-L970 HydrophobicContact CD2-CD2 3.82Å; L594-L970 HydrophobicContact CG-CD2 4.42Å
595	E	90.1	Very high	90.2	Very high	72 Å²	72	45.6 Å²	45.6	34%	0.336	21%	0.214	S	C	.	.	H	α-helix	trans	-58.9	-38.8	167.9	-173.5	173.7	-166.7	0	0	111.1	K591 Y593 S598 N599 P1103	K591-E595 PolarHBondContact O-N 3.01Å; Y593-E595 PolarHBondContact O-N 3.1Å; E595-S598 PolarHBondContact O-OG 2.67Å; E595-S598 VanDerWaalsContact O-OG 3.07Å; E595-N599 PolarHBondContact O-ND2 2.85Å; E595-N599 VanDerWaalsContact O-ND2 3.07Å; E595-P1103 WeakPolarHBondContact OE1-CD 3.09Å; E595-P1103 WeakPolarHBondContact OE1-CG 3.44Å
596	G	91.2	Very high	90.7	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.01	18%	0.183	C	C	.	.	H	α-helix	trans	-70.6	-38.6	172.6	0	0	0	0	0	114	Y593 L594 S598 N599 T1100	Y593-G596 CarbonylContact O-C 3.58Å; Y593-G596 WeakPolarHBondContact O-CA 2.85Å; Y593-G596 PolarHBondContact O-N 3.32Å; L594-G596 PolarHBondContact O-N 2.71Å; G596-S598 VanDerWaalsContact C-N 3.31Å; G596-S598 PolarHBondContact O-N 3.33Å; G596-N599 PolarHBondContact O-N 2.89Å; G596-N599 PolarHBondContact O-ND2 3.01Å; G596-N599 VanDerWaalsContact O-ND2 3.08Å; G596-T1100 WeakPolarHBondContact CA-O 3.41Å
597	V	92.1	Very high	91	Very high	4 Å²	4	32.2 Å²	32.2	2%	0.024	15%	0.153	C	C	.	.	H	α-helix	trans	-63.1	-33.3	-179.9	173.4	0	0	0	0	112.6	R579 Y593 L594 N599 Y969	R579-V597 HydrophobicContact CB-CG1 3.92Å; R579-V597 HydrophobicContact CG-CG1 4.44Å; Y593-V597 HydrophobicContact CD1-CG2 3.83Å; Y593-V597 HydrophobicContact CD2-CG2 4.38Å; Y593-V597 HydrophobicContact CE1-CG2 3.44Å; Y593-V597 VanDerWaalsContact CE1-CG2 3.44Å; Y593-V597 HydrophobicContact CE2-CG2 4.02Å; Y593-V597 HydrophobicContact CG-CG2 4.29Å; Y593-V597 WeakPolarHBondContact O-CG2 3Å; Y593-V597 PolarHBondContact O-N 2.67Å; L594-V597 HydrophobicContact CD2-CB 4.31Å; L594-V597 HydrophobicContact CD2-CG2 4.39Å; L594-V597 PolarHBondContact O-N 2.84Å; V597-N599 PolarHBondContact O-N 3.22Å; V597-Y969 HydrophobicContact CG1-CD2 4.03Å; V597-Y969 HydrophobicContact CG1-CE2 3.91Å; V597-Y969 HydrophobicContact CG2-CD2 4.33Å
598	S	89.6	Confident	91.3	Very high	18 Å²	18	31.9 Å²	31.9	13%	0.126	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	16.3	179.4	61.2	0	0	0	0	115	L594 E595 G596 S665	L594-S598 PolarHBondContact O-N 3.29Å; E595-S598 PolarHBondContact O-OG 2.67Å; E595-S598 VanDerWaalsContact O-OG 3.07Å; G596-S598 VanDerWaalsContact C-N 3.31Å; G596-S598 PolarHBondContact O-N 3.33Å; S598-S665 WeakPolarHBondContact O-CA 3.39Å; S598-S665 WeakPolarHBondContact O-CB 3.46Å
599	N	91.4	Very high	91.4	Very high	9 Å²	9	31.9 Å²	31.9	5%	0.048	16%	0.161	C	C	.	.			trans	-104.6	133.6	174.1	-67.5	-91.5	0	0	0	109.7	L575 E595 G596 V597 I663 A664 T1100 N1101	L575-N599 HydrophobicContact CD2-CB 4.16Å; L575-N599 WeakPolarHBondContact CD2-O 3.03Å; E595-N599 PolarHBondContact O-ND2 2.85Å; E595-N599 VanDerWaalsContact O-ND2 3.07Å; G596-N599 PolarHBondContact O-N 2.89Å; G596-N599 PolarHBondContact O-ND2 3.01Å; G596-N599 VanDerWaalsContact O-ND2 3.08Å; V597-N599 PolarHBondContact O-N 3.22Å; N599-I663 HydrophobicContact CB-CG2 3.61Å; N599-A664 CarbonylContact C-O 3.52Å; N599-A664 WeakPolarHBondContact CA-O 3.27Å; N599-T1100 PolarHBondContact ND2-O 3.42Å; N599-N1101 PolarHBondContact OD1-ND2 2.71Å
600	E	89.3	Confident	91.5	Very high	13 Å²	13	30.7 Å²	30.7	6%	0.061	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	169	170.7	-50.2	96.7	153.1	0	0	112.1	L575 M578 Y602 I663 A664	L575-E600 WeakPolarHBondContact O-CA 3.46Å; M578-E600 HydrophobicContact CE-CG 4.44Å; M578-E600 VanDerWaalsContact CE-OE1 3.28Å; M578-E600 WeakPolarHBondContact CE-OE1 3.49Å; M578-E600 HydrophobicContact SD-CG 4.37Å; E600-Y602 HydrophobicContact CB-CE2 3.85Å; E600-Y602 WeakPolarHBondContact O-CD2 3.31Å; E600-Y602 PolarHBondContact OE2-OH 3.34Å; E600-Y602 VanDerWaalsContact OE2-OH 3.07Å; E600-I663 WeakPolarHBondContact O-CA 3.21Å; E600-A664 PolarHBondContact N-O 2.97Å; E600-A664 PolarHBondContact O-N 2.67Å
601	M	89.7	Confident	91.6	Very high	21 Å²	21	30.4 Å²	30.4	10%	0.103	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	124	177.2	-167.1	-176.8	-57.2	0	0	111.5	L575 F662 I998 L1001 I1002	L575-M601 HydrophobicContact CB-CE 4.38Å; L575-M601 HydrophobicContact CD1-CE 4.28Å; L575-M601 PolarHBondContact O-N 3.28Å; M601-F662 WeakPolarHBondContact CA-O 3.49Å; M601-I998 HydrophobicContact CB-CD1 3.86Å; M601-I998 HydrophobicContact CG-CD1 3.52Å; M601-I998 WeakPolarHBondContact O-CD1 3.42Å; M601-I998 HydrophobicContact SD-CD1 3.64Å; M601-I998 HydrophobicContact SD-CG2 4.39Å; M601-L1001 HydrophobicContact CG-CD2 4.48Å; M601-L1001 HydrophobicContact SD-CD2 3.5Å; M601-L1001 WeakPolarHBondContact SD-CD2 3.42Å; M601-L1001 HydrophobicContact SD-CG 4.17Å; M601-I1002 HydrophobicContact CE-CG1 4.23Å
602	Y	88.9	Confident	91.5	Very high	29 Å²	29	29.3 Å²	29.3	11%	0.114	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	157.2	-175.1	-68.1	-74.7	0	0	0	112.4	E600 F661 F662 A664 A667 V670	E600-Y602 HydrophobicContact CB-CE2 3.85Å; E600-Y602 WeakPolarHBondContact O-CD2 3.31Å; E600-Y602 PolarHBondContact OE2-OH 3.34Å; E600-Y602 VanDerWaalsContact OE2-OH 3.07Å; Y602-F661 WeakPolarHBondContact O-CA 3.34Å; Y602-F662 PolarHBondContact N-O 3.4Å; Y602-F662 PolarHBondContact O-N 3.45Å; Y602-A664 HydrophobicContact CD2-CB 4.23Å; Y602-A667 HydrophobicContact CD1-CB 4.09Å; Y602-A667 HydrophobicContact CE1-CB 3.59Å; Y602-A667 PolarHBondContact OH-N 3.38Å; Y602-V670 HydrophobicContact CD2-CG2 3.79Å; Y602-V670 HydrophobicContact CG-CG2 3.87Å
603	T	90.4	Very high	91.6	Very high	25 Å²	25	30 Å²	30	15%	0.153	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	135.3	174.6	74.3	0	0	0	0	111.2	G660 F661 N995 N997 I998	T603-G660 WeakPolarHBondContact CA-O 3.27Å; T603-F661 HydrophobicContact CG2-CD1 3.58Å; T603-F661 HydrophobicContact CG2-CE1 3.63Å; T603-F661 HydrophobicContact CG2-CG 4.44Å; T603-N995 PolarHBondContact OG1-OD1 3.02Å; T603-N997 HydrophobicContact CG2-CB 4.41Å; T603-I998 HydrophobicContact CG2-CD1 4.29Å
604	E	92.4	Very high	91.6	Very high	21 Å²	21	30.9 Å²	30.9	10%	0.098	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	146.7	-179.8	-166.2	72.7	-110.9	0	0	111.3	G660 F662 V670 K671 F674	E604-G660 PolarHBondContact N-O 3.32Å; E604-G660 PolarHBondContact O-N 2.91Å; E604-F662 HydrophobicContact CB-CD2 4.43Å; E604-F662 HydrophobicContact CB-CE2 4.2Å; E604-V670 HydrophobicContact CB-CG1 3.72Å; E604-V670 HydrophobicContact CG-CG1 4.44Å; E604-K671 IonicContact OE1-NZ 3.67Å; E604-K671 PolarHBondContact OE1-NZ 3.3Å; E604-K671 WeakPolarHBondContact OE2-CD 3.47Å; E604-K671 WeakPolarHBondContact OE2-CE 3.38Å; E604-K671 IonicContact OE2-NZ 3.56Å; E604-K671 PolarHBondContact OE2-NZ 2.99Å; E604-F674 HydrophobicContact CG-CB 4.15Å
605	Y	93.2	Very high	91.7	Very high	112 Å²	112	30.7 Å²	30.7	44%	0.439	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	137.3	173.9	-72.5	-78.4	0	0	0	111.8	L659 F674	Y605-L659 HydrophobicContact CD1-CB 4.43Å; Y605-L659 HydrophobicContact CD1-CD1 4.15Å; Y605-L659 HydrophobicContact CD2-CD1 4.06Å; Y605-L659 HydrophobicContact CE1-CB 4.26Å; Y605-L659 HydrophobicContact CE1-CD1 4.09Å; Y605-L659 HydrophobicContact CE2-CD1 3.99Å; Y605-L659 HydrophobicContact CG-CD1 4.14Å; Y605-F674 WeakPolarHBondContact O-CA 3.45Å; Y605-F674 WeakPolarHBondContact O-CB 3.25Å; Y605-F674 WeakPolarHBondContact O-CD2 3.11Å
606	L	93.8	Very high	92	Very high	12 Å²	12	27.9 Å²	27.9	6%	0.063	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-72	142.8	175.8	-63.8	178.5	0	0	0	111.3	F610 M630 I633 I654 T658 F662	L606-F610 HydrophobicContact CB-CD2 4.17Å; L606-F610 HydrophobicContact CD2-CD2 4.3Å; L606-M630 HydrophobicContact CD1-SD 4.4Å; L606-M630 HydrophobicContact CD2-SD 3.99Å; L606-I633 HydrophobicContact CD1-CG2 4.35Å; L606-I654 HydrophobicContact CD1-CD1 4.26Å; L606-I654 HydrophobicContact CD1-CG1 4.41Å; L606-I654 HydrophobicContact CD1-CG2 3.66Å; L606-T658 HydrophobicContact CD1-CG2 3.89Å; L606-T658 PolarHBondContact N-O 2.89Å; L606-T658 VanDerWaalsContact N-O 3.08Å; L606-F662 HydrophobicContact CD2-CE2 4.34Å; L606-F662 HydrophobicContact CD2-CZ 3.72Å
607	S	92.9	Very high	92.1	Very high	10 Å²	10	30.4 Å²	30.4	7%	0.07	18%	0.183	C	C	.	.	P	Polyproline II helix	trans	-59.9	148.8	170	175.9	0	0	0	0	112.2	A609 F610 A673 F674 Y676	S607-A609 PolarHBondContact O-N 2.84Å; S607-A609 VanDerWaalsContact O-N 3.08Å; S607-A609 PolarHBondContact OG-N 3.49Å; S607-A609 VanDerWaalsContact OG-N 3.17Å; S607-F610 PolarHBondContact O-N 3.18Å; S607-A673 WeakPolarHBondContact CB-O 3.47Å; S607-A673 PolarHBondContact N-O 3.16Å; S607-A673 VanDerWaalsContact N-O 3.12Å; S607-F674 WeakPolarHBondContact CB-O 3.28Å; S607-Y676 VanDerWaalsContact CB-O 3.29Å; S607-Y676 WeakPolarHBondContact CB-O 3.44Å; S607-Y676 PolarHBondContact OG-O 3.2Å
608	S	90.1	Very high	92.2	Very high	72 Å²	72	30.2 Å²	30.2	50%	0.503	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-58.2	-20.6	170.8	58	0	0	0	0	113.1	F610 V611	S608-F610 PolarHBondContact O-N 3.09Å; S608-V611 PolarHBondContact O-N 2.96Å
609	A	90.3	Very high	92.5	Very high	37 Å²	37	29.4 Å²	29.4	31%	0.306	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-63.6	-15.6	173.1	0	0	0	0	0	114.2	S607 Y676	S607-A609 PolarHBondContact O-N 2.84Å; S607-A609 VanDerWaalsContact O-N 3.08Å; S607-A609 PolarHBondContact OG-N 3.49Å; S607-A609 VanDerWaalsContact OG-N 3.17Å; A609-Y676 HydrophobicContact CB-CD1 4.2Å
610	F	93.3	Very high	92.7	Very high	1 Å²	1	31.4 Å²	31.4	0%	0.004	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-98	-8.3	178.1	-59.3	-53.7	0	0	0	114	L606 S607 S608 G612 L613 V618 L621 L626 A673 Y676	L606-F610 HydrophobicContact CB-CD2 4.17Å; L606-F610 HydrophobicContact CD2-CD2 4.3Å; S607-F610 PolarHBondContact O-N 3.18Å; S608-F610 PolarHBondContact O-N 3.09Å; F610-G612 PolarHBondContact O-N 3.19Å; F610-L613 HydrophobicContact CD1-CD1 4.28Å; F610-L613 WeakPolarHBondContact O-CB 3.4Å; F610-L613 PolarHBondContact O-N 3.32Å; F610-V618 HydrophobicContact CB-CG1 4.29Å; F610-V618 HydrophobicContact CB-CG2 4.08Å; F610-V618 HydrophobicContact CD1-CG1 3.9Å; F610-V618 HydrophobicContact CD1-CG2 4.14Å; F610-V618 HydrophobicContact CD2-CG1 4.38Å; F610-V618 HydrophobicContact CE1-CG1 4.28Å; F610-V618 HydrophobicContact CG-CG1 3.95Å; F610-V618 HydrophobicContact CG-CG2 4.37Å; F610-L621 HydrophobicContact CE1-CB 4.46Å; F610-L621 HydrophobicContact CE1-CD1 4.38Å; F610-L626 HydrophobicContact CZ-CD1 4.29Å; F610-A673 WeakPolarHBondContact CE2-O 3.4Å; F610-Y676 HydrophobicContact CD1-CD1 4.48Å; F610-Y676 AromaticContact CE1-CD1 3.58Å; F610-Y676 HydrophobicContact CE1-CD1 3.58Å; F610-Y676 AromaticContact CE1-CE1 3.91Å; F610-Y676 HydrophobicContact CE1-CE1 3.91Å; F610-Y676 HydrophobicContact CE1-CG 4.46Å; F610-Y676 HydrophobicContact CE2-CD1 4.18Å; F610-Y676 AromaticContact CZ-CD1 3.4Å; F610-Y676 HydrophobicContact CZ-CD1 3.4Å; F610-Y676 HydrophobicContact CZ-CE1 4.15Å; F610-Y676 AromaticContact CZ-CG 3.88Å; F610-Y676 HydrophobicContact CZ-CG 3.88Å
611	V	93.1	Very high	92.8	Very high	63 Å²	63	33.2 Å²	33.2	38%	0.382	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	134.7	-177.1	178	0	0	0	0	110.6	S608 L613 E656	S608-V611 PolarHBondContact O-N 2.96Å; V611-L613 PolarHBondContact O-N 3.38Å; V611-E656 HydrophobicContact CG2-CB 3.99Å
612	G	91	Very high	93	Very high	46 Å²	46	32.2 Å²	32.2	47%	0.474	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.3	-10.4	-177	0	0	0	0	0	115.3	F610 I654	F610-G612 PolarHBondContact O-N 3.19Å; G612-I654 PolarHBondContact N-O 2.91Å
613	L	94	Very high	93.3	Very high	59 Å²	59	31.3 Å²	31.3	31%	0.309	19%	0.186	S	C	.	.	S	Bend	trans	-75.4	156	171.5	-58.6	-176.6	0	0	0	111.3	F610 V611 V618 L621 K653 I654	F610-L613 HydrophobicContact CD1-CD1 4.28Å; F610-L613 WeakPolarHBondContact O-CB 3.4Å; F610-L613 PolarHBondContact O-N 3.32Å; V611-L613 PolarHBondContact O-N 3.38Å; L613-V618 HydrophobicContact CB-CG2 3.69Å; L613-V618 HydrophobicContact CD1-CG2 4.13Å; L613-L621 HydrophobicContact CD1-CD1 4.18Å; L613-K653 WeakPolarHBondContact O-CA 2.97Å; L613-I654 PolarHBondContact O-N 2.91Å
614	S	94.8	Very high	93.4	Very high	20 Å²	20	33.2 Å²	33.2	14%	0.14	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-76.9	145.7	171.3	8.3	0	0	0	0	111.3	T617 V618 K653	S614-T617 VanDerWaalsContact O-CB 3.32Å; S614-T617 WeakPolarHBondContact O-CB 3.46Å; S614-T617 PolarHBondContact O-N 2.96Å; S614-T617 PolarHBondContact OG-OG1 2.91Å; S614-V618 PolarHBondContact O-N 3.38Å; S614-V618 VanDerWaalsContact O-N 3.13Å; S614-K653 VanDerWaalsContact CB-NZ 3.34Å; S614-K653 PolarHBondContact OG-NZ 2.95Å
615	F	94.4	Very high	93.3	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-51.4	-49.2	179.4	174.2	-85.6	0	0	0	113.8	T617 V618 C619 M630 I633 N647 P648 I654	F615-T617 VanDerWaalsContact C-N 3.27Å; F615-T617 PolarHBondContact O-N 3.15Å; F615-V618 PolarHBondContact O-N 3.33Å; F615-C619 WeakPolarHBondContact CE1-SG 3.34Å; F615-C619 WeakPolarHBondContact CZ-SG 3.44Å; F615-C619 PolarHBondContact O-N 3.17Å; F615-M630 HydrophobicContact CD2-CE 3.7Å; F615-M630 HydrophobicContact CE2-CE 3.59Å; F615-M630 HydrophobicContact CE2-CG 4.29Å; F615-M630 HydrophobicContact CE2-SD 4.36Å; F615-M630 HydrophobicContact CG-CE 4.47Å; F615-M630 HydrophobicContact CZ-CE 4.24Å; F615-I633 HydrophobicContact CD2-CD1 4.24Å; F615-I633 HydrophobicContact CD2-CG1 4.23Å; F615-I633 HydrophobicContact CD2-CG2 3.95Å; F615-I633 HydrophobicContact CE2-CG1 4.47Å; F615-I633 HydrophobicContact CE2-CG2 3.98Å; F615-N647 HydrophobicContact CE1-CB 4.28Å; F615-N647 WeakPolarHBondContact CE1-OD1 3.42Å; F615-P648 HydrophobicContact CB-CG 3.92Å; F615-P648 HydrophobicContact CD1-CG 4.08Å; F615-P648 VanDerWaalsContact CD1-O 3.26Å; F615-P648 WeakPolarHBondContact CD1-O 3.1Å; F615-P648 HydrophobicContact CD2-CG 3.71Å; F615-P648 HydrophobicContact CE2-CG 4.23Å; F615-P648 HydrophobicContact CG-CG 3.63Å; F615-I654 HydrophobicContact CB-CD1 4.38Å; F615-I654 HydrophobicContact CD2-CD1 4.47Å
616	P	95.3	Very high	93.2	Very high	13 Å²	13	30.1 Å²	30.1	8%	0.084	19%	0.186	C	C	.	.	H	α-helix	trans	-56.8	-36.2	175.7	-28.8	36.2	0	0	0	114.5	V618 C619 E620 L1069	P616-V618 VanDerWaalsContact C-N 3.34Å; P616-C619 PolarHBondContact O-N 3.49Å; P616-E620 PolarHBondContact O-N 3.46Å; P616-L1069 HydrophobicContact CB-CD1 3.96Å; P616-L1069 HydrophobicContact CB-CG 4.05Å; P616-L1069 HydrophobicContact CG-CD1 4.47Å; P616-L1069 WeakPolarHBondContact O-CD2 3.16Å
617	T	94.2	Very high	93.2	Very high	54 Å²	54	36.1 Å²	36.1	33%	0.331	21%	0.212	S	C	.	.	H	α-helix	trans	-68.1	-35.3	177.4	-43.2	0	0	0	0	111.6	S614 F615 L621	S614-T617 VanDerWaalsContact O-CB 3.32Å; S614-T617 WeakPolarHBondContact O-CB 3.46Å; S614-T617 PolarHBondContact O-N 2.96Å; S614-T617 PolarHBondContact OG-OG1 2.91Å; F615-T617 VanDerWaalsContact C-N 3.27Å; F615-T617 PolarHBondContact O-N 3.15Å; T617-L621 WeakPolarHBondContact O-CG 3.43Å; T617-L621 PolarHBondContact O-N 3.47Å
618	V	94.8	Very high	93.3	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-75.2	-40.5	176.1	-179.3	0	0	0	0	110.7	F610 L613 S614 F615 P616 E620 L621 C622 M630 I654	F610-V618 HydrophobicContact CB-CG1 4.29Å; F610-V618 HydrophobicContact CB-CG2 4.08Å; F610-V618 HydrophobicContact CD1-CG1 3.9Å; F610-V618 HydrophobicContact CD1-CG2 4.14Å; F610-V618 HydrophobicContact CD2-CG1 4.38Å; F610-V618 HydrophobicContact CE1-CG1 4.28Å; F610-V618 HydrophobicContact CG-CG1 3.95Å; F610-V618 HydrophobicContact CG-CG2 4.37Å; L613-V618 HydrophobicContact CB-CG2 3.69Å; L613-V618 HydrophobicContact CD1-CG2 4.13Å; S614-V618 PolarHBondContact O-N 3.38Å; S614-V618 VanDerWaalsContact O-N 3.13Å; F615-V618 PolarHBondContact O-N 3.33Å; P616-V618 VanDerWaalsContact C-N 3.34Å; V618-E620 PolarHBondContact O-N 3.18Å; V618-L621 PolarHBondContact O-N 3Å; V618-C622 WeakPolarHBondContact O-CB 3.41Å; V618-C622 PolarHBondContact O-N 3.01Å; V618-C622 PolarHBondContact O-SG 3.48Å; V618-M630 HydrophobicContact CB-CE 3.87Å; V618-M630 HydrophobicContact CG1-CE 3.6Å; V618-M630 HydrophobicContact CG1-SD 4.29Å; V618-I654 HydrophobicContact CG2-CG1 4.01Å
619	C	95.4	Very high	93.6	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.007	19%	0.185	C	C	.	.	H	α-helix	trans	-57.2	-45.2	172.4	-75.1	0	0	0	0	112.3	F615 P616 C622 F623 M630 L1069 L1075	F615-C619 WeakPolarHBondContact CE1-SG 3.34Å; F615-C619 WeakPolarHBondContact CZ-SG 3.44Å; F615-C619 PolarHBondContact O-N 3.17Å; P616-C619 PolarHBondContact O-N 3.49Å; C619-C622 PolarHBondContact O-N 2.92Å; C619-F623 VanDerWaalsContact O-CB 3.31Å; C619-F623 WeakPolarHBondContact O-CB 3.26Å; C619-F623 PolarHBondContact O-N 3.36Å; C619-M630 WeakPolarHBondContact SG-CE 3.36Å; C619-M630 PolarHBondContact SG-O 2.88Å; C619-L1069 HydrophobicContact CB-CD2 3.66Å; C619-L1075 HydrophobicContact CB-CD1 4.34Å
620	E	94.8	Very high	93.8	Very high	51 Å²	51	30.5 Å²	30.5	24%	0.238	17%	0.17	C	C	.	.	H	α-helix	trans	-58.9	-49.3	174.6	-177.9	-175.3	174.9	0	0	111.8	P616 V618 C622 F623 V624 K1070	P616-E620 PolarHBondContact O-N 3.46Å; V618-E620 PolarHBondContact O-N 3.18Å; E620-C622 PolarHBondContact O-N 2.71Å; E620-F623 PolarHBondContact O-N 2.57Å; E620-V624 HydrophobicContact CG-CG2 4.26Å; E620-V624 WeakPolarHBondContact O-CB 3.35Å; E620-V624 VanDerWaalsContact O-CG2 3.28Å; E620-V624 WeakPolarHBondContact O-CG2 3.37Å; E620-V624 PolarHBondContact O-N 2.65Å; E620-K1070 WeakPolarHBondContact OE1-CE 3.38Å; E620-K1070 IonicContact OE1-NZ 2.73Å; E620-K1070 PolarHBondContact OE1-NZ 3.34Å; E620-K1070 WeakPolarHBondContact OE2-CE 3.29Å; E620-K1070 IonicContact OE2-NZ 3.51Å; E620-K1070 PolarHBondContact OE2-NZ 3.46Å
621	L	92.6	Very high	93.9	Very high	50 Å²	50	31.5 Å²	31.5	26%	0.262	18%	0.175	S	C	.	.	H	α-helix	trans	-62.2	-44	178.5	-72.1	169.9	0	0	0	112.1	F610 L613 T617 V618 K625	F610-L621 HydrophobicContact CE1-CB 4.46Å; F610-L621 HydrophobicContact CE1-CD1 4.38Å; L613-L621 HydrophobicContact CD1-CD1 4.18Å; T617-L621 WeakPolarHBondContact O-CG 3.43Å; T617-L621 PolarHBondContact O-N 3.47Å; V618-L621 PolarHBondContact O-N 3Å; L621-K625 VanDerWaalsContact O-CB 3.28Å; L621-K625 WeakPolarHBondContact O-CB 3.26Å; L621-K625 PolarHBondContact O-N 3.13Å
622	C	94.2	Very high	93.9	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.157	C	C	.	.	I	π-helix	trans	-62.2	-44.6	176.9	-72.3	0	0	0	0	111.7	V618 C619 E620 L626 K627 L628 F662	V618-C622 WeakPolarHBondContact O-CB 3.41Å; V618-C622 PolarHBondContact O-N 3.01Å; V618-C622 PolarHBondContact O-SG 3.48Å; C619-C622 PolarHBondContact O-N 2.92Å; E620-C622 PolarHBondContact O-N 2.71Å; C622-L626 CarbonylContact O-C 3.58Å; C622-L626 VanDerWaalsContact O-C 3.32Å; C622-L626 VanDerWaalsContact O-CA 3.3Å; C622-L626 WeakPolarHBondContact O-CA 3.49Å; C622-L626 VanDerWaalsContact O-CB 3.26Å; C622-L626 WeakPolarHBondContact O-CB 3.49Å; C622-L626 PolarHBondContact O-N 3Å; C622-K627 PolarHBondContact O-N 2.89Å; C622-L628 CarbonylContact C-O 3.48Å; C622-L628 HydrophobicContact CB-CB 4.43Å; C622-L628 WeakPolarHBondContact CB-O 3.16Å; C622-L628 PolarHBondContact O-N 3.22Å; C622-F662 HydrophobicContact CB-CE1 4.49Å
623	F	94.6	Very high	94.1	Very high	11 Å²	11	26.3 Å²	26.3	5%	0.048	14%	0.135	C	C	.	.	I	π-helix	trans	-69.5	-49.9	-178.8	-168.6	-97.3	0	0	0	111.8	C619 E620 K627 L628 L629 Y1061 F1065 Y1104	C619-F623 VanDerWaalsContact O-CB 3.31Å; C619-F623 WeakPolarHBondContact O-CB 3.26Å; C619-F623 PolarHBondContact O-N 3.36Å; E620-F623 PolarHBondContact O-N 2.57Å; F623-K627 WeakPolarHBondContact O-CA 3.23Å; F623-K627 PolarHBondContact O-N 3.02Å; F623-L628 WeakPolarHBondContact CA-O 3.31Å; F623-L628 PolarHBondContact N-O 3.5Å; F623-L629 HydrophobicContact CD2-CB 4.42Å; F623-L629 HydrophobicContact CD2-CD1 4.29Å; F623-Y1061 HydrophobicContact CE2-CE1 4.33Å; F623-Y1061 AromaticContact CZ-CD1 3.99Å; F623-Y1061 HydrophobicContact CZ-CD1 3.99Å; F623-Y1061 AromaticContact CZ-CE1 3.86Å; F623-Y1061 HydrophobicContact CZ-CE1 3.86Å; F623-F1065 HydrophobicContact CB-CD1 4.16Å; F623-F1065 HydrophobicContact CB-CE1 3.54Å; F623-F1065 HydrophobicContact CB-CZ 3.95Å; F623-F1065 AromaticContact CD1-CD1 3.61Å; F623-F1065 HydrophobicContact CD1-CD1 3.61Å; F623-F1065 AromaticContact CD1-CE1 3.91Å; F623-F1065 HydrophobicContact CD1-CE1 3.91Å; F623-F1065 HydrophobicContact CD1-CG 4.1Å; F623-F1065 HydrophobicContact CD2-CD1 4.5Å; F623-F1065 HydrophobicContact CD2-CE1 4.28Å; F623-F1065 HydrophobicContact CD2-CE2 4.35Å; F623-F1065 HydrophobicContact CD2-CZ 4.21Å; F623-F1065 HydrophobicContact CE1-CB 4.31Å; F623-F1065 HydrophobicContact CE1-CD1 4.15Å; F623-F1065 HydrophobicContact CE1-CG 4.2Å; F623-F1065 AromaticContact CG-CD1 3.82Å; F623-F1065 HydrophobicContact CG-CD1 3.82Å; F623-F1065 AromaticContact CG-CE1 3.64Å; F623-F1065 HydrophobicContact CG-CE1 3.64Å; F623-F1065 HydrophobicContact CG-CE2 4.49Å; F623-F1065 HydrophobicContact CG-CG 4.35Å; F623-F1065 HydrophobicContact CG-CZ 4Å; F623-Y1104 HydrophobicContact CD1-CD2 4.06Å; F623-Y1104 AromaticContact CE1-CD2 3.73Å; F623-Y1104 HydrophobicContact CE1-CD2 3.73Å; F623-Y1104 HydrophobicContact CE1-CE2 4.41Å
624	V	92.1	Very high	93.9	Very high	65 Å²	65	24.6 Å²	24.6	39%	0.394	13%	0.125	S	C	.	.	I	π-helix	trans	-74.4	-46	-175.2	-179.8	0	0	0	0	112.6	E620 Y1104	E620-V624 HydrophobicContact CG-CG2 4.26Å; E620-V624 WeakPolarHBondContact O-CB 3.35Å; E620-V624 VanDerWaalsContact O-CG2 3.28Å; E620-V624 WeakPolarHBondContact O-CG2 3.37Å; E620-V624 PolarHBondContact O-N 2.65Å; V624-Y1104 HydrophobicContact CG2-CE2 4.01Å
625	K	90.1	Very high	93.4	Very high	66 Å²	66	27.3 Å²	27.3	29%	0.287	13%	0.133	S	C	.	.	I	π-helix	trans	-93	-40.4	-174.7	-67.3	-79.7	-175.1	168.2	0	113.3	L621 D682	L621-K625 VanDerWaalsContact O-CB 3.28Å; L621-K625 WeakPolarHBondContact O-CB 3.26Å; L621-K625 PolarHBondContact O-N 3.13Å; K625-D682 PolarHBondContact NZ-O 3.43Å
626	L	91.4	Very high	92.7	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	15%	0.15	C	C	.	.	I	π-helix	trans	-96.3	-11.9	-175.2	-49.1	-175.9	0	0	0	113.3	F610 C622 L628 R672 A673 Y676 I690	F610-L626 HydrophobicContact CZ-CD1 4.29Å; C622-L626 CarbonylContact O-C 3.58Å; C622-L626 VanDerWaalsContact O-C 3.32Å; C622-L626 VanDerWaalsContact O-CA 3.3Å; C622-L626 WeakPolarHBondContact O-CA 3.49Å; C622-L626 VanDerWaalsContact O-CB 3.26Å; C622-L626 WeakPolarHBondContact O-CB 3.49Å; C622-L626 PolarHBondContact O-N 3Å; L626-L628 VanDerWaalsContact C-N 3.25Å; L626-L628 HydrophobicContact CB-CB 4.34Å; L626-L628 HydrophobicContact CB-CD1 3.91Å; L626-L628 HydrophobicContact CB-CG 3.92Å; L626-L628 HydrophobicContact CD1-CD1 4.22Å; L626-L628 PolarHBondContact O-N 3.46Å; L626-R672 HydrophobicContact CD2-CB 4.49Å; L626-R672 PolarHBondContact O-NH2 2.85Å; L626-A673 HydrophobicContact CD1-CB 4.4Å; L626-Y676 HydrophobicContact CD2-CD2 3.81Å; L626-Y676 HydrophobicContact CD2-CE2 4.43Å; L626-Y676 HydrophobicContact CD2-CG 4.42Å; L626-I690 HydrophobicContact CD2-CD1 3.41Å; L626-I690 VanDerWaalsContact CD2-CD1 3.41Å
627	K	93.6	Very high	91.4	Very high	139 Å²	139	32.7 Å²	32.7	60%	0.604	16%	0.16	S	C	*	.			trans	53.6	42.1	-170.2	-55.3	-169.1	178.6	-167.2	0	112.4	C622 F623 P687	C622-K627 PolarHBondContact O-N 2.89Å; F623-K627 WeakPolarHBondContact O-CA 3.23Å; F623-K627 PolarHBondContact O-N 3.02Å; K627-P687 HydrophobicContact CD-CG 4.21Å; K627-P687 HydrophobicContact CG-CG 4.33Å
628	L	94.8	Very high	89.9	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.185	C	C	.	.			trans	-123	127.8	179	-61.5	176.5	0	0	0	110.2	C622 F623 L626 M630 F662 A664 E669 V670 A673	C622-L628 CarbonylContact C-O 3.48Å; C622-L628 HydrophobicContact CB-CB 4.43Å; C622-L628 WeakPolarHBondContact CB-O 3.16Å; C622-L628 PolarHBondContact O-N 3.22Å; F623-L628 WeakPolarHBondContact CA-O 3.31Å; F623-L628 PolarHBondContact N-O 3.5Å; L626-L628 VanDerWaalsContact C-N 3.25Å; L626-L628 HydrophobicContact CB-CB 4.34Å; L626-L628 HydrophobicContact CB-CD1 3.91Å; L626-L628 HydrophobicContact CB-CG 3.92Å; L626-L628 HydrophobicContact CD1-CD1 4.22Å; L626-L628 PolarHBondContact O-N 3.46Å; L628-M630 PolarHBondContact O-N 2.91Å; L628-F662 HydrophobicContact CB-CD1 3.92Å; L628-F662 HydrophobicContact CB-CE1 4.33Å; L628-F662 HydrophobicContact CD1-CD1 4.46Å; L628-F662 HydrophobicContact CD1-CE1 4.49Å; L628-A664 HydrophobicContact CD2-CB 3.75Å; L628-E669 HydrophobicContact CD2-CB 4.3Å; L628-V670 HydrophobicContact CD2-CG2 4.24Å; L628-A673 HydrophobicContact CD1-CB 4.09Å
629	L	96.3	Very high	88.2	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	102.9	177.7	175.7	61.9	0	0	0	110.2	F623 I631 F662 I663 F1065 L1075 F1077 N1101	F623-L629 HydrophobicContact CD2-CB 4.42Å; F623-L629 HydrophobicContact CD2-CD1 4.29Å; L629-I631 HydrophobicContact CG-CG1 4.29Å; L629-F662 CarbonylContact O-C 3.32Å; L629-F662 VanDerWaalsContact O-CA 3.29Å; L629-F662 WeakPolarHBondContact O-CA 3.44Å; L629-I663 HydrophobicContact CB-CB 4.33Å; L629-I663 HydrophobicContact CD2-CB 4.33Å; L629-I663 HydrophobicContact CD2-CD1 4.26Å; L629-I663 PolarHBondContact N-O 2.9Å; L629-I663 PolarHBondContact O-N 3.01Å; L629-F1065 HydrophobicContact CD1-CD2 4.49Å; L629-F1065 HydrophobicContact CD1-CE2 3.57Å; L629-F1065 HydrophobicContact CD1-CZ 4.09Å; L629-L1075 HydrophobicContact CD1-CD1 4.39Å; L629-F1077 HydrophobicContact CD2-CB 3.81Å; L629-N1101 VanDerWaalsContact CB-OD1 3.29Å; L629-N1101 WeakPolarHBondContact CB-OD1 3.46Å; L629-N1101 HydrophobicContact CD2-CB 4.02Å; L629-N1101 WeakPolarHBondContact CD2-OD1 3.46Å
630	M	95.9	Very high	86.3	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	124.8	177.9	-169.4	175.8	63.7	0	0	111.1	L606 F615 V618 C619 L628 I633 F661 F662 L1075	L606-M630 HydrophobicContact CD1-SD 4.4Å; L606-M630 HydrophobicContact CD2-SD 3.99Å; F615-M630 HydrophobicContact CD2-CE 3.7Å; F615-M630 HydrophobicContact CE2-CE 3.59Å; F615-M630 HydrophobicContact CE2-CG 4.29Å; F615-M630 HydrophobicContact CE2-SD 4.36Å; F615-M630 HydrophobicContact CG-CE 4.47Å; F615-M630 HydrophobicContact CZ-CE 4.24Å; V618-M630 HydrophobicContact CB-CE 3.87Å; V618-M630 HydrophobicContact CG1-CE 3.6Å; V618-M630 HydrophobicContact CG1-SD 4.29Å; C619-M630 WeakPolarHBondContact SG-CE 3.36Å; C619-M630 PolarHBondContact SG-O 2.88Å; L628-M630 PolarHBondContact O-N 2.91Å; M630-I633 HydrophobicContact SD-CG2 4.3Å; M630-F661 WeakPolarHBondContact CA-O 3.33Å; M630-F662 HydrophobicContact CB-CD1 3.76Å; M630-F662 HydrophobicContact CB-CE1 3.62Å; M630-F662 HydrophobicContact CB-CZ 4.45Å; M630-F662 HydrophobicContact CG-CD1 4.11Å; M630-F662 HydrophobicContact CG-CE1 3.77Å; M630-F662 HydrophobicContact CG-CZ 4.13Å; M630-F662 HydrophobicContact SD-CE1 4.03Å; M630-F662 HydrophobicContact SD-CZ 3.99Å; M630-L1075 WeakPolarHBondContact O-CD2 3.36Å
631	I	94.8	Very high	84.9	Confident	21 Å²	21	53.7 Å²	53.7	11%	0.108	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	-38.8	-173.9	-68	-170.1	0	0	0	113.4	L629 I646 N647 F661 I663 L1075 F1077 L1117	L629-I631 HydrophobicContact CG-CG1 4.29Å; I631-I646 HydrophobicContact CG2-CG2 3.97Å; I631-N647 PolarHBondContact O-N 3.09Å; I631-F661 PolarHBondContact N-O 3.33Å; I631-I663 HydrophobicContact CD1-CD1 3.31Å; I631-I663 HydrophobicContact CD1-CG1 3.74Å; I631-I663 HydrophobicContact CG1-CD1 4.47Å; I631-L1075 HydrophobicContact CB-CD2 4.3Å; I631-L1075 HydrophobicContact CG1-CD2 3.93Å; I631-F1077 HydrophobicContact CD1-CB 4.35Å; I631-L1117 HydrophobicContact CG2-CD1 4.15Å
632	A	93.8	Very high	83.9	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	166.2	-175	0	0	0	0	0	111.4	I644 L645 I646 F661 L1001	A632-I644 HydrophobicContact CB-CG2 4.04Å; A632-L645 VanDerWaalsContact CA-O 3.26Å; A632-L645 WeakPolarHBondContact CA-O 3.12Å; A632-L645 WeakPolarHBondContact CB-O 3.41Å; A632-I646 HydrophobicContact CB-CB 4.49Å; A632-I646 HydrophobicContact CB-CG1 4.3Å; A632-F661 HydrophobicContact CB-CB 4.02Å; A632-F661 HydrophobicContact CB-CD2 3.89Å; A632-F661 HydrophobicContact CB-CG 4.16Å; A632-F661 PolarHBondContact O-N 2.93Å; A632-L1001 HydrophobicContact CB-CD1 3.89Å; A632-L1001 HydrophobicContact CB-CD2 4.47Å
633	I	93.6	Very high	83.2	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.005	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	152.4	171.9	51.8	167.1	0	0	0	111.4	L606 F615 M630 L645 P648 L652 I654 T658 L659	L606-I633 HydrophobicContact CD1-CG2 4.35Å; F615-I633 HydrophobicContact CD2-CD1 4.24Å; F615-I633 HydrophobicContact CD2-CG1 4.23Å; F615-I633 HydrophobicContact CD2-CG2 3.95Å; F615-I633 HydrophobicContact CE2-CG1 4.47Å; F615-I633 HydrophobicContact CE2-CG2 3.98Å; M630-I633 HydrophobicContact SD-CG2 4.3Å; I633-L645 PolarHBondContact N-O 3Å; I633-L645 PolarHBondContact O-N 3.35Å; I633-P648 HydrophobicContact CD1-CG 3.81Å; I633-P648 HydrophobicContact CG1-CG 3.87Å; I633-L652 HydrophobicContact CD1-CD2 3.53Å; I633-I654 HydrophobicContact CD1-CD1 3.78Å; I633-I654 HydrophobicContact CG2-CD1 4.21Å; I633-T658 HydrophobicContact CB-CG2 3.72Å; I633-T658 HydrophobicContact CD1-CG2 4.49Å; I633-T658 HydrophobicContact CG2-CG2 3.77Å; I633-L659 CarbonylContact C-O 2.94Å; I633-L659 VanDerWaalsContact CA-O 3.31Å; I633-L659 WeakPolarHBondContact CA-O 3.5Å
634	E	90.9	Very high	82.9	Confident	22 Å²	22	59.6 Å²	59.6	10%	0.103	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	115.8	165.2	-170.7	-161.2	-172.9	0	0	109.9	K636 S642 L659	E634-K636 VanDerWaalsContact CD-NZ 3.34Å; E634-K636 WeakPolarHBondContact OE1-CE 3.48Å; E634-K636 IonicContact OE1-NZ 3.1Å; E634-K636 PolarHBondContact OE1-NZ 2.76Å; E634-K636 VanDerWaalsContact OE2-CE 3.25Å; E634-K636 WeakPolarHBondContact OE2-CE 3.32Å; E634-K636 IonicContact OE2-NZ 2.66Å; E634-K636 PolarHBondContact OE2-NZ 3.13Å; E634-S642 WeakPolarHBondContact OE1-CB 3.34Å; E634-S642 PolarHBondContact OE1-OG 3.14Å; E634-L659 HydrophobicContact CB-CB 3.83Å; E634-L659 PolarHBondContact N-O 3.41Å
635	Y	84.1	Confident	82.8	Confident	77 Å²	77	59.2 Å²	59.2	30%	0.302	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	122.9	174.2	-175.9	-99.3	0	0	0	110.9	S642 R643 L645 L652	Y635-S642 WeakPolarHBondContact O-CA 3.45Å; Y635-R643 PolarHBondContact N-O 3.34Å; Y635-R643 PolarHBondContact O-N 2.76Å; Y635-L645 HydrophobicContact CD1-CD1 4.37Å; Y635-L645 HydrophobicContact CG-CD1 3.94Å; Y635-L652 HydrophobicContact CD2-CD1 3.93Å; Y635-L652 HydrophobicContact CD2-CG 4.44Å; Y635-L652 HydrophobicContact CE2-CD1 4.22Å; Y635-L652 HydrophobicContact CE2-CG 4.48Å; Y635-L652 HydrophobicContact CG-CD1 4.45Å
636	K	80.4	Confident	82.9	Confident	83 Å²	83	57.3 Å²	57.3	36%	0.361	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	111.4	178.6	-75.2	165.6	180	141.6	0	109.5	E634 S642	E634-K636 VanDerWaalsContact CD-NZ 3.34Å; E634-K636 WeakPolarHBondContact OE1-CE 3.48Å; E634-K636 IonicContact OE1-NZ 3.1Å; E634-K636 PolarHBondContact OE1-NZ 2.76Å; E634-K636 VanDerWaalsContact OE2-CE 3.25Å; E634-K636 WeakPolarHBondContact OE2-CE 3.32Å; E634-K636 IonicContact OE2-NZ 2.66Å; E634-K636 PolarHBondContact OE2-NZ 3.13Å; K636-S642 WeakPolarHBondContact CE-OG 3.46Å; K636-S642 WeakPolarHBondContact CG-OG 3.45Å
637	S	66.5	Low	83	Confident	43 Å²	43	57.2 Å²	57.2	30%	0.301	28%	0.284	S	S	.	.			trans	-72.8	160.9	177	-173.4	0	0	0	0	111.6	N639 R640 E641	S637-N639 PolarHBondContact O-N 3.18Å; S637-R640 WeakPolarHBondContact O-CA 3.49Å; S637-R640 PolarHBondContact O-N 2.9Å; S637-E641 PolarHBondContact N-O 3.09Å
638	A	62.8	Low	82.9	Confident	103 Å²	103	51.1 Å²	51.1	85%	0.851	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-25.9	175.9	0	0	0	0	0	113.2	R640	A638-R640 PolarHBondContact O-N 3.32Å
639	N	58.9	Low	82.5	Confident	131 Å²	131	51.5 Å²	51.5	70%	0.701	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	5.4	175.4	-64.6	0.2	0	0	0	113.9	S637 E641	S637-N639 PolarHBondContact O-N 3.18Å; N639-E641 PolarHBondContact O-N 2.99Å
640	R	56.4	Low	82.1	Confident	232 Å²	232	55.8 Å²	55.8	88%	0.875	29%	0.285	S	S	*	.	S	Bend	trans	62.1	20.8	-174.3	-57.5	-179.3	173.1	-178.3	-3.2	115.4	S637 A638	S637-R640 WeakPolarHBondContact O-CA 3.49Å; S637-R640 PolarHBondContact O-N 2.9Å; A638-R640 PolarHBondContact O-N 3.32Å
641	E	65.4	Low	81.6	Confident	82 Å²	82	62.8 Å²	62.8	38%	0.383	32%	0.317	S	S	.	.			trans	-85.1	122.9	165.9	-71.6	175.2	-169.8	0	0	110	S637 N639 R643	S637-E641 PolarHBondContact N-O 3.09Å; N639-E641 PolarHBondContact O-N 2.99Å; E641-R643 IonicContact OE2-CZ 2.85Å; E641-R643 IonicContact OE2-NE 2.87Å; E641-R643 IonicContact OE2-NH2 3.45Å; E641-R643 PolarHBondContact OE2-NH2 3.33Å
642	S	72.3	Confident	81.3	Confident	61 Å²	61	62.7 Å²	62.7	43%	0.427	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	131	166	-68.2	0	0	0	0	110	E634 Y635 K636	E634-S642 WeakPolarHBondContact OE1-CB 3.34Å; E634-S642 PolarHBondContact OE1-OG 3.14Å; Y635-S642 WeakPolarHBondContact O-CA 3.45Å; K636-S642 WeakPolarHBondContact CE-OG 3.46Å; K636-S642 WeakPolarHBondContact CG-OG 3.45Å
643	R	79.6	Confident	81.2	Confident	98 Å²	98	67.3 Å²	67.3	37%	0.37	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	134.1	173	-61.2	-177.6	-177.7	-144.7	-11.4	108.8	Y635 E641 E1013	Y635-R643 PolarHBondContact N-O 3.34Å; Y635-R643 PolarHBondContact O-N 2.76Å; E641-R643 IonicContact OE2-CZ 2.85Å; E641-R643 IonicContact OE2-NE 2.87Å; E641-R643 IonicContact OE2-NH2 3.45Å; E641-R643 PolarHBondContact OE2-NH2 3.33Å; R643-E1013 IonicContact CZ-OE1 2.87Å; R643-E1013 IonicContact NH1-OE1 2.67Å; R643-E1013 IonicContact NH2-OE1 2.82Å; R643-E1013 PolarHBondContact NH2-OE1 2.94Å
644	I	88.4	Confident	81.2	Confident	25 Å²	25	67.4 Å²	67.4	13%	0.128	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	121.3	174.2	-60.1	178.2	0	0	0	108	A632 F661 T1000 L1001	A632-I644 HydrophobicContact CB-CG2 4.04Å; I644-F661 HydrophobicContact CD1-CE1 4.23Å; I644-F661 HydrophobicContact CD1-CE2 4.29Å; I644-F661 HydrophobicContact CD1-CZ 3.6Å; I644-F661 HydrophobicContact CG1-CE2 4.19Å; I644-F661 HydrophobicContact CG1-CZ 3.97Å; I644-F661 HydrophobicContact CG2-CD2 4.49Å; I644-F661 HydrophobicContact CG2-CE2 4Å; I644-F661 HydrophobicContact CG2-CZ 4.26Å; I644-T1000 HydrophobicContact CD1-CG2 3.68Å; I644-T1000 HydrophobicContact CG1-CG2 4.49Å; I644-L1001 HydrophobicContact CD1-CB 4.23Å; I644-L1001 HydrophobicContact CG2-CB 4.47Å; I644-L1001 HydrophobicContact CG2-CD1 3.89Å
645	L	89	Confident	81.1	Confident	58 Å²	58	70.1 Å²	70.1	30%	0.304	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	119.3	177.6	-61.9	-177.7	0	0	0	109.6	A632 I633 Y635 P648 L652	A632-L645 VanDerWaalsContact CA-O 3.26Å; A632-L645 WeakPolarHBondContact CA-O 3.12Å; A632-L645 WeakPolarHBondContact CB-O 3.41Å; I633-L645 PolarHBondContact N-O 3Å; I633-L645 PolarHBondContact O-N 3.35Å; Y635-L645 HydrophobicContact CD1-CD1 4.37Å; Y635-L645 HydrophobicContact CG-CD1 3.94Å; L645-P648 HydrophobicContact CB-CB 4.36Å; L645-P648 HydrophobicContact CB-CG 4.34Å; L645-L652 HydrophobicContact CD1-CD1 3.5Å
646	I	92.1	Very high	81.4	Confident	25 Å²	25	72.5 Å²	72.5	13%	0.128	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	122	-178.5	-47.6	-177.1	0	0	0	108.9	I631 A632 L1001 T1004 L1005 C1040 L1117	I631-I646 HydrophobicContact CG2-CG2 3.97Å; A632-I646 HydrophobicContact CB-CB 4.49Å; A632-I646 HydrophobicContact CB-CG1 4.3Å; I646-L1001 HydrophobicContact CD1-CD1 3.76Å; I646-L1001 HydrophobicContact CG1-CD1 3.83Å; I646-T1004 HydrophobicContact CD1-CG2 3.93Å; I646-T1004 HydrophobicContact CG1-CG2 4.35Å; I646-L1005 HydrophobicContact CD1-CB 3.74Å; I646-L1005 HydrophobicContact CD1-CD1 4.06Å; I646-L1005 HydrophobicContact CD1-CG 4.49Å; I646-C1040 PolarHBondContact O-SG 3.06Å; I646-L1117 HydrophobicContact CG2-CD1 3.63Å
647	N	93.9	Very high	81.8	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	36%	0.364	C	S	.	.	S	Bend	trans	42	62.4	-174.9	-177.8	34.9	0	0	0	114.2	F615 I631 C1040 N1073 L1075 L1117 Q1119	F615-N647 HydrophobicContact CE1-CB 4.28Å; F615-N647 WeakPolarHBondContact CE1-OD1 3.42Å; I631-N647 PolarHBondContact O-N 3.09Å; N647-C1040 PolarHBondContact O-SG 3.44Å; N647-N1073 PolarHBondContact ND2-O 2.98Å; N647-L1075 HydrophobicContact CB-CB 4.35Å; N647-L1117 HydrophobicContact CB-CB 4.18Å; N647-L1117 HydrophobicContact CB-CD1 3.82Å; N647-L1117 PolarHBondContact ND2-O 3.16Å; N647-Q1119 PolarHBondContact ND2-NE2 3.04Å; N647-Q1119 PolarHBondContact O-NE2 2.98Å
648	P	91.4	Very high	83	Confident	11 Å²	11	68.4 Å²	68.4	7%	0.071	35%	0.351	C	S	.	.			trans	-67.5	145	177.3	26.8	-32.9	0	0	0	112.5	F615 I633 L645 L652	F615-P648 HydrophobicContact CB-CG 3.92Å; F615-P648 HydrophobicContact CD1-CG 4.08Å; F615-P648 VanDerWaalsContact CD1-O 3.26Å; F615-P648 WeakPolarHBondContact CD1-O 3.1Å; F615-P648 HydrophobicContact CD2-CG 3.71Å; F615-P648 HydrophobicContact CE2-CG 4.23Å; F615-P648 HydrophobicContact CG-CG 3.63Å; I633-P648 HydrophobicContact CD1-CG 3.81Å; I633-P648 HydrophobicContact CG1-CG 3.87Å; L645-P648 HydrophobicContact CB-CB 4.36Å; L645-P648 HydrophobicContact CB-CG 4.34Å; P648-L652 HydrophobicContact CB-CB 4.27Å; P648-L652 HydrophobicContact CB-CD1 4.01Å; P648-L652 HydrophobicContact CG-CD2 4.48Å
649	G	86.8	Confident	84.4	Confident	7 Å²	7	63.9 Å²	63.9	7%	0.072	31%	0.313	C	S	.	.			trans	-67.9	170.7	-177.9	0	0	0	0	0	115.1	H651 L652	G649-H651 PolarHBondContact O-N 2.98Å; G649-L652 PolarHBondContact O-N 2.68Å
650	N	87.9	Confident	86.1	Confident	91 Å²	91	57.7 Å²	57.7	49%	0.487	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-18.1	-178	64.8	0.7	0	0	0	116.2	L652 K653	N650-L652 VanDerWaalsContact C-N 3.33Å; N650-K653 PolarHBondContact O-NZ 2.94Å
651	H	85.7	Confident	88	Confident	148 Å²	148	46.7 Å²	46.7	69%	0.685	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-30.3	176.2	63.8	-99	0	0	0	112.4	G649	G649-H651 PolarHBondContact O-N 2.98Å
652	L	88.1	Confident	89.3	Confident	18 Å²	18	42.8 Å²	42.8	9%	0.094	22%	0.22	C	C	.	.			trans	-84.2	130.9	178.8	-169.1	152.6	0	0	0	110	I633 Y635 L645 P648 G649 N650	I633-L652 HydrophobicContact CD1-CD2 3.53Å; Y635-L652 HydrophobicContact CD2-CD1 3.93Å; Y635-L652 HydrophobicContact CD2-CG 4.44Å; Y635-L652 HydrophobicContact CE2-CD1 4.22Å; Y635-L652 HydrophobicContact CE2-CG 4.48Å; Y635-L652 HydrophobicContact CG-CD1 4.45Å; L645-L652 HydrophobicContact CD1-CD1 3.5Å; P648-L652 HydrophobicContact CB-CB 4.27Å; P648-L652 HydrophobicContact CB-CD1 4.01Å; P648-L652 HydrophobicContact CG-CD2 4.48Å; G649-L652 PolarHBondContact O-N 2.68Å; N650-L652 VanDerWaalsContact C-N 3.33Å
653	K	91	Very high	90.4	Very high	97 Å²	97	40 Å²	40	42%	0.422	20%	0.2	S	C	.	.	B	Isolated β-bridge	trans	-106.5	141.2	175.3	-57.4	-49.1	-172.9	-160.9	0	111	L613 S614 N650 Q655	L613-K653 WeakPolarHBondContact O-CA 2.97Å; S614-K653 VanDerWaalsContact CB-NZ 3.34Å; S614-K653 PolarHBondContact OG-NZ 2.95Å; N650-K653 PolarHBondContact O-NZ 2.94Å; K653-Q655 PolarHBondContact O-N 3.39Å
654	I	93.1	Very high	91	Very high	4 Å²	4	35.5 Å²	35.5	2%	0.021	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-65.4	131.5	177.5	-59.1	-52.6	0	0	0	109.7	L606 G612 L613 F615 V618 I633 T658	L606-I654 HydrophobicContact CD1-CD1 4.26Å; L606-I654 HydrophobicContact CD1-CG1 4.41Å; L606-I654 HydrophobicContact CD1-CG2 3.66Å; G612-I654 PolarHBondContact N-O 2.91Å; L613-I654 PolarHBondContact O-N 2.91Å; F615-I654 HydrophobicContact CB-CD1 4.38Å; F615-I654 HydrophobicContact CD2-CD1 4.47Å; V618-I654 HydrophobicContact CG2-CG1 4.01Å; I633-I654 HydrophobicContact CD1-CD1 3.78Å; I633-I654 HydrophobicContact CG2-CD1 4.21Å; I654-T658 HydrophobicContact CG2-CG2 4.49Å
655	Q	90.4	Very high	90.9	Very high	78 Å²	78	37.7 Å²	37.7	36%	0.364	20%	0.201	S	C	.	.	P	Polyproline II helix	trans	-95.5	164.5	176.3	-64.4	178.6	-0.7	0	0	110.1	K653 T658	K653-Q655 PolarHBondContact O-N 3.39Å; Q655-T658 PolarHBondContact N-OG1 3.15Å; Q655-T658 PolarHBondContact O-OG1 3.42Å
656	E	89.4	Confident	90.7	Very high	127 Å²	127	37.2 Å²	37.2	59%	0.593	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.5	138.6	171.9	-174.1	159	-155.6	0	0	110.8	V611 T658	V611-E656 HydrophobicContact CG2-CB 3.99Å; E656-T658 VanDerWaalsContact C-N 3.3Å; E656-T658 PolarHBondContact O-N 3.03Å
657	G	88.5	Confident	90.1	Very high	35 Å²	35	37.1 Å²	37.1	36%	0.361	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.6	16.5	-175.8	0	0	0	0	0	114.7
658	T	92	Very high	89.7	Confident	6 Å²	6	42.4 Å²	42.4	4%	0.037	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-66.6	127.7	167.1	-70.2	0	0	0	0	110.6	L606 I633 I654 Q655 E656	L606-T658 HydrophobicContact CD1-CG2 3.89Å; L606-T658 PolarHBondContact N-O 2.89Å; L606-T658 VanDerWaalsContact N-O 3.08Å; I633-T658 HydrophobicContact CB-CG2 3.72Å; I633-T658 HydrophobicContact CD1-CG2 4.49Å; I633-T658 HydrophobicContact CG2-CG2 3.77Å; I654-T658 HydrophobicContact CG2-CG2 4.49Å; Q655-T658 PolarHBondContact N-OG1 3.15Å; Q655-T658 PolarHBondContact O-OG1 3.42Å; E656-T658 VanDerWaalsContact C-N 3.3Å; E656-T658 PolarHBondContact O-N 3.03Å
659	L	92.9	Very high	89.5	Confident	8 Å²	8	44.4 Å²	44.4	4%	0.042	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	129.5	168	-168.7	75	0	0	0	109.3	Y605 I633 E634 F661	Y605-L659 HydrophobicContact CD1-CB 4.43Å; Y605-L659 HydrophobicContact CD1-CD1 4.15Å; Y605-L659 HydrophobicContact CD2-CD1 4.06Å; Y605-L659 HydrophobicContact CE1-CB 4.26Å; Y605-L659 HydrophobicContact CE1-CD1 4.09Å; Y605-L659 HydrophobicContact CE2-CD1 3.99Å; Y605-L659 HydrophobicContact CG-CD1 4.14Å; I633-L659 CarbonylContact C-O 2.94Å; I633-L659 VanDerWaalsContact CA-O 3.31Å; I633-L659 WeakPolarHBondContact CA-O 3.5Å; E634-L659 HydrophobicContact CB-CB 3.83Å; E634-L659 PolarHBondContact N-O 3.41Å; L659-F661 HydrophobicContact CD2-CZ 4.35Å
660	G	94.3	Very high	89.6	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	144.6	173	0	0	0	0	0	111.5	T603 E604 F662	T603-G660 WeakPolarHBondContact CA-O 3.27Å; E604-G660 PolarHBondContact N-O 3.32Å; E604-G660 PolarHBondContact O-N 2.91Å; G660-F662 WeakPolarHBondContact O-CD2 3.44Å
661	F	95	Very high	89.7	Confident	1 Å²	1	44.1 Å²	44.1	0%	0.004	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	126.7	174.6	-64.5	-100.4	0	0	0	109.5	Y602 T603 M630 I631 A632 I644 L659 N997 L1001	Y602-F661 WeakPolarHBondContact O-CA 3.34Å; T603-F661 HydrophobicContact CG2-CD1 3.58Å; T603-F661 HydrophobicContact CG2-CE1 3.63Å; T603-F661 HydrophobicContact CG2-CG 4.44Å; M630-F661 WeakPolarHBondContact CA-O 3.33Å; I631-F661 PolarHBondContact N-O 3.33Å; A632-F661 HydrophobicContact CB-CB 4.02Å; A632-F661 HydrophobicContact CB-CD2 3.89Å; A632-F661 HydrophobicContact CB-CG 4.16Å; A632-F661 PolarHBondContact O-N 2.93Å; I644-F661 HydrophobicContact CD1-CE1 4.23Å; I644-F661 HydrophobicContact CD1-CE2 4.29Å; I644-F661 HydrophobicContact CD1-CZ 3.6Å; I644-F661 HydrophobicContact CG1-CE2 4.19Å; I644-F661 HydrophobicContact CG1-CZ 3.97Å; I644-F661 HydrophobicContact CG2-CD2 4.49Å; I644-F661 HydrophobicContact CG2-CE2 4Å; I644-F661 HydrophobicContact CG2-CZ 4.26Å; L659-F661 HydrophobicContact CD2-CZ 4.35Å; F661-N997 HydrophobicContact CE1-CB 3.61Å; F661-N997 HydrophobicContact CZ-CB 3.76Å; F661-L1001 HydrophobicContact CB-CD2 3.78Å; F661-L1001 HydrophobicContact CD1-CB 4.24Å; F661-L1001 HydrophobicContact CD1-CD2 3.34Å; F661-L1001 HydrophobicContact CD1-CG 4.37Å; F661-L1001 HydrophobicContact CE1-CB 4.06Å; F661-L1001 HydrophobicContact CE1-CD2 4.03Å; F661-L1001 HydrophobicContact CG-CD2 3.69Å
662	F	94.6	Very high	89.9	Confident	1 Å²	1	37.5 Å²	37.5	0%	0.004	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	148.1	-171.1	-61.9	-88.8	0	0	0	111.7	M601 Y602 E604 L606 C622 L628 L629 M630 G660 V670 A673	M601-F662 WeakPolarHBondContact CA-O 3.49Å; Y602-F662 PolarHBondContact N-O 3.4Å; Y602-F662 PolarHBondContact O-N 3.45Å; E604-F662 HydrophobicContact CB-CD2 4.43Å; E604-F662 HydrophobicContact CB-CE2 4.2Å; L606-F662 HydrophobicContact CD2-CE2 4.34Å; L606-F662 HydrophobicContact CD2-CZ 3.72Å; C622-F662 HydrophobicContact CB-CE1 4.49Å; L628-F662 HydrophobicContact CB-CD1 3.92Å; L628-F662 HydrophobicContact CB-CE1 4.33Å; L628-F662 HydrophobicContact CD1-CD1 4.46Å; L628-F662 HydrophobicContact CD1-CE1 4.49Å; L629-F662 CarbonylContact O-C 3.32Å; L629-F662 VanDerWaalsContact O-CA 3.29Å; L629-F662 WeakPolarHBondContact O-CA 3.44Å; M630-F662 HydrophobicContact CB-CD1 3.76Å; M630-F662 HydrophobicContact CB-CE1 3.62Å; M630-F662 HydrophobicContact CB-CZ 4.45Å; M630-F662 HydrophobicContact CG-CD1 4.11Å; M630-F662 HydrophobicContact CG-CE1 3.77Å; M630-F662 HydrophobicContact CG-CZ 4.13Å; M630-F662 HydrophobicContact SD-CE1 4.03Å; M630-F662 HydrophobicContact SD-CZ 3.99Å; G660-F662 WeakPolarHBondContact O-CD2 3.44Å; F662-V670 HydrophobicContact CB-CG1 4.01Å; F662-V670 HydrophobicContact CD2-CG1 3.6Å; F662-V670 HydrophobicContact CE2-CG1 4.26Å; F662-V670 HydrophobicContact CG-CG1 3.9Å; F662-A673 HydrophobicContact CE1-CB 4.23Å; F662-A673 HydrophobicContact CE2-CB 4.11Å; F662-A673 HydrophobicContact CZ-CB 3.64Å
663	I	94.8	Very high	90.1	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	129.7	157.5	-61.5	-179.6	0	0	0	107.8	L575 N599 E600 L629 I631 T1100 N1101	L575-I663 HydrophobicContact CD1-CD1 3.54Å; L575-I663 HydrophobicContact CD1-CG1 4.25Å; L575-I663 HydrophobicContact CD2-CB 4.43Å; L575-I663 HydrophobicContact CD2-CD1 3.78Å; L575-I663 HydrophobicContact CD2-CG1 3.94Å; L575-I663 HydrophobicContact CD2-CG2 3.66Å; L575-I663 HydrophobicContact CG-CD1 4.34Å; N599-I663 HydrophobicContact CB-CG2 3.61Å; E600-I663 WeakPolarHBondContact O-CA 3.21Å; L629-I663 HydrophobicContact CB-CB 4.33Å; L629-I663 HydrophobicContact CD2-CB 4.33Å; L629-I663 HydrophobicContact CD2-CD1 4.26Å; L629-I663 PolarHBondContact N-O 2.9Å; L629-I663 PolarHBondContact O-N 3.01Å; I631-I663 HydrophobicContact CD1-CD1 3.31Å; I631-I663 HydrophobicContact CD1-CG1 3.74Å; I631-I663 HydrophobicContact CG1-CD1 4.47Å; I663-T1100 HydrophobicContact CD1-CG2 4.46Å; I663-N1101 HydrophobicContact CG2-CB 3.74Å
664	A	91.1	Very high	90.2	Very high	4 Å²	4	35.5 Å²	35.5	3%	0.033	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	172.3	176.8	0	0	0	0	0	109.9	N599 E600 Y602 L628 V670	N599-A664 CarbonylContact C-O 3.52Å; N599-A664 WeakPolarHBondContact CA-O 3.27Å; E600-A664 PolarHBondContact N-O 2.97Å; E600-A664 PolarHBondContact O-N 2.67Å; Y602-A664 HydrophobicContact CD2-CB 4.23Å; L628-A664 HydrophobicContact CD2-CB 3.75Å; A664-V670 HydrophobicContact CB-CG2 3.57Å
665	S	87	Confident	90.1	Very high	71 Å²	71	38.1 Å²	38.1	50%	0.497	20%	0.197	S	C	.	.	S	Bend	trans	-103.2	3.6	-177.9	53.6	0	0	0	0	116.1	S598	S598-S665 WeakPolarHBondContact O-CA 3.39Å; S598-S665 WeakPolarHBondContact O-CB 3.46Å
666	D	83.8	Confident	90.1	Very high	48 Å²	48	34.9 Å²	34.9	26%	0.257	18%	0.181	S	C	.	.			trans	-161.1	136.4	172.8	-178.3	-12.5	0	0	0	108.7	K668 E669	D666-K668 PolarHBondContact O-N 2.91Å; D666-K668 VanDerWaalsContact O-N 3.13Å; D666-K668 WeakPolarHBondContact OD1-CB 3.2Å; D666-K668 WeakPolarHBondContact OD1-CG 3.47Å; D666-K668 PolarHBondContact OD1-N 3.26Å; D666-K668 IonicContact OD1-NZ 3.96Å; D666-K668 PolarHBondContact OD1-NZ 3.07Å; D666-K668 VanDerWaalsContact OD1-NZ 3.13Å; D666-K668 IonicContact OD2-NZ 2.75Å; D666-E669 HydrophobicContact CB-CG 3.99Å; D666-E669 WeakPolarHBondContact O-CB 3.4Å; D666-E669 PolarHBondContact O-N 3.49Å
667	A	81.4	Confident	90.1	Very high	23 Å²	23	29.7 Å²	29.7	19%	0.19	16%	0.159	C	C	.	.	H	α-helix	trans	-51.2	-34.5	172.4	0	0	0	0	0	112.9	Y602 E669 V670 K671	Y602-A667 HydrophobicContact CD1-CB 4.09Å; Y602-A667 HydrophobicContact CE1-CB 3.59Å; Y602-A667 PolarHBondContact OH-N 3.38Å; A667-E669 VanDerWaalsContact C-N 3.31Å; A667-E669 PolarHBondContact O-N 2.91Å; A667-V670 PolarHBondContact O-N 3.19Å; A667-K671 PolarHBondContact O-N 2.92Å
668	K	83.9	Confident	90	Very high	111 Å²	111	34.3 Å²	34.3	48%	0.483	17%	0.169	S	C	.	.	H	α-helix	trans	-66.3	-32.4	-179.8	-62.8	169.9	-159.9	68.4	0	112.6	D434 D666 V670	D434-K668 VanDerWaalsContact OD1-CE 3.26Å; D434-K668 WeakPolarHBondContact OD1-CE 3.26Å; D434-K668 IonicContact OD1-NZ 3.3Å; D434-K668 PolarHBondContact OD1-NZ 3.27Å; D666-K668 PolarHBondContact O-N 2.91Å; D666-K668 VanDerWaalsContact O-N 3.13Å; D666-K668 WeakPolarHBondContact OD1-CB 3.2Å; D666-K668 WeakPolarHBondContact OD1-CG 3.47Å; D666-K668 PolarHBondContact OD1-N 3.26Å; D666-K668 IonicContact OD1-NZ 3.96Å; D666-K668 PolarHBondContact OD1-NZ 3.07Å; D666-K668 VanDerWaalsContact OD1-NZ 3.13Å; D666-K668 IonicContact OD2-NZ 2.75Å; K668-V670 VanDerWaalsContact C-N 3.32Å
669	E	87.8	Confident	89.6	Confident	53 Å²	53	38.6 Å²	38.6	25%	0.248	21%	0.205	C	C	.	.	H	α-helix	trans	-69.3	-34.7	178.4	-65.5	-76.1	94.1	0	0	110.5	L628 D666 A667 R672	L628-E669 HydrophobicContact CD2-CB 4.3Å; D666-E669 HydrophobicContact CB-CG 3.99Å; D666-E669 WeakPolarHBondContact O-CB 3.4Å; D666-E669 PolarHBondContact O-N 3.49Å; A667-E669 VanDerWaalsContact C-N 3.31Å; A667-E669 PolarHBondContact O-N 2.91Å; E669-R672 VanDerWaalsContact CD-CZ 3.41Å; E669-R672 VanDerWaalsContact CD-NH2 3.31Å; E669-R672 WeakPolarHBondContact O-CB 3.38Å; E669-R672 VanDerWaalsContact O-CG 3.32Å; E669-R672 WeakPolarHBondContact O-CG 3.39Å; E669-R672 PolarHBondContact O-N 2.85Å; E669-R672 PolarHBondContact O-NE 3.01Å; E669-R672 IonicContact OE1-CZ 3.41Å; E669-R672 IonicContact OE1-NH1 2.71Å; E669-R672 PolarHBondContact OE1-NH1 3.04Å; E669-R672 IonicContact OE1-NH2 2.78Å; E669-R672 IonicContact OE2-CZ 3.22Å; E669-R672 IonicContact OE2-NH1 3.13Å; E669-R672 PolarHBondContact OE2-NH1 3.33Å; E669-R672 IonicContact OE2-NH2 3.63Å; E669-R672 PolarHBondContact OE2-NH2 2.96Å
670	V	89.4	Confident	89.2	Confident	1 Å²	1	41 Å²	41	1%	0.006	22%	0.222	C	C	.	.	H	α-helix	trans	-70.8	-33	-178.7	-167.5	0	0	0	0	112.4	Y602 E604 L628 F662 A664 A667 K668 R672 A673	Y602-V670 HydrophobicContact CD2-CG2 3.79Å; Y602-V670 HydrophobicContact CG-CG2 3.87Å; E604-V670 HydrophobicContact CB-CG1 3.72Å; E604-V670 HydrophobicContact CG-CG1 4.44Å; L628-V670 HydrophobicContact CD2-CG2 4.24Å; F662-V670 HydrophobicContact CB-CG1 4.01Å; F662-V670 HydrophobicContact CD2-CG1 3.6Å; F662-V670 HydrophobicContact CE2-CG1 4.26Å; F662-V670 HydrophobicContact CG-CG1 3.9Å; A664-V670 HydrophobicContact CB-CG2 3.57Å; A667-V670 PolarHBondContact O-N 3.19Å; K668-V670 VanDerWaalsContact C-N 3.32Å; V670-R672 PolarHBondContact O-N 3.05Å; V670-A673 WeakPolarHBondContact O-CB 3.35Å; V670-A673 PolarHBondContact O-N 2.91Å
671	K	89.4	Confident	88.9	Confident	91 Å²	91	41.7 Å²	41.7	40%	0.396	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-22.7	175.1	-65.9	-76.6	162.7	-144.9	0	113.4	E604 A667 A673 F674 F675	E604-K671 IonicContact OE1-NZ 3.67Å; E604-K671 PolarHBondContact OE1-NZ 3.3Å; E604-K671 WeakPolarHBondContact OE2-CD 3.47Å; E604-K671 WeakPolarHBondContact OE2-CE 3.38Å; E604-K671 IonicContact OE2-NZ 3.56Å; E604-K671 PolarHBondContact OE2-NZ 2.99Å; A667-K671 PolarHBondContact O-N 2.92Å; K671-A673 VanDerWaalsContact C-N 3.26Å; K671-A673 PolarHBondContact O-N 2.87Å; K671-F674 PolarHBondContact O-N 3.34Å; K671-F675 HydrophobicContact CB-CD2 4.36Å; K671-F675 HydrophobicContact CB-CE2 3.96Å; K671-F675 WeakPolarHBondContact O-CD2 3.46Å; K671-F675 PolarHBondContact O-N 2.85Å
672	R	90.9	Very high	88.4	Confident	9 Å²	9	44.7 Å²	44.7	3%	0.034	24%	0.241	C	C	.	.	H	α-helix	trans	-61.6	-30.1	174.1	-61.9	-174.6	-65.3	-139.3	3.9	113.3	L626 E669 V670 F674 F675 Y676 P687 I690	L626-R672 HydrophobicContact CD2-CB 4.49Å; L626-R672 PolarHBondContact O-NH2 2.85Å; E669-R672 VanDerWaalsContact CD-CZ 3.41Å; E669-R672 VanDerWaalsContact CD-NH2 3.31Å; E669-R672 WeakPolarHBondContact O-CB 3.38Å; E669-R672 VanDerWaalsContact O-CG 3.32Å; E669-R672 WeakPolarHBondContact O-CG 3.39Å; E669-R672 PolarHBondContact O-N 2.85Å; E669-R672 PolarHBondContact O-NE 3.01Å; E669-R672 IonicContact OE1-CZ 3.41Å; E669-R672 IonicContact OE1-NH1 2.71Å; E669-R672 PolarHBondContact OE1-NH1 3.04Å; E669-R672 IonicContact OE1-NH2 2.78Å; E669-R672 IonicContact OE2-CZ 3.22Å; E669-R672 IonicContact OE2-NH1 3.13Å; E669-R672 PolarHBondContact OE2-NH1 3.33Å; E669-R672 IonicContact OE2-NH2 3.63Å; E669-R672 PolarHBondContact OE2-NH2 2.96Å; V670-R672 PolarHBondContact O-N 3.05Å; R672-F674 VanDerWaalsContact C-N 3.27Å; R672-F674 PolarHBondContact O-N 3.33Å; R672-F675 PolarHBondContact O-N 2.94Å; R672-Y676 PolarHBondContact O-N 2.82Å; R672-P687 WeakPolarHBondContact CD-O 3.07Å; R672-I690 HydrophobicContact CB-CG2 4.18Å; R672-I690 HydrophobicContact CG-CB 4.37Å; R672-I690 HydrophobicContact CG-CG2 4.41Å
673	A	92	Very high	88	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-61.9	-35.3	175.8	0	0	0	0	0	112.2	S607 F610 L626 L628 F662 V670 K671	S607-A673 WeakPolarHBondContact CB-O 3.47Å; S607-A673 PolarHBondContact N-O 3.16Å; S607-A673 VanDerWaalsContact N-O 3.12Å; F610-A673 WeakPolarHBondContact CE2-O 3.4Å; L626-A673 HydrophobicContact CD1-CB 4.4Å; L628-A673 HydrophobicContact CD1-CB 4.09Å; F662-A673 HydrophobicContact CE1-CB 4.23Å; F662-A673 HydrophobicContact CE2-CB 4.11Å; F662-A673 HydrophobicContact CZ-CB 3.64Å; V670-A673 WeakPolarHBondContact O-CB 3.35Å; V670-A673 PolarHBondContact O-N 2.91Å; K671-A673 VanDerWaalsContact C-N 3.26Å; K671-A673 PolarHBondContact O-N 2.87Å
674	F	92.3	Very high	87.4	Confident	74 Å²	74	53.2 Å²	53.2	33%	0.325	29%	0.287	S	S	.	.	H	α-helix	trans	-78.8	-36.1	174.3	-175.6	-109.3	0	0	0	112.7	E604 Y605 S607 K671 R672	E604-F674 HydrophobicContact CG-CB 4.15Å; Y605-F674 WeakPolarHBondContact O-CA 3.45Å; Y605-F674 WeakPolarHBondContact O-CB 3.25Å; Y605-F674 WeakPolarHBondContact O-CD2 3.11Å; S607-F674 WeakPolarHBondContact CB-O 3.28Å; K671-F674 PolarHBondContact O-N 3.34Å; R672-F674 VanDerWaalsContact C-N 3.27Å; R672-F674 PolarHBondContact O-N 3.33Å
675	F	90.8	Very high	86.9	Confident	58 Å²	58	59 Å²	59	25%	0.254	32%	0.322	S	S	.	.	H	α-helix	trans	-83.3	-9.5	-178.3	-60.9	-36.4	0	0	0	115.2	K671 R672 C677 H681 K692	K671-F675 HydrophobicContact CB-CD2 4.36Å; K671-F675 HydrophobicContact CB-CE2 3.96Å; K671-F675 WeakPolarHBondContact O-CD2 3.46Å; K671-F675 PolarHBondContact O-N 2.85Å; R672-F675 PolarHBondContact O-N 2.94Å; F675-C677 PolarHBondContact O-N 3.11Å; F675-H681 PolarHBondContact O-CE1 3.37Å; F675-K692 HydrophobicContact CD1-CB 3.73Å; F675-K692 HydrophobicContact CD1-CG 3.98Å; F675-K692 HydrophobicContact CE1-CB 3.85Å; F675-K692 HydrophobicContact CE1-CD 4.18Å; F675-K692 HydrophobicContact CE1-CG 4.04Å; F675-K692 HydrophobicContact CG-CB 4.14Å; F675-K692 HydrophobicContact CZ-CB 4.33Å
676	Y	90.6	Very high	86.7	Confident	10 Å²	10	58.8 Å²	58.8	4%	0.039	32%	0.316	C	S	.	.			trans	-58.7	136.4	-179.1	-173.9	-108.2	0	0	0	111.8	S607 A609 F610 L626 R672 H681 D682	S607-Y676 VanDerWaalsContact CB-O 3.29Å; S607-Y676 WeakPolarHBondContact CB-O 3.44Å; S607-Y676 PolarHBondContact OG-O 3.2Å; A609-Y676 HydrophobicContact CB-CD1 4.2Å; F610-Y676 HydrophobicContact CD1-CD1 4.48Å; F610-Y676 AromaticContact CE1-CD1 3.58Å; F610-Y676 HydrophobicContact CE1-CD1 3.58Å; F610-Y676 AromaticContact CE1-CE1 3.91Å; F610-Y676 HydrophobicContact CE1-CE1 3.91Å; F610-Y676 HydrophobicContact CE1-CG 4.46Å; F610-Y676 HydrophobicContact CE2-CD1 4.18Å; F610-Y676 AromaticContact CZ-CD1 3.4Å; F610-Y676 HydrophobicContact CZ-CD1 3.4Å; F610-Y676 HydrophobicContact CZ-CE1 4.15Å; F610-Y676 AromaticContact CZ-CG 3.88Å; F610-Y676 HydrophobicContact CZ-CG 3.88Å; L626-Y676 HydrophobicContact CD2-CD2 3.81Å; L626-Y676 HydrophobicContact CD2-CE2 4.43Å; L626-Y676 HydrophobicContact CD2-CG 4.42Å; R672-Y676 PolarHBondContact O-N 2.82Å; Y676-H681 HydrophobicContact CD2-CB 4.04Å; Y676-H681 HydrophobicContact CE2-CB 3.86Å; Y676-D682 PolarHBondContact OH-OD1 2.69Å
677	C	89.7	Confident	86.7	Confident	19 Å²	19	57 Å²	57	13%	0.128	31%	0.307	C	S	.	.			trans	-147.5	115.1	-179.4	177.5	0	0	0	0	107.7	F675 A679 C680 H681 C693	F675-C677 PolarHBondContact O-N 3.11Å; C677-A679 VanDerWaalsContact C-N 3.29Å; C677-A679 PolarHBondContact O-N 2.91Å; C677-C680 HydrophobicContact CB-CB 4.22Å; C677-C680 PolarHBondContact O-N 3.35Å; C677-H681 PolarHBondContact N-ND1 2.76Å; C677-H681 WeakPolarHBondContact O-CB 3.45Å; C677-H681 PolarHBondContact O-N 3.06Å; C677-C693 HydrophobicContact CB-CB 4.14Å; C677-C693 VanDerWaalsContact CB-SG 3.56Å
678	K	85.8	Confident	86.8	Confident	131 Å²	131	63 Å²	63	57%	0.57	33%	0.329	S	S	*	.	H	α-helix	trans	-54.9	-44.7	-174	-167.5	173.2	-177.2	175.9	0	112.5	C680 H681 D682	K678-C680 VanDerWaalsContact C-N 3.27Å; K678-C680 PolarHBondContact O-N 3.37Å; K678-H681 PolarHBondContact O-N 2.95Å; K678-D682 WeakPolarHBondContact CE-OD2 3.29Å; K678-D682 WeakPolarHBondContact CG-OD2 3.2Å; K678-D682 WeakPolarHBondContact O-CB 3.49Å; K678-D682 PolarHBondContact O-N 3.42Å; K678-D682 VanDerWaalsContact O-N 3.16Å
679	A	85	Confident	86.8	Confident	96 Å²	96	65.7 Å²	65.7	79%	0.793	34%	0.336	S	S	*	.	H	α-helix	trans	-65.3	-23.2	179.8	0	0	0	0	0	114.9	C677	C677-A679 VanDerWaalsContact C-N 3.29Å; C677-A679 PolarHBondContact O-N 2.91Å
680	C	84.7	Confident	86.7	Confident	58 Å²	58	63.5 Å²	63.5	39%	0.392	33%	0.326	S	S	.	.	H	α-helix	trans	-101.3	-27.4	179.5	-65.5	0	0	0	0	113.4	C677 K678 C693 C695	C677-C680 HydrophobicContact CB-CB 4.22Å; C677-C680 PolarHBondContact O-N 3.35Å; K678-C680 VanDerWaalsContact C-N 3.27Å; K678-C680 PolarHBondContact O-N 3.37Å; C680-C693 HydrophobicContact CB-CB 4.22Å; C680-C695 PolarHBondContact SG-SG 3.09Å
681	H	87.9	Confident	86.4	Confident	16 Å²	16	70.5 Å²	70.5	7%	0.074	36%	0.356	C	S	.	.	H	α-helix	trans	-126.2	2.3	-161.3	-53.3	148	0	0	0	114.5	F675 Y676 C677 K678 D683 V684 K691	F675-H681 PolarHBondContact O-CE1 3.37Å; Y676-H681 HydrophobicContact CD2-CB 4.04Å; Y676-H681 HydrophobicContact CE2-CB 3.86Å; C677-H681 PolarHBondContact N-ND1 2.76Å; C677-H681 WeakPolarHBondContact O-CB 3.45Å; C677-H681 PolarHBondContact O-N 3.06Å; K678-H681 PolarHBondContact O-N 2.95Å; H681-D683 PolarHBondContact O-N 3.18Å; H681-V684 HydrophobicContact CB-CG2 4.49Å; H681-V684 PolarHBondContact O-N 2.68Å; H681-K691 PolarHBondContact CE1-O 3.07Å
682	D	84	Confident	86	Confident	64 Å²	64	74 Å²	74	34%	0.342	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-46.1	178.3	-119.2	-0.1	0	0	0	111.7	K625 Y676 K678 V684	K625-D682 PolarHBondContact NZ-O 3.43Å; Y676-D682 PolarHBondContact OH-OD1 2.69Å; K678-D682 WeakPolarHBondContact CE-OD2 3.29Å; K678-D682 WeakPolarHBondContact CG-OD2 3.2Å; K678-D682 WeakPolarHBondContact O-CB 3.49Å; K678-D682 PolarHBondContact O-N 3.42Å; K678-D682 VanDerWaalsContact O-N 3.16Å; D682-V684 VanDerWaalsContact C-N 3.32Å; D682-V684 PolarHBondContact O-N 3.07Å
683	D	85	Confident	85.5	Confident	160 Å²	160	75.4 Å²	75.4	86%	0.856	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	1.1	-177	-60.8	-40.1	0	0	0	114.2	H681	H681-D683 PolarHBondContact O-N 3.18Å
684	V	83.6	Confident	84.5	Confident	20 Å²	20	79.2 Å²	79.2	12%	0.121	42%	0.422	C	S	.	.			trans	-81.6	122.7	-178.4	177.2	0	0	0	0	110	H681 D682 D686 R689 I690	H681-V684 HydrophobicContact CB-CG2 4.49Å; H681-V684 PolarHBondContact O-N 2.68Å; D682-V684 VanDerWaalsContact C-N 3.32Å; D682-V684 PolarHBondContact O-N 3.07Å; V684-D686 VanDerWaalsContact CG1-O 3.25Å; V684-D686 WeakPolarHBondContact CG1-O 3.4Å; V684-R689 HydrophobicContact CG1-CB 3.88Å; V684-I690 HydrophobicContact CG1-CG1 4.09Å
685	T	78.9	Confident	83.7	Confident	125 Å²	125	78.9 Å²	78.9	77%	0.767	43%	0.427	S	S	*	.			trans	-96.2	-32.8	179.3	53.7	0	0	0	0	114.1
686	D	84.1	Confident	82.2	Confident	68 Å²	68	87.4 Å²	87.4	36%	0.364	46%	0.458	S	S	.	.			trans	-90.7	113.2	174.6	172.7	16.4	0	0	0	110.3	V684 K688 R689	V684-D686 VanDerWaalsContact CG1-O 3.25Å; V684-D686 WeakPolarHBondContact CG1-O 3.4Å; D686-K688 PolarHBondContact O-N 3.21Å; D686-K688 VanDerWaalsContact O-N 3.16Å; D686-K688 WeakPolarHBondContact OD1-CB 3.15Å; D686-K688 PolarHBondContact OD1-N 3.02Å; D686-R689 HydrophobicContact CB-CG 4.32Å; D686-R689 WeakPolarHBondContact O-CB 3.3Å; D686-R689 PolarHBondContact O-N 3.19Å; D686-R689 VanDerWaalsContact O-N 3.1Å
687	P	82.9	Confident	80.5	Confident	10 Å²	10	95.5 Å²	95.5	7%	0.065	49%	0.488	C	S	.	.	G	3₁₀ helix	trans	-65.5	-19.4	-176.4	29.7	-37.3	0	0	0	113	K627 R672 R689 I690	K627-P687 HydrophobicContact CD-CG 4.21Å; K627-P687 HydrophobicContact CG-CG 4.33Å; R672-P687 WeakPolarHBondContact CD-O 3.07Å; P687-R689 PolarHBondContact O-N 2.69Å; P687-R689 VanDerWaalsContact O-N 3.17Å; P687-I690 HydrophobicContact CB-CD1 4.38Å; P687-I690 WeakPolarHBondContact O-CB 3.27Å; P687-I690 PolarHBondContact O-N 2.58Å
688	K	84.5	Confident	78.3	Confident	150 Å²	150	103.2 Å²	103.2	65%	0.652	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-66.3	-15.5	175.4	-63.3	-174	176.8	-174.9	0	113.4	D686	D686-K688 PolarHBondContact O-N 3.21Å; D686-K688 VanDerWaalsContact O-N 3.16Å; D686-K688 WeakPolarHBondContact OD1-CB 3.15Å; D686-K688 PolarHBondContact OD1-N 3.02Å
689	R	84.1	Confident	76.2	Confident	166 Å²	166	104.9 Å²	104.9	63%	0.626	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-84.9	-11	174.9	-63	178.6	61.8	-166.6	-4.6	113.3	V684 D686 P687 K691	V684-R689 HydrophobicContact CG1-CB 3.88Å; D686-R689 HydrophobicContact CB-CG 4.32Å; D686-R689 WeakPolarHBondContact O-CB 3.3Å; D686-R689 PolarHBondContact O-N 3.19Å; D686-R689 VanDerWaalsContact O-N 3.1Å; P687-R689 PolarHBondContact O-N 2.69Å; P687-R689 VanDerWaalsContact O-N 3.17Å; R689-K691 PolarHBondContact O-N 3.24Å; R689-K691 VanDerWaalsContact O-N 3.13Å
690	I	84.3	Confident	73.8	Confident	8 Å²	8	108.1 Å²	108.1	4%	0.041	54%	0.541	C	S	.	.			trans	-78.1	98	179.9	-58.1	177.7	0	0	0	108.9	L626 R672 V684 P687	L626-I690 HydrophobicContact CD2-CD1 3.41Å; L626-I690 VanDerWaalsContact CD2-CD1 3.41Å; R672-I690 HydrophobicContact CB-CG2 4.18Å; R672-I690 HydrophobicContact CG-CB 4.37Å; R672-I690 HydrophobicContact CG-CG2 4.41Å; V684-I690 HydrophobicContact CG1-CG1 4.09Å; P687-I690 HydrophobicContact CB-CD1 4.38Å; P687-I690 WeakPolarHBondContact O-CB 3.27Å; P687-I690 PolarHBondContact O-N 2.58Å
691	K	83.8	Confident	71.2	Confident	147 Å²	147	114.6 Å²	114.6	64%	0.639	57%	0.566	S	S	*	*			trans	-120.9	170.8	179	-63.6	-170.2	177.7	-174.8	0	110.4	H681 R689 C693	H681-K691 PolarHBondContact CE1-O 3.07Å; R689-K691 PolarHBondContact O-N 3.24Å; R689-K691 VanDerWaalsContact O-N 3.13Å; K691-C693 PolarHBondContact O-N 3.45Å
692	K	81.6	Confident	68.4	Low	166 Å²	166	122.5 Å²	122.5	72%	0.722	60%	0.603	S	S	*	*			trans	-53.2	114.6	178	-173	177.6	-178.9	178.7	0	110.9	F675	F675-K692 HydrophobicContact CD1-CB 3.73Å; F675-K692 HydrophobicContact CD1-CG 3.98Å; F675-K692 HydrophobicContact CE1-CB 3.85Å; F675-K692 HydrophobicContact CE1-CD 4.18Å; F675-K692 HydrophobicContact CE1-CG 4.04Å; F675-K692 HydrophobicContact CG-CB 4.14Å; F675-K692 HydrophobicContact CZ-CB 4.33Å
693	C	78.8	Confident	65.9	Low	37 Å²	37	125 Å²	125	25%	0.25	62%	0.622	C	S	.	*			trans	-75.1	160.5	-179.3	70	0	0	0	0	112.6	C677 C680 K691 C695	C677-C693 HydrophobicContact CB-CB 4.14Å; C677-C693 VanDerWaalsContact CB-SG 3.56Å; C680-C693 HydrophobicContact CB-CB 4.22Å; K691-C693 PolarHBondContact O-N 3.45Å; C693-C695 VanDerWaalsContact C-N 3.35Å
694	G	71.9	Confident	63.4	Low	81 Å²	81	123.1 Å²	123.1	84%	0.835	62%	0.619	S	S	*	*			trans	-86.9	3.7	176.2	0	0	0	0	0	114.9	R696	G694-R696 PolarHBondContact O-N 3.23Å
695	C	76	Confident	61.1	Low	66 Å²	66	129 Å²	129	45%	0.446	66%	0.655	S	S	.	*	P	Polyproline II helix	trans	-63.9	124.5	179.2	-64.5	0	0	0	0	110.5	C680 C693	C680-C695 PolarHBondContact SG-SG 3.09Å; C693-C695 VanDerWaalsContact C-N 3.35Å
696	R	57.9	Low	58.7	Low	237 Å²	237	131.1 Å²	131.1	89%	0.894	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-68	139.5	171.6	-70.9	-173.8	176.8	-167.3	-1.3	109.7	G694 L698	G694-R696 PolarHBondContact O-N 3.23Å; R696-L698 PolarHBondContact O-N 3.12Å
697	R	55.8	Low	56.3	Low	180 Å²	180	133.1 Å²	133.1	68%	0.679	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-61.4	130.3	162.4	-71.6	179.7	172.4	171	-6.5	108	E699	R697-E699 PolarHBondContact O-N 3.32Å
698	L	43.3	Very low	54.3	Low	181 Å²	181	138 Å²	138	95%	0.948	71%	0.712	S	S	*	*	S	Bend	trans	-81.5	59.6	177.4	-82.6	165.5	0	0	0	110.5	R696	R696-L698 PolarHBondContact O-N 3.12Å
699	E	41.6	Very low	51.6	Low	166 Å²	166	140.3 Å²	140.3	78%	0.776	72%	0.722	S	S	*	*			trans	-158	80.1	175.2	-118.4	173.1	-142.4	0	0	110.1	R697	R697-E699 PolarHBondContact O-N 3.32Å
700	D	35.5	Very low	49.3	Very low	164 Å²	164	142.3 Å²	142.3	88%	0.877	74%	0.735	S	S	*	*			trans	-163.5	40.3	164.5	-120.9	-14.7	0	0	0	112.4
701	E	30.2	Very low	46.6	Very low	194 Å²	194	151.9 Å²	151.9	91%	0.907	78%	0.777	S	S	*	*			trans	-115.7	93.5	162.1	-81.8	-155.8	146.7	0	0	110.3
702	Q	29.2	Very low	44.1	Very low	183 Å²	183	153.1 Å²	153.1	86%	0.855	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-72.4	123.4	157.7	-70.2	-179.7	-6.1	0	0	108.7
703	P	31.4	Very low	41.5	Very low	115 Å²	115	157 Å²	157	75%	0.747	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-68.1	137.1	171.8	27.8	-32.8	0	0	0	109.9
704	P	31.3	Very low	39	Very low	122 Å²	122	162.4 Å²	162.4	79%	0.792	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-71.2	144.9	-172.8	28	-35	0	0	0	112.7	L706	P704-L706 PolarHBondContact O-N 3.04Å
705	T	35	Very low	36.9	Very low	144 Å²	144	162.5 Å²	162.5	88%	0.883	82%	0.822	S	S	*	*			trans	-68.4	108.5	176.9	39.2	0	0	0	0	112.4
706	L	29	Very low	34.5	Very low	168 Å²	168	163.3 Å²	163.3	88%	0.88	84%	0.841	S	S	*	*			trans	-142.2	115.7	163.9	-99	165.3	0	0	0	110.9	P704	P704-L706 PolarHBondContact O-N 3.04Å
707	S	34.6	Very low	33	Very low	110 Å²	110	160 Å²	160	77%	0.769	84%	0.838	S	S	*	*			trans	-88.5	156.5	175.1	61.6	0	0	0	0	111.4
708	P	39.6	Very low	31.7	Very low	113 Å²	113	161.2 Å²	161.2	73%	0.734	84%	0.843	S	S	*	*				-144	130	127.2	31.6	-14.7	0	0	0	116.6
709	K	27.8	Very low	30.9	Very low	199 Å²	199	159.4 Å²	159.4	87%	0.865	83%	0.834	S	S	*	*			trans	63.1	113.1	133.4	-63.1	178.4	178.9	174.3	0	120.7
710	K	36.4	Very low	30.2	Very low	208 Å²	208	156.8 Å²	156.8	90%	0.904	83%	0.834	S	S	*	*			trans	-48	148.4	152.2	-71.8	173.3	171.8	173.1	0	112.8
711	K	28.2	Very low	30	Very low	209 Å²	209	154.9 Å²	154.9	91%	0.909	83%	0.83	S	S	*	*			trans	-142.8	128.8	146.8	-151.4	172.8	-172.7	178.7	0	110.6
712	Q	30.8	Very low	30	Very low	173 Å²	173	153 Å²	153	81%	0.808	83%	0.826	S	S	*	*			trans	-79.7	155.5	-179.2	-62.9	160.9	-72.5	0	0	112
713	R	27.7	Very low	29.7	Very low	247 Å²	247	151.1 Å²	151.1	93%	0.932	83%	0.828	S	S	*	*				-153.1	141.7	124.2	-148.8	169.4	-179.1	176.5	-1.3	112.3
714	N	26.7	Very low	29.6	Very low	151 Å²	151	151 Å²	151	81%	0.807	83%	0.829	S	S	*	*			trans	-84.4	158.5	-178.6	-77.2	-14.2	0	0	0	113.5
715	G	26.8	Very low	29.6	Very low	82 Å²	82	151.1 Å²	151.1	85%	0.845	83%	0.831	S	S	*	*				128.7	123.8	125.6	0	0	0	0	0	116.9
716	G	25.5	Very low	29.1	Very low	83 Å²	83	153 Å²	153	86%	0.856	83%	0.827	S	S	*	*			trans	151.4	88.3	165.5	0	0	0	0	0	115.4
717	M	27.2	Very low	29.1	Very low	167 Å²	167	153.7 Å²	153.7	82%	0.823	83%	0.83	S	S	*	*			trans	-81.4	135.1	174.4	-80.7	149.3	73.8	0	0	112
718	R	28.2	Very low	28.7	Very low	206 Å²	206	155.1 Å²	155.1	78%	0.777	83%	0.826	S	S	*	*				151.4	148.9	96.4	-118.2	172.3	-176.7	174.3	-0.4	114.2
719	N	25.7	Very low	28.4	Very low	144 Å²	144	159.8 Å²	159.8	77%	0.77	83%	0.829	S	S	*	*			trans	77.2	108.5	155.6	-63.3	0.6	0	0	0	120.4
720	S	27.1	Very low	28.4	Very low	110 Å²	110	159.4 Å²	159.4	77%	0.769	83%	0.83	S	S	*	*			trans	-58.5	167.9	158.3	-28.2	0	0	0	0	112.6
721	P	31.7	Very low	27.9	Very low	124 Å²	124	155 Å²	155	81%	0.805	82%	0.817	S	S	*	*				-134.3	164.9	69.5	30.8	-12.6	0	0	0	116.1
722	N	30.1	Very low	28.2	Very low	154 Å²	154	151.2 Å²	151.2	82%	0.824	81%	0.813	S	S	*	*			trans	-39	130.4	175.6	-65.4	-20.5	0	0	0	115.3
723	T	23.2	Very low	28.3	Very low	145 Å²	145	150.9 Å²	150.9	89%	0.89	82%	0.816	S	S	*	*			trans	-168	92.9	142.2	9.1	0	0	0	0	110.6
724	S	28.9	Very low	28.6	Very low	111 Å²	111	147 Å²	147	78%	0.776	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-94.9	134.1	158.7	45.7	0	0	0	0	108.7
725	P	31	Very low	28.7	Very low	126 Å²	126	147.4 Å²	147.4	82%	0.818	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-70.1	135.9	-175.8	27.3	-33.4	0	0	0	111.1	L727	P725-L727 PolarHBondContact O-N 3.47Å
726	K	24.8	Very low	29.3	Very low	184 Å²	184	149.5 Å²	149.5	80%	0.8	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-65.6	118.9	171.8	-65.3	174.5	176.9	176.4	0	109.4	M728	K726-M728 HydrophobicContact CB-CG 3.99Å; K726-M728 HydrophobicContact CD-CG 4.29Å; K726-M728 HydrophobicContact CD-SD 4.35Å; K726-M728 PolarHBondContact O-N 2.89Å
727	L	28.9	Very low	29.4	Very low	182 Å²	182	149 Å²	149	95%	0.953	81%	0.807	S	S	*	*			trans	-80	90.7	155.7	-149.6	81	0	0	0	107	P725	P725-L727 PolarHBondContact O-N 3.47Å
728	M	27.1	Very low	29.5	Very low	140 Å²	140	148 Å²	148	69%	0.69	81%	0.805	S	S	*	*			trans	-76.8	149.7	175.8	-78.7	-163.4	65.5	0	0	111.2	K726	K726-M728 HydrophobicContact CB-CG 3.99Å; K726-M728 HydrophobicContact CD-CG 4.29Å; K726-M728 HydrophobicContact CD-SD 4.35Å; K726-M728 PolarHBondContact O-N 2.89Å
729	R	32.3	Very low	29.6	Very low	210 Å²	210	145.4 Å²	145.4	79%	0.792	81%	0.807	S	S	*	*			trans	-38.2	141	164.1	-69.7	173.4	170.1	163.9	-6.5	111.9
730	H	28.8	Very low	30.1	Very low	191 Å²	191	146 Å²	146	88%	0.884	81%	0.805	S	S	*	*			trans	-108.8	118.2	144.6	-92.6	-80	0	0	0	108.5
731	D	24.4	Very low	30.6	Very low	117 Å²	117	148.4 Å²	148.4	63%	0.626	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-69.6	146.8	170.2	-57.9	-61.3	0	0	0	110.4
732	P	35.5	Very low	30.8	Very low	128 Å²	128	149.1 Å²	149.1	83%	0.831	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-66.3	127.5	155.5	-13	29.2	0	0	0	108.9
733	L	32.3	Very low	30.9	Very low	167 Å²	167	148.9 Å²	148.9	87%	0.874	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-66.7	135.5	-172.9	-69.1	163.2	0	0	0	112.9
734	L	34.1	Very low	31.5	Very low	166 Å²	166	150.4 Å²	150.4	87%	0.869	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-72.2	129.6	159.6	-78.4	162.8	0	0	0	110.2
735	I	28.9	Very low	32.3	Very low	158 Å²	158	149.8 Å²	149.8	81%	0.81	79%	0.79	S	S	*	*			trans	-125.2	132.1	149.4	-67.4	-176	0	0	0	106.1
736	P	40.2	Very low	33.4	Very low	127 Å²	127	148.1 Å²	148.1	83%	0.825	78%	0.782	S	S	*	*			trans	-90.3	147.2	-157.7	34.9	-36	0	0	0	113.4
737	G	26.3	Very low	35.1	Very low	72 Å²	72	145.3 Å²	145.3	74%	0.742	78%	0.775	S	S	*	*			trans	-178.9	91.9	173.9	0	0	0	0	0	114.5
738	N	29.4	Very low	37.4	Very low	145 Å²	145	140 Å²	140	78%	0.775	75%	0.751	S	S	*	*			trans	78.1	46.9	158.2	-129.9	72.7	0	0	0	119.8	Q740	N738-Q740 PolarHBondContact O-N 3.28Å
739	D	30.9	Very low	40	Very low	152 Å²	152	137.1 Å²	137.1	81%	0.813	73%	0.734	S	S	*	*			trans	-69.5	61.1	160.3	-74.6	-49.3	0	0	0	112.7
740	Q	35.4	Very low	42.6	Very low	157 Å²	157	131.5 Å²	131.5	73%	0.734	72%	0.715	S	S	*	*			trans	-138	114.9	161.2	-72.4	-165.9	1.1	0	0	109	N738	N738-Q740 PolarHBondContact O-N 3.28Å
741	I	37.8	Very low	45.6	Very low	161 Å²	161	123.9 Å²	123.9	83%	0.826	68%	0.679	S	S	*	*	S	Bend	trans	104.6	128.1	-168.2	-58.8	155.7	0	0	0	110.8
742	D	36.1	Very low	48.8	Very low	139 Å²	139	118.3 Å²	118.3	74%	0.743	65%	0.649	S	S	*	*	S	Bend	trans	102.8	-18.9	177.4	-64.6	-7.6	0	0	0	119.9	M744 D745	D742-M744 PolarHBondContact O-N 3.35Å; D742-D745 PolarHBondContact O-N 2.85Å
743	N	33.5	Very low	51.3	Low	148 Å²	148	114.7 Å²	114.7	79%	0.791	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	15.7	-179.5	-114.8	-23	0	0	0	116.1
744	M	35.1	Very low	54	Low	177 Å²	177	107.3 Å²	107.3	87%	0.872	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.9	-14.1	173.3	-90.2	-158	154.4	0	0	114.8	D742	D742-M744 PolarHBondContact O-N 3.35Å
745	D	45.6	Very low	56.6	Low	99 Å²	99	99.4 Å²	99.4	53%	0.529	55%	0.548	S	S	.	.	G	3₁₀ helix	trans	-89.7	-6.9	-168.6	-131.8	55.8	0	0	0	114.5	D742 K750	D742-D745 PolarHBondContact O-N 2.85Å; D745-K750 IonicContact OD2-NZ 2.76Å; D745-K750 PolarHBondContact OD2-NZ 2.9Å
746	S	53.8	Low	59.5	Low	91 Å²	91	92.4 Å²	92.4	64%	0.636	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-78.8	-18.3	-176.2	55.3	0	0	0	0	114.8
747	N	61.8	Low	62.1	Low	124 Å²	124	86.4 Å²	86.4	66%	0.663	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-90.3	-1.5	178.7	-85.5	-30	0	0	0	114.2	K749	N747-K749 PolarHBondContact O-N 3.16Å
748	V	77.1	Confident	65.3	Low	72 Å²	72	83.2 Å²	83.2	44%	0.436	44%	0.438	S	S	.	.			trans	-79.6	118.8	-178.1	-175	0	0	0	0	110.4	K750	V748-K750 HydrophobicContact CB-CG 4.42Å; V748-K750 HydrophobicContact CG1-CG 4.04Å; V748-K750 PolarHBondContact O-N 3.2Å
749	K	81.8	Confident	68.4	Low	79 Å²	79	78.1 Å²	78.1	34%	0.343	41%	0.408	S	S	.	.			trans	-67.9	99.4	171.3	-64.5	-173.3	169.9	-161.5	0	110	N747 W759 G1026 G1027 Y1028	N747-K749 PolarHBondContact O-N 3.16Å; K749-W759 HydrophobicContact CB-CE3 3.82Å; K749-W759 HydrophobicContact CB-CZ3 3.63Å; K749-W759 HydrophobicContact CD-CH2 4.4Å; K749-W759 HydrophobicContact CD-CZ3 4.18Å; K749-G1026 WeakPolarHBondContact CD-O 3.44Å; K749-G1026 WeakPolarHBondContact CE-O 3.21Å; K749-G1026 PolarHBondContact NZ-O 3.18Å; K749-G1027 WeakPolarHBondContact CG-O 3.41Å; K749-Y1028 HydrophobicContact CG-CD1 4.48Å; K749-Y1028 HydrophobicContact CG-CE1 4.39Å
750	K	86.6	Confident	71.4	Confident	91 Å²	91	72 Å²	72	40%	0.396	38%	0.377	S	S	.	.			trans	-97.7	-18.1	-179.9	-68.4	171.8	-179.9	169.4	0	113.1	D745 V748 W759	D745-K750 IonicContact OD2-NZ 2.76Å; D745-K750 PolarHBondContact OD2-NZ 2.9Å; V748-K750 HydrophobicContact CB-CG 4.42Å; V748-K750 HydrophobicContact CG1-CG 4.04Å; V748-K750 PolarHBondContact O-N 3.2Å; K750-W759 PolarHBondContact O-N 3.05Å; K750-W759 VanDerWaalsContact O-N 3.11Å
751	Y	91.4	Very high	74	Confident	31 Å²	31	67.4 Å²	67.4	12%	0.122	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	166.2	-177.1	-58.8	-72.1	0	0	0	111.4	F757 H758 W759 G1027 L1034 R1037	Y751-F757 WeakPolarHBondContact CA-O 3.37Å; Y751-H758 AromaticContact CE1-CE1 3.87Å; Y751-H758 AromaticContact CE1-ND1 3.96Å; Y751-W759 VanDerWaalsContact C-CB 3.41Å; Y751-G1027 PolarHBondContact O-N 3.29Å; Y751-L1034 HydrophobicContact CD2-CD2 4.35Å; Y751-L1034 HydrophobicContact CE2-CD2 3.89Å; Y751-R1037 PolarHBondContact OH-NE 2.77Å
752	D	91.3	Very high	76.6	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.005	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	174.6	171.5	83.1	-70.3	0	0	0	112	T754 G755 M756 F757 L1024 R1025	D752-T754 VanDerWaalsContact C-N 3.27Å; D752-T754 PolarHBondContact O-N 2.93Å; D752-T754 PolarHBondContact OD1-OG1 3.2Å; D752-T754 WeakPolarHBondContact OD2-CA 3.21Å; D752-T754 VanDerWaalsContact OD2-CB 3.32Å; D752-T754 WeakPolarHBondContact OD2-CB 3.03Å; D752-T754 PolarHBondContact OD2-N 3.26Å; D752-T754 PolarHBondContact OD2-OG1 3.34Å; D752-G755 PolarHBondContact O-N 3.1Å; D752-G755 WeakPolarHBondContact OD1-CA 3.2Å; D752-G755 PolarHBondContact OD1-N 3Å; D752-M756 PolarHBondContact OD1-N 2.6Å; D752-F757 PolarHBondContact N-O 2.91Å; D752-F757 VanDerWaalsContact N-O 3.09Å; D752-F757 PolarHBondContact OD1-N 3Å; D752-L1024 HydrophobicContact CB-CD1 4.5Å; D752-L1024 HydrophobicContact CB-CD2 3.83Å; D752-L1024 HydrophobicContact CB-CG 3.94Å; D752-R1025 CarbonylContact C-O 3.6Å; D752-R1025 WeakPolarHBondContact CA-O 3.15Å
753	S	88.9	Confident	79.3	Confident	51 Å²	51	60.6 Å²	60.6	36%	0.357	33%	0.332	S	S	.	.	S	Bend	trans	-61.8	-26.1	179.5	52.8	0	0	0	0	115.3	R1025	S753-R1025 PolarHBondContact N-O 2.94Å
754	T	88.1	Confident	82.2	Confident	13 Å²	13	59.5 Å²	59.5	8%	0.08	32%	0.322	C	S	.	.	S	Bend	trans	-90.1	-23.2	177	71.3	0	0	0	0	113.2	D752 M756 L1014 L1017 N1036	D752-T754 VanDerWaalsContact C-N 3.27Å; D752-T754 PolarHBondContact O-N 2.93Å; D752-T754 PolarHBondContact OD1-OG1 3.2Å; D752-T754 WeakPolarHBondContact OD2-CA 3.21Å; D752-T754 VanDerWaalsContact OD2-CB 3.32Å; D752-T754 WeakPolarHBondContact OD2-CB 3.03Å; D752-T754 PolarHBondContact OD2-N 3.26Å; D752-T754 PolarHBondContact OD2-OG1 3.34Å; T754-M756 WeakPolarHBondContact OG1-CB 3.44Å; T754-M756 VanDerWaalsContact OG1-CG 3.24Å; T754-M756 WeakPolarHBondContact OG1-CG 3.43Å; T754-M756 PolarHBondContact OG1-N 2.75Å; T754-L1014 HydrophobicContact CG2-CB 4.3Å; T754-L1014 HydrophobicContact CG2-CD1 4.21Å; T754-L1017 HydrophobicContact CG2-CD1 3.73Å; T754-N1036 PolarHBondContact O-ND2 2.8Å
755	G	88.8	Confident	85.1	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.287	C	S	.	.	S	Bend	trans	84.3	9.4	-175	0	0	0	0	0	114.5	D752 S809	D752-G755 PolarHBondContact O-N 3.1Å; D752-G755 WeakPolarHBondContact OD1-CA 3.2Å; D752-G755 PolarHBondContact OD1-N 3Å; G755-S809 WeakPolarHBondContact O-CB 3.47Å; G755-S809 PolarHBondContact O-OG 3.44Å
756	M	90.1	Very high	87.4	Confident	11 Å²	11	53.7 Å²	53.7	5%	0.054	29%	0.291	C	S	.	.	S	Bend	trans	-85.4	-21	-176.8	-61.8	-61.8	-82.9	0	0	113	D752 T754 S809 G1009 T1011 N1036 R1039	D752-M756 PolarHBondContact OD1-N 2.6Å; T754-M756 WeakPolarHBondContact OG1-CB 3.44Å; T754-M756 VanDerWaalsContact OG1-CG 3.24Å; T754-M756 WeakPolarHBondContact OG1-CG 3.43Å; T754-M756 PolarHBondContact OG1-N 2.75Å; M756-S809 VanDerWaalsContact C-OG 3.26Å; M756-S809 WeakPolarHBondContact CA-OG 3.22Å; M756-S809 WeakPolarHBondContact O-CB 3.35Å; M756-S809 PolarHBondContact O-N 2.81Å; M756-S809 PolarHBondContact O-OG 2.77Å; M756-S809 VanDerWaalsContact O-OG 3.06Å; M756-G1009 WeakPolarHBondContact CE-O 3.43Å; M756-T1011 HydrophobicContact CE-CG2 4.21Å; M756-N1036 HydrophobicContact SD-CB 3.89Å; M756-R1039 VanDerWaalsContact CE-CZ 3.48Å; M756-R1039 VanDerWaalsContact CE-NE 3.33Å; M756-R1039 PolarHBondContact O-NH2 3.05Å; M756-R1039 VanDerWaalsContact O-NH2 3.11Å
757	F	94.3	Very high	89.3	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-137.5	150.4	-175.1	-61.8	-76.4	0	0	0	113.1	Y751 D752 M804 R807 A808 T1007 L1014 L1024	Y751-F757 WeakPolarHBondContact CA-O 3.37Å; D752-F757 PolarHBondContact N-O 2.91Å; D752-F757 VanDerWaalsContact N-O 3.09Å; D752-F757 PolarHBondContact OD1-N 3Å; F757-M804 HydrophobicContact CD1-CG 3.58Å; F757-M804 WeakPolarHBondContact CD1-O 3.47Å; F757-M804 HydrophobicContact CD2-CG 4.17Å; F757-M804 HydrophobicContact CD2-SD 4.33Å; F757-M804 HydrophobicContact CE1-CB 4.49Å; F757-M804 HydrophobicContact CE1-CG 3.38Å; F757-M804 WeakPolarHBondContact CE1-O 3.49Å; F757-M804 HydrophobicContact CE1-SD 4.31Å; F757-M804 HydrophobicContact CE2-CG 3.98Å; F757-M804 HydrophobicContact CE2-SD 3.91Å; F757-M804 HydrophobicContact CG-CG 3.99Å; F757-M804 HydrophobicContact CZ-CG 3.59Å; F757-M804 HydrophobicContact CZ-SD 3.9Å; F757-R807 WeakPolarHBondContact CA-O 3.31Å; F757-A808 HydrophobicContact CD1-CB 4.25Å; F757-A808 HydrophobicContact CE1-CB 4.02Å; F757-T1007 WeakPolarHBondContact CZ-O 3.46Å; F757-L1014 HydrophobicContact CD2-CD2 3.9Å; F757-L1014 HydrophobicContact CE2-CD2 3.47Å; F757-L1014 VanDerWaalsContact CE2-CD2 3.47Å; F757-L1024 HydrophobicContact CB-CD2 4.2Å
758	H	94.2	Very high	90.9	Very high	5 Å²	5	50.8 Å²	50.8	2%	0.023	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-71.3	135.8	170.3	-73.8	-105	0	0	0	110.3	Y751 R807 A808 F811 Y813 L816 P839	Y751-H758 AromaticContact CE1-CE1 3.87Å; Y751-H758 AromaticContact CE1-ND1 3.96Å; H758-R807 PolarHBondContact CD2-O 3.45Å; H758-R807 PolarHBondContact N-O 3.17Å; H758-A808 PolarHBondContact CD2-O 3.22Å; H758-F811 PolarHBondContact CE1-O 2.85Å; H758-F811 PolarHBondContact NE2-O 3.21Å; H758-Y813 AromaticContact ND1-CD2 3.85Å; H758-L816 HydrophobicContact CB-CD1 4.28Å; H758-P839 HydrophobicContact CB-CG 3.99Å
759	W	94.6	Very high	91.7	Very high	39 Å²	39	49 Å²	49	15%	0.148	25%	0.249	C	C	.	.			trans	-129.5	146.4	-175.4	-176.1	93.5	0	0	0	111.2	K749 K750 Y751 A761 N837 L1024 G1026	K749-W759 HydrophobicContact CB-CE3 3.82Å; K749-W759 HydrophobicContact CB-CZ3 3.63Å; K749-W759 HydrophobicContact CD-CH2 4.4Å; K749-W759 HydrophobicContact CD-CZ3 4.18Å; K750-W759 PolarHBondContact O-N 3.05Å; K750-W759 VanDerWaalsContact O-N 3.11Å; Y751-W759 VanDerWaalsContact C-CB 3.41Å; W759-A761 HydrophobicContact CH2-CB 4.49Å; W759-N837 PolarHBondContact NE1-ND2 3.3Å; W759-L1024 PolarHBondContact NE1-O 2.86Å; W759-G1026 VanDerWaalsContact CD2-CA 3.47Å; W759-G1026 VanDerWaalsContact CE2-CA 3.42Å
760	C	92.8	Very high	92.3	Very high	22 Å²	22	46.7 Å²	46.7	15%	0.149	24%	0.24	C	C	.	.			trans	-132.3	162.4	166.1	73.6	0	0	0	0	112.3	N837	C760-N837 PolarHBondContact N-O 3.18Å; C760-N837 PolarHBondContact O-ND2 2.78Å; C760-N837 VanDerWaalsContact SG-C 3.56Å; C760-N837 PolarHBondContact SG-O 2.78Å
761	A	90.8	Very high	92.7	Very high	61 Å²	61	45.8 Å²	45.8	50%	0.504	24%	0.242	S	C	.	.			trans	-52.9	143.9	170	0	0	0	0	0	110.8	W759 K763	W759-A761 HydrophobicContact CH2-CB 4.49Å; A761-K763 PolarHBondContact O-N 3.21Å
762	P	92.6	Very high	92.8	Very high	87 Å²	87	50 Å²	50	57%	0.565	26%	0.258	S	S	*	.			trans	-60.1	130.2	-177.3	25.4	-34.4	0	0	0	110.7	H836	P762-H836 WeakPolarHBondContact CA-O 3.21Å
763	K	93.3	Very high	92.8	Very high	70 Å²	70	54 Å²	54	30%	0.304	29%	0.286	S	S	.	.			trans	-105	130.9	179.8	-63.8	178.9	-175.6	172.3	0	111.4	A761 V768 W832 H836	A761-K763 PolarHBondContact O-N 3.21Å; K763-V768 HydrophobicContact CD-CG1 4.09Å; K763-W832 HydrophobicContact CB-CZ2 4.39Å; K763-W832 PolarHBondContact O-NE1 2.76Å; K763-H836 PolarHBondContact N-O 3.48Å; K763-H836 VanDerWaalsContact N-O 3.12Å
764	E	94.1	Very high	92.9	Very high	125 Å²	125	55.7 Å²	55.7	58%	0.584	29%	0.288	S	S	*	.			trans	-57.9	141.3	162.9	-66.7	158	166.7	0	0	110	E766 K767	E764-E766 VanDerWaalsContact C-N 3.27Å; E764-E766 PolarHBondContact O-N 3.46Å; E764-K767 HydrophobicContact CB-CD 4.4Å; E764-K767 WeakPolarHBondContact O-CB 3.36Å; E764-K767 PolarHBondContact O-N 3.21Å; E764-K767 VanDerWaalsContact OE2-CE 3.23Å; E764-K767 WeakPolarHBondContact OE2-CE 3.34Å; E764-K767 IonicContact OE2-NZ 2.96Å; E764-K767 PolarHBondContact OE2-NZ 3.05Å
765	I	94.9	Very high	93	Very high	25 Å²	25	55.1 Å²	55.1	13%	0.128	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-60.8	-34.6	-172.9	-161.5	174.1	0	0	0	112.8	K767 V768 I769 I825 K829 W832 I843	I765-K767 PolarHBondContact O-N 3.26Å; I765-K767 VanDerWaalsContact O-N 3.07Å; I765-V768 HydrophobicContact CG1-CG2 4.33Å; I765-V768 WeakPolarHBondContact O-CG2 3.48Å; I765-V768 PolarHBondContact O-N 3.12Å; I765-I769 HydrophobicContact CG1-CD1 4.16Å; I765-I769 HydrophobicContact CG1-CG1 4.33Å; I765-I769 HydrophobicContact CG2-CD1 4.34Å; I765-I769 WeakPolarHBondContact O-CG1 3.46Å; I765-I769 PolarHBondContact O-N 3.24Å; I765-I769 VanDerWaalsContact O-N 3.17Å; I765-I825 HydrophobicContact CD1-CD1 3.97Å; I765-K829 HydrophobicContact CD1-CB 4.49Å; I765-K829 HydrophobicContact CD1-CG 3.68Å; I765-W832 HydrophobicContact CB-CD2 4.49Å; I765-W832 HydrophobicContact CB-CG 4.12Å; I765-W832 HydrophobicContact CD1-CB 4.02Å; I765-W832 HydrophobicContact CD1-CD2 4.46Å; I765-W832 HydrophobicContact CD1-CG 3.97Å; I765-W832 HydrophobicContact CG1-CB 4.49Å; I765-W832 HydrophobicContact CG1-CD2 4.06Å; I765-W832 HydrophobicContact CG1-CG 3.9Å; I765-I843 HydrophobicContact CD1-CD1 4.02Å; I765-I843 HydrophobicContact CG1-CD1 3.9Å
766	E	93.9	Very high	92.9	Very high	130 Å²	130	57 Å²	57	61%	0.607	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-60.8	-20.5	178.1	-52.8	-56.5	148.8	0	0	113.3	E764 V768	E764-E766 VanDerWaalsContact C-N 3.27Å; E764-E766 PolarHBondContact O-N 3.46Å; E766-V768 VanDerWaalsContact C-N 3.32Å
767	K	93.7	Very high	92.7	Very high	147 Å²	147	63 Å²	63	64%	0.639	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-82.5	-7.2	177	-68.2	170.5	173.7	151.7	0	113.8	E764 I765	E764-K767 HydrophobicContact CB-CD 4.4Å; E764-K767 WeakPolarHBondContact O-CB 3.36Å; E764-K767 PolarHBondContact O-N 3.21Å; E764-K767 VanDerWaalsContact OE2-CE 3.23Å; E764-K767 WeakPolarHBondContact OE2-CE 3.34Å; E764-K767 IonicContact OE2-NZ 2.96Å; E764-K767 PolarHBondContact OE2-NZ 3.05Å; I765-K767 PolarHBondContact O-N 3.26Å; I765-K767 VanDerWaalsContact O-N 3.07Å
768	V	94.9	Very high	92.4	Very high	6 Å²	6	65.8 Å²	65.8	4%	0.036	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.1	-12.9	178.4	-60.2	0	0	0	0	113.3	K763 I765 E766 W832 V841 S842 I843	K763-V768 HydrophobicContact CD-CG1 4.09Å; I765-V768 HydrophobicContact CG1-CG2 4.33Å; I765-V768 WeakPolarHBondContact O-CG2 3.48Å; I765-V768 PolarHBondContact O-N 3.12Å; E766-V768 VanDerWaalsContact C-N 3.32Å; V768-W832 HydrophobicContact CB-CH2 4.11Å; V768-W832 HydrophobicContact CB-CZ2 4.31Å; V768-W832 HydrophobicContact CG1-CH2 3.84Å; V768-W832 HydrophobicContact CG1-CZ2 3.88Å; V768-W832 HydrophobicContact CG2-CH2 3.47Å; V768-W832 VanDerWaalsContact CG2-CH2 3.47Å; V768-W832 HydrophobicContact CG2-CZ2 3.51Å; V768-W832 HydrophobicContact CG2-CZ3 3.98Å; V768-V841 WeakPolarHBondContact CG1-O 3.37Å; V768-S842 CarbonylContact O-C 3.55Å; V768-S842 VanDerWaalsContact O-CA 3.31Å; V768-S842 WeakPolarHBondContact O-CA 3.22Å; V768-I843 HydrophobicContact CG2-CD1 4.03Å; V768-I843 HydrophobicContact CG2-CG1 4.26Å; V768-I843 PolarHBondContact O-N 3.12Å
769	I	95.8	Very high	91.9	Very high	35 Å²	35	71 Å²	71	18%	0.179	38%	0.379	C	S	.	.	B	Isolated β-bridge	trans	-67.6	132.3	171.9	-69.9	167.8	0	0	0	109	I765 I825 I843 P845	I765-I769 HydrophobicContact CG1-CD1 4.16Å; I765-I769 HydrophobicContact CG1-CG1 4.33Å; I765-I769 HydrophobicContact CG2-CD1 4.34Å; I765-I769 WeakPolarHBondContact O-CG1 3.46Å; I765-I769 PolarHBondContact O-N 3.24Å; I765-I769 VanDerWaalsContact O-N 3.17Å; I769-I825 HydrophobicContact CD1-CD1 3.76Å; I769-I825 HydrophobicContact CD1-CG1 4.43Å; I769-I825 HydrophobicContact CG1-CD1 4.14Å; I769-I843 CarbonylContact C-O 3.56Å; I769-I843 WeakPolarHBondContact CA-O 3.38Å; I769-I843 HydrophobicContact CG1-CB 4.32Å; I769-I843 HydrophobicContact CG1-CG2 4.43Å; I769-P845 HydrophobicContact CG2-CG 4.18Å
770	L	93.8	Very high	91.6	Very high	31 Å²	31	69.7 Å²	69.7	16%	0.162	38%	0.375	C	S	.	.			trans	-119.3	133.9	173.4	-59	177.8	0	0	0	108.6	E774 A775 I843 L844 P845	L770-E774 HydrophobicContact CB-CB 4.49Å; L770-E774 HydrophobicContact CD2-CB 4.44Å; L770-A775 HydrophobicContact CB-CB 4.45Å; L770-I843 PolarHBondContact N-O 2.9Å; L770-L844 VanDerWaalsContact O-CD1 3.28Å; L770-L844 WeakPolarHBondContact O-CD1 3.31Å; L770-P845 WeakPolarHBondContact O-CD 3.47Å
771	T	94.2	Very high	91.5	Very high	72 Å²	72	71.8 Å²	71.8	44%	0.442	39%	0.39	S	S	.	.			trans	-71.1	161.3	162.6	63.9	0	0	0	0	110.5	S773 E774 A775	T771-S773 PolarHBondContact O-N 3.08Å; T771-S773 VanDerWaalsContact O-N 3.15Å; T771-E774 VanDerWaalsContact CB-OE2 3.27Å; T771-E774 WeakPolarHBondContact CB-OE2 3.26Å; T771-E774 VanDerWaalsContact CG2-OE2 3.31Å; T771-E774 WeakPolarHBondContact CG2-OE2 3.34Å; T771-E774 PolarHBondContact N-OE2 3.47Å; T771-E774 PolarHBondContact O-N 3.11Å; T771-E774 WeakPolarHBondContact OG1-CG 3.32Å; T771-E774 PolarHBondContact OG1-N 3.05Å; T771-E774 PolarHBondContact OG1-OE2 3.01Å; T771-A775 PolarHBondContact O-N 3.48Å
772	R	93.1	Very high	91.5	Very high	119 Å²	119	70.1 Å²	70.1	45%	0.449	38%	0.379	S	S	.	.	H	α-helix	trans	-53	-36.5	175.9	-168.7	-176.4	-67.8	157.9	-1	112.7	A776 D853 A856	R772-A776 WeakPolarHBondContact O-CB 3.26Å; R772-A776 PolarHBondContact O-N 3.11Å; R772-A776 VanDerWaalsContact O-N 3.11Å; R772-D853 IonicContact CZ-OD1 2.71Å; R772-D853 IonicContact CZ-OD2 3.18Å; R772-D853 IonicContact NE-OD1 2.67Å; R772-D853 PolarHBondContact NE-OD1 2.85Å; R772-D853 IonicContact NH2-OD1 2.84Å; R772-D853 PolarHBondContact NH2-OD1 3.5Å; R772-D853 IonicContact NH2-OD2 2.81Å; R772-D853 PolarHBondContact NH2-OD2 3.45Å; R772-A856 HydrophobicContact CB-CB 4.47Å; R772-A856 HydrophobicContact CG-CB 3.41Å; R772-A856 VanDerWaalsContact CG-CB 3.41Å
773	S	91.4	Very high	91.7	Very high	85 Å²	85	66 Å²	66	59%	0.594	35%	0.352	S	S	*	.	H	α-helix	trans	-71.4	-41	177.8	-56.1	0	0	0	0	112.5	T771 A776 M777	T771-S773 PolarHBondContact O-N 3.08Å; T771-S773 VanDerWaalsContact O-N 3.15Å; S773-A776 PolarHBondContact O-N 2.62Å; S773-M777 WeakPolarHBondContact O-CG 3.36Å; S773-M777 PolarHBondContact O-N 2.9Å
774	E	92.1	Very high	91.9	Very high	86 Å²	86	62.7 Å²	62.7	40%	0.402	34%	0.338	S	S	.	.	H	α-helix	trans	-69.9	-37.5	177.5	-69.8	157.7	148.4	0	0	112	L770 T771 M777 T778	L770-E774 HydrophobicContact CB-CB 4.49Å; L770-E774 HydrophobicContact CD2-CB 4.44Å; T771-E774 VanDerWaalsContact CB-OE2 3.27Å; T771-E774 WeakPolarHBondContact CB-OE2 3.26Å; T771-E774 VanDerWaalsContact CG2-OE2 3.31Å; T771-E774 WeakPolarHBondContact CG2-OE2 3.34Å; T771-E774 PolarHBondContact N-OE2 3.47Å; T771-E774 PolarHBondContact O-N 3.11Å; T771-E774 WeakPolarHBondContact OG1-CG 3.32Å; T771-E774 PolarHBondContact OG1-N 3.05Å; T771-E774 PolarHBondContact OG1-OE2 3.01Å; E774-M777 HydrophobicContact CG-CE 4.04Å; E774-M777 PolarHBondContact O-N 3.25Å; E774-T778 WeakPolarHBondContact O-CB 3.21Å; E774-T778 PolarHBondContact O-N 3.2Å; E774-T778 PolarHBondContact O-OG1 2.97Å
775	A	90.4	Very high	92.1	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.008	31%	0.31	C	S	.	.	H	α-helix	trans	-58.5	-48.2	170.1	0	0	0	0	0	111	L770 T771 M777 T778 A856	L770-A775 HydrophobicContact CB-CB 4.45Å; T771-A775 PolarHBondContact O-N 3.48Å; A775-M777 VanDerWaalsContact C-N 3.3Å; A775-M777 PolarHBondContact O-N 2.92Å; A775-T778 CarbonylContact O-C 3.24Å; A775-T778 WeakPolarHBondContact O-CA 3.34Å; A775-T778 WeakPolarHBondContact O-CB 3.41Å; A775-T778 PolarHBondContact O-N 3.34Å; A775-A856 CarbonylContact C-O 3.57Å; A775-A856 VanDerWaalsContact C-O 3.24Å; A775-A856 HydrophobicContact CB-CB 4.35Å
776	A	87	Confident	92.3	Very high	41 Å²	41	55.6 Å²	55.6	34%	0.339	30%	0.304	S	S	.	.	H	α-helix	trans	-69	-21.5	178.5	0	0	0	0	0	114.6	R772 S773 A856	R772-A776 WeakPolarHBondContact O-CB 3.26Å; R772-A776 PolarHBondContact O-N 3.11Å; R772-A776 VanDerWaalsContact O-N 3.11Å; S773-A776 PolarHBondContact O-N 2.62Å; A776-A856 HydrophobicContact CB-CB 4.45Å; A776-A856 PolarHBondContact N-O 3.01Å
777	M	86	Confident	92.4	Very high	137 Å²	137	49.4 Å²	49.4	68%	0.675	28%	0.275	S	S	*	.	H	α-helix	trans	-81.1	-19.6	168.9	-71.6	-171.9	-61	0	0	112.7	S773 E774 A775	S773-M777 WeakPolarHBondContact O-CG 3.36Å; S773-M777 PolarHBondContact O-N 2.9Å; E774-M777 HydrophobicContact CG-CE 4.04Å; E774-M777 PolarHBondContact O-N 3.25Å; A775-M777 VanDerWaalsContact C-N 3.3Å; A775-M777 PolarHBondContact O-N 2.92Å
778	T	87.1	Confident	92.6	Very high	57 Å²	57	42.6 Å²	42.6	35%	0.35	25%	0.246	S	C	.	.	S	Bend	trans	-90.6	109.3	179.4	-53.9	0	0	0	0	109.3	E774 A775 L780	E774-T778 WeakPolarHBondContact O-CB 3.21Å; E774-T778 PolarHBondContact O-N 3.2Å; E774-T778 PolarHBondContact O-OG1 2.97Å; A775-T778 CarbonylContact O-C 3.24Å; A775-T778 WeakPolarHBondContact O-CA 3.34Å; A775-T778 WeakPolarHBondContact O-CB 3.41Å; A775-T778 PolarHBondContact O-N 3.34Å; T778-L780 VanDerWaalsContact C-N 3.34Å; T778-L780 HydrophobicContact CG2-CD2 3.86Å; T778-L780 HydrophobicContact CG2-CG 3.94Å; T778-L780 PolarHBondContact O-N 3.2Å
779	V	84.3	Confident	92.5	Very high	114 Å²	114	43 Å²	43	69%	0.691	25%	0.247	S	C	*	.			trans	-72.4	90.1	179.2	-175.9	0	0	0	0	110
780	L	87.1	Confident	92.2	Very high	12 Å²	12	41.6 Å²	41.6	6%	0.063	24%	0.241	C	C	.	.			trans	-91.7	120.8	176.3	-63.7	171.7	0	0	0	110.3	T778 V820	T778-L780 VanDerWaalsContact C-N 3.34Å; T778-L780 HydrophobicContact CG2-CD2 3.86Å; T778-L780 HydrophobicContact CG2-CG 3.94Å; T778-L780 PolarHBondContact O-N 3.2Å; L780-V820 HydrophobicContact CD1-CG2 3.76Å
781	S	91.5	Very high	91.9	Very high	66 Å²	66	43.8 Å²	43.8	46%	0.462	25%	0.253	S	S	.	.			trans	-148.8	147.3	176.1	175.6	0	0	0	0	108.2	H783 L861	S781-H783 VanDerWaalsContact C-N 3.35Å; S781-L861 WeakPolarHBondContact CA-O 3.49Å
782	G	91.4	Very high	91.6	Very high	27 Å²	27	44.6 Å²	44.6	28%	0.278	26%	0.258	S	S	.	.	S	Bend	trans	65.9	38.7	-174.6	0	0	0	0	0	112.6	L861 D863	G782-L861 PolarHBondContact N-O 3.34Å; G782-D863 WeakPolarHBondContact CA-OD1 3.39Å
783	H	95.6	Very high	91.3	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	164.9	-169.4	76.2	-84	0	0	0	111.5	S781 V785 H818 V857 C862 D863	S781-H783 VanDerWaalsContact C-N 3.35Å; H783-V785 VanDerWaalsContact NE2-CG2 3.25Å; H783-V785 WeakPolarHBondContact NE2-CG2 3.35Å; H783-H818 HydrophobicContact CB-CB 4.19Å; H783-H818 WeakPolarHBondContact CB-O 3.21Å; H783-V857 PolarHBondContact CE1-O 3.07Å; H783-V857 PolarHBondContact NE2-O 3.02Å; H783-V857 VanDerWaalsContact NE2-O 3.09Å; H783-C862 CarbonylContact O-C 3.57Å; H783-C862 WeakPolarHBondContact O-CA 3.2Å; H783-C862 WeakPolarHBondContact O-CB 3.4Å; H783-D863 PolarHBondContact O-N 2.86Å
784	V	98.1	Very high	91.1	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	126.5	178.6	-179.7	0	0	0	0	109.3	C563 V786 K817 H818 I819 V820 M864 V866	C563-V784 HydrophobicContact CB-CG2 4.11Å; V784-V786 HydrophobicContact CG1-CG2 4Å; V784-K817 HydrophobicContact CG2-CB 4.14Å; V784-K817 HydrophobicContact CG2-CD 4.06Å; V784-H818 PolarHBondContact N-O 3.06Å; V784-I819 HydrophobicContact CB-CG1 4.38Å; V784-I819 WeakPolarHBondContact O-CA 3.32Å; V784-V820 PolarHBondContact O-N 2.95Å; V784-M864 WeakPolarHBondContact CA-O 3.36Å; V784-V866 HydrophobicContact CG1-CG2 4.12Å
785	V	98	Very high	90.8	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	125.2	172.8	-178.4	0	0	0	0	108	H783 V822 V857 C862 M864 C865 V866	H783-V785 VanDerWaalsContact NE2-CG2 3.25Å; H783-V785 WeakPolarHBondContact NE2-CG2 3.35Å; V785-V822 HydrophobicContact CG1-CG2 3.91Å; V785-V857 HydrophobicContact CG1-CG2 4.21Å; V785-V857 HydrophobicContact CG2-CB 4.5Å; V785-V857 HydrophobicContact CG2-CG2 3.96Å; V785-C862 HydrophobicContact CG2-CB 3.96Å; V785-M864 PolarHBondContact N-O 3.48Å; V785-C865 CarbonylContact O-C 3.48Å; V785-C865 WeakPolarHBondContact O-CA 3.49Å; V785-V866 PolarHBondContact O-N 3.28Å
786	V	98.2	Very high	90.8	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.006	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	104.2	178.2	-171.6	0	0	0	0	108.9	V784 I788 L802 I819 V820 F821 V822 V866 L868	V784-V786 HydrophobicContact CG1-CG2 4Å; V786-I788 HydrophobicContact CG1-CD1 4.13Å; V786-I788 HydrophobicContact CG1-CG1 3.97Å; V786-L802 HydrophobicContact CB-CD2 4.47Å; V786-L802 HydrophobicContact CG1-CD2 3.79Å; V786-L802 HydrophobicContact CG2-CD2 3.81Å; V786-I819 HydrophobicContact CG2-CG2 4.01Å; V786-V820 PolarHBondContact N-O 2.87Å; V786-F821 HydrophobicContact CB-CD1 3.64Å; V786-F821 HydrophobicContact CB-CE1 3.86Å; V786-F821 HydrophobicContact CG1-CD1 3.89Å; V786-F821 HydrophobicContact CG1-CE1 3.88Å; V786-F821 HydrophobicContact CG2-CD1 4.28Å; V786-F821 HydrophobicContact CG2-CE1 4.1Å; V786-F821 WeakPolarHBondContact O-CA 3.45Å; V786-V822 PolarHBondContact O-N 3.35Å; V786-V866 CarbonylContact C-O 3.52Å; V786-V866 WeakPolarHBondContact CA-O 3.32Å; V786-V866 HydrophobicContact CG1-CB 4.3Å; V786-V866 HydrophobicContact CG1-CG1 4.38Å; V786-V866 HydrophobicContact CG2-CB 4.35Å; V786-L868 HydrophobicContact CG1-CD1 4.07Å
787	C	97.8	Very high	90.9	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	120.4	176.4	-70.5	0	0	0	0	109.8	P848 V866 I867 L868	C787-P848 HydrophobicContact CB-CB 3.68Å; C787-P848 HydrophobicContact CB-CG 3.64Å; C787-V866 PolarHBondContact N-O 2.79Å; C787-I867 HydrophobicContact CB-CG1 4.16Å; C787-L868 PolarHBondContact O-N 3.19Å
788	I	96.3	Very high	91.2	Very high	3 Å²	3	32 Å²	32	2%	0.015	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	124.1	-175.8	-63	172.4	0	0	0	110.2	V786 L799 F821 V822 Y827 L828	V786-I788 HydrophobicContact CG1-CD1 4.13Å; V786-I788 HydrophobicContact CG1-CG1 3.97Å; I788-L799 HydrophobicContact CD1-CD1 3.55Å; I788-L799 HydrophobicContact CD1-CD2 3.74Å; I788-L799 HydrophobicContact CD1-CG 4.3Å; I788-F821 HydrophobicContact CD1-CD1 3.53Å; I788-F821 HydrophobicContact CD1-CE1 4.03Å; I788-F821 HydrophobicContact CD1-CG 4.49Å; I788-V822 PolarHBondContact N-O 2.85Å; I788-Y827 HydrophobicContact CG2-CD1 3.9Å; I788-Y827 HydrophobicContact CG2-CE1 3.84Å; I788-L828 HydrophobicContact CD1-CD2 4Å
789	F	94.1	Very high	91.6	Very high	15 Å²	15	29.3 Å²	29.3	7%	0.066	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	108.3	166.4	-66.4	-77.7	0	0	0	109.4	P848 L849 I867 L868 A870 E884 A888	F789-P848 HydrophobicContact CE1-CB 4.27Å; F789-P848 HydrophobicContact CE1-CG 4.2Å; F789-P848 HydrophobicContact CE2-CB 4.09Å; F789-P848 HydrophobicContact CE2-CG 4.16Å; F789-P848 HydrophobicContact CZ-CB 3.68Å; F789-P848 HydrophobicContact CZ-CG 3.94Å; F789-L849 HydrophobicContact CE1-CD1 4.14Å; F789-L849 HydrophobicContact CE1-CD2 4.39Å; F789-L849 HydrophobicContact CE1-CG 3.88Å; F789-L849 HydrophobicContact CZ-CD2 4.02Å; F789-L849 HydrophobicContact CZ-CG 3.96Å; F789-I867 HydrophobicContact CE2-CG2 4.14Å; F789-L868 PolarHBondContact N-O 3.47Å; F789-A870 WeakPolarHBondContact O-CB 3.46Å; F789-A870 PolarHBondContact O-N 3.21Å; F789-E884 WeakPolarHBondContact CB-OE2 3.29Å; F789-E884 HydrophobicContact CD1-CB 3.92Å; F789-E884 HydrophobicContact CD1-CG 4.49Å; F789-E884 HydrophobicContact CD2-CB 4.03Å; F789-E884 HydrophobicContact CE1-CB 4.07Å; F789-E884 HydrophobicContact CE2-CB 4.16Å; F789-E884 HydrophobicContact CG-CB 3.91Å; F789-E884 HydrophobicContact CZ-CB 4.17Å; F789-A888 HydrophobicContact CE2-CB 3.81Å; F789-A888 HydrophobicContact CZ-CB 3.85Å
790	G	89.6	Confident	92.1	Very high	6 Å²	6	24.5 Å²	24.5	6%	0.062	16%	0.16	C	C	.	.			trans	-167.1	139.9	-178.7	0	0	0	0	0	112.7	S824	G790-S824 VanDerWaalsContact O-CB 3.26Å; G790-S824 WeakPolarHBondContact O-CB 3.41Å
791	D	86.6	Confident	92.5	Very high	76 Å²	76	24.5 Å²	24.5	41%	0.406	16%	0.16	S	C	.	.			trans	-115	173.4	-176	-63.1	-54.9	0	0	0	112.1	S793 S794 R830 N871	D791-S793 PolarHBondContact O-N 2.9Å; D791-S794 PolarHBondContact N-OG 3.06Å; D791-S794 WeakPolarHBondContact O-CB 3.22Å; D791-S794 PolarHBondContact O-N 2.99Å; D791-S794 PolarHBondContact O-OG 3.08Å; D791-R830 PolarHBondContact O-NH1 3.22Å; D791-N871 PolarHBondContact OD2-ND2 2.9Å; D791-N871 PolarHBondContact OD2-OD1 3.31Å
792	V	88.3	Confident	92.8	Very high	89 Å²	89	21.4 Å²	21.4	54%	0.539	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-36.2	-179.6	-170.2	0	0	0	0	112.9	E826 R830	V792-E826 HydrophobicContact CG2-CB 3.84Å; V792-E826 WeakPolarHBondContact CG2-OE2 3.49Å; V792-R830 PolarHBondContact O-NH1 3.44Å
793	S	86.6	Confident	93	Very high	100 Å²	100	20.1 Å²	20.1	70%	0.699	13%	0.125	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-10	179.4	52	0	0	0	0	114.6	D791	D791-S793 PolarHBondContact O-N 2.9Å
794	S	87.4	Confident	93	Very high	2 Å²	2	20.5 Å²	20.5	1%	0.014	13%	0.126	C	C	.	.	S	Bend	trans	-71.7	153.1	-176.5	67.9	0	0	0	0	112.3	D791 Y827 R830 N871	D791-S794 PolarHBondContact N-OG 3.06Å; D791-S794 WeakPolarHBondContact O-CB 3.22Å; D791-S794 PolarHBondContact O-N 2.99Å; D791-S794 PolarHBondContact O-OG 3.08Å; S794-Y827 WeakPolarHBondContact OG-CD2 3.29Å; S794-Y827 WeakPolarHBondContact OG-CE2 3.18Å; S794-R830 PolarHBondContact O-NH1 3.05Å; S794-R830 PolarHBondContact O-NH2 2.85Å; S794-N871 VanDerWaalsContact CB-OD1 3.28Å; S794-N871 WeakPolarHBondContact CB-OD1 3.5Å
795	A	86.6	Confident	92.8	Very high	24 Å²	24	20.6 Å²	20.6	20%	0.198	13%	0.127	C	C	.	.	P	Polyproline II helix	trans	-67.7	151.6	177.8	0	0	0	0	0	111.4	P498 Y827	P498-A795 HydrophobicContact CG-CB 3.9Å; A795-Y827 WeakPolarHBondContact O-CE2 3.21Å; A795-Y827 PolarHBondContact O-OH 3.39Å; A795-Y827 VanDerWaalsContact O-OH 3.12Å
796	L	89.6	Confident	92.7	Very high	54 Å²	54	20.9 Å²	20.9	28%	0.283	13%	0.129	S	C	.	.	P	Polyproline II helix	trans	-69.8	140	173.3	-63.3	-178.8	0	0	0	109.8	Q527 R830 E831	Q527-L796 PolarHBondContact NE2-O 3.42Å; L796-R830 HydrophobicContact CD2-CB 3.92Å; L796-E831 HydrophobicContact CD2-CG 4.11Å
797	I	89.9	Confident	92.6	Very high	10 Å²	10	20.8 Å²	20.8	5%	0.051	13%	0.128	C	C	.	.			trans	-88.1	-28.1	175.8	-76.7	169	0	0	0	109.8	L556 L799 Y827 E831 L868 A870	L556-I797 HydrophobicContact CD1-CG2 3.61Å; L556-I797 WeakPolarHBondContact CD1-O 3.43Å; L556-I797 HydrophobicContact CD2-CG2 3.9Å; L556-I797 HydrophobicContact CG-CG2 4.33Å; I797-L799 HydrophobicContact CB-CD2 4.38Å; I797-L799 HydrophobicContact CG2-CD2 3.95Å; I797-Y827 WeakPolarHBondContact CB-OH 3.18Å; I797-Y827 WeakPolarHBondContact CG1-OH 3.35Å; I797-Y827 PolarHBondContact N-OH 2.99Å; I797-E831 PolarHBondContact N-OE1 3.31Å; I797-L868 HydrophobicContact CD1-CB 4.17Å; I797-L868 HydrophobicContact CG2-CD1 4.49Å; I797-A870 HydrophobicContact CD1-CB 3.74Å; I797-A870 HydrophobicContact CG1-CB 4Å
798	G	92.2	Very high	92.4	Very high	15 Å²	15	20.9 Å²	20.9	16%	0.155	13%	0.129	C	C	.	.			trans	78.3	55.3	-173	0	0	0	0	0	111.5	L556 R800 N801 E831	L556-G798 WeakPolarHBondContact CD1-O 3.43Å; G798-R800 PolarHBondContact O-N 2.73Å; G798-N801 WeakPolarHBondContact O-CB 3.39Å; G798-N801 PolarHBondContact O-N 3.04Å; G798-E831 PolarHBondContact N-OE1 3.1Å
799	L	95.4	Very high	92.2	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-20.6	-175.3	-64.1	174.5	0	0	0	113.4	I788 I797 N801 L802 V803 F821 L828 E831 L835 L868	I788-L799 HydrophobicContact CD1-CD1 3.55Å; I788-L799 HydrophobicContact CD1-CD2 3.74Å; I788-L799 HydrophobicContact CD1-CG 4.3Å; I797-L799 HydrophobicContact CB-CD2 4.38Å; I797-L799 HydrophobicContact CG2-CD2 3.95Å; L799-N801 PolarHBondContact O-N 3.23Å; L799-N801 VanDerWaalsContact O-N 3.16Å; L799-L802 WeakPolarHBondContact O-CB 3.48Å; L799-L802 PolarHBondContact O-N 2.83Å; L799-V803 PolarHBondContact O-N 2.68Å; L799-V803 VanDerWaalsContact O-N 3.11Å; L799-F821 HydrophobicContact CD1-CD1 4.38Å; L799-F821 HydrophobicContact CD1-CE1 3.99Å; L799-F821 HydrophobicContact CD1-CZ 4.4Å; L799-F821 HydrophobicContact CD2-CE1 4.31Å; L799-L828 HydrophobicContact CD1-CD2 3.87Å; L799-E831 WeakPolarHBondContact CB-OE2 3.31Å; L799-E831 HydrophobicContact CD1-CB 3.99Å; L799-E831 HydrophobicContact CD1-CG 3.83Å; L799-E831 HydrophobicContact CG-CG 4.12Å; L799-E831 PolarHBondContact N-OE2 2.91Å; L799-L835 HydrophobicContact CB-CD1 4.1Å; L799-L835 HydrophobicContact CB-CD2 4.25Å; L799-L835 HydrophobicContact CD1-CD1 4.3Å; L799-L868 HydrophobicContact CD2-CD1 4.09Å
800	R	94.5	Very high	92	Very high	14 Å²	14	20.4 Å²	20.4	5%	0.053	13%	0.127	C	C	.	.	H	α-helix	trans	-46	-39.6	167.4	177	172	65.5	-167.3	-4.9	112.3	G798 L802 V803 M804 L835 F838 N1022	G798-R800 PolarHBondContact O-N 2.73Å; R800-L802 VanDerWaalsContact C-N 3.31Å; R800-L802 PolarHBondContact O-N 2.71Å; R800-V803 PolarHBondContact O-N 3.5Å; R800-M804 HydrophobicContact CG-CE 3.72Å; R800-M804 WeakPolarHBondContact O-CB 3.35Å; R800-M804 PolarHBondContact O-N 2.71Å; R800-L835 HydrophobicContact CB-CD2 4.45Å; R800-F838 HydrophobicContact CG-CE2 4.43Å; R800-N1022 PolarHBondContact NH1-O 3.36Å; R800-N1022 PolarHBondContact NH1-OD1 3.3Å; R800-N1022 PolarHBondContact NH2-OD1 2.98Å
801	N	95.1	Very high	92.1	Very high	11 Å²	11	21.2 Å²	21.2	6%	0.059	13%	0.129	C	C	.	.	H	α-helix	trans	-73.1	-21.8	-177.6	-58.3	-22.2	0	0	0	113.2	L556 G798 L799 P805	L556-N801 HydrophobicContact CB-CB 4Å; L556-N801 HydrophobicContact CD1-CB 3.99Å; G798-N801 WeakPolarHBondContact O-CB 3.39Å; G798-N801 PolarHBondContact O-N 3.04Å; L799-N801 PolarHBondContact O-N 3.23Å; L799-N801 VanDerWaalsContact O-N 3.16Å; N801-P805 WeakPolarHBondContact O-CD 3.46Å; N801-P805 WeakPolarHBondContact O-CG 3.42Å
802	L	96.9	Very high	92.3	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.005	12%	0.115	C	C	.	.	H	α-helix	trans	-81.7	-41	171.9	-175.6	72.7	0	0	0	111.3	L556 I559 A560 V786 L799 R800 L868	L556-L802 HydrophobicContact CB-CB 4.15Å; L556-L802 WeakPolarHBondContact O-CD1 3.17Å; I559-L802 HydrophobicContact CB-CD1 4.27Å; I559-L802 HydrophobicContact CG2-CD1 3.79Å; A560-L802 HydrophobicContact CB-CD1 4.11Å; A560-L802 WeakPolarHBondContact CB-O 3.36Å; V786-L802 HydrophobicContact CB-CD2 4.47Å; V786-L802 HydrophobicContact CG1-CD2 3.79Å; V786-L802 HydrophobicContact CG2-CD2 3.81Å; L799-L802 WeakPolarHBondContact O-CB 3.48Å; L799-L802 PolarHBondContact O-N 2.83Å; R800-L802 VanDerWaalsContact C-N 3.31Å; R800-L802 PolarHBondContact O-N 2.71Å; L802-L868 HydrophobicContact CD2-CD1 4.32Å
803	V	96.8	Very high	92.5	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-78.2	-37.9	-175.5	179.1	0	0	0	0	112.2	L799 R800 L806 R807 I819 F821 L835 F838 V841	L799-V803 PolarHBondContact O-N 2.68Å; L799-V803 VanDerWaalsContact O-N 3.11Å; R800-V803 PolarHBondContact O-N 3.5Å; V803-L806 CarbonylContact O-C 3.05Å; V803-L806 PolarHBondContact O-N 3.27Å; V803-R807 HydrophobicContact CG1-CG 3.9Å; V803-R807 VanDerWaalsContact O-CG 3.3Å; V803-R807 WeakPolarHBondContact O-CG 3.47Å; V803-R807 PolarHBondContact O-N 2.89Å; V803-R807 VanDerWaalsContact O-N 3.14Å; V803-I819 HydrophobicContact CB-CD1 4.44Å; V803-I819 HydrophobicContact CG1-CD1 4.12Å; V803-I819 HydrophobicContact CG2-CD1 4.13Å; V803-F821 HydrophobicContact CG2-CE2 4.31Å; V803-F821 HydrophobicContact CG2-CZ 3.73Å; V803-L835 HydrophobicContact CB-CD2 4.25Å; V803-L835 HydrophobicContact CG2-CD2 3.92Å; V803-F838 HydrophobicContact CB-CD2 4.25Å; V803-F838 HydrophobicContact CB-CE2 4.43Å; V803-F838 HydrophobicContact CG1-CB 3.81Å; V803-F838 HydrophobicContact CG1-CD1 4.1Å; V803-F838 HydrophobicContact CG1-CD2 3.56Å; V803-F838 HydrophobicContact CG1-CE2 4.13Å; V803-F838 HydrophobicContact CG1-CG 3.55Å; V803-V841 HydrophobicContact CG1-CG2 4.42Å
804	M	94.1	Very high	92.6	Very high	9 Å²	9	21.8 Å²	21.8	4%	0.044	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-48.9	-175.4	-174.7	-179.6	-55.3	0	0	112.8	F757 R800 L806 R807 A808 F838 L1014 I1018	F757-M804 HydrophobicContact CD1-CG 3.58Å; F757-M804 WeakPolarHBondContact CD1-O 3.47Å; F757-M804 HydrophobicContact CD2-CG 4.17Å; F757-M804 HydrophobicContact CD2-SD 4.33Å; F757-M804 HydrophobicContact CE1-CB 4.49Å; F757-M804 HydrophobicContact CE1-CG 3.38Å; F757-M804 WeakPolarHBondContact CE1-O 3.49Å; F757-M804 HydrophobicContact CE1-SD 4.31Å; F757-M804 HydrophobicContact CE2-CG 3.98Å; F757-M804 HydrophobicContact CE2-SD 3.91Å; F757-M804 HydrophobicContact CG-CG 3.99Å; F757-M804 HydrophobicContact CZ-CG 3.59Å; F757-M804 HydrophobicContact CZ-SD 3.9Å; R800-M804 HydrophobicContact CG-CE 3.72Å; R800-M804 WeakPolarHBondContact O-CB 3.35Å; R800-M804 PolarHBondContact O-N 2.71Å; M804-L806 VanDerWaalsContact C-N 3.33Å; M804-L806 PolarHBondContact O-N 3.33Å; M804-R807 CarbonylContact O-C 3.56Å; M804-R807 WeakPolarHBondContact O-CA 3.37Å; M804-R807 PolarHBondContact O-N 2.94Å; M804-A808 PolarHBondContact O-N 2.85Å; M804-F838 HydrophobicContact CB-CZ 4.08Å; M804-F838 HydrophobicContact CG-CZ 4.46Å; M804-L1014 HydrophobicContact SD-CD2 4.41Å; M804-I1018 HydrophobicContact CE-CD1 4.35Å
805	P	95.4	Very high	92.8	Very high	3 Å²	3	24.7 Å²	24.7	2%	0.019	12%	0.12	C	C	.	.	G	3₁₀ helix	trans	-64.5	-36.1	177.8	-18.8	32.3	0	0	0	112.8	A560 N801 R807 A808 V1006	A560-P805 HydrophobicContact CB-CB 3.97Å; A560-P805 HydrophobicContact CB-CG 4Å; N801-P805 WeakPolarHBondContact O-CD 3.46Å; N801-P805 WeakPolarHBondContact O-CG 3.42Å; P805-R807 PolarHBondContact O-N 2.88Å; P805-R807 VanDerWaalsContact O-N 3.16Å; P805-A808 WeakPolarHBondContact O-CB 3.37Å; P805-A808 PolarHBondContact O-N 3.49Å; P805-V1006 WeakPolarHBondContact CB-O 3.13Å
806	L	95.8	Very high	93.2	Very high	5 Å²	5	23.8 Å²	23.8	3%	0.026	11%	0.112	C	C	.	.	G	3₁₀ helix	trans	-70.5	-2.4	173.9	-65.7	177.8	0	0	0	113.7	A560 C563 L564 V803 M804 I819	A560-L806 HydrophobicContact CB-CG 4.15Å; A560-L806 WeakPolarHBondContact O-CD2 3.29Å; C563-L806 HydrophobicContact CB-CD1 4.49Å; C563-L806 HydrophobicContact CB-CD2 4.11Å; L564-L806 HydrophobicContact CD1-CD2 4.36Å; L564-L806 HydrophobicContact CD2-CD2 3.79Å; L564-L806 HydrophobicContact CG-CD2 3.84Å; V803-L806 CarbonylContact O-C 3.05Å; V803-L806 PolarHBondContact O-N 3.27Å; M804-L806 VanDerWaalsContact C-N 3.33Å; M804-L806 PolarHBondContact O-N 3.33Å; L806-I819 HydrophobicContact CB-CD1 4.1Å; L806-I819 HydrophobicContact CD1-CD1 3.77Å; L806-I819 HydrophobicContact CD1-CG1 4.34Å
807	R	95.6	Very high	93.5	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.107	C	C	.	.	G	3₁₀ helix	trans	-124.3	17.5	177.2	-62.5	-64.9	177.1	-96.7	4.5	112.3	F757 H758 V803 M804 P805 K817 F838 P839 K840	F757-R807 WeakPolarHBondContact CA-O 3.31Å; H758-R807 PolarHBondContact CD2-O 3.45Å; H758-R807 PolarHBondContact N-O 3.17Å; V803-R807 HydrophobicContact CG1-CG 3.9Å; V803-R807 VanDerWaalsContact O-CG 3.3Å; V803-R807 WeakPolarHBondContact O-CG 3.47Å; V803-R807 PolarHBondContact O-N 2.89Å; V803-R807 VanDerWaalsContact O-N 3.14Å; M804-R807 CarbonylContact O-C 3.56Å; M804-R807 WeakPolarHBondContact O-CA 3.37Å; M804-R807 PolarHBondContact O-N 2.94Å; P805-R807 PolarHBondContact O-N 2.88Å; P805-R807 VanDerWaalsContact O-N 3.16Å; R807-K817 VanDerWaalsContact CZ-O 3.28Å; R807-K817 PolarHBondContact NH1-O 3.36Å; R807-K817 PolarHBondContact NH2-O 2.87Å; R807-F838 HydrophobicContact CB-CD1 3.84Å; R807-F838 HydrophobicContact CB-CE1 4.16Å; R807-F838 HydrophobicContact CG-CB 4.38Å; R807-F838 HydrophobicContact CG-CD1 3.81Å; R807-F838 HydrophobicContact CG-CE1 4.5Å; R807-F838 HydrophobicContact CG-CG 4.34Å; R807-P839 PolarHBondContact NE-O 3.34Å; R807-P839 PolarHBondContact NH2-O 2.92Å; R807-K840 PolarHBondContact NH2-O 3.4Å
808	A	93.9	Very high	93.8	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.008	12%	0.115	C	C	.	.	B	Isolated β-bridge	trans	-59.9	144.8	174.1	0	0	0	0	0	112.3	F757 H758 M804 P805 N810 F811	F757-A808 HydrophobicContact CD1-CB 4.25Å; F757-A808 HydrophobicContact CE1-CB 4.02Å; H758-A808 PolarHBondContact CD2-O 3.22Å; M804-A808 PolarHBondContact O-N 2.85Å; P805-A808 WeakPolarHBondContact O-CB 3.37Å; P805-A808 PolarHBondContact O-N 3.49Å; A808-N810 WeakPolarHBondContact CB-OD1 3.45Å; A808-N810 PolarHBondContact O-N 3.27Å; A808-F811 PolarHBondContact O-N 3.46Å
809	S	92.3	Very high	94.1	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-6.5	-171.5	63.2	0	0	0	0	115.2	G755 M756 F811 R1037 R1039	G755-S809 WeakPolarHBondContact O-CB 3.47Å; G755-S809 PolarHBondContact O-OG 3.44Å; M756-S809 VanDerWaalsContact C-OG 3.26Å; M756-S809 WeakPolarHBondContact CA-OG 3.22Å; M756-S809 WeakPolarHBondContact O-CB 3.35Å; M756-S809 PolarHBondContact O-N 2.81Å; M756-S809 PolarHBondContact O-OG 2.77Å; M756-S809 VanDerWaalsContact O-OG 3.06Å; S809-F811 PolarHBondContact O-N 2.96Å; S809-R1037 PolarHBondContact O-NE 3.22Å; S809-R1037 PolarHBondContact O-NH2 3.24Å; S809-R1039 PolarHBondContact OG-NH2 2.93Å
810	N	90.2	Very high	94.2	Very high	9 Å²	9	24.2 Å²	24.2	5%	0.048	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	1.1	169.7	62.7	-13.4	0	0	0	113.6	A808 R1039 C1040 F1120	A808-N810 WeakPolarHBondContact CB-OD1 3.45Å; A808-N810 PolarHBondContact O-N 3.27Å; N810-R1039 WeakPolarHBondContact CB-O 3.15Å; N810-C1040 PolarHBondContact ND2-O 3.05Å; N810-F1120 VanDerWaalsContact O-CD2 3.29Å; N810-F1120 WeakPolarHBondContact O-CD2 3.36Å
811	F	91.4	Very high	94.4	Very high	23 Å²	23	23.6 Å²	23.6	10%	0.101	11%	0.106	C	C	.	.	S	Bend	trans	-105.5	145.9	164.3	-66.4	-78.8	0	0	0	111.1	L564 H758 A808 S809 E815 L816 R1041	L564-F811 HydrophobicContact CD1-CE2 3.97Å; L564-F811 HydrophobicContact CD1-CZ 3.77Å; L564-F811 HydrophobicContact CD2-CE1 4.33Å; L564-F811 HydrophobicContact CD2-CE2 4.3Å; L564-F811 HydrophobicContact CD2-CZ 3.8Å; L564-F811 HydrophobicContact CG-CZ 4.37Å; H758-F811 PolarHBondContact CE1-O 2.85Å; H758-F811 PolarHBondContact NE2-O 3.21Å; A808-F811 PolarHBondContact O-N 3.46Å; S809-F811 PolarHBondContact O-N 2.96Å; F811-E815 HydrophobicContact CD1-CB 4.44Å; F811-L816 HydrophobicContact CB-CD2 3.78Å; F811-R1041 HydrophobicContact CE1-CB 4.36Å; F811-R1041 HydrophobicContact CZ-CB 4.03Å
812	H	91.3	Very high	94.5	Very high	26 Å²	26	23 Å²	23	12%	0.12	10%	0.103	C	C	.	.			trans	-73.7	151.5	166.6	-63.4	88.3	0	0	0	110.6	H814 E815 L816 F1120 D1121	H812-H814 AromaticContact CG-CE1 3.96Å; H812-H814 PolarHBondContact O-N 3.28Å; H812-H814 VanDerWaalsContact O-N 3.09Å; H812-E815 HydrophobicContact CB-CG 4.07Å; H812-E815 WeakPolarHBondContact CB-OE2 3.02Å; H812-E815 IonicContact CG-OE2 2.87Å; H812-E815 PolarHBondContact N-OE2 2.97Å; H812-E815 IonicContact ND1-OE2 3.84Å; H812-E815 PolarHBondContact ND1-OE2 3.11Å; H812-E815 WeakPolarHBondContact O-CB 3.37Å; H812-E815 PolarHBondContact O-N 3.49Å; H812-L816 PolarHBondContact O-N 3.4Å; H812-F1120 AromaticContact CE1-CE2 3.34Å; H812-F1120 WeakPolarHBondContact CE1-CE2 3.31Å; H812-F1120 AromaticContact CE1-CZ 3.61Å; H812-F1120 AromaticContact ND1-CE2 3.8Å; H812-F1120 AromaticContact NE2-CE2 3.65Å; H812-F1120 AromaticContact NE2-CZ 3.43Å; H812-F1120 WeakPolarHBondContact NE2-CZ 3.27Å; H812-D1121 PolarHBondContact CE1-O 3.4Å; H812-D1121 VanDerWaalsContact CE1-O 3.3Å; H812-D1121 PolarHBondContact NE2-O 3.4Å
813	Y	91.2	Very high	94.4	Very high	133 Å²	133	23 Å²	23	52%	0.522	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-30.6	-178.1	-169.5	-93.3	0	0	0	113.6	H758 L816 P839 K840	H758-Y813 AromaticContact ND1-CD2 3.85Å; Y813-L816 HydrophobicContact CD2-CD1 3.98Å; Y813-L816 HydrophobicContact CE2-CD1 4.43Å; Y813-P839 HydrophobicContact CE2-CB 3.66Å; Y813-P839 HydrophobicContact CE2-CG 4.01Å; Y813-K840 WeakPolarHBondContact O-CE 3.36Å; Y813-K840 PolarHBondContact O-NZ 2.95Å
814	H	89.8	Confident	94.4	Very high	117 Å²	117	24.5 Å²	24.5	54%	0.542	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-31.7	175.7	64.1	-98.6	0	0	0	112.9	H812 L816 K840	H812-H814 AromaticContact CG-CE1 3.96Å; H812-H814 PolarHBondContact O-N 3.28Å; H812-H814 VanDerWaalsContact O-N 3.09Å; H814-L816 VanDerWaalsContact C-N 3.32Å; H814-L816 PolarHBondContact O-N 3.41Å; H814-K840 PolarHBondContact O-NZ 2.98Å
815	E	91.3	Very high	94.4	Very high	63 Å²	63	25.9 Å²	25.9	29%	0.294	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-18.4	176.1	-61.7	174.4	125.1	0	0	113.1	F811 H812 K817 R1041	F811-E815 HydrophobicContact CD1-CB 4.44Å; H812-E815 HydrophobicContact CB-CG 4.07Å; H812-E815 WeakPolarHBondContact CB-OE2 3.02Å; H812-E815 IonicContact CG-OE2 2.87Å; H812-E815 PolarHBondContact N-OE2 2.97Å; H812-E815 IonicContact ND1-OE2 3.84Å; H812-E815 PolarHBondContact ND1-OE2 3.11Å; H812-E815 WeakPolarHBondContact O-CB 3.37Å; H812-E815 PolarHBondContact O-N 3.49Å; E815-K817 PolarHBondContact O-N 3.49Å; E815-K817 VanDerWaalsContact O-N 3.1Å; E815-R1041 IonicContact OE1-CZ 3.18Å; E815-R1041 VanDerWaalsContact OE1-CZ 3.3Å; E815-R1041 IonicContact OE1-NH1 3.74Å; E815-R1041 PolarHBondContact OE1-NH1 3.03Å; E815-R1041 IonicContact OE1-NH2 3.68Å; E815-R1041 PolarHBondContact OE1-NH2 3.5Å; E815-R1041 IonicContact OE2-CZ 2.69Å; E815-R1041 IonicContact OE2-NH1 2.75Å; E815-R1041 PolarHBondContact OE2-NH1 2.91Å; E815-R1041 IonicContact OE2-NH2 3.21Å
816	L	94.4	Very high	94.4	Very high	6 Å²	6	31.2 Å²	31.2	3%	0.031	15%	0.145	C	C	.	.	S	Bend	trans	-59.9	114.3	178.3	-65	179.6	0	0	0	111.6	H758 F811 H812 Y813 H814 H818 P839 K840	H758-L816 HydrophobicContact CB-CD1 4.28Å; F811-L816 HydrophobicContact CB-CD2 3.78Å; H812-L816 PolarHBondContact O-N 3.4Å; Y813-L816 HydrophobicContact CD2-CD1 3.98Å; Y813-L816 HydrophobicContact CE2-CD1 4.43Å; H814-L816 VanDerWaalsContact C-N 3.32Å; H814-L816 PolarHBondContact O-N 3.41Å; L816-H818 PolarHBondContact O-N 3.11Å; L816-P839 HydrophobicContact CD1-CG 4.16Å; L816-K840 HydrophobicContact CB-CD 4.18Å; L816-K840 VanDerWaalsContact O-CD 3.31Å; L816-K840 WeakPolarHBondContact O-CD 3.5Å; L816-K840 PolarHBondContact O-NZ 3.46Å
817	K	95.1	Very high	94.3	Very high	38 Å²	38	31 Å²	31	17%	0.165	14%	0.144	C	C	.	.			trans	-60.9	129.3	173.1	-53.5	-168.5	-176	-161.6	0	110.3	C563 V784 R807 E815 D863	C563-K817 PolarHBondContact O-NZ 2.85Å; V784-K817 HydrophobicContact CG2-CB 4.14Å; V784-K817 HydrophobicContact CG2-CD 4.06Å; R807-K817 VanDerWaalsContact CZ-O 3.28Å; R807-K817 PolarHBondContact NH1-O 3.36Å; R807-K817 PolarHBondContact NH2-O 2.87Å; E815-K817 PolarHBondContact O-N 3.49Å; E815-K817 VanDerWaalsContact O-N 3.1Å; K817-D863 HydrophobicContact CD-CB 4.22Å; K817-D863 WeakPolarHBondContact CD-OD2 3.07Å; K817-D863 WeakPolarHBondContact CE-OD2 3.41Å; K817-D863 IonicContact NZ-OD2 3.36Å; K817-D863 PolarHBondContact NZ-OD2 3.47Å
818	H	97.1	Very high	94.3	Very high	48 Å²	48	31.1 Å²	31.1	22%	0.222	14%	0.144	C	C	.	.			trans	-67.5	139.9	174.8	-159.7	107	0	0	0	109.4	H783 V784 L816 K840 S842	H783-H818 HydrophobicContact CB-CB 4.19Å; H783-H818 WeakPolarHBondContact CB-O 3.21Å; V784-H818 PolarHBondContact N-O 3.06Å; L816-H818 PolarHBondContact O-N 3.11Å; H818-K840 HydrophobicContact CB-CB 4.42Å; H818-S842 PolarHBondContact NE2-OG 3.49Å
819	I	98.3	Very high	94.4	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	127.2	179.8	-63.7	168.6	0	0	0	108.6	V784 V786 V803 L806 F821 K840 V841 S842	V784-I819 HydrophobicContact CB-CG1 4.38Å; V784-I819 WeakPolarHBondContact O-CA 3.32Å; V786-I819 HydrophobicContact CG2-CG2 4.01Å; V803-I819 HydrophobicContact CB-CD1 4.44Å; V803-I819 HydrophobicContact CG1-CD1 4.12Å; V803-I819 HydrophobicContact CG2-CD1 4.13Å; L806-I819 HydrophobicContact CB-CD1 4.1Å; L806-I819 HydrophobicContact CD1-CD1 3.77Å; L806-I819 HydrophobicContact CD1-CG1 4.34Å; I819-F821 HydrophobicContact CG2-CD2 4.34Å; I819-F821 HydrophobicContact CG2-CE1 4.39Å; I819-F821 HydrophobicContact CG2-CE2 3.93Å; I819-F821 HydrophobicContact CG2-CZ 3.96Å; I819-K840 PolarHBondContact N-O 3.25Å; I819-V841 WeakPolarHBondContact O-CA 3.48Å; I819-S842 PolarHBondContact O-N 2.86Å
820	V	97.8	Very high	94.4	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.006	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	115.4	174.8	-172.5	0	0	0	0	109.6	L780 V784 V786 V822 S842 L844 V857	L780-V820 HydrophobicContact CD1-CG2 3.76Å; V784-V820 PolarHBondContact O-N 2.95Å; V786-V820 PolarHBondContact N-O 2.87Å; V820-V822 HydrophobicContact CG1-CG2 4.43Å; V820-S842 WeakPolarHBondContact CA-O 3.39Å; V820-L844 HydrophobicContact CG1-CB 4.38Å; V820-V857 HydrophobicContact CG1-CG1 3.9Å
821	F	98.1	Very high	94.6	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	130.1	172.1	-66.8	-73.2	0	0	0	110.3	V786 I788 L799 V803 I819 L828 L835 V841 S842 I843 L844	V786-F821 HydrophobicContact CB-CD1 3.64Å; V786-F821 HydrophobicContact CB-CE1 3.86Å; V786-F821 HydrophobicContact CG1-CD1 3.89Å; V786-F821 HydrophobicContact CG1-CE1 3.88Å; V786-F821 HydrophobicContact CG2-CD1 4.28Å; V786-F821 HydrophobicContact CG2-CE1 4.1Å; V786-F821 WeakPolarHBondContact O-CA 3.45Å; I788-F821 HydrophobicContact CD1-CD1 3.53Å; I788-F821 HydrophobicContact CD1-CE1 4.03Å; I788-F821 HydrophobicContact CD1-CG 4.49Å; L799-F821 HydrophobicContact CD1-CD1 4.38Å; L799-F821 HydrophobicContact CD1-CE1 3.99Å; L799-F821 HydrophobicContact CD1-CZ 4.4Å; L799-F821 HydrophobicContact CD2-CE1 4.31Å; V803-F821 HydrophobicContact CG2-CE2 4.31Å; V803-F821 HydrophobicContact CG2-CZ 3.73Å; I819-F821 HydrophobicContact CG2-CD2 4.34Å; I819-F821 HydrophobicContact CG2-CE1 4.39Å; I819-F821 HydrophobicContact CG2-CE2 3.93Å; I819-F821 HydrophobicContact CG2-CZ 3.96Å; F821-L828 HydrophobicContact CB-CD1 3.96Å; F821-L828 HydrophobicContact CB-CD2 4.19Å; F821-L828 HydrophobicContact CG-CD2 4.29Å; F821-L835 HydrophobicContact CE2-CD1 4.01Å; F821-L835 HydrophobicContact CZ-CD1 4.18Å; F821-V841 HydrophobicContact CD2-CG1 3.89Å; F821-V841 HydrophobicContact CE2-CG1 3.64Å; F821-S842 PolarHBondContact N-O 3.01Å; F821-I843 HydrophobicContact CB-CG1 4.39Å; F821-I843 HydrophobicContact CD2-CG1 4.47Å; F821-L844 PolarHBondContact O-N 2.98Å
822	V	97.6	Very high	94.8	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	112.5	176	-175.9	0	0	0	0	108.3	V785 V786 I788 V820 L844 D853 V857	V785-V822 HydrophobicContact CG1-CG2 3.91Å; V786-V822 PolarHBondContact O-N 3.35Å; I788-V822 PolarHBondContact N-O 2.85Å; V820-V822 HydrophobicContact CG1-CG2 4.43Å; V822-L844 HydrophobicContact CG2-CB 4.37Å; V822-L844 HydrophobicContact CG2-CD2 4.49Å; V822-D853 HydrophobicContact CG1-CB 4.48Å; V822-V857 HydrophobicContact CG2-CG1 4.22Å
823	G	95.7	Very high	94.8	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.1	-168.8	-176.4	0	0	0	0	0	113.5	I825 G846	G823-I825 PolarHBondContact O-N 3.05Å; G823-G846 CarbonylContact C-O 3.56Å; G823-G846 WeakPolarHBondContact CA-O 3.27Å; G823-G846 PolarHBondContact O-N 3.49Å; G823-G846 VanDerWaalsContact O-O 3.1Å
824	S	95.6	Very high	94.8	Very high	31 Å²	31	40.9 Å²	40.9	22%	0.217	19%	0.191	C	C	.	.			trans	-64.6	128	178.9	-178	0	0	0	0	111.6	G790 E826 Y827 L828	G790-S824 VanDerWaalsContact O-CB 3.26Å; G790-S824 WeakPolarHBondContact O-CB 3.41Å; S824-E826 PolarHBondContact O-N 3.14Å; S824-E826 PolarHBondContact OG-N 3.27Å; S824-Y827 PolarHBondContact O-N 2.82Å; S824-L828 WeakPolarHBondContact O-CG 3.45Å; S824-L828 PolarHBondContact O-N 3.18Å; S824-L828 VanDerWaalsContact O-N 3.14Å
825	I	95.1	Very high	95.1	Very high	39 Å²	39	35.4 Å²	35.4	20%	0.2	17%	0.166	C	C	.	.	H	α-helix	trans	-66.2	-26.8	175.1	-170.2	55.9	0	0	0	112.3	I765 I769 G823 L828 K829 I843 P845	I765-I825 HydrophobicContact CD1-CD1 3.97Å; I769-I825 HydrophobicContact CD1-CD1 3.76Å; I769-I825 HydrophobicContact CD1-CG1 4.43Å; I769-I825 HydrophobicContact CG1-CD1 4.14Å; G823-I825 PolarHBondContact O-N 3.05Å; I825-L828 PolarHBondContact O-N 3.26Å; I825-K829 HydrophobicContact CD1-CG 4.48Å; I825-K829 HydrophobicContact CG1-CD 4.35Å; I825-K829 HydrophobicContact CG1-CG 4.42Å; I825-K829 WeakPolarHBondContact O-CB 3.34Å; I825-K829 VanDerWaalsContact O-CG 3.26Å; I825-K829 WeakPolarHBondContact O-CG 3.32Å; I825-K829 PolarHBondContact O-N 2.98Å; I825-I843 HydrophobicContact CD1-CG2 4.08Å; I825-P845 HydrophobicContact CB-CB 4.02Å
826	E	94.3	Very high	95.3	Very high	114 Å²	114	34.7 Å²	34.7	53%	0.533	16%	0.163	S	C	.	.	H	α-helix	trans	-71.9	-36.7	-177.9	-52.6	-178.7	149.8	0	0	111.1	V792 S824	V792-E826 HydrophobicContact CG2-CB 3.84Å; V792-E826 WeakPolarHBondContact CG2-OE2 3.49Å; S824-E826 PolarHBondContact O-N 3.14Å; S824-E826 PolarHBondContact OG-N 3.27Å
827	Y	94.9	Very high	95.3	Very high	1 Å²	1	35.2 Å²	35.2	0%	0.004	17%	0.166	C	C	.	.	H	α-helix	trans	-67.1	-53	169.4	-176.6	-97.9	0	0	0	111.4	I788 S794 A795 I797 S824 K829 R830 E831 A870	I788-Y827 HydrophobicContact CG2-CD1 3.9Å; I788-Y827 HydrophobicContact CG2-CE1 3.84Å; S794-Y827 WeakPolarHBondContact OG-CD2 3.29Å; S794-Y827 WeakPolarHBondContact OG-CE2 3.18Å; A795-Y827 WeakPolarHBondContact O-CE2 3.21Å; A795-Y827 PolarHBondContact O-OH 3.39Å; A795-Y827 VanDerWaalsContact O-OH 3.12Å; I797-Y827 WeakPolarHBondContact CB-OH 3.18Å; I797-Y827 WeakPolarHBondContact CG1-OH 3.35Å; I797-Y827 PolarHBondContact N-OH 2.99Å; S824-Y827 PolarHBondContact O-N 2.82Å; Y827-K829 PolarHBondContact O-N 2.74Å; Y827-R830 WeakPolarHBondContact O-CB 3.29Å; Y827-R830 PolarHBondContact O-N 2.8Å; Y827-E831 HydrophobicContact CE1-CG 3.91Å; Y827-E831 PolarHBondContact O-N 3.42Å; Y827-A870 HydrophobicContact CE2-CB 3.71Å
828	L	95.4	Very high	95.3	Very high	2 Å²	2	33.6 Å²	33.6	1%	0.01	16%	0.159	C	C	.	.	H	α-helix	trans	-62.6	-27.9	-175.7	-71.7	171.9	0	0	0	113.4	I788 L799 F821 S824 I825 R830 E831 W832 I843	I788-L828 HydrophobicContact CD1-CD2 4Å; L799-L828 HydrophobicContact CD1-CD2 3.87Å; F821-L828 HydrophobicContact CB-CD1 3.96Å; F821-L828 HydrophobicContact CB-CD2 4.19Å; F821-L828 HydrophobicContact CG-CD2 4.29Å; S824-L828 WeakPolarHBondContact O-CG 3.45Å; S824-L828 PolarHBondContact O-N 3.18Å; S824-L828 VanDerWaalsContact O-N 3.14Å; I825-L828 PolarHBondContact O-N 3.26Å; L828-R830 VanDerWaalsContact C-N 3.27Å; L828-R830 PolarHBondContact O-N 3.34Å; L828-E831 PolarHBondContact O-N 3.46Å; L828-W832 WeakPolarHBondContact O-CB 3.16Å; L828-W832 PolarHBondContact O-N 2.82Å; L828-I843 HydrophobicContact CB-CD1 4.37Å; L828-I843 HydrophobicContact CD1-CD1 4.5Å; L828-I843 HydrophobicContact CD1-CG1 4.39Å; L828-I843 HydrophobicContact CD1-CG2 3.6Å
829	K	95.1	Very high	95.2	Very high	108 Å²	108	31.4 Å²	31.4	47%	0.47	15%	0.149	S	C	.	.	H	α-helix	trans	-59.1	-34.5	172.2	-85.2	172.6	174.8	179.5	0	113.3	I765 I825 Y827	I765-K829 HydrophobicContact CD1-CB 4.49Å; I765-K829 HydrophobicContact CD1-CG 3.68Å; I825-K829 HydrophobicContact CD1-CG 4.48Å; I825-K829 HydrophobicContact CG1-CD 4.35Å; I825-K829 HydrophobicContact CG1-CG 4.42Å; I825-K829 WeakPolarHBondContact O-CB 3.34Å; I825-K829 VanDerWaalsContact O-CG 3.26Å; I825-K829 WeakPolarHBondContact O-CG 3.32Å; I825-K829 PolarHBondContact O-N 2.98Å; Y827-K829 PolarHBondContact O-N 2.74Å
830	R	93.3	Very high	95.1	Very high	82 Å²	82	33.6 Å²	33.6	31%	0.309	16%	0.158	S	C	.	.	H	α-helix	trans	-75	-39.5	177.5	-63.1	161.4	57.1	-151.6	-4.2	112	D791 V792 S794 L796 Y827 L828	D791-R830 PolarHBondContact O-NH1 3.22Å; V792-R830 PolarHBondContact O-NH1 3.44Å; S794-R830 PolarHBondContact O-NH1 3.05Å; S794-R830 PolarHBondContact O-NH2 2.85Å; L796-R830 HydrophobicContact CD2-CB 3.92Å; Y827-R830 WeakPolarHBondContact O-CB 3.29Å; Y827-R830 PolarHBondContact O-N 2.8Å; L828-R830 VanDerWaalsContact C-N 3.27Å; L828-R830 PolarHBondContact O-N 3.34Å
831	E	93.8	Very high	95	Very high	4 Å²	4	33.9 Å²	33.9	2%	0.019	16%	0.16	C	C	.	.	H	α-helix	trans	-73.8	-27.5	177.4	-75.4	-82.4	169.6	0	0	113	L796 I797 G798 L799 Y827 L828 E833 T834 L835	L796-E831 HydrophobicContact CD2-CG 4.11Å; I797-E831 PolarHBondContact N-OE1 3.31Å; G798-E831 PolarHBondContact N-OE1 3.1Å; L799-E831 WeakPolarHBondContact CB-OE2 3.31Å; L799-E831 HydrophobicContact CD1-CB 3.99Å; L799-E831 HydrophobicContact CD1-CG 3.83Å; L799-E831 HydrophobicContact CG-CG 4.12Å; L799-E831 PolarHBondContact N-OE2 2.91Å; Y827-E831 HydrophobicContact CE1-CG 3.91Å; Y827-E831 PolarHBondContact O-N 3.42Å; L828-E831 PolarHBondContact O-N 3.46Å; E831-E833 PolarHBondContact O-N 3.24Å; E831-E833 VanDerWaalsContact O-N 3.12Å; E831-T834 PolarHBondContact O-N 3.06Å; E831-T834 PolarHBondContact O-OG1 3.39Å; E831-L835 HydrophobicContact CB-CD1 4.47Å
832	W	95.4	Very high	95	Very high	17 Å²	17	34.5 Å²	34.5	6%	0.064	16%	0.164	C	C	.	.	H	α-helix	trans	-58.7	-29.5	-171	-169.5	-110.6	0	0	0	114.4	K763 I765 V768 L828 T834 L835 H836 V841 I843	K763-W832 HydrophobicContact CB-CZ2 4.39Å; K763-W832 PolarHBondContact O-NE1 2.76Å; I765-W832 HydrophobicContact CB-CD2 4.49Å; I765-W832 HydrophobicContact CB-CG 4.12Å; I765-W832 HydrophobicContact CD1-CB 4.02Å; I765-W832 HydrophobicContact CD1-CD2 4.46Å; I765-W832 HydrophobicContact CD1-CG 3.97Å; I765-W832 HydrophobicContact CG1-CB 4.49Å; I765-W832 HydrophobicContact CG1-CD2 4.06Å; I765-W832 HydrophobicContact CG1-CG 3.9Å; V768-W832 HydrophobicContact CB-CH2 4.11Å; V768-W832 HydrophobicContact CB-CZ2 4.31Å; V768-W832 HydrophobicContact CG1-CH2 3.84Å; V768-W832 HydrophobicContact CG1-CZ2 3.88Å; V768-W832 HydrophobicContact CG2-CH2 3.47Å; V768-W832 VanDerWaalsContact CG2-CH2 3.47Å; V768-W832 HydrophobicContact CG2-CZ2 3.51Å; V768-W832 HydrophobicContact CG2-CZ3 3.98Å; L828-W832 WeakPolarHBondContact O-CB 3.16Å; L828-W832 PolarHBondContact O-N 2.82Å; W832-T834 PolarHBondContact O-N 3.18Å; W832-T834 VanDerWaalsContact O-N 3.14Å; W832-L835 HydrophobicContact CD2-CB 4.5Å; W832-L835 HydrophobicContact CE3-CB 3.81Å; W832-L835 HydrophobicContact CE3-CD1 4.27Å; W832-L835 HydrophobicContact CZ3-CB 3.91Å; W832-L835 PolarHBondContact O-N 2.84Å; W832-H836 HydrophobicContact CZ2-CB 4.09Å; W832-H836 PolarHBondContact O-N 3.05Å; W832-V841 HydrophobicContact CH2-CB 4.41Å; W832-V841 HydrophobicContact CH2-CG1 4.11Å; W832-V841 HydrophobicContact CZ3-CG1 3.81Å; W832-I843 HydrophobicContact CD2-CD1 4.46Å; W832-I843 HydrophobicContact CE3-CD1 3.81Å; W832-I843 HydrophobicContact CZ3-CD1 4.07Å
833	E	91.3	Very high	95	Very high	148 Å²	148	34.5 Å²	34.5	69%	0.692	16%	0.164	S	C	*	.	H	α-helix	trans	-54.2	-29.4	174.3	-57.4	-175.5	-157.5	0	0	112.6	E831 H836	E831-E833 PolarHBondContact O-N 3.24Å; E831-E833 VanDerWaalsContact O-N 3.12Å; E833-H836 PolarHBondContact O-NE2 2.9Å
834	T	92.2	Very high	95.1	Very high	38 Å²	38	34.6 Å²	34.6	23%	0.233	17%	0.165	C	C	.	.	H	α-helix	trans	-95.4	-10.5	178.2	72.7	0	0	0	0	113.9	E831 W832	E831-T834 PolarHBondContact O-N 3.06Å; E831-T834 PolarHBondContact O-OG1 3.39Å; W832-T834 PolarHBondContact O-N 3.18Å; W832-T834 VanDerWaalsContact O-N 3.14Å
835	L	95.3	Very high	95.1	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.01	17%	0.17	C	C	.	.	H	α-helix	trans	-109.3	-21.4	-170.4	-63.4	-179.2	0	0	0	114.1	L799 R800 V803 F821 E831 W832 N837 F838	L799-L835 HydrophobicContact CB-CD1 4.1Å; L799-L835 HydrophobicContact CB-CD2 4.25Å; L799-L835 HydrophobicContact CD1-CD1 4.3Å; R800-L835 HydrophobicContact CB-CD2 4.45Å; V803-L835 HydrophobicContact CB-CD2 4.25Å; V803-L835 HydrophobicContact CG2-CD2 3.92Å; F821-L835 HydrophobicContact CE2-CD1 4.01Å; F821-L835 HydrophobicContact CZ-CD1 4.18Å; E831-L835 HydrophobicContact CB-CD1 4.47Å; W832-L835 HydrophobicContact CD2-CB 4.5Å; W832-L835 HydrophobicContact CE3-CB 3.81Å; W832-L835 HydrophobicContact CE3-CD1 4.27Å; W832-L835 HydrophobicContact CZ3-CB 3.91Å; W832-L835 PolarHBondContact O-N 2.84Å; L835-N837 PolarHBondContact O-N 2.92Å; L835-F838 HydrophobicContact CD2-CD2 4.4Å; L835-F838 WeakPolarHBondContact O-CD2 3.42Å; L835-F838 PolarHBondContact O-N 3.04Å
836	H	94.8	Very high	94.9	Very high	49 Å²	49	35.1 Å²	35.1	23%	0.227	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-8.5	-168.2	61.4	42.1	0	0	0	116.3	P762 K763 W832 E833	P762-H836 WeakPolarHBondContact CA-O 3.21Å; K763-H836 PolarHBondContact N-O 3.48Å; K763-H836 VanDerWaalsContact N-O 3.12Å; W832-H836 HydrophobicContact CZ2-CB 4.09Å; W832-H836 PolarHBondContact O-N 3.05Å; E833-H836 PolarHBondContact O-NE2 2.9Å
837	N	94.9	Very high	94.9	Very high	17 Å²	17	32.7 Å²	32.7	9%	0.091	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	1.4	175.3	-70.6	109.3	0	0	0	114.8	W759 C760 L835	W759-N837 PolarHBondContact NE1-ND2 3.3Å; C760-N837 PolarHBondContact N-O 3.18Å; C760-N837 PolarHBondContact O-ND2 2.78Å; C760-N837 VanDerWaalsContact SG-C 3.56Å; C760-N837 PolarHBondContact SG-O 2.78Å; L835-N837 PolarHBondContact O-N 2.92Å
838	F	95.9	Very high	95	Very high	4 Å²	4	32.8 Å²	32.8	2%	0.018	17%	0.169	C	C	.	.			trans	-95.1	137.8	179.8	-66.5	-66.9	0	0	0	113.4	R800 V803 M804 R807 L835 V841 L1024	R800-F838 HydrophobicContact CG-CE2 4.43Å; V803-F838 HydrophobicContact CB-CD2 4.25Å; V803-F838 HydrophobicContact CB-CE2 4.43Å; V803-F838 HydrophobicContact CG1-CB 3.81Å; V803-F838 HydrophobicContact CG1-CD1 4.1Å; V803-F838 HydrophobicContact CG1-CD2 3.56Å; V803-F838 HydrophobicContact CG1-CE2 4.13Å; V803-F838 HydrophobicContact CG1-CG 3.55Å; M804-F838 HydrophobicContact CB-CZ 4.08Å; M804-F838 HydrophobicContact CG-CZ 4.46Å; R807-F838 HydrophobicContact CB-CD1 3.84Å; R807-F838 HydrophobicContact CB-CE1 4.16Å; R807-F838 HydrophobicContact CG-CB 4.38Å; R807-F838 HydrophobicContact CG-CD1 3.81Å; R807-F838 HydrophobicContact CG-CE1 4.5Å; R807-F838 HydrophobicContact CG-CG 4.34Å; L835-F838 HydrophobicContact CD2-CD2 4.4Å; L835-F838 WeakPolarHBondContact O-CD2 3.42Å; L835-F838 PolarHBondContact O-N 3.04Å; F838-V841 HydrophobicContact CB-CG2 4.01Å; F838-L1024 HydrophobicContact CE1-CD2 4.24Å; F838-L1024 HydrophobicContact CZ-CD2 4.5Å
839	P	94.9	Very high	95	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.013	19%	0.187	C	C	.	.	S	Bend	trans	-76.1	160.4	174.4	31.6	-34.8	0	0	0	112.2	H758 R807 Y813 L816 V841	H758-P839 HydrophobicContact CB-CG 3.99Å; R807-P839 PolarHBondContact NE-O 3.34Å; R807-P839 PolarHBondContact NH2-O 2.92Å; Y813-P839 HydrophobicContact CE2-CB 3.66Å; Y813-P839 HydrophobicContact CE2-CG 4.01Å; L816-P839 HydrophobicContact CD1-CG 4.16Å; P839-V841 PolarHBondContact O-N 2.8Å
840	K	95.4	Very high	95.1	Very high	47 Å²	47	32.4 Å²	32.4	20%	0.204	17%	0.174	C	C	.	.	S	Bend	trans	49.6	52.8	177.8	-57.9	-171	-169.8	177.2	0	114.2	R807 Y813 H814 L816 H818 I819	R807-K840 PolarHBondContact NH2-O 3.4Å; Y813-K840 WeakPolarHBondContact O-CE 3.36Å; Y813-K840 PolarHBondContact O-NZ 2.95Å; H814-K840 PolarHBondContact O-NZ 2.98Å; L816-K840 HydrophobicContact CB-CD 4.18Å; L816-K840 VanDerWaalsContact O-CD 3.31Å; L816-K840 WeakPolarHBondContact O-CD 3.5Å; L816-K840 PolarHBondContact O-NZ 3.46Å; H818-K840 HydrophobicContact CB-CB 4.42Å; I819-K840 PolarHBondContact N-O 3.25Å
841	V	97	Very high	95.2	Very high	6 Å²	6	33.2 Å²	33.2	4%	0.036	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	135.3	172.9	-178.2	0	0	0	0	108.2	V768 V803 I819 F821 W832 F838 P839	V768-V841 WeakPolarHBondContact CG1-O 3.37Å; V803-V841 HydrophobicContact CG1-CG2 4.42Å; I819-V841 WeakPolarHBondContact O-CA 3.48Å; F821-V841 HydrophobicContact CD2-CG1 3.89Å; F821-V841 HydrophobicContact CE2-CG1 3.64Å; W832-V841 HydrophobicContact CH2-CB 4.41Å; W832-V841 HydrophobicContact CH2-CG1 4.11Å; W832-V841 HydrophobicContact CZ3-CG1 3.81Å; F838-V841 HydrophobicContact CB-CG2 4.01Å; P839-V841 PolarHBondContact O-N 2.8Å
842	S	96.9	Very high	95.2	Very high	13 Å²	13	35.1 Å²	35.1	9%	0.091	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	156.5	175.8	-66.7	0	0	0	0	111	V768 H818 I819 V820 F821	V768-S842 CarbonylContact O-C 3.55Å; V768-S842 VanDerWaalsContact O-CA 3.31Å; V768-S842 WeakPolarHBondContact O-CA 3.22Å; H818-S842 PolarHBondContact NE2-OG 3.49Å; I819-S842 PolarHBondContact O-N 2.86Å; V820-S842 WeakPolarHBondContact CA-O 3.39Å; F821-S842 PolarHBondContact N-O 3.01Å
843	I	97.7	Very high	95.2	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	125.3	178.2	-64	174	0	0	0	108.6	I765 V768 I769 L770 F821 I825 L828 W832	I765-I843 HydrophobicContact CD1-CD1 4.02Å; I765-I843 HydrophobicContact CG1-CD1 3.9Å; V768-I843 HydrophobicContact CG2-CD1 4.03Å; V768-I843 HydrophobicContact CG2-CG1 4.26Å; V768-I843 PolarHBondContact O-N 3.12Å; I769-I843 CarbonylContact C-O 3.56Å; I769-I843 WeakPolarHBondContact CA-O 3.38Å; I769-I843 HydrophobicContact CG1-CB 4.32Å; I769-I843 HydrophobicContact CG1-CG2 4.43Å; L770-I843 PolarHBondContact N-O 2.9Å; F821-I843 HydrophobicContact CB-CG1 4.39Å; F821-I843 HydrophobicContact CD2-CG1 4.47Å; I825-I843 HydrophobicContact CD1-CG2 4.08Å; L828-I843 HydrophobicContact CB-CD1 4.37Å; L828-I843 HydrophobicContact CD1-CD1 4.5Å; L828-I843 HydrophobicContact CD1-CG1 4.39Å; L828-I843 HydrophobicContact CD1-CG2 3.6Å; W832-I843 HydrophobicContact CD2-CD1 4.46Å; W832-I843 HydrophobicContact CE3-CD1 3.81Å; W832-I843 HydrophobicContact CZ3-CD1 4.07Å
844	L	97.2	Very high	95.4	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.01	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	104.5	166.1	177.4	60.8	0	0	0	108.3	L770 V820 F821 V822 G846 D853 V857	L770-L844 VanDerWaalsContact O-CD1 3.28Å; L770-L844 WeakPolarHBondContact O-CD1 3.31Å; V820-L844 HydrophobicContact CG1-CB 4.38Å; F821-L844 PolarHBondContact O-N 2.98Å; V822-L844 HydrophobicContact CG2-CB 4.37Å; V822-L844 HydrophobicContact CG2-CD2 4.49Å; L844-G846 PolarHBondContact O-N 2.96Å; L844-D853 HydrophobicContact CD2-CB 3.89Å; L844-V857 HydrophobicContact CD2-CG1 3.5Å
845	P	95.5	Very high	95.5	Very high	50 Å²	50	30.9 Å²	30.9	33%	0.325	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	120.1	177.3	29.3	-34.8	0	0	0	109.9	I769 L770 I825	I769-P845 HydrophobicContact CG2-CG 4.18Å; L770-P845 WeakPolarHBondContact O-CD 3.47Å; I825-P845 HydrophobicContact CB-CB 4.02Å
846	G	92.6	Very high	95.4	Very high	31 Å²	31	31.1 Å²	31.1	32%	0.32	17%	0.169	S	C	.	.	S	Bend	trans	174.1	-155.4	-173.6	0	0	0	0	0	112.7	G823 L844	G823-G846 CarbonylContact C-O 3.56Å; G823-G846 WeakPolarHBondContact CA-O 3.27Å; G823-G846 PolarHBondContact O-N 3.49Å; G823-G846 VanDerWaalsContact O-O 3.1Å; L844-G846 PolarHBondContact O-N 2.96Å
847	T	94.5	Very high	95.3	Very high	63 Å²	63	28.8 Å²	28.8	39%	0.387	16%	0.159	S	C	.	.			trans	-130.4	136.7	174.7	173.6	0	0	0	0	110.8	L849 S850	T847-L849 PolarHBondContact O-N 2.78Å; T847-L849 VanDerWaalsContact O-N 3.1Å; T847-L849 PolarHBondContact OG1-N 2.91Å; T847-S850 VanDerWaalsContact O-CB 3.31Å; T847-S850 WeakPolarHBondContact O-CB 3.38Å; T847-S850 PolarHBondContact O-N 3.32Å
848	P	95.1	Very high	95.3	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.013	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-20.7	174.3	-27.2	36	0	0	0	115.1	C787 F789 S850 L854	C787-P848 HydrophobicContact CB-CB 3.68Å; C787-P848 HydrophobicContact CB-CG 3.64Å; F789-P848 HydrophobicContact CE1-CB 4.27Å; F789-P848 HydrophobicContact CE1-CG 4.2Å; F789-P848 HydrophobicContact CE2-CB 4.09Å; F789-P848 HydrophobicContact CE2-CG 4.16Å; F789-P848 HydrophobicContact CZ-CB 3.68Å; F789-P848 HydrophobicContact CZ-CG 3.94Å; P848-S850 VanDerWaalsContact C-N 3.27Å; P848-S850 PolarHBondContact O-N 3.28Å; P848-L854 VanDerWaalsContact O-CD1 3.29Å; P848-L854 WeakPolarHBondContact O-CD1 3.48Å
849	L	95.8	Very high	95.2	Very high	75 Å²	75	29.4 Å²	29.4	39%	0.393	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-18	177.2	-60	174.2	0	0	0	112.4	F789 T847 R851 L887 A888 N891	F789-L849 HydrophobicContact CE1-CD1 4.14Å; F789-L849 HydrophobicContact CE1-CD2 4.39Å; F789-L849 HydrophobicContact CE1-CG 3.88Å; F789-L849 HydrophobicContact CZ-CD2 4.02Å; F789-L849 HydrophobicContact CZ-CG 3.96Å; T847-L849 PolarHBondContact O-N 2.78Å; T847-L849 VanDerWaalsContact O-N 3.1Å; T847-L849 PolarHBondContact OG1-N 2.91Å; L849-R851 PolarHBondContact O-N 2.76Å; L849-L887 HydrophobicContact CD2-CB 4.22Å; L849-A888 HydrophobicContact CD2-CB 4.22Å; L849-N891 PolarHBondContact O-ND2 3.43Å
850	S	96.8	Very high	95	Very high	28 Å²	28	30.9 Å²	30.9	20%	0.196	17%	0.17	C	C	.	.			trans	-78	102.9	178.7	172.2	0	0	0	0	111.1	T847 P848 A852 D853 L854	T847-S850 VanDerWaalsContact O-CB 3.31Å; T847-S850 WeakPolarHBondContact O-CB 3.38Å; T847-S850 PolarHBondContact O-N 3.32Å; P848-S850 VanDerWaalsContact C-N 3.27Å; P848-S850 PolarHBondContact O-N 3.28Å; S850-A852 PolarHBondContact O-N 3.45Å; S850-D853 WeakPolarHBondContact CB-OD2 3.39Å; S850-D853 PolarHBondContact O-N 3.2Å; S850-D853 PolarHBondContact OG-N 2.96Å; S850-D853 PolarHBondContact OG-OD2 3.42Å; S850-L854 PolarHBondContact O-N 2.59Å
851	R	95.3	Very high	94.9	Very high	99 Å²	99	31.6 Å²	31.6	37%	0.374	18%	0.176	S	C	.	.	H	α-helix	trans	-54	-26.2	173.2	-66.1	-175.7	-178.1	-143.7	-15.7	113.1	L849 R855 N891 S894 M895	L849-R851 PolarHBondContact O-N 2.76Å; R851-R855 WeakPolarHBondContact O-CB 3.45Å; R851-R855 VanDerWaalsContact O-CG 3.25Å; R851-R855 WeakPolarHBondContact O-CG 3.42Å; R851-R855 PolarHBondContact O-N 3.5Å; R851-N891 VanDerWaalsContact CZ-OD1 3.29Å; R851-N891 PolarHBondContact NE-OD1 2.94Å; R851-N891 PolarHBondContact NH2-O 3.16Å; R851-N891 PolarHBondContact NH2-OD1 3.49Å; R851-S894 PolarHBondContact NH1-O 2.91Å; R851-S894 PolarHBondContact NH2-OG 3.47Å; R851-M895 HydrophobicContact CB-CE 4.33Å; R851-M895 HydrophobicContact CG-CG 4.3Å; R851-M895 HydrophobicContact CG-SD 4.21Å
852	A	94.3	Very high	94.8	Very high	44 Å²	44	31.8 Å²	31.8	36%	0.364	18%	0.177	S	C	.	.	H	α-helix	trans	-69.9	-36.3	177.9	0	0	0	0	0	112.4	S850 A856	S850-A852 PolarHBondContact O-N 3.45Å; A852-A856 WeakPolarHBondContact O-CB 3.44Å; A852-A856 PolarHBondContact O-N 3.06Å; A852-A856 VanDerWaalsContact O-N 3.15Å
853	D	95.7	Very high	94.7	Very high	7 Å²	7	33.6 Å²	33.6	4%	0.037	19%	0.186	C	C	.	.	H	α-helix	trans	-75.6	-42.6	177	-62.8	-52.6	0	0	0	110.7	R772 V822 L844 S850 R855 A856 V857	R772-D853 IonicContact CZ-OD1 2.71Å; R772-D853 IonicContact CZ-OD2 3.18Å; R772-D853 IonicContact NE-OD1 2.67Å; R772-D853 PolarHBondContact NE-OD1 2.85Å; R772-D853 IonicContact NH2-OD1 2.84Å; R772-D853 PolarHBondContact NH2-OD1 3.5Å; R772-D853 IonicContact NH2-OD2 2.81Å; R772-D853 PolarHBondContact NH2-OD2 3.45Å; V822-D853 HydrophobicContact CG1-CB 4.48Å; L844-D853 HydrophobicContact CD2-CB 3.89Å; S850-D853 WeakPolarHBondContact CB-OD2 3.39Å; S850-D853 PolarHBondContact O-N 3.2Å; S850-D853 PolarHBondContact OG-N 2.96Å; S850-D853 PolarHBondContact OG-OD2 3.42Å; D853-R855 VanDerWaalsContact C-N 3.32Å; D853-R855 PolarHBondContact O-N 2.66Å; D853-A856 PolarHBondContact O-N 2.7Å; D853-A856 VanDerWaalsContact O-N 3.12Å; D853-V857 PolarHBondContact O-N 3.32Å
854	L	95.6	Very high	94.6	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61.2	-36.5	173.9	-60	-179.3	0	0	0	113.2	P848 S850 V857 I859 I892 M895	P848-L854 VanDerWaalsContact O-CD1 3.29Å; P848-L854 WeakPolarHBondContact O-CD1 3.48Å; S850-L854 PolarHBondContact O-N 2.59Å; L854-V857 VanDerWaalsContact O-CG2 3.31Å; L854-V857 WeakPolarHBondContact O-CG2 3.42Å; L854-I859 HydrophobicContact CB-CD1 4.46Å; L854-I859 HydrophobicContact CB-CG2 4.19Å; L854-I859 HydrophobicContact CD2-CD1 4.02Å; L854-I859 WeakPolarHBondContact O-CB 3.43Å; L854-I859 VanDerWaalsContact O-CG2 3.3Å; L854-I859 WeakPolarHBondContact O-CG2 3.41Å; L854-I859 PolarHBondContact O-N 3.02Å; L854-I892 HydrophobicContact CD1-CG1 3.74Å; L854-M895 HydrophobicContact CB-CE 4.05Å; L854-M895 HydrophobicContact CB-SD 4.21Å; L854-M895 HydrophobicContact CD1-SD 3.89Å
855	R	93.7	Very high	94.7	Very high	107 Å²	107	33.6 Å²	33.6	40%	0.404	19%	0.186	S	C	.	.	H	α-helix	trans	-68.2	-39.9	172.1	-77.6	-176.4	-172.5	-70.5	5.4	112.2	R851 D853 V857 N858 M895 Q896 F897	R851-R855 WeakPolarHBondContact O-CB 3.45Å; R851-R855 VanDerWaalsContact O-CG 3.25Å; R851-R855 WeakPolarHBondContact O-CG 3.42Å; R851-R855 PolarHBondContact O-N 3.5Å; D853-R855 VanDerWaalsContact C-N 3.32Å; D853-R855 PolarHBondContact O-N 2.66Å; R855-V857 VanDerWaalsContact C-N 3.28Å; R855-V857 PolarHBondContact O-N 3.07Å; R855-N858 PolarHBondContact O-N 2.79Å; R855-M895 HydrophobicContact CG-CE 3.62Å; R855-Q896 VanDerWaalsContact CZ-O 3.25Å; R855-Q896 PolarHBondContact NH1-O 3.2Å; R855-Q896 PolarHBondContact NH2-O 2.84Å; R855-F897 HydrophobicContact CG-CE1 4.44Å
856	A	93.2	Very high	94.8	Very high	6 Å²	6	31.2 Å²	31.2	5%	0.05	17%	0.17	C	C	.	.	H	α-helix	trans	-67.8	-25.7	-177.5	0	0	0	0	0	113.9	R772 A775 A776 A852 D853 N858	R772-A856 HydrophobicContact CB-CB 4.47Å; R772-A856 HydrophobicContact CG-CB 3.41Å; R772-A856 VanDerWaalsContact CG-CB 3.41Å; A775-A856 CarbonylContact C-O 3.57Å; A775-A856 VanDerWaalsContact C-O 3.24Å; A775-A856 HydrophobicContact CB-CB 4.35Å; A776-A856 HydrophobicContact CB-CB 4.45Å; A776-A856 PolarHBondContact N-O 3.01Å; A852-A856 WeakPolarHBondContact O-CB 3.44Å; A852-A856 PolarHBondContact O-N 3.06Å; A852-A856 VanDerWaalsContact O-N 3.15Å; D853-A856 PolarHBondContact O-N 2.7Å; D853-A856 VanDerWaalsContact O-N 3.12Å; A856-N858 VanDerWaalsContact C-N 3.32Å
857	V	94.4	Very high	95	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	0.1	171.7	-57.5	0	0	0	0	113.6	H783 V785 V820 V822 L844 D853 L854 R855 I859	H783-V857 PolarHBondContact CE1-O 3.07Å; H783-V857 PolarHBondContact NE2-O 3.02Å; H783-V857 VanDerWaalsContact NE2-O 3.09Å; V785-V857 HydrophobicContact CG1-CG2 4.21Å; V785-V857 HydrophobicContact CG2-CB 4.5Å; V785-V857 HydrophobicContact CG2-CG2 3.96Å; V820-V857 HydrophobicContact CG1-CG1 3.9Å; V822-V857 HydrophobicContact CG2-CG1 4.22Å; L844-V857 HydrophobicContact CD2-CG1 3.5Å; D853-V857 PolarHBondContact O-N 3.32Å; L854-V857 VanDerWaalsContact O-CG2 3.31Å; L854-V857 WeakPolarHBondContact O-CG2 3.42Å; R855-V857 VanDerWaalsContact C-N 3.28Å; R855-V857 PolarHBondContact O-N 3.07Å; V857-I859 HydrophobicContact CG2-CB 4.4Å
858	N	93.3	Very high	95	Very high	34 Å²	34	26.7 Å²	26.7	18%	0.182	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	51.9	-174.4	-50.3	-60.8	0	0	0	113	R855 A856 N860 L861	R855-N858 PolarHBondContact O-N 2.79Å; A856-N858 VanDerWaalsContact C-N 3.32Å; N858-N860 PolarHBondContact O-N 3.32Å; N858-L861 HydrophobicContact CB-CB 4.45Å; N858-L861 HydrophobicContact CB-CD1 4.36Å; N858-L861 PolarHBondContact O-N 3.38Å
859	I	94.6	Very high	94.8	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-55.9	-25	-178.3	-167	164.6	0	0	0	114.4	L854 V857 L861 C862 C865 I892 M895 F897 I941	L854-I859 HydrophobicContact CB-CD1 4.46Å; L854-I859 HydrophobicContact CB-CG2 4.19Å; L854-I859 HydrophobicContact CD2-CD1 4.02Å; L854-I859 WeakPolarHBondContact O-CB 3.43Å; L854-I859 VanDerWaalsContact O-CG2 3.3Å; L854-I859 WeakPolarHBondContact O-CG2 3.41Å; L854-I859 PolarHBondContact O-N 3.02Å; V857-I859 HydrophobicContact CG2-CB 4.4Å; I859-L861 PolarHBondContact O-N 3.2Å; I859-C862 PolarHBondContact O-N 3.37Å; I859-C862 PolarHBondContact O-SG 2.96Å; I859-C865 HydrophobicContact CD1-CB 4.19Å; I859-C865 HydrophobicContact CG1-CB 4.49Å; I859-I892 HydrophobicContact CD1-CD1 3.88Å; I859-I892 HydrophobicContact CD1-CG1 3.94Å; I859-I892 HydrophobicContact CD1-CG2 3.97Å; I859-M895 HydrophobicContact CG2-CE 4.31Å; I859-F897 HydrophobicContact CG2-CE1 4.08Å; I859-F897 HydrophobicContact CG2-CZ 3.76Å; I859-I941 HydrophobicContact CG1-CD1 4.45Å; I859-I941 HydrophobicContact CG1-CG2 4.25Å; I859-I941 HydrophobicContact CG2-CD1 4.17Å
860	N	91.6	Very high	94.2	Very high	33 Å²	33	23.5 Å²	23.5	18%	0.176	12%	0.121	C	C	.	.	G	3₁₀ helix	trans	-70.7	-8.3	173.4	63.1	-40.8	0	0	0	114.4	N858 F897 I935	N858-N860 PolarHBondContact O-N 3.32Å; N860-F897 HydrophobicContact CB-CD1 3.72Å; N860-F897 HydrophobicContact CB-CD2 3.86Å; N860-F897 HydrophobicContact CB-CE1 3.75Å; N860-F897 HydrophobicContact CB-CE2 3.91Å; N860-F897 HydrophobicContact CB-CG 3.78Å; N860-F897 HydrophobicContact CB-CZ 3.85Å; N860-I935 HydrophobicContact CB-CB 4.46Å
861	L	92.6	Very high	93.3	Very high	63 Å²	63	23 Å²	23	33%	0.33	12%	0.116	S	C	.	.	G	3₁₀ helix	trans	-119.3	15.2	177	-55.7	179.2	0	0	0	112.2	S781 G782 N858 I859	S781-L861 WeakPolarHBondContact CA-O 3.49Å; G782-L861 PolarHBondContact N-O 3.34Å; N858-L861 HydrophobicContact CB-CB 4.45Å; N858-L861 HydrophobicContact CB-CD1 4.36Å; N858-L861 PolarHBondContact O-N 3.38Å; I859-L861 PolarHBondContact O-N 3.2Å
862	C	94.8	Very high	91.9	Very high	9 Å²	9	19.6 Å²	19.6	6%	0.061	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	148.6	173.8	81.4	0	0	0	0	111.2	H783 V785 I859	H783-C862 CarbonylContact O-C 3.57Å; H783-C862 WeakPolarHBondContact O-CA 3.2Å; H783-C862 WeakPolarHBondContact O-CB 3.4Å; V785-C862 HydrophobicContact CG2-CB 3.96Å; I859-C862 PolarHBondContact O-N 3.37Å; I859-C862 PolarHBondContact O-SG 2.96Å
863	D	94.1	Very high	90.3	Very high	52 Å²	52	19.2 Å²	19.2	28%	0.278	10%	0.096	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	-25	174	-81	0.8	0	0	0	112	G782 H783 K817 P942	G782-D863 WeakPolarHBondContact CA-OD1 3.39Å; H783-D863 PolarHBondContact O-N 2.86Å; K817-D863 HydrophobicContact CD-CB 4.22Å; K817-D863 WeakPolarHBondContact CD-OD2 3.07Å; K817-D863 WeakPolarHBondContact CE-OD2 3.41Å; K817-D863 IonicContact NZ-OD2 3.36Å; K817-D863 PolarHBondContact NZ-OD2 3.47Å; D863-P942 WeakPolarHBondContact O-CG 3.21Å
864	M	96.8	Very high	88.4	Confident	2 Å²	2	23.9 Å²	23.9	1%	0.01	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	134.3	175.6	-167.7	57.4	61.6	0	0	110.2	S562 C563 Q566 V784 V785 V866 P942 I944	S562-M864 WeakPolarHBondContact O-CE 3.4Å; C563-M864 HydrophobicContact CB-CB 4.09Å; C563-M864 HydrophobicContact CB-CG 4.32Å; Q566-M864 HydrophobicContact CB-CE 3.89Å; Q566-M864 HydrophobicContact CG-CE 3.75Å; V784-M864 WeakPolarHBondContact CA-O 3.36Å; V785-M864 PolarHBondContact N-O 3.48Å; M864-V866 HydrophobicContact CG-CG2 4.04Å; M864-P942 HydrophobicContact CE-CB 3.92Å; M864-P942 HydrophobicContact SD-CB 4.03Å; M864-I944 HydrophobicContact CG-CG2 3.84Å; M864-I944 HydrophobicContact SD-CB 4.08Å; M864-I944 HydrophobicContact SD-CG2 3.81Å
865	C	97.8	Very high	86.9	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	119	161.6	-176.4	0	0	0	0	109.2	V785 I859 P942 I943 I944	V785-C865 CarbonylContact O-C 3.48Å; V785-C865 WeakPolarHBondContact O-CA 3.49Å; I859-C865 HydrophobicContact CD1-CB 4.19Å; I859-C865 HydrophobicContact CG1-CB 4.49Å; C865-P942 PolarHBondContact N-O 2.98Å; C865-I943 HydrophobicContact CB-CG1 4.26Å; C865-I943 CarbonylContact O-C 3.53Å; C865-I943 VanDerWaalsContact O-CA 3.32Å; C865-I943 WeakPolarHBondContact O-CA 3.37Å; C865-I944 PolarHBondContact O-N 3.24Å
866	V	98.3	Very high	85.4	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	127.8	177.6	-179.3	0	0	0	0	108.6	I559 C563 V784 V785 V786 C787 M864 L868 I944	I559-V866 HydrophobicContact CG2-CB 4.35Å; I559-V866 HydrophobicContact CG2-CG1 3.46Å; I559-V866 VanDerWaalsContact CG2-CG1 3.46Å; I559-V866 HydrophobicContact CG2-CG2 3.92Å; C563-V866 WeakPolarHBondContact SG-CG2 3.33Å; V784-V866 HydrophobicContact CG1-CG2 4.12Å; V785-V866 PolarHBondContact O-N 3.28Å; V786-V866 CarbonylContact C-O 3.52Å; V786-V866 WeakPolarHBondContact CA-O 3.32Å; V786-V866 HydrophobicContact CG1-CB 4.3Å; V786-V866 HydrophobicContact CG1-CG1 4.38Å; V786-V866 HydrophobicContact CG2-CB 4.35Å; C787-V866 PolarHBondContact N-O 2.79Å; M864-V866 HydrophobicContact CG-CG2 4.04Å; V866-L868 HydrophobicContact CG1-CD1 4.33Å; V866-L868 HydrophobicContact CG1-CD2 3.77Å; V866-L868 HydrophobicContact CG1-CG 3.89Å; V866-I944 WeakPolarHBondContact CA-O 3.26Å; V866-I944 HydrophobicContact CB-CG2 4.33Å; V866-I944 HydrophobicContact CG1-CG2 4.41Å; V866-I944 HydrophobicContact CG2-CG2 3.87Å
867	I	97.6	Very high	84.6	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	117.1	179.5	-55.3	177.3	0	0	0	109.5	C787 F789 C885 A888 S889 I892 I943 I944 T945 E946	C787-I867 HydrophobicContact CB-CG1 4.16Å; F789-I867 HydrophobicContact CE2-CG2 4.14Å; I867-C885 HydrophobicContact CG2-CB 4.15Å; I867-A888 HydrophobicContact CD1-CB 4.02Å; I867-A888 HydrophobicContact CG2-CB 4.19Å; I867-S889 WeakPolarHBondContact CD1-OG 3.35Å; I867-I892 HydrophobicContact CD1-CD1 3.92Å; I867-I943 HydrophobicContact CD1-CG2 3.6Å; I867-I943 HydrophobicContact CG1-CG2 4.11Å; I867-I944 PolarHBondContact N-O 3.38Å; I867-T945 HydrophobicContact CB-CG2 4.3Å; I867-T945 HydrophobicContact CG2-CG2 4.42Å; I867-E946 PolarHBondContact O-N 2.73Å
868	L	95	Very high	83.7	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	145.7	-178	-51.1	176.1	0	0	0	110.9	L556 I559 V786 C787 F789 I797 L799 L802 V866 E946	L556-L868 HydrophobicContact CD2-CD1 3.89Å; L556-L868 HydrophobicContact CD2-CD2 4.23Å; I559-L868 HydrophobicContact CD1-CD2 4.01Å; V786-L868 HydrophobicContact CG1-CD1 4.07Å; C787-L868 PolarHBondContact O-N 3.19Å; F789-L868 PolarHBondContact N-O 3.47Å; I797-L868 HydrophobicContact CD1-CB 4.17Å; I797-L868 HydrophobicContact CG2-CD1 4.49Å; L799-L868 HydrophobicContact CD2-CD1 4.09Å; L802-L868 HydrophobicContact CD2-CD1 4.32Å; V866-L868 HydrophobicContact CG1-CD1 4.33Å; V866-L868 HydrophobicContact CG1-CD2 3.77Å; V866-L868 HydrophobicContact CG1-CG 3.89Å; L868-E946 HydrophobicContact CD2-CB 4.06Å; L868-E946 WeakPolarHBondContact CD2-OE2 3.4Å
869	S	89.6	Confident	83	Confident	4 Å²	4	37.7 Å²	37.7	3%	0.028	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	132.2	169.6	177.2	0	0	0	0	110.8	N871 Q872	S869-N871 PolarHBondContact OG-N 3.22Å; S869-N871 VanDerWaalsContact OG-N 3.14Å; S869-Q872 WeakPolarHBondContact O-CG 3.46Å; S869-Q872 PolarHBondContact O-NE2 3.45Å
870	A	84.3	Confident	82.6	Confident	6 Å²	6	41.9 Å²	41.9	5%	0.05	23%	0.231	C	C	.	.	S	Bend	trans	-95.6	-10.9	166.5	0	0	0	0	0	111.8	F789 I797 Y827 Q872	F789-A870 WeakPolarHBondContact O-CB 3.46Å; F789-A870 PolarHBondContact O-N 3.21Å; I797-A870 HydrophobicContact CD1-CB 3.74Å; I797-A870 HydrophobicContact CG1-CB 4Å; Y827-A870 HydrophobicContact CE2-CB 3.71Å; A870-Q872 PolarHBondContact O-N 2.99Å
871	N	77.9	Confident	82.2	Confident	18 Å²	18	41.4 Å²	41.4	10%	0.096	23%	0.228	C	C	.	.			trans	-86.4	16	-174.9	-79.8	-7.6	0	0	0	113.6	D791 S794 S869 N873	D791-N871 PolarHBondContact OD2-ND2 2.9Å; D791-N871 PolarHBondContact OD2-OD1 3.31Å; S794-N871 VanDerWaalsContact CB-OD1 3.28Å; S794-N871 WeakPolarHBondContact CB-OD1 3.5Å; S869-N871 PolarHBondContact OG-N 3.22Å; S869-N871 VanDerWaalsContact OG-N 3.14Å; N871-N873 PolarHBondContact O-N 3.38Å
872	Q	64.8	Low	82.1	Confident	26 Å²	26	38.4 Å²	38.4	12%	0.121	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-21.4	-174.9	-49.9	-172.6	-1.5	0	0	113.8	S869 A870 E946 V948	S869-Q872 WeakPolarHBondContact O-CG 3.46Å; S869-Q872 PolarHBondContact O-NE2 3.45Å; A870-Q872 PolarHBondContact O-N 2.99Å; Q872-E946 PolarHBondContact NE2-OE1 3.5Å; Q872-V948 HydrophobicContact CB-CG2 4.13Å; Q872-V948 HydrophobicContact CG-CG2 3.79Å
873	N	61.7	Low	82	Confident	37 Å²	37	42.2 Å²	42.2	20%	0.198	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-5.1	-163.8	-61.9	0.8	0	0	0	115	C495 A496 N871	C495-N873 VanDerWaalsContact O-CG 3.23Å; C495-N873 PolarHBondContact O-ND2 3.25Å; A496-N873 PolarHBondContact O-ND2 3.13Å; N871-N873 PolarHBondContact O-N 3.38Å
874	N	55.9	Low	81.9	Confident	104 Å²	104	42.2 Å²	42.2	56%	0.556	23%	0.226	S	C	*	.	S	Bend	trans	-109.5	11.8	-165.8	-73	-26.9	0	0	0	114.7
875	I	62.9	Low	81.7	Confident	41 Å²	41	42.2 Å²	42.2	21%	0.21	23%	0.226	C	C	.	.			trans	-128.7	119	-174.3	-57.5	177.4	0	0	0	109.8	D877 L880 Q881 K883	I875-D877 VanDerWaalsContact C-N 3.25Å; I875-D877 HydrophobicContact CG2-CB 4.44Å; I875-D877 PolarHBondContact O-N 2.6Å; I875-L880 HydrophobicContact CG2-CB 4.14Å; I875-Q881 HydrophobicContact CB-CG 4.32Å; I875-Q881 PolarHBondContact O-NE2 2.7Å; I875-K883 HydrophobicContact CD1-CD 4.46Å
876	D	62.9	Low	81.6	Confident	179 Å²	179	43.1 Å²	43.1	96%	0.957	23%	0.231	S	C	*	.	S	Bend	trans	-65.5	-24.3	-178.3	-63.8	-42.2	0	0	0	113.8
877	D	76.9	Confident	81.5	Confident	74 Å²	74	48 Å²	48	40%	0.396	26%	0.256	S	S	.	.			trans	-94.5	110.8	176.9	-171.2	-26.5	0	0	0	110.6	I875 S879 L880	I875-D877 VanDerWaalsContact C-N 3.25Å; I875-D877 HydrophobicContact CG2-CB 4.44Å; I875-D877 PolarHBondContact O-N 2.6Å; D877-S879 VanDerWaalsContact CG-OG 3.32Å; D877-S879 PolarHBondContact O-N 2.94Å; D877-S879 WeakPolarHBondContact OD1-CB 3.18Å; D877-S879 PolarHBondContact OD1-N 3.39Å; D877-S879 PolarHBondContact OD1-OG 2.93Å; D877-L880 HydrophobicContact CB-CB 4.38Å; D877-L880 HydrophobicContact CB-CD1 4.19Å; D877-L880 HydrophobicContact CB-CG 4.37Å; D877-L880 PolarHBondContact O-N 3.46Å; D877-L880 VanDerWaalsContact O-N 3.11Å
878	T	75.1	Confident	81.4	Confident	90 Å²	90	48 Å²	48	55%	0.552	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-20	-179.4	56	0	0	0	0	113.9	N949	T878-N949 PolarHBondContact O-ND2 2.96Å; T878-N949 VanDerWaalsContact O-ND2 3.12Å
879	S	78.9	Confident	81.4	Confident	53 Å²	53	48 Å²	48	37%	0.371	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-30.7	175.4	70.3	0	0	0	0	112.4	D877 N952	D877-S879 VanDerWaalsContact CG-OG 3.32Å; D877-S879 PolarHBondContact O-N 2.94Å; D877-S879 WeakPolarHBondContact OD1-CB 3.18Å; D877-S879 PolarHBondContact OD1-N 3.39Å; D877-S879 PolarHBondContact OD1-OG 2.93Å; S879-N952 PolarHBondContact O-ND2 2.95Å; S879-N952 PolarHBondContact O-OD1 2.9Å
880	L	85.3	Confident	81.7	Confident	88 Å²	88	50.2 Å²	50.2	46%	0.461	27%	0.267	S	S	.	.	S	Bend	trans	-91	2.5	-173.5	-67.4	177.1	0	0	0	114.4	I875 D877 D882 K883	I875-L880 HydrophobicContact CG2-CB 4.14Å; D877-L880 HydrophobicContact CB-CB 4.38Å; D877-L880 HydrophobicContact CB-CD1 4.19Å; D877-L880 HydrophobicContact CB-CG 4.37Å; D877-L880 PolarHBondContact O-N 3.46Å; D877-L880 VanDerWaalsContact O-N 3.11Å; L880-D882 PolarHBondContact O-N 3.28Å; L880-K883 WeakPolarHBondContact O-CB 3.38Å; L880-K883 WeakPolarHBondContact O-CD 3.47Å; L880-K883 WeakPolarHBondContact O-CG 3.47Å; L880-K883 PolarHBondContact O-N 3.33Å
881	Q	83.9	Confident	82.2	Confident	24 Å²	24	51 Å²	51	11%	0.112	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-38.3	-178.3	-69.8	178.7	-10.7	0	0	112.6	I875 K883 V948	I875-Q881 HydrophobicContact CB-CG 4.32Å; I875-Q881 PolarHBondContact O-NE2 2.7Å; Q881-K883 PolarHBondContact O-N 2.75Å; Q881-V948 HydrophobicContact CB-CB 4.47Å; Q881-V948 VanDerWaalsContact OE1-CG1 3.26Å
882	D	89.8	Confident	83	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	2.4	-176.4	-60.7	-57.8	0	0	0	114.8	L880 E884 C885 I886 L947 V948 N949 N952	L880-D882 PolarHBondContact O-N 3.28Å; D882-E884 PolarHBondContact O-N 2.76Å; D882-C885 WeakPolarHBondContact O-CB 3.36Å; D882-C885 PolarHBondContact O-N 2.74Å; D882-I886 HydrophobicContact CB-CD1 3.86Å; D882-I886 HydrophobicContact CB-CG1 4.27Å; D882-I886 WeakPolarHBondContact O-CG1 3.43Å; D882-I886 PolarHBondContact O-N 3.29Å; D882-L947 HydrophobicContact CB-CD2 4.01Å; D882-L947 WeakPolarHBondContact OD1-CA 3.5Å; D882-V948 WeakPolarHBondContact OD1-CB 3.47Å; D882-V948 WeakPolarHBondContact OD1-CG2 3.44Å; D882-V948 PolarHBondContact OD1-N 3.02Å; D882-V948 PolarHBondContact OD2-N 3Å; D882-N949 PolarHBondContact OD2-N 3.21Å; D882-N949 VanDerWaalsContact OD2-N 3.12Å; D882-N952 HydrophobicContact CB-CB 4.33Å; D882-N952 PolarHBondContact OD2-ND2 3.06Å
883	K	91.4	Very high	84.4	Confident	89 Å²	89	50.9 Å²	50.9	39%	0.387	27%	0.269	S	S	.	.	H	α-helix	trans	-52.1	-38.6	-170.7	73.2	-169.8	172	-176.5	0	113.6	I875 L880 Q881 L887	I875-K883 HydrophobicContact CD1-CD 4.46Å; L880-K883 WeakPolarHBondContact O-CB 3.38Å; L880-K883 WeakPolarHBondContact O-CD 3.47Å; L880-K883 WeakPolarHBondContact O-CG 3.47Å; L880-K883 PolarHBondContact O-N 3.33Å; Q881-K883 PolarHBondContact O-N 2.75Å; K883-L887 VanDerWaalsContact O-CB 3.27Å; K883-L887 WeakPolarHBondContact O-CB 3.4Å; K883-L887 WeakPolarHBondContact O-CD1 3.46Å; K883-L887 WeakPolarHBondContact O-CG 3.24Å; K883-L887 PolarHBondContact O-N 3.14Å
884	E	92.1	Very high	85.9	Confident	52 Å²	52	52.3 Å²	52.3	24%	0.243	28%	0.282	C	S	.	.	H	α-helix	trans	-75.1	-39.4	-176.2	-62.3	178.8	172.1	0	0	111.2	F789 D882 A888	F789-E884 WeakPolarHBondContact CB-OE2 3.29Å; F789-E884 HydrophobicContact CD1-CB 3.92Å; F789-E884 HydrophobicContact CD1-CG 4.49Å; F789-E884 HydrophobicContact CD2-CB 4.03Å; F789-E884 HydrophobicContact CE1-CB 4.07Å; F789-E884 HydrophobicContact CE2-CB 4.16Å; F789-E884 HydrophobicContact CG-CB 3.91Å; F789-E884 HydrophobicContact CZ-CB 4.17Å; D882-E884 PolarHBondContact O-N 2.76Å; E884-A888 VanDerWaalsContact O-CB 3.3Å; E884-A888 WeakPolarHBondContact O-CB 3.45Å; E884-A888 PolarHBondContact O-N 3.12Å
885	C	94.1	Very high	87.7	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.007	26%	0.255	C	S	.	.	H	α-helix	trans	-64.3	-45.5	175.8	-68.4	0	0	0	0	112	I867 D882 A888 S889 T945	I867-C885 HydrophobicContact CG2-CB 4.15Å; D882-C885 WeakPolarHBondContact O-CB 3.36Å; D882-C885 PolarHBondContact O-N 2.74Å; C885-A888 PolarHBondContact O-N 3.09Å; C885-S889 WeakPolarHBondContact O-CB 3.45Å; C885-S889 PolarHBondContact O-N 3.23Å; C885-S889 PolarHBondContact O-OG 3.48Å; C885-T945 HydrophobicContact CB-CG2 3.7Å
886	I	95	Very high	89	Confident	19 Å²	19	52.5 Å²	52.5	10%	0.097	28%	0.279	C	S	.	.	H	α-helix	trans	-66.1	-48.9	177.7	-61.6	162.3	0	0	0	110.2	D882 A888 S889 L890 N952 F955 L956	D882-I886 HydrophobicContact CB-CD1 3.86Å; D882-I886 HydrophobicContact CB-CG1 4.27Å; D882-I886 WeakPolarHBondContact O-CG1 3.43Å; D882-I886 PolarHBondContact O-N 3.29Å; I886-A888 VanDerWaalsContact C-N 3.31Å; I886-A888 PolarHBondContact O-N 3.44Å; I886-S889 WeakPolarHBondContact O-CB 3.25Å; I886-S889 PolarHBondContact O-N 3.15Å; I886-S889 VanDerWaalsContact O-N 3.14Å; I886-L890 HydrophobicContact CG2-CD1 3.97Å; I886-L890 HydrophobicContact CG2-CG 4.41Å; I886-L890 WeakPolarHBondContact O-CG 3.32Å; I886-L890 PolarHBondContact O-N 3.34Å; I886-N952 HydrophobicContact CD1-CB 4.13Å; I886-F955 HydrophobicContact CD1-CB 4.28Å; I886-F955 HydrophobicContact CD1-CD2 4.16Å; I886-F955 HydrophobicContact CG2-CB 3.87Å; I886-L956 HydrophobicContact CG1-CD2 4.26Å
887	L	95.3	Very high	90.2	Very high	103 Å²	103	44.7 Å²	44.7	54%	0.539	24%	0.236	S	C	.	.	H	α-helix	trans	-60	-39.5	178.3	-74.7	171.3	0	0	0	112.2	L849 K883 N891	L849-L887 HydrophobicContact CD2-CB 4.22Å; K883-L887 VanDerWaalsContact O-CB 3.27Å; K883-L887 WeakPolarHBondContact O-CB 3.4Å; K883-L887 WeakPolarHBondContact O-CD1 3.46Å; K883-L887 WeakPolarHBondContact O-CG 3.24Å; K883-L887 PolarHBondContact O-N 3.14Å; L887-N891 WeakPolarHBondContact O-CB 3.46Å; L887-N891 PolarHBondContact O-N 3.4Å
888	A	95.9	Very high	90.4	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-63.7	-44.6	173.9	0	0	0	0	0	112.4	F789 L849 I867 E884 C885 I886 N891 I892	F789-A888 HydrophobicContact CE2-CB 3.81Å; F789-A888 HydrophobicContact CZ-CB 3.85Å; L849-A888 HydrophobicContact CD2-CB 4.22Å; I867-A888 HydrophobicContact CD1-CB 4.02Å; I867-A888 HydrophobicContact CG2-CB 4.19Å; E884-A888 VanDerWaalsContact O-CB 3.3Å; E884-A888 WeakPolarHBondContact O-CB 3.45Å; E884-A888 PolarHBondContact O-N 3.12Å; C885-A888 PolarHBondContact O-N 3.09Å; I886-A888 VanDerWaalsContact C-N 3.31Å; I886-A888 PolarHBondContact O-N 3.44Å; A888-N891 WeakPolarHBondContact O-CB 3.44Å; A888-N891 PolarHBondContact O-N 3.35Å; A888-I892 WeakPolarHBondContact O-CG1 3.27Å; A888-I892 PolarHBondContact O-N 2.94Å
889	S	95.8	Very high	89.9	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.007	24%	0.243	C	C	.	.	H	α-helix	trans	-58.4	-50.5	178.1	-55.9	0	0	0	0	111.4	I867 C885 I886 N891 I892 K893 T945	I867-S889 WeakPolarHBondContact CD1-OG 3.35Å; C885-S889 WeakPolarHBondContact O-CB 3.45Å; C885-S889 PolarHBondContact O-N 3.23Å; C885-S889 PolarHBondContact O-OG 3.48Å; I886-S889 WeakPolarHBondContact O-CB 3.25Å; I886-S889 PolarHBondContact O-N 3.15Å; I886-S889 VanDerWaalsContact O-N 3.14Å; S889-N891 VanDerWaalsContact C-N 3.35Å; S889-N891 PolarHBondContact O-N 3Å; S889-I892 PolarHBondContact O-N 2.85Å; S889-K893 WeakPolarHBondContact O-CG 3.49Å; S889-K893 PolarHBondContact O-N 3.04Å; S889-T945 PolarHBondContact OG-OG1 2.84Å
890	L	95.1	Very high	88.6	Confident	49 Å²	49	47.2 Å²	47.2	26%	0.257	25%	0.247	S	C	.	.	H	α-helix	trans	-67.5	-33.5	177.7	-64.1	176.4	0	0	0	112.5	I886 S894	I886-L890 HydrophobicContact CG2-CD1 3.97Å; I886-L890 HydrophobicContact CG2-CG 4.41Å; I886-L890 WeakPolarHBondContact O-CG 3.32Å; I886-L890 PolarHBondContact O-N 3.34Å; L890-S894 WeakPolarHBondContact O-CB 3.34Å; L890-S894 PolarHBondContact O-N 3.49Å; L890-S894 VanDerWaalsContact O-N 3.11Å; L890-S894 PolarHBondContact O-OG 3.23Å
891	N	95.9	Very high	86.9	Confident	22 Å²	22	47.9 Å²	47.9	12%	0.118	25%	0.25	C	S	.	.	H	α-helix	trans	-62.8	-44.7	175.1	-173.2	38	0	0	0	111.4	L849 R851 L887 A888 S889 S894 M895	L849-N891 PolarHBondContact O-ND2 3.43Å; R851-N891 VanDerWaalsContact CZ-OD1 3.29Å; R851-N891 PolarHBondContact NE-OD1 2.94Å; R851-N891 PolarHBondContact NH2-O 3.16Å; R851-N891 PolarHBondContact NH2-OD1 3.49Å; L887-N891 WeakPolarHBondContact O-CB 3.46Å; L887-N891 PolarHBondContact O-N 3.4Å; A888-N891 WeakPolarHBondContact O-CB 3.44Å; A888-N891 PolarHBondContact O-N 3.35Å; S889-N891 VanDerWaalsContact C-N 3.35Å; S889-N891 PolarHBondContact O-N 3Å; N891-S894 PolarHBondContact O-OG 2.79Å; N891-M895 WeakPolarHBondContact O-CG 3.11Å
892	I	95.2	Very high	85.2	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-67.4	-48.8	177.2	-63.2	158.3	0	0	0	110.7	L854 I859 I867 A888 S889 S894 M895 I941 I943	L854-I892 HydrophobicContact CD1-CG1 3.74Å; I859-I892 HydrophobicContact CD1-CD1 3.88Å; I859-I892 HydrophobicContact CD1-CG1 3.94Å; I859-I892 HydrophobicContact CD1-CG2 3.97Å; I867-I892 HydrophobicContact CD1-CD1 3.92Å; A888-I892 WeakPolarHBondContact O-CG1 3.27Å; A888-I892 PolarHBondContact O-N 2.94Å; S889-I892 PolarHBondContact O-N 2.85Å; I892-S894 PolarHBondContact O-N 3.34Å; I892-S894 VanDerWaalsContact O-N 3.11Å; I892-M895 WeakPolarHBondContact O-CB 3.46Å; I892-M895 PolarHBondContact O-N 2.98Å; I892-I941 HydrophobicContact CG2-CB 4.19Å; I892-I941 HydrophobicContact CG2-CD1 3.74Å; I892-I941 HydrophobicContact CG2-CG2 4.07Å; I892-I943 HydrophobicContact CB-CD1 3.84Å; I892-I943 HydrophobicContact CD1-CD1 4.37Å; I892-I943 HydrophobicContact CG2-CD1 3.66Å; I892-I943 HydrophobicContact CG2-CG1 4.25Å
893	K	93.1	Very high	82.8	Confident	42 Å²	42	54.5 Å²	54.5	18%	0.183	31%	0.306	C	S	.	.	H	α-helix	trans	-56.6	-29.1	178.8	-74	-177.5	178.5	178.3	0	113.1	S889 G938 V939 I943 L956 D957	S889-K893 WeakPolarHBondContact O-CG 3.49Å; S889-K893 PolarHBondContact O-N 3.04Å; K893-G938 CarbonylContact O-C 3.53Å; K893-V939 PolarHBondContact O-N 3.2Å; K893-I943 HydrophobicContact CG-CD1 4Å; K893-L956 PolarHBondContact NZ-O 3.38Å; K893-D957 IonicContact NZ-OD1 2.98Å; K893-D957 PolarHBondContact NZ-OD1 3.32Å
894	S	93.2	Very high	80.2	Confident	66 Å²	66	56.2 Å²	56.2	46%	0.462	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	13.5	178.2	61.6	0	0	0	0	115.3	R851 L890 N891 I892	R851-S894 PolarHBondContact NH1-O 2.91Å; R851-S894 PolarHBondContact NH2-OG 3.47Å; L890-S894 WeakPolarHBondContact O-CB 3.34Å; L890-S894 PolarHBondContact O-N 3.49Å; L890-S894 VanDerWaalsContact O-N 3.11Å; L890-S894 PolarHBondContact O-OG 3.23Å; N891-S894 PolarHBondContact O-OG 2.79Å; I892-S894 PolarHBondContact O-N 3.34Å; I892-S894 VanDerWaalsContact O-N 3.11Å
895	M	93.4	Very high	77.8	Confident	0 Å²	0	59 Å²	59	0%	0	33%	0.331	C	S	.	.			trans	-81.6	150.9	170.5	-71.3	174.1	68.5	0	0	111.8	R851 L854 R855 I859 N891 I892 F897 G938	R851-M895 HydrophobicContact CB-CE 4.33Å; R851-M895 HydrophobicContact CG-CG 4.3Å; R851-M895 HydrophobicContact CG-SD 4.21Å; L854-M895 HydrophobicContact CB-CE 4.05Å; L854-M895 HydrophobicContact CB-SD 4.21Å; L854-M895 HydrophobicContact CD1-SD 3.89Å; R855-M895 HydrophobicContact CG-CE 3.62Å; I859-M895 HydrophobicContact CG2-CE 4.31Å; N891-M895 WeakPolarHBondContact O-CG 3.11Å; I892-M895 WeakPolarHBondContact O-CB 3.46Å; I892-M895 PolarHBondContact O-N 2.98Å; M895-F897 HydrophobicContact CB-CE2 3.67Å; M895-F897 HydrophobicContact CB-CZ 3.75Å; M895-F897 HydrophobicContact CE-CE1 3.96Å; M895-F897 HydrophobicContact CE-CZ 3.73Å; M895-F897 HydrophobicContact SD-CZ 4.4Å; M895-G938 WeakPolarHBondContact O-CA 3.32Å; M895-G938 PolarHBondContact O-N 2.87Å
896	Q	91	Very high	75.1	Confident	149 Å²	149	63 Å²	63	70%	0.696	37%	0.365	S	S	*	.	B	Isolated β-bridge	trans	-123.5	146.3	173.3	-67.7	177.8	-7.8	0	0	109.4	R855	R855-Q896 VanDerWaalsContact CZ-O 3.25Å; R855-Q896 PolarHBondContact NH1-O 3.2Å; R855-Q896 PolarHBondContact NH2-O 2.84Å
897	F	88.6	Confident	72.2	Confident	15 Å²	15	68.9 Å²	68.9	7%	0.066	40%	0.397	C	S	.	.			trans	-133.5	141.7	-174.9	-57.1	-93	0	0	0	110.9	R855 I859 N860 M895 T936 I941	R855-F897 HydrophobicContact CG-CE1 4.44Å; I859-F897 HydrophobicContact CG2-CE1 4.08Å; I859-F897 HydrophobicContact CG2-CZ 3.76Å; N860-F897 HydrophobicContact CB-CD1 3.72Å; N860-F897 HydrophobicContact CB-CD2 3.86Å; N860-F897 HydrophobicContact CB-CE1 3.75Å; N860-F897 HydrophobicContact CB-CE2 3.91Å; N860-F897 HydrophobicContact CB-CG 3.78Å; N860-F897 HydrophobicContact CB-CZ 3.85Å; M895-F897 HydrophobicContact CB-CE2 3.67Å; M895-F897 HydrophobicContact CB-CZ 3.75Å; M895-F897 HydrophobicContact CE-CE1 3.96Å; M895-F897 HydrophobicContact CE-CZ 3.73Å; M895-F897 HydrophobicContact SD-CZ 4.4Å; F897-T936 PolarHBondContact N-O 2.94Å; F897-I941 HydrophobicContact CE2-CD1 3.82Å; F897-I941 HydrophobicContact CZ-CD1 3.98Å
898	D	80.8	Confident	69.5	Low	120 Å²	120	68.3 Å²	68.3	64%	0.642	40%	0.401	S	S	*	.			trans	-98.4	124.8	-179.6	-58.8	-51.5	0	0	0	111	S900 I901	D898-S900 PolarHBondContact O-N 3.37Å; D898-I901 PolarHBondContact O-N 3.47Å
899	D	63.4	Low	66.6	Low	86 Å²	86	77.4 Å²	77.4	46%	0.46	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-13.6	179.6	-74.1	6.7	0	0	0	114.1	I901 S934 T936	D899-I901 VanDerWaalsContact C-N 3.32Å; D899-I901 PolarHBondContact O-N 3.16Å; D899-S934 VanDerWaalsContact CG-CB 3.49Å; D899-S934 VanDerWaalsContact CG-OG 3.28Å; D899-S934 WeakPolarHBondContact OD1-CB 3.35Å; D899-S934 PolarHBondContact OD1-OG 2.96Å; D899-S934 WeakPolarHBondContact OD2-CB 3.45Å; D899-S934 PolarHBondContact OD2-OG 3.4Å; D899-T936 WeakPolarHBondContact OD1-CG2 3.3Å
900	S	51.9	Low	63.8	Low	64 Å²	64	81 Å²	81	45%	0.448	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-22.4	-177.1	52.5	0	0	0	0	114.1	D898 G902 V903 L904	D898-S900 PolarHBondContact O-N 3.37Å; S900-G902 PolarHBondContact O-N 3.25Å; S900-V903 PolarHBondContact O-N 2.9Å; S900-L904 WeakPolarHBondContact O-CG 3.38Å; S900-L904 PolarHBondContact O-N 3.47Å
901	I	51	Low	60.7	Low	103 Å²	103	88 Å²	88	53%	0.528	51%	0.509	S	S	.	.	H	α-helix	trans	-67.4	-37.9	-176.7	-67.3	177.2	0	0	0	111.6	D898 D899 V903 L904	D898-I901 PolarHBondContact O-N 3.47Å; D899-I901 VanDerWaalsContact C-N 3.32Å; D899-I901 PolarHBondContact O-N 3.16Å; I901-V903 PolarHBondContact O-N 2.76Å; I901-L904 PolarHBondContact O-N 3.29Å
902	G	46.6	Very low	57.5	Low	70 Å²	70	93.2 Å²	93.2	72%	0.722	54%	0.542	S	S	*	.	H	α-helix	trans	-67.9	-16.1	178.6	0	0	0	0	0	114.9	S900	S900-G902 PolarHBondContact O-N 3.25Å
903	V	39.4	Very low	54.4	Low	92 Å²	92	98.2 Å²	98.2	56%	0.558	58%	0.575	S	S	*	*	H	α-helix	trans	-98.1	-24.2	-177	-179.2	0	0	0	0	112.4	S900 I901	S900-V903 PolarHBondContact O-N 2.9Å; I901-V903 PolarHBondContact O-N 2.76Å
904	L	37.6	Very low	51.4	Low	125 Å²	125	102.9 Å²	102.9	65%	0.654	61%	0.609	S	S	*	*	H	α-helix	trans	-90.6	-30.2	-171.2	-69.5	171.3	0	0	0	114.4	S900 I901	S900-L904 WeakPolarHBondContact O-CG 3.38Å; S900-L904 PolarHBondContact O-N 3.47Å; I901-L904 PolarHBondContact O-N 3.29Å
905	Q	42.3	Very low	48.9	Very low	110 Å²	110	103.5 Å²	103.5	51%	0.514	63%	0.627	S	S	.	*	G	3₁₀ helix	trans	-76.4	-21.2	179.8	-96.2	-179.8	-18.7	0	0	114.5	N907 S908	Q905-N907 VanDerWaalsContact C-N 3.29Å; Q905-N907 PolarHBondContact O-N 2.86Å; Q905-S908 PolarHBondContact O-OG 3.4Å
906	A	37	Very low	46	Very low	86 Å²	86	112.6 Å²	112.6	71%	0.711	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-74.6	-15.5	178.6	0	0	0	0	0	114
907	N	34.6	Very low	42.9	Very low	143 Å²	143	113.2 Å²	113.2	77%	0.765	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-106.7	5.7	-174.9	-80.2	-36.1	0	0	0	114.2	Q905	Q905-N907 VanDerWaalsContact C-N 3.29Å; Q905-N907 PolarHBondContact O-N 2.86Å
908	S	37.4	Very low	40.6	Very low	90 Å²	90	124.6 Å²	124.6	63%	0.629	72%	0.722	S	S	*	*			trans	-99.8	25.8	-173.8	67.5	0	0	0	0	115.3	Q905	Q905-S908 PolarHBondContact O-OG 3.4Å
909	Q	36.3	Very low	38.1	Very low	191 Å²	191	123.9 Å²	123.9	89%	0.893	73%	0.726	S	S	*	*	S	Bend	trans	-116	96.4	159.9	-70.7	-160.8	2.4	0	0	109.8	F911	Q909-F911 PolarHBondContact O-N 3.35Å
910	G	36.1	Very low	36.4	Very low	76 Å²	76	124.9 Å²	124.9	78%	0.784	74%	0.74	S	S	*	*			trans	-76.8	109.1	-179.2	0	0	0	0	0	112.4
911	F	29.3	Very low	35.6	Very low	197 Å²	197	128 Å²	128	86%	0.864	76%	0.759	S	S	*	*			trans	-148.2	103.9	148.5	-141.7	-91.1	0	0	0	110.2	Q909	Q909-F911 PolarHBondContact O-N 3.35Å
912	T	30	Very low	34.7	Very low	132 Å²	132	129.6 Å²	129.6	81%	0.81	77%	0.769	S	S	*	*			trans	-104.9	114.7	172.5	46.9	0	0	0	0	109.5
913	P	30.2	Very low	33.9	Very low	106 Å²	106	134.5 Å²	134.5	69%	0.688	78%	0.778	S	S	*	*			trans	-65.1	139.7	167.1	-15.9	30.3	0	0	0	109.9
914	P	29.9	Very low	33.3	Very low	139 Å²	139	134.7 Å²	134.7	90%	0.903	78%	0.784	S	S	*	*	S	Bend	trans	-75.7	129	179.2	29.7	-33.2	0	0	0	111.2
915	G	39.5	Very low	32.9	Very low	80 Å²	80	135.2 Å²	135.2	83%	0.825	79%	0.794	S	S	*	*			trans	130.7	39.3	165.5	0	0	0	0	0	118.1
916	M	32.5	Very low	32.4	Very low	190 Å²	190	135.2 Å²	135.2	94%	0.936	80%	0.802	S	S	*	*			trans	-140.8	115.1	168.9	-121.8	171	179.7	0	0	112.4
917	D	26.9	Very low	32.1	Very low	163 Å²	163	140.6 Å²	140.6	87%	0.872	81%	0.812	S	S	*	*			trans	-73.6	142	-179.9	-74.9	-50	0	0	0	112.4	S919	D917-S919 PolarHBondContact O-N 3.23Å
918	R	39.2	Very low	31.6	Very low	253 Å²	253	137.6 Å²	137.6	96%	0.955	82%	0.815	S	S	*	*			trans	-81.4	109.7	176.1	-74.7	-179.8	170.2	-179.8	-3.5	111.3
919	S	29.8	Very low	31.1	Very low	105 Å²	105	141.8 Å²	141.8	73%	0.734	83%	0.826	S	S	*	*			trans	-153.7	147.2	156.2	58	0	0	0	0	111	D917	D917-S919 PolarHBondContact O-N 3.23Å
920	S	27.3	Very low	30.8	Very low	107 Å²	107	139.8 Å²	139.8	75%	0.748	82%	0.821	S	S	*	*			trans	83.6	113.4	-175.8	-38.8	0	0	0	0	115.6
921	P	35.6	Very low	30.6	Very low	131 Å²	131	147.3 Å²	147.3	85%	0.851	83%	0.826	S	S	*	*	S	Bend	trans	-97.2	37.4	175	40.3	-35.1	0	0	0	113
922	D	30.5	Very low	31.1	Very low	136 Å²	136	144.3 Å²	144.3	73%	0.727	81%	0.814	S	S	*	*			trans	-133.3	139	175.7	-81.7	-56.3	0	0	0	109.8
923	N	30.2	Very low	31.7	Very low	172 Å²	172	143.6 Å²	143.6	92%	0.92	81%	0.812	S	S	*	*			trans	79.6	80	-170.7	-53.1	-46.5	0	0	0	116.5
924	S	27.2	Very low	32.7	Very low	97 Å²	97	141.8 Å²	141.8	68%	0.678	80%	0.802	S	S	*	*			trans	-125.4	140.1	148.9	70.4	0	0	0	0	109.9	V926	S924-V926 PolarHBondContact O-N 3.01Å
925	P	29.9	Very low	34.2	Very low	135 Å²	135	137 Å²	137	88%	0.877	77%	0.768	S	S	*	*	S	Bend	trans	-85	58	-173.2	35.5	-36.5	0	0	0	111.8
926	V	31	Very low	35.7	Very low	111 Å²	111	136.5 Å²	136.5	67%	0.673	75%	0.75	S	S	*	*			trans	-135.7	57.4	177.3	-162.7	0	0	0	0	111	S924	S924-V926 PolarHBondContact O-N 3.01Å
927	H	29.9	Very low	38	Very low	198 Å²	198	130 Å²	130	92%	0.917	72%	0.721	S	S	*	*			trans	-134.5	114	162.6	-107.8	45.7	0	0	0	109.1
928	G	25.6	Very low	40.6	Very low	80 Å²	80	122.2 Å²	122.2	83%	0.825	68%	0.679	S	S	*	*			trans	168.6	-14.7	-170.4	0	0	0	0	0	114.7
929	M	26.2	Very low	43	Very low	178 Å²	178	113.6 Å²	113.6	88%	0.877	65%	0.654	S	S	*	*	S	Bend	trans	-102.2	117.1	160.8	-70.7	-172.3	-70.9	0	0	108.8	R931	M929-R931 PolarHBondContact O-N 3.2Å
930	L	30.1	Very low	45.7	Very low	150 Å²	150	111.2 Å²	111.2	79%	0.785	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-56.9	124	162.6	-83.9	153.1	0	0	0	107.8	Q932	L930-Q932 PolarHBondContact O-N 2.8Å
931	R	31.9	Very low	48.9	Very low	234 Å²	234	106.5 Å²	106.5	88%	0.883	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-63.4	123.8	172.4	-78.1	179.5	168.7	-177.6	-5.1	108.2	M929	M929-R931 PolarHBondContact O-N 3.2Å
932	Q	39.3	Very low	51.7	Low	133 Å²	133	101.3 Å²	101.3	62%	0.621	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-55.1	137.3	156.3	-77	179.9	-32.6	0	0	107.9	L930 S934	L930-Q932 PolarHBondContact O-N 2.8Å; Q932-S934 PolarHBondContact O-N 2.61Å
933	P	43.5	Very low	54.8	Low	117 Å²	117	95.1 Å²	95.1	76%	0.76	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-60.1	130.1	174	25.9	-33.1	0	0	0	108.7	I935	P933-I935 PolarHBondContact O-N 3.21Å
934	S	50.2	Low	58	Low	69 Å²	69	87 Å²	87	48%	0.483	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-64.9	120.6	-178.8	36.5	0	0	0	0	110.5	D899 Q932 T936	D899-S934 VanDerWaalsContact CG-CB 3.49Å; D899-S934 VanDerWaalsContact CG-OG 3.28Å; D899-S934 WeakPolarHBondContact OD1-CB 3.35Å; D899-S934 PolarHBondContact OD1-OG 2.96Å; D899-S934 WeakPolarHBondContact OD2-CB 3.45Å; D899-S934 PolarHBondContact OD2-OG 3.4Å; Q932-S934 PolarHBondContact O-N 2.61Å; S934-T936 PolarHBondContact O-N 2.79Å
935	I	62.2	Low	61.3	Low	37 Å²	37	82.4 Å²	82.4	19%	0.19	46%	0.457	C	S	.	.			trans	-76	91.5	176.6	-63.2	-177.3	0	0	0	108.4	N860 P933 T937 N940 I941	N860-I935 HydrophobicContact CB-CB 4.46Å; P933-I935 PolarHBondContact O-N 3.21Å; I935-T937 WeakPolarHBondContact CG2-O 3.5Å; I935-N940 HydrophobicContact CD1-CB 4.43Å; I935-N940 HydrophobicContact CG1-CB 4.45Å; I935-N940 HydrophobicContact CG2-CB 4.13Å; I935-I941 HydrophobicContact CG2-CG1 4.12Å
936	T	70.6	Confident	64.4	Low	71 Å²	71	76.1 Å²	76.1	44%	0.436	42%	0.416	S	S	.	.			trans	-75.7	-25.9	176.5	53.3	0	0	0	0	112.8	F897 D899 S934	F897-T936 PolarHBondContact N-O 2.94Å; D899-T936 WeakPolarHBondContact OD1-CG2 3.3Å; S934-T936 PolarHBondContact O-N 2.79Å
937	T	81.4	Confident	67.3	Low	53 Å²	53	70.9 Å²	70.9	33%	0.325	38%	0.384	S	S	.	.	B	Isolated β-bridge	trans	-126.5	133.9	-177.8	173.7	0	0	0	0	111.6	I935 V939 N940	I935-T937 WeakPolarHBondContact CG2-O 3.5Å; T937-V939 HydrophobicContact CG2-CG1 3.82Å; T937-V939 PolarHBondContact O-N 3.02Å; T937-V939 VanDerWaalsContact O-N 3.12Å; T937-N940 PolarHBondContact O-N 2.73Å
938	G	82.1	Confident	70	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-64.3	-14.5	-174.8	0	0	0	0	0	115.2	K893 M895 N940 I941	K893-G938 CarbonylContact O-C 3.53Å; M895-G938 WeakPolarHBondContact O-CA 3.32Å; M895-G938 PolarHBondContact O-N 2.87Å; G938-N940 PolarHBondContact O-N 2.8Å; G938-I941 WeakPolarHBondContact O-CB 3.47Å; G938-I941 WeakPolarHBondContact O-CG1 3.5Å; G938-I941 PolarHBondContact O-N 3.31Å; G938-I941 VanDerWaalsContact O-N 3.1Å
939	V	87.7	Confident	72.8	Confident	71 Å²	71	59.3 Å²	59.3	43%	0.43	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-61.9	-25.5	177.4	72.4	0	0	0	0	113.3	K893 T937	K893-V939 PolarHBondContact O-N 3.2Å; T937-V939 HydrophobicContact CG2-CG1 3.82Å; T937-V939 PolarHBondContact O-N 3.02Å; T937-V939 VanDerWaalsContact O-N 3.12Å
940	N	88.3	Confident	75.7	Confident	56 Å²	56	53.2 Å²	53.2	30%	0.299	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-88.8	0.7	178.5	-67.9	-22.7	0	0	0	113.3	I935 T937 G938 T1094	I935-N940 HydrophobicContact CD1-CB 4.43Å; I935-N940 HydrophobicContact CG1-CB 4.45Å; I935-N940 HydrophobicContact CG2-CB 4.13Å; T937-N940 PolarHBondContact O-N 2.73Å; G938-N940 PolarHBondContact O-N 2.8Å; N940-T1094 VanDerWaalsContact OD1-CG2 3.26Å; N940-T1094 WeakPolarHBondContact OD1-CG2 3.4Å; N940-T1094 PolarHBondContact OD1-OG1 2.71Å
941	I	93.5	Very high	78.5	Confident	8 Å²	8	49.7 Å²	49.7	4%	0.041	27%	0.266	C	S	.	.	S	Bend	trans	-72.5	127.6	177.1	-64.4	174.1	0	0	0	108.4	I859 I892 F897 I935 G938 I943	I859-I941 HydrophobicContact CG1-CD1 4.45Å; I859-I941 HydrophobicContact CG1-CG2 4.25Å; I859-I941 HydrophobicContact CG2-CD1 4.17Å; I892-I941 HydrophobicContact CG2-CB 4.19Å; I892-I941 HydrophobicContact CG2-CD1 3.74Å; I892-I941 HydrophobicContact CG2-CG2 4.07Å; F897-I941 HydrophobicContact CE2-CD1 3.82Å; F897-I941 HydrophobicContact CZ-CD1 3.98Å; I935-I941 HydrophobicContact CG2-CG1 4.12Å; G938-I941 WeakPolarHBondContact O-CB 3.47Å; G938-I941 WeakPolarHBondContact O-CG1 3.5Å; G938-I941 PolarHBondContact O-N 3.31Å; G938-I941 VanDerWaalsContact O-N 3.1Å; I941-I943 HydrophobicContact CG2-CG1 4.11Å; I941-I943 PolarHBondContact O-N 2.7Å
942	P	94.8	Very high	81.3	Confident	22 Å²	22	38.9 Å²	38.9	14%	0.143	23%	0.226	C	C	.	.			trans	-68.9	115.3	174.2	27.9	-33	0	0	0	109.5	D863 M864 C865	D863-P942 WeakPolarHBondContact O-CG 3.21Å; M864-P942 HydrophobicContact CE-CB 3.92Å; M864-P942 HydrophobicContact SD-CB 4.03Å; C865-P942 PolarHBondContact N-O 2.98Å
943	I	96.1	Very high	83.8	Confident	6 Å²	6	32.8 Å²	32.8	3%	0.031	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	136.6	178.5	-55.2	164.4	0	0	0	108.1	C865 I867 I892 K893 I941 T978	C865-I943 HydrophobicContact CB-CG1 4.26Å; C865-I943 CarbonylContact O-C 3.53Å; C865-I943 VanDerWaalsContact O-CA 3.32Å; C865-I943 WeakPolarHBondContact O-CA 3.37Å; I867-I943 HydrophobicContact CD1-CG2 3.6Å; I867-I943 HydrophobicContact CG1-CG2 4.11Å; I892-I943 HydrophobicContact CB-CD1 3.84Å; I892-I943 HydrophobicContact CD1-CD1 4.37Å; I892-I943 HydrophobicContact CG2-CD1 3.66Å; I892-I943 HydrophobicContact CG2-CG1 4.25Å; K893-I943 HydrophobicContact CG-CD1 4Å; I941-I943 HydrophobicContact CG2-CG1 4.11Å; I941-I943 PolarHBondContact O-N 2.7Å; I943-T978 VanDerWaalsContact O-CA 3.31Å; I943-T978 WeakPolarHBondContact O-CA 3.38Å; I943-T978 WeakPolarHBondContact O-CB 3.35Å
944	I	97.5	Very high	86	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	122.6	164.8	-171.2	168.4	0	0	0	109.8	I559 M864 C865 V866 I867 T978 F980	I559-I944 HydrophobicContact CG1-CD1 4.13Å; I559-I944 HydrophobicContact CG2-CG2 3.97Å; M864-I944 HydrophobicContact CG-CG2 3.84Å; M864-I944 HydrophobicContact SD-CB 4.08Å; M864-I944 HydrophobicContact SD-CG2 3.81Å; C865-I944 PolarHBondContact O-N 3.24Å; V866-I944 WeakPolarHBondContact CA-O 3.26Å; V866-I944 HydrophobicContact CB-CG2 4.33Å; V866-I944 HydrophobicContact CG1-CG2 4.41Å; V866-I944 HydrophobicContact CG2-CG2 3.87Å; I867-I944 PolarHBondContact N-O 3.38Å; I944-T978 WeakPolarHBondContact CA-O 3.43Å; I944-F980 HydrophobicContact CD1-CB 4.47Å
945	T	96.6	Very high	88	Confident	2 Å²	2	30.7 Å²	30.7	1%	0.012	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	125.9	-173.9	-59.2	0	0	0	0	110	I867 C885 S889 L947 L956 T978 F980	I867-T945 HydrophobicContact CB-CG2 4.3Å; I867-T945 HydrophobicContact CG2-CG2 4.42Å; C885-T945 HydrophobicContact CB-CG2 3.7Å; S889-T945 PolarHBondContact OG-OG1 2.84Å; T945-L947 HydrophobicContact CG2-CD2 4.38Å; T945-L956 HydrophobicContact CG2-CD2 4.24Å; T945-T978 PolarHBondContact N-O 3.16Å; T945-F980 PolarHBondContact O-N 2.84Å
946	E	94.6	Very high	89.4	Confident	3 Å²	3	29.1 Å²	29.1	1%	0.014	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	135.1	168.2	-176.7	-178.2	164.6	0	0	110.1	K555 I867 L868 Q872 F980	K555-E946 HydrophobicContact CD-CG 4.2Å; K555-E946 VanDerWaalsContact CD-OE1 3.3Å; K555-E946 WeakPolarHBondContact CD-OE1 3.39Å; K555-E946 WeakPolarHBondContact CE-OE1 3.29Å; K555-E946 WeakPolarHBondContact CE-OE2 3.42Å; K555-E946 IonicContact NZ-OE1 3.88Å; K555-E946 PolarHBondContact NZ-OE1 3.26Å; K555-E946 IonicContact NZ-OE2 2.7Å; K555-E946 PolarHBondContact NZ-OE2 3.5Å; I867-E946 PolarHBondContact O-N 2.73Å; L868-E946 HydrophobicContact CD2-CB 4.06Å; L868-E946 WeakPolarHBondContact CD2-OE2 3.4Å; Q872-E946 PolarHBondContact NE2-OE1 3.5Å; E946-F980 WeakPolarHBondContact CA-O 3.13Å
947	L	91.4	Very high	90.2	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	141.8	171.7	-63	175.7	0	0	0	111.3	D882 T945 V953 L956 A979 F980 A981 V982	D882-L947 HydrophobicContact CB-CD2 4.01Å; D882-L947 WeakPolarHBondContact OD1-CA 3.5Å; T945-L947 HydrophobicContact CG2-CD2 4.38Å; L947-V953 HydrophobicContact CD1-CB 3.77Å; L947-V953 HydrophobicContact CD1-CG2 3.99Å; L947-L956 HydrophobicContact CD1-CD1 3.98Å; L947-A979 HydrophobicContact CD1-CB 4.18Å; L947-F980 PolarHBondContact N-O 2.98Å; L947-A981 HydrophobicContact CB-CB 4.38Å; L947-A981 WeakPolarHBondContact O-CA 3.4Å; L947-V982 PolarHBondContact O-N 2.77Å
948	V	85.6	Confident	90.2	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.012	17%	0.165	C	C	.	.	S	Bend	trans	-91.1	-39.6	176.1	-172.7	0	0	0	0	110.4	Y494 Q872 Q881 D882	Y494-V948 HydrophobicContact CD1-CG1 3.54Å; Y494-V948 HydrophobicContact CE1-CG1 3.34Å; Y494-V948 PolarHBondContact OH-O 3.14Å; Y494-V948 VanDerWaalsContact OH-O 3.1Å; Q872-V948 HydrophobicContact CB-CG2 4.13Å; Q872-V948 HydrophobicContact CG-CG2 3.79Å; Q881-V948 HydrophobicContact CB-CB 4.47Å; Q881-V948 VanDerWaalsContact OE1-CG1 3.26Å; D882-V948 WeakPolarHBondContact OD1-CB 3.47Å; D882-V948 WeakPolarHBondContact OD1-CG2 3.44Å; D882-V948 PolarHBondContact OD1-N 3.02Å; D882-V948 PolarHBondContact OD2-N 3Å
949	N	85.7	Confident	90.2	Very high	34 Å²	34	35.5 Å²	35.5	18%	0.182	19%	0.185	C	C	.	.	S	Bend	trans	-113.8	126.1	-179.7	-176	-11.1	0	0	0	111.5	T878 D882 T951 N952	T878-N949 PolarHBondContact O-ND2 2.96Å; T878-N949 VanDerWaalsContact O-ND2 3.12Å; D882-N949 PolarHBondContact OD2-N 3.21Å; D882-N949 VanDerWaalsContact OD2-N 3.12Å; N949-T951 VanDerWaalsContact C-N 3.31Å; N949-T951 PolarHBondContact O-N 3.49Å; N949-T951 PolarHBondContact OD1-N 3.02Å; N949-T951 PolarHBondContact OD1-OG1 3.37Å; N949-T951 VanDerWaalsContact OD1-OG1 3.05Å; N949-N952 WeakPolarHBondContact O-CB 3.44Å; N949-N952 PolarHBondContact O-N 3.14Å
950	D	87.4	Confident	89.8	Confident	49 Å²	49	33.9 Å²	33.9	26%	0.262	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-60.7	-36.2	-176.5	-68.3	-5.7	0	0	0	113	N952 V953 L968 A981 S983	D950-N952 PolarHBondContact O-N 3.35Å; D950-V953 WeakPolarHBondContact O-CB 3.45Å; D950-V953 WeakPolarHBondContact O-CG1 3.12Å; D950-V953 PolarHBondContact O-N 3.04Å; D950-L968 HydrophobicContact CB-CB 4.34Å; D950-A981 VanDerWaalsContact OD1-CB 3.27Å; D950-A981 WeakPolarHBondContact OD1-CB 3.5Å; D950-S983 VanDerWaalsContact OD1-CB 3.27Å; D950-S983 WeakPolarHBondContact OD1-CB 3.19Å; D950-S983 PolarHBondContact OD1-OG 2.86Å; D950-S983 WeakPolarHBondContact OD2-CB 3.31Å; D950-S983 PolarHBondContact OD2-OG 2.96Å; D950-S983 VanDerWaalsContact OD2-OG 3.07Å
951	T	87.8	Confident	89.2	Confident	76 Å²	76	38.7 Å²	38.7	47%	0.466	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-70.4	-15.2	-176.3	63.4	0	0	0	0	113.4	N949 V953 Q954	N949-T951 VanDerWaalsContact C-N 3.31Å; N949-T951 PolarHBondContact O-N 3.49Å; N949-T951 PolarHBondContact OD1-N 3.02Å; N949-T951 PolarHBondContact OD1-OG1 3.37Å; N949-T951 VanDerWaalsContact OD1-OG1 3.05Å; T951-V953 VanDerWaalsContact C-N 3.28Å; T951-V953 PolarHBondContact O-N 2.75Å; T951-Q954 PolarHBondContact O-NE2 3.34Å; T951-Q954 VanDerWaalsContact O-NE2 3.15Å
952	N	90.8	Very high	88.3	Confident	8 Å²	8	42.9 Å²	42.9	4%	0.043	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-78.8	-9.1	177.7	-79.3	-22.9	0	0	0	113.4	S879 D882 I886 N949 D950 Q954 F955	S879-N952 PolarHBondContact O-ND2 2.95Å; S879-N952 PolarHBondContact O-OD1 2.9Å; D882-N952 HydrophobicContact CB-CB 4.33Å; D882-N952 PolarHBondContact OD2-ND2 3.06Å; I886-N952 HydrophobicContact CD1-CB 4.13Å; N949-N952 WeakPolarHBondContact O-CB 3.44Å; N949-N952 PolarHBondContact O-N 3.14Å; D950-N952 PolarHBondContact O-N 3.35Å; N952-Q954 VanDerWaalsContact C-N 3.29Å; N952-Q954 PolarHBondContact O-N 3.12Å; N952-F955 HydrophobicContact CB-CD2 4.33Å; N952-F955 WeakPolarHBondContact O-CD2 3.3Å; N952-F955 PolarHBondContact O-N 3.11Å; N952-F955 WeakPolarHBondContact OD1-CE2 3.42Å
953	V	92.3	Very high	87.5	Confident	4 Å²	4	46 Å²	46	2%	0.024	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-59.9	-36.2	-176.3	71.2	0	0	0	0	113.4	L947 D950 T951 F955 L956 L968 T971 P973 A979	L947-V953 HydrophobicContact CD1-CB 3.77Å; L947-V953 HydrophobicContact CD1-CG2 3.99Å; D950-V953 WeakPolarHBondContact O-CB 3.45Å; D950-V953 WeakPolarHBondContact O-CG1 3.12Å; D950-V953 PolarHBondContact O-N 3.04Å; T951-V953 VanDerWaalsContact C-N 3.28Å; T951-V953 PolarHBondContact O-N 2.75Å; V953-F955 PolarHBondContact O-N 3.11Å; V953-L956 WeakPolarHBondContact O-CB 3.42Å; V953-L956 PolarHBondContact O-N 2.86Å; V953-L968 HydrophobicContact CB-CD1 3.89Å; V953-L968 HydrophobicContact CG1-CD1 3.92Å; V953-L968 HydrophobicContact CG2-CD1 3.92Å; V953-T971 HydrophobicContact CG1-CG2 3.72Å; V953-P973 HydrophobicContact CG2-CB 3.92Å; V953-P973 HydrophobicContact CG2-CG 4.18Å; V953-A979 HydrophobicContact CG2-CB 3.74Å
954	Q	89.6	Confident	86.6	Confident	41 Å²	41	50 Å²	50	19%	0.192	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-54.7	-36.5	179.3	64.5	-167.6	-16.1	0	0	112.4	T951 N952 L956 D957	T951-Q954 PolarHBondContact O-NE2 3.34Å; T951-Q954 VanDerWaalsContact O-NE2 3.15Å; N952-Q954 VanDerWaalsContact C-N 3.29Å; N952-Q954 PolarHBondContact O-N 3.12Å; Q954-L956 PolarHBondContact O-N 3.19Å; Q954-D957 PolarHBondContact O-N 2.81Å; Q954-D957 VanDerWaalsContact O-O 3.09Å
955	F	92	Very high	85.8	Confident	102 Å²	102	57.3 Å²	57.3	45%	0.447	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-70.7	-3.8	-176.7	-54.7	-53.6	0	0	0	115.1	I886 N952 V953	I886-F955 HydrophobicContact CD1-CB 4.28Å; I886-F955 HydrophobicContact CD1-CD2 4.16Å; I886-F955 HydrophobicContact CG2-CB 3.87Å; N952-F955 HydrophobicContact CB-CD2 4.33Å; N952-F955 WeakPolarHBondContact O-CD2 3.3Å; N952-F955 PolarHBondContact O-N 3.11Å; N952-F955 WeakPolarHBondContact OD1-CE2 3.42Å; V953-F955 PolarHBondContact O-N 3.11Å
956	L	92.1	Very high	85.3	Confident	3 Å²	3	59.5 Å²	59.5	2%	0.016	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-82.2	-29.1	-179.5	-66.3	177.2	0	0	0	113.5	I886 K893 T945 L947 V953 Q954 P973 A979	I886-L956 HydrophobicContact CG1-CD2 4.26Å; K893-L956 PolarHBondContact NZ-O 3.38Å; T945-L956 HydrophobicContact CG2-CD2 4.24Å; L947-L956 HydrophobicContact CD1-CD1 3.98Å; V953-L956 WeakPolarHBondContact O-CB 3.42Å; V953-L956 PolarHBondContact O-N 2.86Å; Q954-L956 PolarHBondContact O-N 3.19Å; L956-P973 HydrophobicContact CB-CB 4.24Å; L956-P973 HydrophobicContact CB-CG 4.27Å; L956-P973 HydrophobicContact CD1-CB 4.3Å; L956-A979 HydrophobicContact CD1-CB 3.67Å
957	D	87.9	Confident	84.9	Confident	10 Å²	10	63.7 Å²	63.7	5%	0.053	34%	0.336	C	S	.	.			trans	-123.2	154.3	178.9	-84.4	-22.4	0	0	0	110.3	K893 Q954 Q972 P973 K1095	K893-D957 IonicContact NZ-OD1 2.98Å; K893-D957 PolarHBondContact NZ-OD1 3.32Å; Q954-D957 PolarHBondContact O-N 2.81Å; Q954-D957 VanDerWaalsContact O-O 3.09Å; D957-Q972 PolarHBondContact OD2-NE2 2.97Å; D957-P973 HydrophobicContact CB-CG 4.13Å; D957-K1095 IonicContact OD1-NZ 3.99Å; D957-K1095 PolarHBondContact OD1-NZ 3.21Å; D957-K1095 IonicContact OD2-NZ 3.71Å; D957-K1095 PolarHBondContact OD2-NZ 3.29Å
958	Q	80.9	Confident	84.8	Confident	171 Å²	171	64.6 Å²	64.6	80%	0.799	34%	0.341	S	S	*	.	S	Bend	trans	-117.9	5.9	-174	-63.4	-179.4	-11.6	0	0	112.7
959	D	82.7	Confident	85	Confident	78 Å²	78	65.4 Å²	65.4	42%	0.417	34%	0.344	S	S	.	.	S	Bend	trans	-132	23.8	-172.1	64.5	-51.2	0	0	0	111.2	R1083 K1095	D959-R1083 IonicContact OD2-CZ 2.79Å; D959-R1083 IonicContact OD2-NH1 3.26Å; D959-R1083 PolarHBondContact OD2-NH1 3.07Å; D959-R1083 IonicContact OD2-NH2 2.72Å; D959-K1095 VanDerWaalsContact CG-NZ 3.3Å; D959-K1095 IonicContact OD1-NZ 2.74Å; D959-K1095 PolarHBondContact OD1-NZ 3.11Å; D959-K1095 IonicContact OD2-NZ 3.61Å; D959-K1095 PolarHBondContact OD2-NZ 3.19Å
960	D	79.1	Confident	85.3	Confident	36 Å²	36	65.5 Å²	65.5	19%	0.193	34%	0.344	C	S	.	.	S	Bend	trans	-102.9	159.5	168.1	-155.8	9.7	0	0	0	109	D962 Q972	D960-D962 PolarHBondContact O-N 2.7Å; D960-Q972 HydrophobicContact CB-CB 4.2Å; D960-Q972 VanDerWaalsContact CG-CB 3.4Å; D960-Q972 WeakPolarHBondContact OD2-CB 3.15Å; D960-Q972 PolarHBondContact OD2-N 3.49Å
961	D	75.7	Confident	85.5	Confident	158 Å²	158	63.8 Å²	63.8	85%	0.845	34%	0.335	S	S	*	.			trans	-88.9	93.8	174	-78.6	-47.6	0	0	0	109.1	D963	D961-D963 PolarHBondContact O-N 2.89Å
962	D	73.9	Confident	85.8	Confident	96 Å²	96	60.3 Å²	60.3	51%	0.513	31%	0.314	S	S	.	.			trans	-65.2	99.4	-174.6	-65.3	-31.9	0	0	0	113.1	D960	D960-D962 PolarHBondContact O-N 2.7Å
963	D	78.9	Confident	85.9	Confident	86 Å²	86	60 Å²	60	46%	0.46	31%	0.312	S	S	.	.			trans	-114.2	114.2	165.3	-179	-6.3	0	0	0	110.4	D961 D965 T966	D961-D963 PolarHBondContact O-N 2.89Å; D963-D965 PolarHBondContact O-N 3.05Å; D963-D965 PolarHBondContact OD1-N 3.33Å; D963-T966 WeakPolarHBondContact O-CB 3.27Å; D963-T966 PolarHBondContact O-N 2.93Å; D963-T966 PolarHBondContact O-OG1 3.01Å
964	P	76.1	Confident	86.1	Confident	92 Å²	92	59.8 Å²	59.8	60%	0.597	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-14.7	-176.9	30.2	-37.5	0	0	0	114.7
965	D	81.7	Confident	86.3	Confident	152 Å²	152	57.8 Å²	57.8	81%	0.813	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-4.1	173.5	-73.1	-21.9	0	0	0	112.1	D963 E967	D963-D965 PolarHBondContact O-N 3.05Å; D963-D965 PolarHBondContact OD1-N 3.33Å; D965-E967 PolarHBondContact O-N 3.44Å
966	T	84.8	Confident	86.5	Confident	49 Å²	49	53.1 Å²	53.1	30%	0.301	28%	0.281	S	S	.	.	S	Bend	trans	-70.3	120.4	177.9	-58.2	0	0	0	0	111.6	D963 L968 L970 T971	D963-T966 WeakPolarHBondContact O-CB 3.27Å; D963-T966 PolarHBondContact O-N 2.93Å; D963-T966 PolarHBondContact O-OG1 3.01Å; T966-L968 PolarHBondContact O-N 3.35Å; T966-L970 HydrophobicContact CG2-CB 3.54Å; T966-L970 HydrophobicContact CG2-CD1 4.38Å; T966-T971 HydrophobicContact CG2-CG2 3.88Å
967	E	86.3	Confident	86.6	Confident	90 Å²	90	53 Å²	53	42%	0.421	28%	0.281	S	S	.	.			trans	-62.7	137.8	173.7	-63.3	-161.8	144.3	0	0	110.9	K426 D965 Y969 L970	K426-E967 IonicContact NZ-OE1 3.78Å; K426-E967 PolarHBondContact NZ-OE1 2.99Å; D965-E967 PolarHBondContact O-N 3.44Å; E967-Y969 HydrophobicContact CB-CD1 3.94Å; E967-Y969 HydrophobicContact CB-CE1 3.8Å; E967-Y969 PolarHBondContact O-N 2.87Å; E967-Y969 WeakPolarHBondContact OE2-CE1 3.45Å; E967-L970 PolarHBondContact O-N 3.36Å
968	L	89.5	Confident	86.9	Confident	19 Å²	19	53.6 Å²	53.6	10%	0.099	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-38	-42.9	-172.3	173.8	65.1	0	0	0	114.6	D950 V953 T966 L970 T971 F974 A981 V984	D950-L968 HydrophobicContact CB-CB 4.34Å; V953-L968 HydrophobicContact CB-CD1 3.89Å; V953-L968 HydrophobicContact CG1-CD1 3.92Å; V953-L968 HydrophobicContact CG2-CD1 3.92Å; T966-L968 PolarHBondContact O-N 3.35Å; L968-L970 VanDerWaalsContact C-N 3.29Å; L968-L970 PolarHBondContact O-N 2.96Å; L968-T971 WeakPolarHBondContact O-CB 3.4Å; L968-T971 PolarHBondContact O-N 3.25Å; L968-T971 PolarHBondContact O-OG1 3.2Å; L968-F974 HydrophobicContact CD1-CB 4.34Å; L968-F974 HydrophobicContact CD1-CD2 4.26Å; L968-F974 HydrophobicContact CD2-CD2 4.21Å; L968-F974 HydrophobicContact CD2-CE2 4.31Å; L968-F974 HydrophobicContact CG-CD2 4Å; L968-F974 HydrophobicContact CG-CE2 4.47Å; L968-F974 HydrophobicContact CG-CG 4.29Å; L968-F974 WeakPolarHBondContact O-CB 3.46Å; L968-A981 HydrophobicContact CD2-CB 3.57Å; L968-V984 HydrophobicContact CD2-CG1 3.81Å
969	Y	90.6	Very high	87.6	Confident	19 Å²	19	45.5 Å²	45.5	8%	0.075	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-70.9	-19.9	-173.8	78.6	-85	0	0	0	115.3	R579 Y593 L594 V597 E967 F974	R579-Y969 VanDerWaalsContact NH1-CD2 3.34Å; Y593-Y969 HydrophobicContact CE1-CD2 4.36Å; Y593-Y969 WeakPolarHBondContact CE1-O 3.49Å; Y593-Y969 VanDerWaalsContact CZ-O 3.23Å; Y593-Y969 PolarHBondContact OH-O 2.94Å; L594-Y969 HydrophobicContact CD2-CE2 4.12Å; V597-Y969 HydrophobicContact CG1-CD2 4.03Å; V597-Y969 HydrophobicContact CG1-CE2 3.91Å; V597-Y969 HydrophobicContact CG2-CD2 4.33Å; E967-Y969 HydrophobicContact CB-CD1 3.94Å; E967-Y969 HydrophobicContact CB-CE1 3.8Å; E967-Y969 PolarHBondContact O-N 2.87Å; E967-Y969 WeakPolarHBondContact OE2-CE1 3.45Å; Y969-F974 VanDerWaalsContact CA-CD1 3.49Å
970	L	91.2	Very high	88.2	Confident	36 Å²	36	41.8 Å²	41.8	19%	0.188	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-83.9	-17.3	177.6	-68.3	170.5	0	0	0	112.3	W589 L594 T966 E967 L968	W589-L970 WeakPolarHBondContact CH2-O 2.98Å; L594-L970 HydrophobicContact CD1-CD2 4.42Å; L594-L970 HydrophobicContact CD2-CD2 3.82Å; L594-L970 HydrophobicContact CG-CD2 4.42Å; T966-L970 HydrophobicContact CG2-CB 3.54Å; T966-L970 HydrophobicContact CG2-CD1 4.38Å; E967-L970 PolarHBondContact O-N 3.36Å; L968-L970 VanDerWaalsContact C-N 3.29Å; L968-L970 PolarHBondContact O-N 2.96Å
971	T	92.6	Very high	88.8	Confident	13 Å²	13	40.1 Å²	40.1	8%	0.08	22%	0.218	C	C	.	.	S	Bend	trans	-69	144.6	-178.3	71	0	0	0	0	111.9	V953 T966 L968 F974 A975	V953-T971 HydrophobicContact CG1-CG2 3.72Å; T966-T971 HydrophobicContact CG2-CG2 3.88Å; L968-T971 WeakPolarHBondContact O-CB 3.4Å; L968-T971 PolarHBondContact O-N 3.25Å; L968-T971 PolarHBondContact O-OG1 3.2Å; T971-F974 PolarHBondContact O-N 3.25Å; T971-A975 WeakPolarHBondContact O-CB 3.24Å; T971-A975 PolarHBondContact O-N 3.2Å
972	Q	92.6	Very high	89.4	Confident	3 Å²	3	33.1 Å²	33.1	1%	0.014	18%	0.181	C	C	.	.	H	α-helix	trans	-60.3	-43.5	-178.3	-177.9	-177.4	-102.5	0	0	113.9	W589 D957 D960 F974 A975 C976 K1095	W589-Q972 HydrophobicContact CH2-CB 4.44Å; W589-Q972 HydrophobicContact CZ2-CB 4.09Å; D957-Q972 PolarHBondContact OD2-NE2 2.97Å; D960-Q972 HydrophobicContact CB-CB 4.2Å; D960-Q972 VanDerWaalsContact CG-CB 3.4Å; D960-Q972 WeakPolarHBondContact OD2-CB 3.15Å; D960-Q972 PolarHBondContact OD2-N 3.49Å; Q972-F974 VanDerWaalsContact C-N 3.29Å; Q972-F974 PolarHBondContact O-N 2.9Å; Q972-A975 PolarHBondContact O-N 2.78Å; Q972-C976 VanDerWaalsContact O-CB 3.3Å; Q972-C976 WeakPolarHBondContact O-CB 3.41Å; Q972-C976 PolarHBondContact O-N 2.69Å; Q972-C976 PolarHBondContact O-SG 3.24Å; Q972-K1095 VanDerWaalsContact NE2-NZ 3.14Å
973	P	94.6	Very high	89.9	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.006	16%	0.16	C	C	.	.	H	α-helix	trans	-63.9	-35.8	-177	-22.6	35.2	0	0	0	112.4	V953 L956 D957 G977 T978 A979	V953-P973 HydrophobicContact CG2-CB 3.92Å; V953-P973 HydrophobicContact CG2-CG 4.18Å; L956-P973 HydrophobicContact CB-CB 4.24Å; L956-P973 HydrophobicContact CB-CG 4.27Å; L956-P973 HydrophobicContact CD1-CB 4.3Å; D957-P973 HydrophobicContact CB-CG 4.13Å; P973-G977 PolarHBondContact O-N 3.38Å; P973-T978 WeakPolarHBondContact CA-OG1 3.46Å; P973-T978 PolarHBondContact O-N 3.21Å; P973-T978 PolarHBondContact O-OG1 3.26Å; P973-A979 HydrophobicContact CB-CB 4.04Å; P973-A979 PolarHBondContact O-N 3.16Å
974	F	95.2	Very high	90.3	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-70.9	-48.9	174.1	-175.4	-90.5	0	0	0	111.6	T570 A573 N574 L968 Y969 T971 Q972 C976 G977 V984	T570-F974 WeakPolarHBondContact CB-O 3.47Å; T570-F974 HydrophobicContact CG2-CD1 3.87Å; T570-F974 HydrophobicContact CG2-CE1 3.7Å; T570-F974 HydrophobicContact CG2-CZ 4.36Å; T570-F974 WeakPolarHBondContact CG2-O 3.39Å; T570-F974 PolarHBondContact OG1-O 3.39Å; A573-F974 HydrophobicContact CB-CZ 3.98Å; N574-F974 WeakPolarHBondContact OD1-CE1 3.27Å; L968-F974 HydrophobicContact CD1-CB 4.34Å; L968-F974 HydrophobicContact CD1-CD2 4.26Å; L968-F974 HydrophobicContact CD2-CD2 4.21Å; L968-F974 HydrophobicContact CD2-CE2 4.31Å; L968-F974 HydrophobicContact CG-CD2 4Å; L968-F974 HydrophobicContact CG-CE2 4.47Å; L968-F974 HydrophobicContact CG-CG 4.29Å; L968-F974 WeakPolarHBondContact O-CB 3.46Å; Y969-F974 VanDerWaalsContact CA-CD1 3.49Å; T971-F974 PolarHBondContact O-N 3.25Å; Q972-F974 VanDerWaalsContact C-N 3.29Å; Q972-F974 PolarHBondContact O-N 2.9Å; F974-C976 PolarHBondContact O-N 3.34Å; F974-G977 PolarHBondContact O-N 3Å; F974-V984 HydrophobicContact CE2-CG1 3.9Å; F974-V984 HydrophobicContact CZ-CG1 4.14Å
975	A	94.6	Very high	90.9	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-60.8	-28.2	179.2	0	0	0	0	0	113.4	W589 Y593 T971 Q972 Y1097 V1098	W589-A975 HydrophobicContact CH2-CB 3.82Å; W589-A975 HydrophobicContact CZ3-CB 3.48Å; W589-A975 VanDerWaalsContact CZ3-CB 3.48Å; Y593-A975 HydrophobicContact CD1-CB 4.39Å; Y593-A975 HydrophobicContact CD2-CB 3.97Å; Y593-A975 HydrophobicContact CE1-CB 4.1Å; Y593-A975 HydrophobicContact CE2-CB 3.69Å; Y593-A975 HydrophobicContact CG-CB 4.33Å; T971-A975 WeakPolarHBondContact O-CB 3.24Å; T971-A975 PolarHBondContact O-N 3.2Å; Q972-A975 PolarHBondContact O-N 2.78Å; A975-Y1097 WeakPolarHBondContact O-CA 3.31Å; A975-V1098 PolarHBondContact O-N 2.83Å
976	C	95.1	Very high	91.2	Very high	3 Å²	3	14 Å²	14	2%	0.02	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-6.8	173.9	-61.8	0	0	0	0	114.3	Q972 F974 T978 Y1080 R1096	Q972-C976 VanDerWaalsContact O-CB 3.3Å; Q972-C976 WeakPolarHBondContact O-CB 3.41Å; Q972-C976 PolarHBondContact O-N 2.69Å; Q972-C976 PolarHBondContact O-SG 3.24Å; F974-C976 PolarHBondContact O-N 3.34Å; C976-T978 VanDerWaalsContact C-N 3.35Å; C976-T978 HydrophobicContact CB-CG2 4.38Å; C976-T978 PolarHBondContact O-N 2.93Å; C976-Y1080 PolarHBondContact O-OH 3.26Å; C976-R1096 WeakPolarHBondContact CA-O 3.47Å; C976-R1096 VanDerWaalsContact CB-O 3.22Å; C976-R1096 WeakPolarHBondContact CB-O 3.26Å; C976-R1096 PolarHBondContact SG-O 2.99Å; C976-R1096 VanDerWaalsContact SG-O 3.35Å
977	G	95.1	Very high	91.3	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	69	28.5	-178.9	0	0	0	0	0	115	T570 P973 F974	T570-G977 VanDerWaalsContact OG1-CA 3.25Å; T570-G977 WeakPolarHBondContact OG1-CA 3.46Å; P973-G977 PolarHBondContact O-N 3.38Å; F974-G977 PolarHBondContact O-N 3Å
978	T	95.1	Very high	91.5	Very high	24 Å²	24	7.8 Å²	7.8	15%	0.147	4%	0.044	C	C	.	.	S	Bend	trans	-97.3	-14.1	172.9	62.7	0	0	0	0	112.7	I943 I944 T945 P973 C976	I943-T978 VanDerWaalsContact O-CA 3.31Å; I943-T978 WeakPolarHBondContact O-CA 3.38Å; I943-T978 WeakPolarHBondContact O-CB 3.35Å; I944-T978 WeakPolarHBondContact CA-O 3.43Å; T945-T978 PolarHBondContact N-O 3.16Å; P973-T978 WeakPolarHBondContact CA-OG1 3.46Å; P973-T978 PolarHBondContact O-N 3.21Å; P973-T978 PolarHBondContact O-OG1 3.26Å; C976-T978 VanDerWaalsContact C-N 3.35Å; C976-T978 HydrophobicContact CB-CG2 4.38Å; C976-T978 PolarHBondContact O-N 2.93Å
979	A	95.3	Very high	91.6	Very high	1 Å²	1	7 Å²	7	1%	0.008	4%	0.039	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	143.4	172.7	0	0	0	0	0	111.4	L947 V953 L956 P973	L947-A979 HydrophobicContact CD1-CB 4.18Å; V953-A979 HydrophobicContact CG2-CB 3.74Å; L956-A979 HydrophobicContact CD1-CB 3.67Å; P973-A979 HydrophobicContact CB-CB 4.04Å; P973-A979 PolarHBondContact O-N 3.16Å
980	F	95.2	Very high	91.6	Very high	0 Å²	0	6.1 Å²	6.1	0%	0	4%	0.036	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	112.3	169.1	-172.7	-91	0	0	0	110.3	K555 F558 I559 I944 T945 E946 L947 V984 L985	K555-F980 HydrophobicContact CB-CE1 4.2Å; K555-F980 HydrophobicContact CG-CD1 4.14Å; K555-F980 HydrophobicContact CG-CE1 3.89Å; F558-F980 HydrophobicContact CB-CE2 3.9Å; F558-F980 HydrophobicContact CB-CZ 4.04Å; F558-F980 HydrophobicContact CD2-CE2 4.16Å; F558-F980 AromaticContact CD2-CZ 3.78Å; F558-F980 HydrophobicContact CD2-CZ 3.78Å; F558-F980 HydrophobicContact CG-CE2 4.16Å; F558-F980 HydrophobicContact CG-CZ 4.19Å; I559-F980 HydrophobicContact CD1-CD1 4.38Å; I559-F980 HydrophobicContact CG1-CB 4.45Å; I559-F980 HydrophobicContact CG1-CD1 4.44Å; I559-F980 HydrophobicContact CG1-CG 4.44Å; I944-F980 HydrophobicContact CD1-CB 4.47Å; T945-F980 PolarHBondContact O-N 2.84Å; E946-F980 WeakPolarHBondContact CA-O 3.13Å; L947-F980 PolarHBondContact N-O 2.98Å; F980-V984 HydrophobicContact CE2-CG2 4.04Å; F980-V984 HydrophobicContact CZ-CG2 3.91Å; F980-L985 HydrophobicContact CZ-CD2 4.27Å; F980-L985 HydrophobicContact CZ-CG 4.5Å
981	A	90.9	Very high	91.5	Very high	0 Å²	0	4.9 Å²	4.9	0%	0	3%	0.031	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	150.5	174.9	0	0	0	0	0	111.6	L947 D950 L968 S983 V984	L947-A981 HydrophobicContact CB-CB 4.38Å; L947-A981 WeakPolarHBondContact O-CA 3.4Å; D950-A981 VanDerWaalsContact OD1-CB 3.27Å; D950-A981 WeakPolarHBondContact OD1-CB 3.5Å; L968-A981 HydrophobicContact CD2-CB 3.57Å; A981-S983 VanDerWaalsContact C-N 3.32Å; A981-S983 WeakPolarHBondContact CB-OG 3.09Å; A981-V984 WeakPolarHBondContact O-CG2 3.39Å
982	V	87.4	Confident	91.5	Very high	11 Å²	11	4.2 Å²	4.2	7%	0.067	3%	0.027	C	C	.	.	G	3₁₀ helix	trans	-72.1	-25.5	178.7	68.6	0	0	0	0	113.2	K493 Y494 L551 L947 V984 L985	K493-V982 HydrophobicContact CD-CG1 4.12Å; K493-V982 HydrophobicContact CD-CG2 4.04Å; Y494-V982 HydrophobicContact CE1-CG1 4.07Å; L551-V982 HydrophobicContact CD1-CG2 4.43Å; L947-V982 PolarHBondContact O-N 2.77Å; V982-V984 VanDerWaalsContact C-N 3.27Å; V982-V984 PolarHBondContact O-N 2.99Å; V982-L985 HydrophobicContact CG2-CD1 4.44Å; V982-L985 WeakPolarHBondContact O-CB 3.34Å; V982-L985 PolarHBondContact O-N 2.82Å; V982-L985 VanDerWaalsContact O-N 3.09Å
983	S	85.2	Confident	91.5	Very high	8 Å²	8	4.9 Å²	4.9	6%	0.056	3%	0.03	C	C	.	.	G	3₁₀ helix	trans	-51.7	-38.8	179.4	54.4	0	0	0	0	113.8	D950 A981 L985 D986	D950-S983 VanDerWaalsContact OD1-CB 3.27Å; D950-S983 WeakPolarHBondContact OD1-CB 3.19Å; D950-S983 PolarHBondContact OD1-OG 2.86Å; D950-S983 WeakPolarHBondContact OD2-CB 3.31Å; D950-S983 PolarHBondContact OD2-OG 2.96Å; D950-S983 VanDerWaalsContact OD2-OG 3.07Å; A981-S983 VanDerWaalsContact C-N 3.32Å; A981-S983 WeakPolarHBondContact CB-OG 3.09Å; S983-L985 PolarHBondContact O-N 2.95Å; S983-D986 WeakPolarHBondContact O-CB 3.47Å; S983-D986 PolarHBondContact O-N 2.78Å
984	V	87.5	Confident	91.2	Very high	9 Å²	9	7.4 Å²	7.4	6%	0.055	4%	0.041	C	C	.	.	G	3₁₀ helix	trans	-57.9	-27.5	-179.2	-51.1	0	0	0	0	112.4	A573 F576 L968 F974 F980 A981 V982 D986 S987	A573-V984 HydrophobicContact CB-CB 4.38Å; A573-V984 HydrophobicContact CB-CG2 4.15Å; F576-V984 WeakPolarHBondContact CE2-O 3.38Å; L968-V984 HydrophobicContact CD2-CG1 3.81Å; F974-V984 HydrophobicContact CE2-CG1 3.9Å; F974-V984 HydrophobicContact CZ-CG1 4.14Å; F980-V984 HydrophobicContact CE2-CG2 4.04Å; F980-V984 HydrophobicContact CZ-CG2 3.91Å; A981-V984 WeakPolarHBondContact O-CG2 3.39Å; V982-V984 VanDerWaalsContact C-N 3.27Å; V982-V984 PolarHBondContact O-N 2.99Å; V984-D986 VanDerWaalsContact C-N 3.26Å; V984-D986 PolarHBondContact O-N 2.84Å; V984-S987 PolarHBondContact O-N 3.06Å
985	L	89.3	Confident	90.7	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.053	C	C	.	.	G	3₁₀ helix	trans	-73	-13.7	179.5	-57.4	-178.8	0	0	0	113.4	L551 L554 K555 F558 F576 F980 V982 S983 S987 L988	L551-L985 HydrophobicContact CD2-CB 3.88Å; L551-L985 HydrophobicContact CD2-CD1 3.98Å; L554-L985 HydrophobicContact CB-CD1 4.23Å; L554-L985 HydrophobicContact CB-CD2 4.35Å; K555-L985 HydrophobicContact CB-CD1 4.26Å; F558-L985 HydrophobicContact CD2-CD2 4.05Å; F558-L985 HydrophobicContact CE2-CD2 3.61Å; F576-L985 HydrophobicContact CZ-CD2 4.19Å; F980-L985 HydrophobicContact CZ-CD2 4.27Å; F980-L985 HydrophobicContact CZ-CG 4.5Å; V982-L985 HydrophobicContact CG2-CD1 4.44Å; V982-L985 WeakPolarHBondContact O-CB 3.34Å; V982-L985 PolarHBondContact O-N 2.82Å; V982-L985 VanDerWaalsContact O-N 3.09Å; S983-L985 PolarHBondContact O-N 2.95Å; L985-S987 VanDerWaalsContact C-N 3.32Å; L985-S987 PolarHBondContact O-N 2.67Å; L985-L988 VanDerWaalsContact O-CB 3.27Å; L985-L988 WeakPolarHBondContact O-CB 3.43Å; L985-L988 PolarHBondContact O-N 2.81Å
986	D	86.6	Confident	90.3	Very high	9 Å²	9	12.6 Å²	12.6	5%	0.048	7%	0.068	C	C	.	.	G	3₁₀ helix	trans	-64.8	-36.7	174.4	-72.2	-24.1	0	0	0	111.4	N423 K493 Q524 S983 V984 L988 M989	N423-D986 HydrophobicContact CB-CB 4.34Å; K493-D986 IonicContact NZ-OD1 3.75Å; K493-D986 PolarHBondContact NZ-OD1 3.04Å; K493-D986 IonicContact NZ-OD2 3.33Å; K493-D986 PolarHBondContact NZ-OD2 3.12Å; Q524-D986 PolarHBondContact NE2-OD1 2.76Å; S983-D986 WeakPolarHBondContact O-CB 3.47Å; S983-D986 PolarHBondContact O-N 2.78Å; V984-D986 VanDerWaalsContact C-N 3.26Å; V984-D986 PolarHBondContact O-N 2.84Å; D986-L988 PolarHBondContact O-N 3.03Å; D986-L988 VanDerWaalsContact O-N 3.1Å; D986-M989 WeakPolarHBondContact O-CB 3.48Å; D986-M989 PolarHBondContact O-N 3.1Å; D986-M989 VanDerWaalsContact O-N 3.1Å
987	S	87.6	Confident	89.9	Confident	8 Å²	8	15.1 Å²	15.1	6%	0.056	8%	0.082	C	C	.	.	H	α-helix	trans	-54.3	-32.7	175.6	-58.2	0	0	0	0	112.6	D427 S577 V984 L985 M989 S990 A991	D427-S987 PolarHBondContact OD1-OG 3.28Å; D427-S987 WeakPolarHBondContact OD2-CA 3.41Å; D427-S987 WeakPolarHBondContact OD2-CB 3.28Å; D427-S987 PolarHBondContact OD2-OG 3.43Å; S577-S987 PolarHBondContact OG-OG 3.04Å; V984-S987 PolarHBondContact O-N 3.06Å; L985-S987 VanDerWaalsContact C-N 3.32Å; L985-S987 PolarHBondContact O-N 2.67Å; S987-M989 VanDerWaalsContact C-N 3.27Å; S987-M989 PolarHBondContact O-N 3.46Å; S987-S990 PolarHBondContact O-N 2.83Å; S987-S990 PolarHBondContact O-OG 3Å; S987-A991 PolarHBondContact O-N 2.97Å; S987-A991 VanDerWaalsContact O-N 3.09Å
988	L	90.6	Very high	89.6	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-66.6	-24.9	-176.7	-165.3	64.5	0	0	0	112.8	I549 L554 F576 L985 D986 S990 A991 T992 I998 L999 I1002	I549-L988 HydrophobicContact CD1-CB 4.42Å; I549-L988 HydrophobicContact CD1-CD2 4.45Å; I549-L988 HydrophobicContact CD1-CG 4.13Å; I549-L988 HydrophobicContact CG2-CD2 4.07Å; L554-L988 HydrophobicContact CD1-CD2 3.39Å; F576-L988 HydrophobicContact CB-CD1 4.29Å; F576-L988 HydrophobicContact CD1-CD1 4.37Å; F576-L988 HydrophobicContact CD2-CB 4.27Å; F576-L988 HydrophobicContact CD2-CD1 4.19Å; F576-L988 HydrophobicContact CE2-CB 4.32Å; F576-L988 HydrophobicContact CG-CD1 4.05Å; L985-L988 VanDerWaalsContact O-CB 3.27Å; L985-L988 WeakPolarHBondContact O-CB 3.43Å; L985-L988 PolarHBondContact O-N 2.81Å; D986-L988 PolarHBondContact O-N 3.03Å; D986-L988 VanDerWaalsContact O-N 3.1Å; L988-S990 VanDerWaalsContact C-N 3.31Å; L988-S990 PolarHBondContact O-N 3.12Å; L988-A991 HydrophobicContact CD1-CB 4.41Å; L988-A991 PolarHBondContact O-N 3.32Å; L988-T992 VanDerWaalsContact O-CB 3.24Å; L988-T992 WeakPolarHBondContact O-CB 3.43Å; L988-T992 PolarHBondContact O-N 3.15Å; L988-T992 PolarHBondContact O-OG1 3.25Å; L988-I998 HydrophobicContact CD1-CG2 4.4Å; L988-L999 HydrophobicContact CD2-CD1 3.92Å; L988-I1002 HydrophobicContact CD1-CD1 3.74Å
989	M	91.3	Very high	89.4	Confident	1 Å²	1	14.3 Å²	14.3	1%	0.005	8%	0.076	C	C	.	.	H	α-helix	trans	-59.7	-43.9	170	-72.1	-66.9	-67.6	0	0	110.9	L488 L490 I522 Q524 I549 D986 S987 Y993	L488-M989 HydrophobicContact CB-CE 3.87Å; L488-M989 HydrophobicContact CD2-CE 4.13Å; L488-M989 HydrophobicContact CG-CE 4.11Å; L490-M989 HydrophobicContact CD2-CE 4.16Å; L490-M989 HydrophobicContact CD2-CG 4.29Å; I522-M989 HydrophobicContact CB-CE 4.3Å; I522-M989 HydrophobicContact CG2-CE 3.86Å; I522-M989 HydrophobicContact CG2-SD 3.86Å; Q524-M989 HydrophobicContact CG-CE 4.4Å; Q524-M989 HydrophobicContact CG-CG 4.04Å; Q524-M989 HydrophobicContact CG-SD 3.49Å; Q524-M989 WeakPolarHBondContact CG-SD 3.39Å; I549-M989 HydrophobicContact CD1-CG 4.39Å; I549-M989 HydrophobicContact CD1-SD 3.74Å; D986-M989 WeakPolarHBondContact O-CB 3.48Å; D986-M989 PolarHBondContact O-N 3.1Å; D986-M989 VanDerWaalsContact O-N 3.1Å; S987-M989 VanDerWaalsContact C-N 3.27Å; S987-M989 PolarHBondContact O-N 3.46Å; M989-Y993 PolarHBondContact O-N 2.83Å
990	S	90.3	Very high	89	Confident	1 Å²	1	17.2 Å²	17.2	1%	0.007	9%	0.094	C	C	.	.	H	α-helix	trans	-71.7	-43.7	178.6	87.6	0	0	0	0	111.4	R433 S987 L988 T992 Y993 F994	R433-S990 PolarHBondContact NH1-OG 3.11Å; R433-S990 PolarHBondContact NH2-OG 3.37Å; S987-S990 PolarHBondContact O-N 2.83Å; S987-S990 PolarHBondContact O-OG 3Å; L988-S990 VanDerWaalsContact C-N 3.31Å; L988-S990 PolarHBondContact O-N 3.12Å; S990-T992 VanDerWaalsContact C-N 3.33Å; S990-T992 PolarHBondContact O-N 2.8Å; S990-Y993 PolarHBondContact O-N 3Å; S990-F994 VanDerWaalsContact O-CD2 3.25Å; S990-F994 WeakPolarHBondContact O-CD2 3.18Å; S990-F994 PolarHBondContact O-N 2.76Å
991	A	89.7	Confident	88.8	Confident	10 Å²	10	17.4 Å²	17.4	8%	0.083	10%	0.095	C	C	.	.	H	α-helix	trans	-62.9	-39.5	-179.9	0	0	0	0	0	112	F576 S987 L988 F994 N995	F576-A991 HydrophobicContact CB-CB 4.27Å; S987-A991 PolarHBondContact O-N 2.97Å; S987-A991 VanDerWaalsContact O-N 3.09Å; L988-A991 HydrophobicContact CD1-CB 4.41Å; L988-A991 PolarHBondContact O-N 3.32Å; A991-F994 PolarHBondContact O-N 3.06Å; A991-N995 PolarHBondContact O-N 2.71Å
992	T	92.1	Very high	88.8	Confident	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-66.6	-39.3	176.8	-54.3	0	0	0	0	111.7	R520 I522 D547 L988 S990 N995 D996 L999	R520-T992 PolarHBondContact NH1-O 3.32Å; R520-T992 PolarHBondContact NH2-O 3.37Å; I522-T992 HydrophobicContact CD1-CG2 4.19Å; I522-T992 HydrophobicContact CG2-CG2 4.26Å; D547-T992 HydrophobicContact CB-CG2 3.72Å; D547-T992 VanDerWaalsContact OD2-CG2 3.23Å; D547-T992 WeakPolarHBondContact OD2-CG2 3.29Å; L988-T992 VanDerWaalsContact O-CB 3.24Å; L988-T992 WeakPolarHBondContact O-CB 3.43Å; L988-T992 PolarHBondContact O-N 3.15Å; L988-T992 PolarHBondContact O-OG1 3.25Å; S990-T992 VanDerWaalsContact C-N 3.33Å; S990-T992 PolarHBondContact O-N 2.8Å; T992-N995 CarbonylContact O-C 3.53Å; T992-N995 PolarHBondContact O-N 3.33Å; T992-D996 PolarHBondContact O-N 3.2Å; T992-L999 HydrophobicContact CG2-CB 4.11Å; T992-L999 HydrophobicContact CG2-CD2 4.2Å
993	Y	92.1	Very high	88.9	Confident	17 Å²	17	18.5 Å²	18.5	7%	0.067	10%	0.098	C	C	.	.	H	α-helix	trans	-61.3	-43.5	175.2	171.2	-104.6	0	0	0	112.7	I410 F428 D485 A486 L488 R520 M989 S990	I410-Y993 HydrophobicContact CG2-CD2 4.24Å; I410-Y993 HydrophobicContact CG2-CE1 4.34Å; I410-Y993 HydrophobicContact CG2-CE2 3.58Å; F428-Y993 AromaticContact CE2-CD1 3.4Å; F428-Y993 HydrophobicContact CE2-CD1 3.4Å; F428-Y993 AromaticContact CE2-CE1 3.83Å; F428-Y993 HydrophobicContact CE2-CE1 3.83Å; F428-Y993 HydrophobicContact CE2-CG 4.11Å; F428-Y993 AromaticContact CZ-CD1 3.71Å; F428-Y993 HydrophobicContact CZ-CD1 3.71Å; F428-Y993 AromaticContact CZ-CE1 3.6Å; F428-Y993 HydrophobicContact CZ-CE1 3.6Å; D485-Y993 PolarHBondContact OD2-OH 2.93Å; A486-Y993 HydrophobicContact CB-CD2 3.77Å; A486-Y993 HydrophobicContact CB-CE2 3.74Å; L488-Y993 HydrophobicContact CD1-CD2 4.44Å; R520-Y993 PolarHBondContact NH1-O 3.23Å; M989-Y993 PolarHBondContact O-N 2.83Å; S990-Y993 PolarHBondContact O-N 3Å
994	F	88.4	Confident	89.1	Confident	54 Å²	54	20 Å²	20	24%	0.237	11%	0.107	C	C	.	.	H	α-helix	trans	-79	-28.8	179.7	-72.3	-69.3	0	0	0	113.8	F428 R433 V436 S990 A991	F428-F994 HydrophobicContact CD2-CE2 4.01Å; F428-F994 HydrophobicContact CE1-CE2 4.48Å; F428-F994 HydrophobicContact CE1-CZ 4.1Å; F428-F994 AromaticContact CE2-CE2 3.85Å; F428-F994 HydrophobicContact CE2-CE2 3.85Å; F428-F994 HydrophobicContact CE2-CZ 4.07Å; F428-F994 HydrophobicContact CG-CE2 4.4Å; F428-F994 HydrophobicContact CZ-CE2 4.1Å; F428-F994 AromaticContact CZ-CZ 3.84Å; F428-F994 HydrophobicContact CZ-CZ 3.84Å; R433-F994 VanDerWaalsContact NH1-CE2 3.26Å; V436-F994 HydrophobicContact CB-CE1 4.1Å; V436-F994 HydrophobicContact CG1-CE1 4.14Å; V436-F994 HydrophobicContact CG2-CD1 4.42Å; V436-F994 HydrophobicContact CG2-CE1 3.69Å; V436-F994 HydrophobicContact CG2-CZ 4.35Å; S990-F994 VanDerWaalsContact O-CD2 3.25Å; S990-F994 WeakPolarHBondContact O-CD2 3.18Å; S990-F994 PolarHBondContact O-N 2.76Å; A991-F994 PolarHBondContact O-N 3.06Å
995	N	86.6	Confident	89.2	Confident	47 Å²	47	20.9 Å²	20.9	25%	0.251	11%	0.111	S	C	.	.			trans	-145.1	97.3	178.4	-70.1	-80.7	0	0	0	111.9	T603 A991 T992 N997 I998	T603-N995 PolarHBondContact OG1-OD1 3.02Å; A991-N995 PolarHBondContact O-N 2.71Å; T992-N995 CarbonylContact O-C 3.53Å; T992-N995 PolarHBondContact O-N 3.33Å; N995-N997 PolarHBondContact O-N 3.22Å; N995-N997 VanDerWaalsContact O-N 3.09Å; N995-I998 HydrophobicContact CB-CB 4.45Å; N995-I998 HydrophobicContact CB-CD1 4.39Å; N995-I998 HydrophobicContact CB-CG1 3.44Å; N995-I998 VanDerWaalsContact CB-CG1 3.44Å; N995-I998 WeakPolarHBondContact O-CB 3.39Å; N995-I998 WeakPolarHBondContact O-CG1 3.48Å; N995-I998 PolarHBondContact O-N 3.46Å
996	D	84.4	Confident	89.4	Confident	61 Å²	61	20.9 Å²	20.9	33%	0.326	11%	0.111	S	C	.	.	H	α-helix	trans	-51.9	-36.6	-178.9	-47.8	18.1	0	0	0	112.4	R520 T992 I998	R520-D996 IonicContact CZ-OD1 3.63Å; R520-D996 IonicContact CZ-OD2 2.69Å; R520-D996 VanDerWaalsContact NH1-CG 3.33Å; R520-D996 IonicContact NH1-OD1 2.71Å; R520-D996 PolarHBondContact NH1-OD1 3.45Å; R520-D996 IonicContact NH1-OD2 2.77Å; R520-D996 VanDerWaalsContact NH2-CG 3.27Å; R520-D996 IonicContact NH2-OD1 3.06Å; R520-D996 PolarHBondContact NH2-OD1 3.31Å; R520-D996 IonicContact NH2-OD2 3.98Å; T992-D996 PolarHBondContact O-N 3.2Å; D996-I998 VanDerWaalsContact C-N 3.3Å; D996-I998 PolarHBondContact O-N 3.5Å
997	N	87.6	Confident	89.5	Confident	56 Å²	56	20.9 Å²	20.9	30%	0.299	11%	0.111	S	C	.	.	H	α-helix	trans	-73.1	-15.7	-177.5	-61.5	-65.8	0	0	0	114.5	T603 F661 N995 T1000 L1001	T603-N997 HydrophobicContact CG2-CB 4.41Å; F661-N997 HydrophobicContact CE1-CB 3.61Å; F661-N997 HydrophobicContact CZ-CB 3.76Å; N995-N997 PolarHBondContact O-N 3.22Å; N995-N997 VanDerWaalsContact O-N 3.09Å; N997-T1000 PolarHBondContact O-N 3.39Å; N997-L1001 PolarHBondContact O-N 2.89Å
998	I	88.5	Confident	89.1	Confident	3 Å²	3	20.7 Å²	20.7	2%	0.015	11%	0.111	C	C	.	.	H	α-helix	trans	-66	-46.7	-177.5	-65.8	-67	0	0	0	110.6	M601 T603 L988 N995 D996 T1000 L1001 I1002	M601-I998 HydrophobicContact CB-CD1 3.86Å; M601-I998 HydrophobicContact CG-CD1 3.52Å; M601-I998 WeakPolarHBondContact O-CD1 3.42Å; M601-I998 HydrophobicContact SD-CD1 3.64Å; M601-I998 HydrophobicContact SD-CG2 4.39Å; T603-I998 HydrophobicContact CG2-CD1 4.29Å; L988-I998 HydrophobicContact CD1-CG2 4.4Å; N995-I998 HydrophobicContact CB-CB 4.45Å; N995-I998 HydrophobicContact CB-CD1 4.39Å; N995-I998 HydrophobicContact CB-CG1 3.44Å; N995-I998 VanDerWaalsContact CB-CG1 3.44Å; N995-I998 WeakPolarHBondContact O-CB 3.39Å; N995-I998 WeakPolarHBondContact O-CG1 3.48Å; N995-I998 PolarHBondContact O-N 3.46Å; D996-I998 VanDerWaalsContact C-N 3.3Å; D996-I998 PolarHBondContact O-N 3.5Å; I998-T1000 VanDerWaalsContact C-N 3.3Å; I998-T1000 PolarHBondContact O-N 3.39Å; I998-L1001 PolarHBondContact O-N 3.49Å; I998-I1002 HydrophobicContact CG2-CD1 3.63Å; I998-I1002 HydrophobicContact CG2-CG1 4.37Å; I998-I1002 WeakPolarHBondContact O-CB 3.32Å; I998-I1002 WeakPolarHBondContact O-CG1 3.16Å; I998-I1002 PolarHBondContact O-N 2.89Å
999	L	90.4	Very high	88.3	Confident	4 Å²	4	20.9 Å²	20.9	2%	0.021	11%	0.113	C	C	.	.	H	α-helix	trans	-59.9	-43.2	176	-178	64.4	0	0	0	110.8	D547 I549 L554 L988 T992 L1001 I1002 R1003	D547-L999 HydrophobicContact CB-CD2 3.84Å; I549-L999 HydrophobicContact CG1-CD1 4.14Å; I549-L999 HydrophobicContact CG1-CD2 3.82Å; L554-L999 HydrophobicContact CD1-CD1 4.21Å; L988-L999 HydrophobicContact CD2-CD1 3.92Å; T992-L999 HydrophobicContact CG2-CB 4.11Å; T992-L999 HydrophobicContact CG2-CD2 4.2Å; L999-L1001 PolarHBondContact O-N 2.66Å; L999-I1002 PolarHBondContact O-N 3.04Å; L999-R1003 HydrophobicContact CD1-CG 4.08Å; L999-R1003 HydrophobicContact CG-CG 4.29Å; L999-R1003 VanDerWaalsContact O-CB 3.29Å; L999-R1003 WeakPolarHBondContact O-CB 3.46Å; L999-R1003 WeakPolarHBondContact O-CG 3.37Å; L999-R1003 PolarHBondContact O-N 3.43Å
1000	T	88.2	Confident	87.7	Confident	62 Å²	62	21.3 Å²	21.3	38%	0.38	12%	0.116	S	C	.	.	H	α-helix	trans	-65.9	-40.1	180	-55.1	0	0	0	0	112.1	I644 N997 I998 T1004	I644-T1000 HydrophobicContact CD1-CG2 3.68Å; I644-T1000 HydrophobicContact CG1-CG2 4.49Å; N997-T1000 PolarHBondContact O-N 3.39Å; I998-T1000 VanDerWaalsContact C-N 3.3Å; I998-T1000 PolarHBondContact O-N 3.39Å; T1000-T1004 WeakPolarHBondContact O-CB 3.48Å; T1000-T1004 PolarHBondContact O-N 3.3Å; T1000-T1004 PolarHBondContact O-OG1 2.85Å
1001	L	90.4	Very high	87.3	Confident	5 Å²	5	22.8 Å²	22.8	3%	0.026	13%	0.125	C	C	.	.	H	α-helix	trans	-65.3	-49.8	174.6	171.9	56.8	0	0	0	111.6	M601 A632 I644 I646 F661 N997 I998 L999 R1003 T1004 L1005	M601-L1001 HydrophobicContact CG-CD2 4.48Å; M601-L1001 HydrophobicContact SD-CD2 3.5Å; M601-L1001 WeakPolarHBondContact SD-CD2 3.42Å; M601-L1001 HydrophobicContact SD-CG 4.17Å; A632-L1001 HydrophobicContact CB-CD1 3.89Å; A632-L1001 HydrophobicContact CB-CD2 4.47Å; I644-L1001 HydrophobicContact CD1-CB 4.23Å; I644-L1001 HydrophobicContact CG2-CB 4.47Å; I644-L1001 HydrophobicContact CG2-CD1 3.89Å; I646-L1001 HydrophobicContact CD1-CD1 3.76Å; I646-L1001 HydrophobicContact CG1-CD1 3.83Å; F661-L1001 HydrophobicContact CB-CD2 3.78Å; F661-L1001 HydrophobicContact CD1-CB 4.24Å; F661-L1001 HydrophobicContact CD1-CD2 3.34Å; F661-L1001 HydrophobicContact CD1-CG 4.37Å; F661-L1001 HydrophobicContact CE1-CB 4.06Å; F661-L1001 HydrophobicContact CE1-CD2 4.03Å; F661-L1001 HydrophobicContact CG-CD2 3.69Å; N997-L1001 PolarHBondContact O-N 2.89Å; I998-L1001 PolarHBondContact O-N 3.49Å; L999-L1001 PolarHBondContact O-N 2.66Å; L1001-R1003 PolarHBondContact O-N 3.06Å; L1001-T1004 PolarHBondContact O-N 3.35Å; L1001-T1004 VanDerWaalsContact O-N 3.17Å; L1001-L1005 WeakPolarHBondContact O-CB 3.47Å; L1001-L1005 PolarHBondContact O-N 2.86Å
1002	I	90.8	Very high	86.8	Confident	2 Å²	2	25.3 Å²	25.3	1%	0.01	14%	0.141	C	C	.	.	H	α-helix	trans	-58	-49.5	178.5	-70.7	170.7	0	0	0	109.9	L554 F558 F576 M601 L988 I998 L999 T1004 L1005 V1006	L554-I1002 HydrophobicContact CD2-CG2 4.09Å; F558-I1002 HydrophobicContact CE1-CG2 4.22Å; F558-I1002 HydrophobicContact CZ-CG2 3.69Å; F576-I1002 HydrophobicContact CD1-CD1 3.64Å; F576-I1002 HydrophobicContact CE1-CD1 4.22Å; F576-I1002 HydrophobicContact CG-CD1 4.34Å; M601-I1002 HydrophobicContact CE-CG1 4.23Å; L988-I1002 HydrophobicContact CD1-CD1 3.74Å; I998-I1002 HydrophobicContact CG2-CD1 3.63Å; I998-I1002 HydrophobicContact CG2-CG1 4.37Å; I998-I1002 WeakPolarHBondContact O-CB 3.32Å; I998-I1002 WeakPolarHBondContact O-CG1 3.16Å; I998-I1002 PolarHBondContact O-N 2.89Å; L999-I1002 PolarHBondContact O-N 3.04Å; I1002-T1004 VanDerWaalsContact C-N 3.33Å; I1002-T1004 PolarHBondContact O-N 2.77Å; I1002-L1005 PolarHBondContact O-N 3.29Å; I1002-V1006 HydrophobicContact CG2-CG2 3.92Å; I1002-V1006 WeakPolarHBondContact O-CB 3.39Å; I1002-V1006 WeakPolarHBondContact O-CG2 3.17Å; I1002-V1006 PolarHBondContact O-N 2.58Å
1003	R	90.1	Very high	86.3	Confident	32 Å²	32	29.6 Å²	29.6	12%	0.121	16%	0.161	C	C	.	.	H	α-helix	trans	-57.3	-44.6	176.4	-71.8	-177.2	70	-141.3	-14.1	111.8	E553 L554 L999 L1001 L1005 V1006 T1007 E1015	E553-R1003 IonicContact OE1-CZ 2.66Å; E553-R1003 IonicContact OE1-NE 3.6Å; E553-R1003 PolarHBondContact OE1-NE 2.89Å; E553-R1003 IonicContact OE1-NH2 3.61Å; E553-R1003 PolarHBondContact OE1-NH2 3.47Å; E553-R1003 IonicContact OE2-NE 3.64Å; E553-R1003 IonicContact OE2-NH2 3.81Å; L554-R1003 HydrophobicContact CD2-CG 4.14Å; L999-R1003 HydrophobicContact CD1-CG 4.08Å; L999-R1003 HydrophobicContact CG-CG 4.29Å; L999-R1003 VanDerWaalsContact O-CB 3.29Å; L999-R1003 WeakPolarHBondContact O-CB 3.46Å; L999-R1003 WeakPolarHBondContact O-CG 3.37Å; L999-R1003 PolarHBondContact O-N 3.43Å; L1001-R1003 PolarHBondContact O-N 3.06Å; R1003-L1005 PolarHBondContact O-N 2.83Å; R1003-V1006 PolarHBondContact O-N 2.78Å; R1003-T1007 WeakPolarHBondContact O-CB 3.38Å; R1003-T1007 WeakPolarHBondContact O-CG2 3.28Å; R1003-T1007 PolarHBondContact O-N 3.3Å; R1003-T1007 PolarHBondContact O-OG1 3.28Å; R1003-E1015 IonicContact CZ-OE1 2.68Å; R1003-E1015 IonicContact CZ-OE2 3.38Å; R1003-E1015 IonicContact NH1-OE1 3.17Å; R1003-E1015 PolarHBondContact NH1-OE1 3.49Å; R1003-E1015 IonicContact NH1-OE2 2.71Å; R1003-E1015 PolarHBondContact NH1-OE2 3.1Å; R1003-E1015 IonicContact NH2-OE1 3.65Å; R1003-E1015 PolarHBondContact NH2-OE1 2.74Å; R1003-E1015 IonicContact NH2-OE2 3.34Å
1004	T	89.3	Confident	86	Confident	38 Å²	38	28.9 Å²	28.9	23%	0.233	16%	0.159	C	C	.	.	H	α-helix	trans	-61.1	-43.6	178.6	-57.5	0	0	0	0	112	I646 T1000 L1001 I1002 G1009	I646-T1004 HydrophobicContact CD1-CG2 3.93Å; I646-T1004 HydrophobicContact CG1-CG2 4.35Å; T1000-T1004 WeakPolarHBondContact O-CB 3.48Å; T1000-T1004 PolarHBondContact O-N 3.3Å; T1000-T1004 PolarHBondContact O-OG1 2.85Å; L1001-T1004 PolarHBondContact O-N 3.35Å; L1001-T1004 VanDerWaalsContact O-N 3.17Å; I1002-T1004 VanDerWaalsContact C-N 3.33Å; I1002-T1004 PolarHBondContact O-N 2.77Å; T1004-G1009 PolarHBondContact O-N 2.98Å; T1004-G1009 VanDerWaalsContact O-N 3.13Å
1005	L	90.1	Very high	85.8	Confident	28 Å²	28	27.2 Å²	27.2	15%	0.147	15%	0.151	C	C	.	.	H	α-helix	trans	-68.7	-46.8	178.4	-177.8	61.6	0	0	0	112.1	L572 I646 L1001 I1002 R1003 V1042 L1117	L572-L1005 HydrophobicContact CD1-CD2 4.07Å; L572-L1005 HydrophobicContact CD2-CD2 3.84Å; I646-L1005 HydrophobicContact CD1-CB 3.74Å; I646-L1005 HydrophobicContact CD1-CD1 4.06Å; I646-L1005 HydrophobicContact CD1-CG 4.49Å; L1001-L1005 WeakPolarHBondContact O-CB 3.47Å; L1001-L1005 PolarHBondContact O-N 2.86Å; I1002-L1005 PolarHBondContact O-N 3.29Å; R1003-L1005 PolarHBondContact O-N 2.83Å; L1005-V1042 HydrophobicContact CD1-CG2 3.86Å; L1005-L1117 HydrophobicContact CD1-CD2 4.24Å
1006	V	92.3	Very high	85.5	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-82.2	-42.9	-167.6	172.4	0	0	0	0	112.5	G557 F558 Q561 L572 P805 I1002 R1003 G1008	G557-V1006 VanDerWaalsContact CA-CG1 3.47Å; F558-V1006 HydrophobicContact CD1-CG1 4.37Å; F558-V1006 HydrophobicContact CD1-CG2 3.88Å; F558-V1006 HydrophobicContact CE1-CG2 3.57Å; F558-V1006 HydrophobicContact CG-CG1 4.48Å; F558-V1006 HydrophobicContact CZ-CG2 4.19Å; Q561-V1006 HydrophobicContact CG-CG1 4.5Å; Q561-V1006 PolarHBondContact NE2-O 3.43Å; L572-V1006 HydrophobicContact CD1-CG2 3.92Å; P805-V1006 WeakPolarHBondContact CB-O 3.13Å; I1002-V1006 HydrophobicContact CG2-CG2 3.92Å; I1002-V1006 WeakPolarHBondContact O-CB 3.39Å; I1002-V1006 WeakPolarHBondContact O-CG2 3.17Å; I1002-V1006 PolarHBondContact O-N 2.58Å; R1003-V1006 PolarHBondContact O-N 2.78Å; V1006-G1008 PolarHBondContact O-N 3.42Å
1007	T	88.8	Confident	85.5	Confident	9 Å²	9	26.7 Å²	26.7	6%	0.055	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-7.6	-179	64.2	0	0	0	0	113.6	E553 F757 R1003 G1009 A1010	E553-T1007 HydrophobicContact CG-CG2 4.05Å; E553-T1007 WeakPolarHBondContact OE1-CG2 3.39Å; F757-T1007 WeakPolarHBondContact CZ-O 3.46Å; R1003-T1007 WeakPolarHBondContact O-CB 3.38Å; R1003-T1007 WeakPolarHBondContact O-CG2 3.28Å; R1003-T1007 PolarHBondContact O-N 3.3Å; R1003-T1007 PolarHBondContact O-OG1 3.28Å; T1007-G1009 VanDerWaalsContact C-N 3.33Å; T1007-G1009 PolarHBondContact OG1-N 3.25Å; T1007-A1010 HydrophobicContact CG2-CB 4.26Å; T1007-A1010 VanDerWaalsContact OG1-CB 3.32Å; T1007-A1010 WeakPolarHBondContact OG1-CB 3.5Å; T1007-A1010 PolarHBondContact OG1-N 2.87Å
1008	G	79.5	Confident	85.3	Confident	5 Å²	5	24.4 Å²	24.4	5%	0.052	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.4	27.6	-169.1	0	0	0	0	0	112.9	V1006 R1039	V1006-G1008 PolarHBondContact O-N 3.42Å; G1008-R1039 PolarHBondContact O-NH1 2.72Å; G1008-R1039 PolarHBondContact O-NH2 3.12Å
1009	G	74.5	Confident	84.8	Confident	3 Å²	3	25.9 Å²	25.9	3%	0.031	16%	0.155	C	C	.	.			trans	94.6	45.3	172.2	0	0	0	0	0	115.8	M756 T1004 T1007 T1011	M756-G1009 WeakPolarHBondContact CE-O 3.43Å; T1004-G1009 PolarHBondContact O-N 2.98Å; T1004-G1009 VanDerWaalsContact O-N 3.13Å; T1007-G1009 VanDerWaalsContact C-N 3.33Å; T1007-G1009 PolarHBondContact OG1-N 3.25Å; G1009-T1011 PolarHBondContact O-N 3.42Å
1010	A	76.9	Confident	84.3	Confident	10 Å²	10	32.4 Å²	32.4	8%	0.083	19%	0.186	C	C	.	.			trans	-64.1	104.7	167.8	0	0	0	0	0	110.7	T1007	T1007-A1010 HydrophobicContact CG2-CB 4.26Å; T1007-A1010 VanDerWaalsContact OG1-CB 3.32Å; T1007-A1010 WeakPolarHBondContact OG1-CB 3.5Å; T1007-A1010 PolarHBondContact OG1-N 2.87Å
1011	T	82	Confident	83.5	Confident	32 Å²	32	34.1 Å²	34.1	20%	0.196	19%	0.19	C	C	.	.			trans	-83.9	157.1	176.5	56.1	0	0	0	0	111.3	M756 G1009 E1013 L1014 E1015	M756-T1011 HydrophobicContact CE-CG2 4.21Å; G1009-T1011 PolarHBondContact O-N 3.42Å; T1011-E1013 PolarHBondContact O-N 3.04Å; T1011-L1014 WeakPolarHBondContact O-CA 3.38Å; T1011-L1014 WeakPolarHBondContact O-CB 3.44Å; T1011-L1014 PolarHBondContact O-N 3.29Å; T1011-L1014 PolarHBondContact OG1-N 2.98Å; T1011-E1015 PolarHBondContact O-N 2.86Å
1012	P	80.8	Confident	83.1	Confident	63 Å²	63	37.4 Å²	37.4	41%	0.409	21%	0.207	S	C	.	.	H	α-helix	trans	-57.5	-29.1	170.8	-25.9	35.5	0	0	0	113.3	W542 L1014 E1015 A1016	W542-P1012 HydrophobicContact CH2-CG 4.45Å; W542-P1012 HydrophobicContact CZ2-CB 4.48Å; P1012-L1014 VanDerWaalsContact C-N 3.32Å; P1012-E1015 PolarHBondContact O-N 3.38Å; P1012-A1016 PolarHBondContact O-N 2.88Å
1013	E	81.1	Confident	82.7	Confident	90 Å²	90	39.2 Å²	39.2	42%	0.421	22%	0.222	S	C	.	.	H	α-helix	trans	-59.5	-41.8	171.6	-60	170.9	-162.7	0	0	111.4	R643 T1011 L1017	R643-E1013 IonicContact CZ-OE1 2.87Å; R643-E1013 IonicContact NH1-OE1 2.67Å; R643-E1013 IonicContact NH2-OE1 2.82Å; R643-E1013 PolarHBondContact NH2-OE1 2.94Å; T1011-E1013 PolarHBondContact O-N 3.04Å; E1013-L1017 WeakPolarHBondContact O-CG 3.35Å; E1013-L1017 PolarHBondContact O-N 2.78Å
1014	L	85.2	Confident	82.4	Confident	3 Å²	3	38.4 Å²	38.4	2%	0.016	22%	0.221	C	C	.	.	H	α-helix	trans	-73.6	-38	176.1	-178.8	62	0	0	0	112.2	T754 F757 M804 T1011 P1012 A1016 L1017 I1018 L1024	T754-L1014 HydrophobicContact CG2-CB 4.3Å; T754-L1014 HydrophobicContact CG2-CD1 4.21Å; F757-L1014 HydrophobicContact CD2-CD2 3.9Å; F757-L1014 HydrophobicContact CE2-CD2 3.47Å; F757-L1014 VanDerWaalsContact CE2-CD2 3.47Å; M804-L1014 HydrophobicContact SD-CD2 4.41Å; T1011-L1014 WeakPolarHBondContact O-CA 3.38Å; T1011-L1014 WeakPolarHBondContact O-CB 3.44Å; T1011-L1014 PolarHBondContact O-N 3.29Å; T1011-L1014 PolarHBondContact OG1-N 2.98Å; P1012-L1014 VanDerWaalsContact C-N 3.32Å; L1014-A1016 VanDerWaalsContact C-N 3.3Å; L1014-A1016 PolarHBondContact O-N 3.11Å; L1014-L1017 PolarHBondContact O-N 3.14Å; L1014-I1018 HydrophobicContact CD1-CD1 4.11Å; L1014-I1018 HydrophobicContact CD1-CG1 4.26Å; L1014-I1018 HydrophobicContact CD2-CD1 4.48Å; L1014-I1018 HydrophobicContact CG-CD1 3.89Å; L1014-I1018 HydrophobicContact CG-CG1 4.45Å; L1014-I1018 WeakPolarHBondContact O-CG1 3.23Å; L1014-I1018 PolarHBondContact O-N 2.88Å; L1014-L1024 HydrophobicContact CD1-CD1 3.75Å
1015	E	83.6	Confident	82.3	Confident	19 Å²	19	41.4 Å²	41.4	9%	0.089	23%	0.228	C	C	.	.	H	α-helix	trans	-60.1	-41.2	174.7	-64.3	-166.2	114.6	0	0	111.3	K531 L535 R1003 T1011 P1012 I1018 A1019	K531-E1015 WeakPolarHBondContact CE-OE1 3.45Å; K531-E1015 IonicContact NZ-OE1 3.52Å; K531-E1015 PolarHBondContact NZ-OE1 2.88Å; L535-E1015 HydrophobicContact CD1-CB 4.11Å; R1003-E1015 IonicContact CZ-OE1 2.68Å; R1003-E1015 IonicContact CZ-OE2 3.38Å; R1003-E1015 IonicContact NH1-OE1 3.17Å; R1003-E1015 PolarHBondContact NH1-OE1 3.49Å; R1003-E1015 IonicContact NH1-OE2 2.71Å; R1003-E1015 PolarHBondContact NH1-OE2 3.1Å; R1003-E1015 IonicContact NH2-OE1 3.65Å; R1003-E1015 PolarHBondContact NH2-OE1 2.74Å; R1003-E1015 IonicContact NH2-OE2 3.34Å; T1011-E1015 PolarHBondContact O-N 2.86Å; P1012-E1015 PolarHBondContact O-N 3.38Å; E1015-I1018 PolarHBondContact O-N 3.44Å; E1015-A1019 WeakPolarHBondContact O-CB 3.25Å; E1015-A1019 PolarHBondContact O-N 2.84Å
1016	A	81.2	Confident	82.1	Confident	51 Å²	51	40.6 Å²	40.6	42%	0.421	23%	0.226	S	C	.	.	H	α-helix	trans	-62.9	-42.5	174.7	0	0	0	0	0	112.7	P1012 L1014 I1018 A1019 E1020	P1012-A1016 PolarHBondContact O-N 2.88Å; L1014-A1016 VanDerWaalsContact C-N 3.3Å; L1014-A1016 PolarHBondContact O-N 3.11Å; A1016-I1018 PolarHBondContact O-N 2.91Å; A1016-A1019 WeakPolarHBondContact O-CB 3.5Å; A1016-A1019 PolarHBondContact O-N 3.29Å; A1016-E1020 PolarHBondContact O-N 2.85Å
1017	L	84.3	Confident	81.8	Confident	45 Å²	45	41.1 Å²	41.1	24%	0.236	23%	0.231	C	C	.	.	H	α-helix	trans	-64	-38.9	175.9	-73	167.7	0	0	0	112.5	T754 E1013 L1014 A1019 E1020	T754-L1017 HydrophobicContact CG2-CD1 3.73Å; E1013-L1017 WeakPolarHBondContact O-CG 3.35Å; E1013-L1017 PolarHBondContact O-N 2.78Å; L1014-L1017 PolarHBondContact O-N 3.14Å; L1017-A1019 VanDerWaalsContact C-N 3.34Å; L1017-E1020 PolarHBondContact O-N 2.83Å
1018	I	83.6	Confident	81.7	Confident	9 Å²	9	47.4 Å²	47.4	5%	0.046	26%	0.255	C	S	.	.	H	α-helix	trans	-72.4	-29.8	175.5	-60.8	166.9	0	0	0	110.6	Y528 M804 L1014 E1015 A1016 E1020 N1022	Y528-I1018 HydrophobicContact CE1-CD1 4.21Å; Y528-I1018 HydrophobicContact CE1-CG2 4.08Å; M804-I1018 HydrophobicContact CE-CD1 4.35Å; L1014-I1018 HydrophobicContact CD1-CD1 4.11Å; L1014-I1018 HydrophobicContact CD1-CG1 4.26Å; L1014-I1018 HydrophobicContact CD2-CD1 4.48Å; L1014-I1018 HydrophobicContact CG-CD1 3.89Å; L1014-I1018 HydrophobicContact CG-CG1 4.45Å; L1014-I1018 WeakPolarHBondContact O-CG1 3.23Å; L1014-I1018 PolarHBondContact O-N 2.88Å; E1015-I1018 PolarHBondContact O-N 3.44Å; A1016-I1018 PolarHBondContact O-N 2.91Å; I1018-E1020 VanDerWaalsContact C-N 3.33Å; I1018-E1020 PolarHBondContact O-N 2.94Å; I1018-N1022 WeakPolarHBondContact O-CA 3.43Å; I1018-N1022 PolarHBondContact O-N 3.32Å
1019	A	78.3	Confident	82	Confident	33 Å²	33	49.8 Å²	49.8	27%	0.273	27%	0.271	S	S	.	.	H	α-helix	trans	-66.7	-30.6	175	0	0	0	0	0	113.5	A532 E1015 A1016 L1017	A532-A1019 HydrophobicContact CB-CB 3.76Å; E1015-A1019 WeakPolarHBondContact O-CB 3.25Å; E1015-A1019 PolarHBondContact O-N 2.84Å; A1016-A1019 WeakPolarHBondContact O-CB 3.5Å; A1016-A1019 PolarHBondContact O-N 3.29Å; L1017-A1019 VanDerWaalsContact C-N 3.34Å
1020	E	79.3	Confident	82.6	Confident	141 Å²	141	52.6 Å²	52.6	66%	0.659	29%	0.287	S	S	*	.	H	α-helix	trans	-74.5	-40.8	177.2	-72	-174.5	173.1	0	0	113.8	A1016 L1017 I1018 R1025	A1016-E1020 PolarHBondContact O-N 2.85Å; L1017-E1020 PolarHBondContact O-N 2.83Å; I1018-E1020 VanDerWaalsContact C-N 3.33Å; I1018-E1020 PolarHBondContact O-N 2.94Å; E1020-R1025 IonicContact OE2-NH1 2.67Å; E1020-R1025 PolarHBondContact OE2-NH1 2.87Å
1021	E	71.8	Confident	83	Confident	98 Å²	98	57.6 Å²	57.6	46%	0.458	32%	0.319	S	S	.	.	H	α-helix	trans	-127.7	-7.9	-169.3	-70.8	-160.5	154.7	0	0	115.8	A1023 R1025	E1021-A1023 HydrophobicContact CB-CB 4.44Å; E1021-A1023 PolarHBondContact O-N 3.09Å; E1021-R1025 IonicContact OE1-CZ 2.71Å; E1021-R1025 IonicContact OE1-NE 3.71Å; E1021-R1025 PolarHBondContact OE1-NE 3.19Å; E1021-R1025 IonicContact OE1-NH2 2.59Å; E1021-R1025 PolarHBondContact OE1-NH2 3.43Å; E1021-R1025 WeakPolarHBondContact OE2-CD 3.29Å; E1021-R1025 VanDerWaalsContact OE2-CG 3.27Å; E1021-R1025 WeakPolarHBondContact OE2-CG 3.34Å; E1021-R1025 IonicContact OE2-CZ 2.68Å; E1021-R1025 IonicContact OE2-NE 2.77Å; E1021-R1025 PolarHBondContact OE2-NE 2.97Å; E1021-R1025 IonicContact OE2-NH2 3.2Å
1022	N	80.8	Confident	83	Confident	74 Å²	74	63.4 Å²	63.4	40%	0.396	34%	0.344	S	S	.	.	S	Bend	trans	52.6	17.4	-168	-159.8	14.9	0	0	0	114.9	R800 I1018	R800-N1022 PolarHBondContact NH1-O 3.36Å; R800-N1022 PolarHBondContact NH1-OD1 3.3Å; R800-N1022 PolarHBondContact NH2-OD1 2.98Å; I1018-N1022 WeakPolarHBondContact O-CA 3.43Å; I1018-N1022 PolarHBondContact O-N 3.32Å
1023	A	82.8	Confident	83.2	Confident	40 Å²	40	61.2 Å²	61.2	33%	0.331	33%	0.33	S	S	.	.	S	Bend	trans	-134	153.5	-173.7	0	0	0	0	0	112.7	E1021 R1025	E1021-A1023 HydrophobicContact CB-CB 4.44Å; E1021-A1023 PolarHBondContact O-N 3.09Å; A1023-R1025 PolarHBondContact O-N 2.86Å
1024	L	85.4	Confident	83.4	Confident	16 Å²	16	60 Å²	60	8%	0.084	33%	0.325	C	S	.	.			trans	-89.9	103.6	179.2	-155.9	81.8	0	0	0	110.4	D752 F757 W759 F838 L1014	D752-L1024 HydrophobicContact CB-CD1 4.5Å; D752-L1024 HydrophobicContact CB-CD2 3.83Å; D752-L1024 HydrophobicContact CB-CG 3.94Å; F757-L1024 HydrophobicContact CB-CD2 4.2Å; W759-L1024 PolarHBondContact NE1-O 2.86Å; F838-L1024 HydrophobicContact CE1-CD2 4.24Å; F838-L1024 HydrophobicContact CZ-CD2 4.5Å; L1014-L1024 HydrophobicContact CD1-CD1 3.75Å
1025	R	86.7	Confident	83.4	Confident	101 Å²	101	62.5 Å²	62.5	38%	0.381	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-71.4	133.1	177.8	-73	176.6	170.3	155.8	-5.1	112	D752 S753 E1020 E1021 A1023	D752-R1025 CarbonylContact C-O 3.6Å; D752-R1025 WeakPolarHBondContact CA-O 3.15Å; S753-R1025 PolarHBondContact N-O 2.94Å; E1020-R1025 IonicContact OE2-NH1 2.67Å; E1020-R1025 PolarHBondContact OE2-NH1 2.87Å; E1021-R1025 IonicContact OE1-CZ 2.71Å; E1021-R1025 IonicContact OE1-NE 3.71Å; E1021-R1025 PolarHBondContact OE1-NE 3.19Å; E1021-R1025 IonicContact OE1-NH2 2.59Å; E1021-R1025 PolarHBondContact OE1-NH2 3.43Å; E1021-R1025 WeakPolarHBondContact OE2-CD 3.29Å; E1021-R1025 VanDerWaalsContact OE2-CG 3.27Å; E1021-R1025 WeakPolarHBondContact OE2-CG 3.34Å; E1021-R1025 IonicContact OE2-CZ 2.68Å; E1021-R1025 IonicContact OE2-NE 2.77Å; E1021-R1025 PolarHBondContact OE2-NE 2.97Å; E1021-R1025 IonicContact OE2-NH2 3.2Å; A1023-R1025 PolarHBondContact O-N 2.86Å
1026	G	85.8	Confident	83.5	Confident	11 Å²	11	64 Å²	64	11%	0.113	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	130.9	174.7	0	0	0	0	0	113.5	K749 W759	K749-G1026 WeakPolarHBondContact CD-O 3.44Å; K749-G1026 WeakPolarHBondContact CE-O 3.21Å; K749-G1026 PolarHBondContact NZ-O 3.18Å; W759-G1026 VanDerWaalsContact CD2-CA 3.47Å; W759-G1026 VanDerWaalsContact CE2-CA 3.42Å
1027	G	85.5	Confident	83.7	Confident	10 Å²	10	62.6 Å²	62.6	10%	0.103	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	164.9	-177.7	0	0	0	0	0	114.5	K749 Y751	K749-G1027 WeakPolarHBondContact CG-O 3.41Å; Y751-G1027 PolarHBondContact O-N 3.29Å
1028	Y	86.2	Confident	83.7	Confident	141 Å²	141	64.4 Å²	64.4	55%	0.553	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-87	143.4	164.8	-69.3	-73.1	0	0	0	109.8	K749 T1030	K749-Y1028 HydrophobicContact CG-CD1 4.48Å; K749-Y1028 HydrophobicContact CG-CE1 4.39Å; Y1028-T1030 PolarHBondContact O-N 2.67Å
1029	S	86	Confident	84	Confident	55 Å²	55	66.4 Å²	66.4	39%	0.385	36%	0.356	S	S	.	.			trans	-77.5	94	-176.8	-59	0	0	0	0	111
1030	T	87.2	Confident	84.5	Confident	62 Å²	62	65.7 Å²	65.7	38%	0.38	35%	0.349	S	S	.	.			trans	-86.3	159.4	169.9	80.4	0	0	0	0	111	Y1028 Q1032 T1033 L1034	Y1028-T1030 PolarHBondContact O-N 2.67Å; T1030-Q1032 PolarHBondContact O-N 3.28Å; T1030-Q1032 PolarHBondContact OG1-N 3.05Å; T1030-T1033 WeakPolarHBondContact O-CB 3.41Å; T1030-T1033 PolarHBondContact O-N 3.18Å; T1030-T1033 VanDerWaalsContact O-N 3.12Å; T1030-T1033 WeakPolarHBondContact OG1-CB 3.44Å; T1030-T1033 PolarHBondContact OG1-N 3.41Å; T1030-T1033 PolarHBondContact OG1-OG1 3.23Å; T1030-L1034 WeakPolarHBondContact O-CG 3.43Å; T1030-L1034 PolarHBondContact O-N 3Å
1031	P	84.8	Confident	84.9	Confident	116 Å²	116	60.9 Å²	60.9	75%	0.753	33%	0.325	S	S	*	.	H	α-helix	trans	-56.3	-34.4	173.6	-26.9	36	0	0	0	113.5	L1034 A1035	P1031-L1034 PolarHBondContact O-N 2.99Å; P1031-A1035 PolarHBondContact O-N 2.85Å
1032	Q	82.9	Confident	85.9	Confident	154 Å²	154	56.6 Å²	56.6	72%	0.72	31%	0.305	S	S	*	.	H	α-helix	trans	-69.7	-43	175.8	-175.2	175.6	-7	0	0	111.6	T1030 L1034 A1035 N1036	T1030-Q1032 PolarHBondContact O-N 3.28Å; T1030-Q1032 PolarHBondContact OG1-N 3.05Å; Q1032-L1034 VanDerWaalsContact C-N 3.27Å; Q1032-L1034 PolarHBondContact O-N 2.92Å; Q1032-A1035 PolarHBondContact O-N 3.01Å; Q1032-N1036 PolarHBondContact O-N 3.38Å
1033	T	84.4	Confident	86.4	Confident	17 Å²	17	53.9 Å²	53.9	10%	0.104	29%	0.293	C	S	.	.	H	α-helix	trans	-59.6	-37.4	173.8	-49.6	0	0	0	0	111.6	T1030	T1030-T1033 WeakPolarHBondContact O-CB 3.41Å; T1030-T1033 PolarHBondContact O-N 3.18Å; T1030-T1033 VanDerWaalsContact O-N 3.12Å; T1030-T1033 WeakPolarHBondContact OG1-CB 3.44Å; T1030-T1033 PolarHBondContact OG1-N 3.41Å; T1030-T1033 PolarHBondContact OG1-OG1 3.23Å
1034	L	85.6	Confident	86.9	Confident	63 Å²	63	54.3 Å²	54.3	33%	0.33	29%	0.288	S	S	.	.	H	α-helix	trans	-75.2	-31.2	177.3	-68.1	173.9	0	0	0	113	Y751 T1030 P1031 Q1032 N1036 R1037	Y751-L1034 HydrophobicContact CD2-CD2 4.35Å; Y751-L1034 HydrophobicContact CE2-CD2 3.89Å; T1030-L1034 WeakPolarHBondContact O-CG 3.43Å; T1030-L1034 PolarHBondContact O-N 3Å; P1031-L1034 PolarHBondContact O-N 2.99Å; Q1032-L1034 VanDerWaalsContact C-N 3.27Å; Q1032-L1034 PolarHBondContact O-N 2.92Å; L1034-N1036 VanDerWaalsContact C-N 3.3Å; L1034-N1036 PolarHBondContact O-N 3.04Å; L1034-R1037 VanDerWaalsContact O-CB 3.23Å; L1034-R1037 WeakPolarHBondContact O-CB 3.32Å; L1034-R1037 VanDerWaalsContact O-CG 3.25Å; L1034-R1037 WeakPolarHBondContact O-CG 3.34Å; L1034-R1037 PolarHBondContact O-N 3.47Å
1035	A	84.9	Confident	87.2	Confident	57 Å²	57	55.2 Å²	55.2	47%	0.471	29%	0.293	S	S	.	.	H	α-helix	trans	-66.3	-29.6	174.5	0	0	0	0	0	112.9	P1031 Q1032 R1037 D1038	P1031-A1035 PolarHBondContact O-N 2.85Å; Q1032-A1035 PolarHBondContact O-N 3.01Å; A1035-R1037 PolarHBondContact O-N 3.1Å; A1035-D1038 PolarHBondContact O-N 3.4Å; A1035-D1038 VanDerWaalsContact O-N 3.12Å
1036	N	85.5	Confident	87.5	Confident	50 Å²	50	52.1 Å²	52.1	27%	0.267	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-8.6	173.7	-70.1	-12.9	0	0	0	113.9	T754 M756 Q1032 L1034 R1039	T754-N1036 PolarHBondContact O-ND2 2.8Å; M756-N1036 HydrophobicContact SD-CB 3.89Å; Q1032-N1036 PolarHBondContact O-N 3.38Å; L1034-N1036 VanDerWaalsContact C-N 3.3Å; L1034-N1036 PolarHBondContact O-N 3.04Å; N1036-R1039 WeakPolarHBondContact O-CD 3.13Å; N1036-R1039 PolarHBondContact O-NE 3.03Å
1037	R	86.8	Confident	87.7	Confident	22 Å²	22	51.7 Å²	51.7	8%	0.083	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-16.2	176.8	-53.5	-179.5	57.4	-131	-7	113.4	Y751 S809 L1034 A1035 R1039	Y751-R1037 PolarHBondContact OH-NE 2.77Å; S809-R1037 PolarHBondContact O-NE 3.22Å; S809-R1037 PolarHBondContact O-NH2 3.24Å; L1034-R1037 VanDerWaalsContact O-CB 3.23Å; L1034-R1037 WeakPolarHBondContact O-CB 3.32Å; L1034-R1037 VanDerWaalsContact O-CG 3.25Å; L1034-R1037 WeakPolarHBondContact O-CG 3.34Å; L1034-R1037 PolarHBondContact O-N 3.47Å; A1035-R1037 PolarHBondContact O-N 3.1Å; R1037-R1039 PolarHBondContact O-N 3.45Å
1038	D	84.6	Confident	87.6	Confident	83 Å²	83	56.7 Å²	56.7	44%	0.444	31%	0.308	S	S	.	.			trans	-75	66.9	178.5	-78.3	-28.1	0	0	0	111.7	A1035 H1122	A1035-D1038 PolarHBondContact O-N 3.4Å; A1035-D1038 VanDerWaalsContact O-N 3.12Å; D1038-H1122 VanDerWaalsContact CG-NE2 3.26Å; D1038-H1122 IonicContact OD1-CD2 3.37Å; D1038-H1122 IonicContact OD1-CE1 3.43Å; D1038-H1122 PolarHBondContact OD1-CE1 3.36Å; D1038-H1122 IonicContact OD1-NE2 3.59Å; D1038-H1122 PolarHBondContact OD1-NE2 3.15Å; D1038-H1122 IonicContact OD2-CE1 2.76Å; D1038-H1122 IonicContact OD2-NE2 2.95Å; D1038-H1122 PolarHBondContact OD2-NE2 2.64Å
1039	R	88.4	Confident	87.2	Confident	50 Å²	50	54.3 Å²	54.3	19%	0.189	31%	0.305	C	S	.	.			trans	-128.6	142.6	179	-63.6	178.1	-66.5	115	-13.4	108.7	M756 S809 N810 G1008 N1036 R1037	M756-R1039 VanDerWaalsContact CE-CZ 3.48Å; M756-R1039 VanDerWaalsContact CE-NE 3.33Å; M756-R1039 PolarHBondContact O-NH2 3.05Å; M756-R1039 VanDerWaalsContact O-NH2 3.11Å; S809-R1039 PolarHBondContact OG-NH2 2.93Å; N810-R1039 WeakPolarHBondContact CB-O 3.15Å; G1008-R1039 PolarHBondContact O-NH1 2.72Å; G1008-R1039 PolarHBondContact O-NH2 3.12Å; N1036-R1039 WeakPolarHBondContact O-CD 3.13Å; N1036-R1039 PolarHBondContact O-NE 3.03Å; R1037-R1039 PolarHBondContact O-N 3.45Å
1040	C	88.8	Confident	87	Confident	19 Å²	19	54.3 Å²	54.3	13%	0.128	31%	0.313	C	S	.	.			trans	-59.6	154.7	175.6	-71.2	0	0	0	0	112	I646 N647 N810 L1117 M1118 Q1119	I646-C1040 PolarHBondContact O-SG 3.06Å; N647-C1040 PolarHBondContact O-SG 3.44Å; N810-C1040 PolarHBondContact ND2-O 3.05Å; C1040-L1117 HydrophobicContact CB-CB 4.18Å; C1040-M1118 CarbonylContact C-O 3.58Å; C1040-M1118 WeakPolarHBondContact CA-O 3.47Å; C1040-Q1119 PolarHBondContact SG-NE2 3.31Å
1041	R	89.1	Confident	86.9	Confident	39 Å²	39	54.4 Å²	54.4	15%	0.147	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	144.1	169.9	67	-167.5	-169.4	178.6	9.2	109.7	F811 E815 L1117 M1118	F811-R1041 HydrophobicContact CE1-CB 4.36Å; F811-R1041 HydrophobicContact CZ-CB 4.03Å; E815-R1041 IonicContact OE1-CZ 3.18Å; E815-R1041 VanDerWaalsContact OE1-CZ 3.3Å; E815-R1041 IonicContact OE1-NH1 3.74Å; E815-R1041 PolarHBondContact OE1-NH1 3.03Å; E815-R1041 IonicContact OE1-NH2 3.68Å; E815-R1041 PolarHBondContact OE1-NH2 3.5Å; E815-R1041 IonicContact OE2-CZ 2.69Å; E815-R1041 IonicContact OE2-NH1 2.75Å; E815-R1041 PolarHBondContact OE2-NH1 2.91Å; E815-R1041 IonicContact OE2-NH2 3.21Å; R1041-L1117 WeakPolarHBondContact O-CA 3.37Å; R1041-M1118 HydrophobicContact CG-CB 4Å; R1041-M1118 PolarHBondContact N-O 2.76Å; R1041-M1118 PolarHBondContact O-N 3.17Å
1042	V	92.3	Very high	87.1	Confident	8 Å²	8	49.2 Å²	49.2	5%	0.048	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	135	172.1	-172.1	0	0	0	0	108.8	A565 L568 L1005 F1077 L1117	A565-V1042 HydrophobicContact CB-CG1 3.89Å; L568-V1042 HydrophobicContact CD1-CG1 3.98Å; L568-V1042 HydrophobicContact CD2-CB 4.33Å; L568-V1042 HydrophobicContact CD2-CG1 3.84Å; L568-V1042 HydrophobicContact CD2-CG2 4.08Å; L568-V1042 HydrophobicContact CG-CG1 4.48Å; L1005-V1042 HydrophobicContact CD1-CG2 3.86Å; V1042-F1077 HydrophobicContact CG1-CZ 4.03Å; V1042-L1117 HydrophobicContact CG2-CD2 3.86Å
1043	A	91.8	Very high	87.3	Confident	17 Å²	17	43.5 Å²	43.5	14%	0.14	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	162.7	175	0	0	0	0	0	111.2	C1116 M1118	A1043-C1116 PolarHBondContact N-O 3.25Å; A1043-C1116 PolarHBondContact O-N 3.06Å; A1043-M1118 HydrophobicContact CB-CG 3.91Å; A1043-M1118 HydrophobicContact CB-SD 3.56Å; A1043-M1118 VanDerWaalsContact CB-SD 3.56Å
1044	Q	92.8	Very high	87.4	Confident	49 Å²	49	48.2 Å²	48.2	23%	0.229	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	137.9	167.4	-79.9	170.3	-24.7	0	0	110.2	A565 Q566 I1114 F1115	A565-Q1044 HydrophobicContact CB-CG 3.85Å; Q566-Q1044 PolarHBondContact O-NE2 2.93Å; Q1044-I1114 WeakPolarHBondContact CA-O 3.49Å; Q1044-F1115 HydrophobicContact CG-CD1 4.09Å; Q1044-F1115 HydrophobicContact CG-CE1 4.24Å
1045	L	91.7	Very high	87.4	Confident	36 Å²	36	46.2 Å²	46.2	19%	0.188	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	130.7	172.2	-62.2	173.1	0	0	0	109.2	F1052 M1074 L1113 I1114 C1116	L1045-F1052 HydrophobicContact CD1-CE2 4.09Å; L1045-M1074 HydrophobicContact CD1-CE 3.9Å; L1045-M1074 HydrophobicContact CD1-SD 4.05Å; L1045-L1113 CarbonylContact O-C 3.56Å; L1045-L1113 WeakPolarHBondContact O-CA 3.43Å; L1045-I1114 PolarHBondContact N-O 2.99Å; L1045-I1114 PolarHBondContact O-N 3.42Å; L1045-C1116 HydrophobicContact CD1-CB 4.27Å
1046	A	92.6	Very high	87.2	Confident	35 Å²	35	43.5 Å²	43.5	29%	0.289	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	145	168.5	0	0	0	0	0	110.6	D1049 L1113	A1046-D1049 WeakPolarHBondContact CB-OD1 3.3Å; A1046-L1113 HydrophobicContact CB-CD2 3.7Å
1047	L	89.6	Confident	87	Confident	2 Å²	2	47.6 Å²	47.6	1%	0.01	27%	0.273	C	S	.	.	S	Bend	trans	-92	-13.1	171.8	-66.6	-174.4	0	0	0	113.6	D1049 F1052 A1053 L1064 L1108 P1110 D1112 I1114	L1047-D1049 PolarHBondContact O-N 2.9Å; L1047-F1052 HydrophobicContact CD2-CB 4Å; L1047-A1053 VanDerWaalsContact O-CA 3.24Å; L1047-A1053 WeakPolarHBondContact O-CA 3.09Å; L1047-A1053 WeakPolarHBondContact O-CB 3.36Å; L1047-L1064 HydrophobicContact CD2-CD1 4.3Å; L1047-L1064 HydrophobicContact CD2-CD2 4.14Å; L1047-L1108 HydrophobicContact CD1-CB 4.22Å; L1047-L1108 HydrophobicContact CD1-CD1 4.11Å; L1047-L1108 HydrophobicContact CD1-CD2 4.23Å; L1047-L1108 HydrophobicContact CD1-CG 4.43Å; L1047-P1110 CarbonylContact C-O 3.42Å; L1047-P1110 WeakPolarHBondContact CB-O 3.48Å; L1047-D1112 HydrophobicContact CD1-CB 4.2Å; L1047-D1112 PolarHBondContact N-O 3.36Å; L1047-I1114 HydrophobicContact CD1-CD1 4.1Å; L1047-I1114 HydrophobicContact CD1-CG1 4.1Å; L1047-I1114 HydrophobicContact CD2-CG1 3.97Å; L1047-I1114 HydrophobicContact CG-CD1 4.44Å; L1047-I1114 HydrophobicContact CG-CG1 3.91Å
1048	L	84.6	Confident	86.7	Confident	116 Å²	116	48.6 Å²	48.6	61%	0.607	29%	0.29	S	S	*	.	S	Bend	trans	-63.4	-31.2	177.2	-71.6	168.6	0	0	0	112.7	P1110 T1111	L1048-P1110 HydrophobicContact CD2-CB 4.45Å; L1048-P1110 WeakPolarHBondContact CG-O 3.43Å; L1048-P1110 PolarHBondContact N-O 3.09Å; L1048-P1110 VanDerWaalsContact N-O 3.16Å; L1048-T1111 HydrophobicContact CD2-CG2 4.42Å
1049	D	78	Confident	86.9	Confident	90 Å²	90	45.5 Å²	45.5	48%	0.481	28%	0.278	S	S	.	.	S	Bend	trans	-142.3	147.8	-171.3	59.5	-46.5	0	0	0	112.7	A1046 L1047	A1046-D1049 WeakPolarHBondContact CB-OD1 3.3Å; L1047-D1049 PolarHBondContact O-N 2.9Å
1050	G	82.1	Confident	87.2	Confident	55 Å²	55	44.7 Å²	44.7	57%	0.567	28%	0.28	S	S	*	.	S	Bend	trans	100.4	-163.6	179.3	0	0	0	0	0	115	F1052 A1053	G1050-F1052 PolarHBondContact O-N 2.84Å; G1050-F1052 VanDerWaalsContact O-N 3.15Å; G1050-A1053 PolarHBondContact O-N 3.31Å
1051	P	83.4	Confident	87.5	Confident	64 Å²	64	43.8 Å²	43.8	42%	0.416	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	0.9	-165.8	32.5	-37.4	0	0	0	115	K1067 Y1072	P1051-K1067 WeakPolarHBondContact O-CE 3.44Å; P1051-K1067 PolarHBondContact O-NZ 3.03Å; P1051-Y1072 HydrophobicContact CB-CE2 4.42Å; P1051-Y1072 WeakPolarHBondContact CB-OH 3.17Å; P1051-Y1072 HydrophobicContact CG-CE2 4.15Å
1052	F	89.1	Confident	87.8	Confident	8 Å²	8	41.9 Å²	41.9	4%	0.035	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.6	2.2	-178.7	-52.5	-63.5	0	0	0	113.6	L1045 L1047 G1050 D1054 L1055 G1056 L1064 K1067 A1068 Y1072 M1074	L1045-F1052 HydrophobicContact CD1-CE2 4.09Å; L1047-F1052 HydrophobicContact CD2-CB 4Å; G1050-F1052 PolarHBondContact O-N 2.84Å; G1050-F1052 VanDerWaalsContact O-N 3.15Å; F1052-D1054 VanDerWaalsContact C-OD1 3.3Å; F1052-D1054 WeakPolarHBondContact CA-OD1 3.42Å; F1052-D1054 PolarHBondContact O-N 3.48Å; F1052-L1055 WeakPolarHBondContact O-CB 3.33Å; F1052-L1055 PolarHBondContact O-N 2.81Å; F1052-G1056 PolarHBondContact O-N 2.71Å; F1052-L1064 HydrophobicContact CB-CD1 3.74Å; F1052-L1064 HydrophobicContact CD1-CD1 3.64Å; F1052-L1064 HydrophobicContact CD2-CD1 4.35Å; F1052-L1064 HydrophobicContact CE1-CD1 4.32Å; F1052-L1064 HydrophobicContact CG-CD1 3.66Å; F1052-K1067 HydrophobicContact CD1-CD 4.1Å; F1052-K1067 HydrophobicContact CD1-CG 4.43Å; F1052-K1067 HydrophobicContact CE1-CD 4.33Å; F1052-K1067 HydrophobicContact CE1-CG 4.17Å; F1052-A1068 HydrophobicContact CE1-CB 3.99Å; F1052-A1068 HydrophobicContact CZ-CB 3.81Å; F1052-Y1072 HydrophobicContact CE1-CD2 4.31Å; F1052-Y1072 HydrophobicContact CE1-CE2 4.12Å; F1052-Y1072 HydrophobicContact CE2-CE2 4.49Å; F1052-Y1072 AromaticContact CZ-CD2 3.65Å; F1052-Y1072 HydrophobicContact CZ-CD2 3.65Å; F1052-Y1072 AromaticContact CZ-CE2 3.68Å; F1052-Y1072 HydrophobicContact CZ-CE2 3.68Å; F1052-M1074 HydrophobicContact CE2-CE 3.72Å; F1052-M1074 HydrophobicContact CZ-CE 3.79Å
1053	A	87.1	Confident	87.8	Confident	34 Å²	34	45 Å²	45	28%	0.281	28%	0.283	S	S	.	.	H	α-helix	trans	-61.9	-25.9	179.5	0	0	0	0	0	112.8	L1047 G1050 L1055 G1056	L1047-A1053 VanDerWaalsContact O-CA 3.24Å; L1047-A1053 WeakPolarHBondContact O-CA 3.09Å; L1047-A1053 WeakPolarHBondContact O-CB 3.36Å; G1050-A1053 PolarHBondContact O-N 3.31Å; A1053-L1055 PolarHBondContact O-N 3.45Å; A1053-G1056 PolarHBondContact O-N 2.67Å; A1053-G1056 VanDerWaalsContact O-N 3.14Å
1054	D	86.6	Confident	88	Confident	115 Å²	115	44.2 Å²	44.2	62%	0.615	28%	0.276	S	S	*	.	H	α-helix	trans	-63.8	-19.7	171.7	63.5	-33.1	0	0	0	114.4	F1052 K1067	F1052-D1054 VanDerWaalsContact C-OD1 3.3Å; F1052-D1054 WeakPolarHBondContact CA-OD1 3.42Å; F1052-D1054 PolarHBondContact O-N 3.48Å; D1054-K1067 IonicContact OD1-NZ 3.04Å; D1054-K1067 PolarHBondContact OD1-NZ 2.97Å; D1054-K1067 IonicContact OD2-NZ 2.91Å; D1054-K1067 PolarHBondContact OD2-NZ 3.14Å
1055	L	86.4	Confident	88.1	Confident	21 Å²	21	42 Å²	42	11%	0.11	27%	0.266	C	S	.	.	H	α-helix	trans	-99.5	-11	174.5	-75.7	141.4	0	0	0	113.1	F1052 A1053 D1057 G1059 D1063 L1064 K1067	F1052-L1055 WeakPolarHBondContact O-CB 3.33Å; F1052-L1055 PolarHBondContact O-N 2.81Å; A1053-L1055 PolarHBondContact O-N 3.45Å; L1055-D1057 VanDerWaalsContact C-N 3.34Å; L1055-G1059 VanDerWaalsContact O-CA 3.32Å; L1055-G1059 WeakPolarHBondContact O-CA 3.45Å; L1055-G1059 PolarHBondContact O-N 3.47Å; L1055-G1059 VanDerWaalsContact O-N 3.16Å; L1055-D1063 HydrophobicContact CD2-CB 3.74Å; L1055-L1064 HydrophobicContact CD1-CD1 4.42Å; L1055-K1067 HydrophobicContact CD1-CB 4.49Å; L1055-K1067 HydrophobicContact CD1-CD 3.41Å; L1055-K1067 VanDerWaalsContact CD1-CD 3.41Å
1056	G	80.5	Confident	88.2	Confident	0 Å²	0	41 Å²	41	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-69.4	-31.3	179.5	0	0	0	0	0	113.2	F1052 A1053 G1058 V1109 P1110	F1052-G1056 PolarHBondContact O-N 2.71Å; A1053-G1056 PolarHBondContact O-N 2.67Å; A1053-G1056 VanDerWaalsContact O-N 3.14Å; G1056-G1058 VanDerWaalsContact C-N 3.27Å; G1056-G1058 PolarHBondContact O-N 3.11Å; G1056-V1109 CarbonylContact O-C 3.57Å; G1056-P1110 WeakPolarHBondContact O-CD 3.33Å; G1056-P1110 VanDerWaalsContact O-N 3.14Å
1057	D	82.1	Confident	88.3	Confident	136 Å²	136	42.2 Å²	42.2	73%	0.727	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	63	-177.4	-69.6	-23.8	0	0	0	112.3	L1055	L1055-D1057 VanDerWaalsContact C-N 3.34Å
1058	G	79.5	Confident	88.5	Confident	43 Å²	43	42.1 Å²	42.1	44%	0.443	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	22.5	176.4	0	0	0	0	0	114.9	G1056	G1056-G1058 VanDerWaalsContact C-N 3.27Å; G1056-G1058 PolarHBondContact O-N 3.11Å
1059	G	89.3	Confident	88.9	Confident	18 Å²	18	36.7 Å²	36.7	19%	0.186	23%	0.231	C	C	.	.			trans	-75.1	165.1	172.7	0	0	0	0	0	113.1	L1055 L1108	L1055-G1059 VanDerWaalsContact O-CA 3.32Å; L1055-G1059 WeakPolarHBondContact O-CA 3.45Å; L1055-G1059 PolarHBondContact O-N 3.47Å; L1055-G1059 VanDerWaalsContact O-N 3.16Å; G1059-L1108 WeakPolarHBondContact O-CB 3.34Å; G1059-L1108 WeakPolarHBondContact O-CG 3.46Å; G1059-L1108 PolarHBondContact O-N 2.84Å
1060	C	94.3	Very high	89.5	Confident	33 Å²	33	38.4 Å²	38.4	22%	0.223	24%	0.235	C	C	.	.	B	Isolated β-bridge	trans	-87	140	177.1	-64.7	0	0	0	0	112	G1062 D1063 L1064	C1060-G1062 PolarHBondContact O-N 3.49Å; C1060-D1063 PolarHBondContact O-N 3.23Å; C1060-D1063 VanDerWaalsContact O-N 3.15Å; C1060-L1064 PolarHBondContact O-N 3.43Å
1061	Y	95.3	Very high	89.9	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-55.7	-36.6	176.1	177.6	-99	0	0	0	113	F623 D1063 L1064 F1065 C1076 F1077 G1078 I1079 P1102 F1106 L1108	F623-Y1061 HydrophobicContact CE2-CE1 4.33Å; F623-Y1061 AromaticContact CZ-CD1 3.99Å; F623-Y1061 HydrophobicContact CZ-CD1 3.99Å; F623-Y1061 AromaticContact CZ-CE1 3.86Å; F623-Y1061 HydrophobicContact CZ-CE1 3.86Å; Y1061-D1063 VanDerWaalsContact C-N 3.34Å; Y1061-D1063 PolarHBondContact O-N 3.09Å; Y1061-L1064 WeakPolarHBondContact O-CB 3.43Å; Y1061-L1064 PolarHBondContact O-N 3.26Å; Y1061-F1065 PolarHBondContact O-N 2.78Å; Y1061-C1076 HydrophobicContact CE2-CB 4.4Å; Y1061-C1076 PolarHBondContact OH-O 3.49Å; Y1061-F1077 WeakPolarHBondContact OH-CA 3.48Å; Y1061-F1077 PolarHBondContact OH-N 2.93Å; Y1061-G1078 PolarHBondContact OH-N 3.39Å; Y1061-I1079 HydrophobicContact CD2-CD1 3.81Å; Y1061-I1079 HydrophobicContact CD2-CG1 3.94Å; Y1061-I1079 HydrophobicContact CE2-CD1 4.31Å; Y1061-I1079 HydrophobicContact CE2-CG1 3.95Å; Y1061-I1079 HydrophobicContact CG-CD1 4.49Å; Y1061-P1102 HydrophobicContact CD1-CG 3.75Å; Y1061-P1102 HydrophobicContact CD2-CG 3.85Å; Y1061-P1102 HydrophobicContact CE1-CG 3.74Å; Y1061-P1102 HydrophobicContact CE2-CG 3.82Å; Y1061-P1102 HydrophobicContact CG-CG 3.8Å; Y1061-F1106 PolarHBondContact N-O 2.84Å; Y1061-L1108 HydrophobicContact CD2-CD2 4.21Å
1062	G	94.1	Very high	90.3	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-64.9	-33.4	179.2	0	0	0	0	0	114.5	C1060 C1066 Y1104	C1060-G1062 PolarHBondContact O-N 3.49Å; G1062-C1066 PolarHBondContact O-N 3.46Å; G1062-C1066 PolarHBondContact O-SG 3.01Å; G1062-Y1104 PolarHBondContact N-O 2.93Å
1063	D	93.9	Very high	90.4	Very high	72 Å²	72	43.1 Å²	43.1	39%	0.385	24%	0.24	S	C	.	.	H	α-helix	trans	-72.6	-39.9	176.5	-64.8	-28.3	0	0	0	110.9	L1055 C1060 Y1061 C1066 K1067 Y1104	L1055-D1063 HydrophobicContact CD2-CB 3.74Å; C1060-D1063 PolarHBondContact O-N 3.23Å; C1060-D1063 VanDerWaalsContact O-N 3.15Å; Y1061-D1063 VanDerWaalsContact C-N 3.34Å; Y1061-D1063 PolarHBondContact O-N 3.09Å; D1063-C1066 PolarHBondContact O-N 2.81Å; D1063-K1067 WeakPolarHBondContact O-CB 3.43Å; D1063-K1067 PolarHBondContact O-N 3.04Å; D1063-Y1104 PolarHBondContact OD1-OH 3.12Å
1064	L	94.4	Very high	90.7	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.01	23%	0.229	C	C	.	.	H	α-helix	trans	-58.5	-49.8	171.1	173.9	67	0	0	0	111.2	L1047 F1052 L1055 C1060 Y1061 C1066 K1067 A1068 L1108 I1114	L1047-L1064 HydrophobicContact CD2-CD1 4.3Å; L1047-L1064 HydrophobicContact CD2-CD2 4.14Å; F1052-L1064 HydrophobicContact CB-CD1 3.74Å; F1052-L1064 HydrophobicContact CD1-CD1 3.64Å; F1052-L1064 HydrophobicContact CD2-CD1 4.35Å; F1052-L1064 HydrophobicContact CE1-CD1 4.32Å; F1052-L1064 HydrophobicContact CG-CD1 3.66Å; L1055-L1064 HydrophobicContact CD1-CD1 4.42Å; C1060-L1064 PolarHBondContact O-N 3.43Å; Y1061-L1064 WeakPolarHBondContact O-CB 3.43Å; Y1061-L1064 PolarHBondContact O-N 3.26Å; L1064-C1066 VanDerWaalsContact C-N 3.34Å; L1064-C1066 PolarHBondContact O-N 2.81Å; L1064-K1067 PolarHBondContact O-N 3.31Å; L1064-A1068 VanDerWaalsContact O-CB 3.29Å; L1064-A1068 WeakPolarHBondContact O-CB 3.2Å; L1064-A1068 PolarHBondContact O-N 2.97Å; L1064-L1108 HydrophobicContact CB-CD1 3.96Å; L1064-L1108 HydrophobicContact CD2-CD1 3.8Å; L1064-L1108 HydrophobicContact CD2-CD2 4.49Å; L1064-L1108 HydrophobicContact CG-CD1 4.47Å; L1064-I1114 HydrophobicContact CD2-CD1 3.99Å; L1064-I1114 HydrophobicContact CD2-CG1 3.88Å; L1064-I1114 HydrophobicContact CD2-CG2 4.25Å
1065	F	95.5	Very high	91.1	Very high	1 Å²	1	36.6 Å²	36.6	0%	0.004	20%	0.2	C	C	.	.	H	α-helix	trans	-54.3	-50	176.8	176.5	-88.6	0	0	0	111.2	F623 L629 Y1061 K1067 L1069 L1075 C1076	F623-F1065 HydrophobicContact CB-CD1 4.16Å; F623-F1065 HydrophobicContact CB-CE1 3.54Å; F623-F1065 HydrophobicContact CB-CZ 3.95Å; F623-F1065 AromaticContact CD1-CD1 3.61Å; F623-F1065 HydrophobicContact CD1-CD1 3.61Å; F623-F1065 AromaticContact CD1-CE1 3.91Å; F623-F1065 HydrophobicContact CD1-CE1 3.91Å; F623-F1065 HydrophobicContact CD1-CG 4.1Å; F623-F1065 HydrophobicContact CD2-CD1 4.5Å; F623-F1065 HydrophobicContact CD2-CE1 4.28Å; F623-F1065 HydrophobicContact CD2-CE2 4.35Å; F623-F1065 HydrophobicContact CD2-CZ 4.21Å; F623-F1065 HydrophobicContact CE1-CB 4.31Å; F623-F1065 HydrophobicContact CE1-CD1 4.15Å; F623-F1065 HydrophobicContact CE1-CG 4.2Å; F623-F1065 AromaticContact CG-CD1 3.82Å; F623-F1065 HydrophobicContact CG-CD1 3.82Å; F623-F1065 AromaticContact CG-CE1 3.64Å; F623-F1065 HydrophobicContact CG-CE1 3.64Å; F623-F1065 HydrophobicContact CG-CE2 4.49Å; F623-F1065 HydrophobicContact CG-CG 4.35Å; F623-F1065 HydrophobicContact CG-CZ 4Å; L629-F1065 HydrophobicContact CD1-CD2 4.49Å; L629-F1065 HydrophobicContact CD1-CE2 3.57Å; L629-F1065 HydrophobicContact CD1-CZ 4.09Å; Y1061-F1065 PolarHBondContact O-N 2.78Å; F1065-K1067 PolarHBondContact O-N 2.81Å; F1065-L1069 HydrophobicContact CE1-CD2 3.81Å; F1065-L1069 HydrophobicContact CZ-CD2 3.96Å; F1065-L1069 WeakPolarHBondContact O-CB 3.3Å; F1065-L1069 PolarHBondContact O-N 3.06Å; F1065-L1075 HydrophobicContact CE2-CD1 3.56Å; F1065-L1075 HydrophobicContact CE2-CG 4.26Å; F1065-L1075 HydrophobicContact CZ-CD1 3.66Å; F1065-C1076 HydrophobicContact CD2-CB 4.15Å; F1065-C1076 WeakPolarHBondContact CD2-O 3.38Å; F1065-C1076 WeakPolarHBondContact CE2-O 3.33Å
1066	C	94.4	Very high	91.5	Very high	15 Å²	15	35.7 Å²	35.7	10%	0.101	20%	0.195	C	C	.	.	H	α-helix	trans	-64.5	-41.3	-180	-67.6	0	0	0	0	112.7	G1062 D1063 L1064 K1070	G1062-C1066 PolarHBondContact O-N 3.46Å; G1062-C1066 PolarHBondContact O-SG 3.01Å; D1063-C1066 PolarHBondContact O-N 2.81Å; L1064-C1066 VanDerWaalsContact C-N 3.34Å; L1064-C1066 PolarHBondContact O-N 2.81Å; C1066-K1070 WeakPolarHBondContact O-CB 3.34Å; C1066-K1070 WeakPolarHBondContact O-CG 3.26Å; C1066-K1070 PolarHBondContact O-N 2.93Å
1067	K	93.8	Very high	92.1	Very high	61 Å²	61	36 Å²	36	27%	0.265	20%	0.197	S	C	.	.	H	α-helix	trans	-68	-44.2	179.3	-171.6	-178.7	171.9	-170.5	0	111.6	P1051 F1052 D1054 L1055 D1063 L1064 F1065 T1071	P1051-K1067 WeakPolarHBondContact O-CE 3.44Å; P1051-K1067 PolarHBondContact O-NZ 3.03Å; F1052-K1067 HydrophobicContact CD1-CD 4.1Å; F1052-K1067 HydrophobicContact CD1-CG 4.43Å; F1052-K1067 HydrophobicContact CE1-CD 4.33Å; F1052-K1067 HydrophobicContact CE1-CG 4.17Å; D1054-K1067 IonicContact OD1-NZ 3.04Å; D1054-K1067 PolarHBondContact OD1-NZ 2.97Å; D1054-K1067 IonicContact OD2-NZ 2.91Å; D1054-K1067 PolarHBondContact OD2-NZ 3.14Å; L1055-K1067 HydrophobicContact CD1-CB 4.49Å; L1055-K1067 HydrophobicContact CD1-CD 3.41Å; L1055-K1067 VanDerWaalsContact CD1-CD 3.41Å; D1063-K1067 WeakPolarHBondContact O-CB 3.43Å; D1063-K1067 PolarHBondContact O-N 3.04Å; L1064-K1067 PolarHBondContact O-N 3.31Å; F1065-K1067 PolarHBondContact O-N 2.81Å; K1067-T1071 WeakPolarHBondContact O-CB 3.25Å; K1067-T1071 PolarHBondContact O-N 3.43Å; K1067-T1071 VanDerWaalsContact O-N 3.1Å; K1067-T1071 PolarHBondContact O-OG1 2.81Å
1068	A	93.5	Very high	92.8	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-65.1	-44.9	178.6	0	0	0	0	0	112.1	F1052 L1064 Y1072 N1073 M1074	F1052-A1068 HydrophobicContact CE1-CB 3.99Å; F1052-A1068 HydrophobicContact CZ-CB 3.81Å; L1064-A1068 VanDerWaalsContact O-CB 3.29Å; L1064-A1068 WeakPolarHBondContact O-CB 3.2Å; L1064-A1068 PolarHBondContact O-N 2.97Å; A1068-Y1072 PolarHBondContact O-N 3.37Å; A1068-N1073 PolarHBondContact O-N 3.12Å; A1068-M1074 CarbonylContact C-O 3.31Å; A1068-M1074 HydrophobicContact CB-CB 4.35Å; A1068-M1074 PolarHBondContact O-N 3.31Å
1069	L	93.8	Very high	93.6	Very high	2 Å²	2	27.5 Å²	27.5	1%	0.01	14%	0.141	C	C	.	.	H	α-helix	trans	-68.2	-44.5	-179.1	-175.2	61.9	0	0	0	112.3	P616 C619 F1065 N1073 M1074 L1075	P616-L1069 HydrophobicContact CB-CD1 3.96Å; P616-L1069 HydrophobicContact CB-CG 4.05Å; P616-L1069 HydrophobicContact CG-CD1 4.47Å; P616-L1069 WeakPolarHBondContact O-CD2 3.16Å; C619-L1069 HydrophobicContact CB-CD2 3.66Å; F1065-L1069 HydrophobicContact CE1-CD2 3.81Å; F1065-L1069 HydrophobicContact CZ-CD2 3.96Å; F1065-L1069 WeakPolarHBondContact O-CB 3.3Å; F1065-L1069 PolarHBondContact O-N 3.06Å; L1069-N1073 WeakPolarHBondContact O-CA 3.41Å; L1069-N1073 PolarHBondContact O-N 2.94Å; L1069-N1073 VanDerWaalsContact O-N 3.08Å; L1069-M1074 WeakPolarHBondContact CA-O 3.38Å; L1069-M1074 PolarHBondContact N-O 2.9Å; L1069-L1075 HydrophobicContact CD1-CD1 4.25Å
1070	K	91.5	Very high	93.9	Very high	126 Å²	126	26.9 Å²	26.9	55%	0.548	13%	0.133	S	C	.	.	H	α-helix	trans	-68.6	-41.3	178.8	-74.9	175.4	-179.6	168	0	113.6	E620 C1066	E620-K1070 WeakPolarHBondContact OE1-CE 3.38Å; E620-K1070 IonicContact OE1-NZ 2.73Å; E620-K1070 PolarHBondContact OE1-NZ 3.34Å; E620-K1070 WeakPolarHBondContact OE2-CE 3.29Å; E620-K1070 IonicContact OE2-NZ 3.51Å; E620-K1070 PolarHBondContact OE2-NZ 3.46Å; C1066-K1070 WeakPolarHBondContact O-CB 3.34Å; C1066-K1070 WeakPolarHBondContact O-CG 3.26Å; C1066-K1070 PolarHBondContact O-N 2.93Å
1071	T	90.5	Very high	94	Very high	85 Å²	85	26.2 Å²	26.2	52%	0.521	13%	0.126	S	C	.	.	H	α-helix	trans	-86.1	-37.4	-169.9	-45.8	0	0	0	0	111.9	K1067	K1067-T1071 WeakPolarHBondContact O-CB 3.25Å; K1067-T1071 PolarHBondContact O-N 3.43Å; K1067-T1071 VanDerWaalsContact O-N 3.1Å; K1067-T1071 PolarHBondContact O-OG1 2.81Å
1072	Y	90	Very high	93.9	Very high	105 Å²	105	27.8 Å²	27.8	41%	0.412	13%	0.134	S	C	.	.	H	α-helix	trans	-126.2	0	-170.2	-57.5	-80.4	0	0	0	113.9	P1051 F1052 A1068 M1074	P1051-Y1072 HydrophobicContact CB-CE2 4.42Å; P1051-Y1072 WeakPolarHBondContact CB-OH 3.17Å; P1051-Y1072 HydrophobicContact CG-CE2 4.15Å; F1052-Y1072 HydrophobicContact CE1-CD2 4.31Å; F1052-Y1072 HydrophobicContact CE1-CE2 4.12Å; F1052-Y1072 HydrophobicContact CE2-CE2 4.49Å; F1052-Y1072 AromaticContact CZ-CD2 3.65Å; F1052-Y1072 HydrophobicContact CZ-CD2 3.65Å; F1052-Y1072 AromaticContact CZ-CE2 3.68Å; F1052-Y1072 HydrophobicContact CZ-CE2 3.68Å; A1068-Y1072 PolarHBondContact O-N 3.37Å; Y1072-M1074 HydrophobicContact CD2-CE 3.81Å; Y1072-M1074 HydrophobicContact CG-CE 3.74Å; Y1072-M1074 PolarHBondContact O-N 3.13Å
1073	N	92.3	Very high	93.7	Very high	36 Å²	36	29.3 Å²	29.3	19%	0.193	14%	0.14	C	C	.	.			trans	53.9	28.7	-170.2	-52.5	-84.7	0	0	0	113.1	N647 A1068 L1069 Q1119	N647-N1073 PolarHBondContact ND2-O 2.98Å; A1068-N1073 PolarHBondContact O-N 3.12Å; L1069-N1073 WeakPolarHBondContact O-CA 3.41Å; L1069-N1073 PolarHBondContact O-N 2.94Å; L1069-N1073 VanDerWaalsContact O-N 3.08Å; N1073-Q1119 HydrophobicContact CB-CG 3.86Å; N1073-Q1119 PolarHBondContact O-NE2 3.09Å
1074	M	93.3	Very high	93.3	Very high	13 Å²	13	27 Å²	27	6%	0.064	13%	0.128	C	C	.	.			trans	-89.4	119.1	176.9	-66.8	-166.6	-69.1	0	0	109.6	L1045 F1052 A1068 L1069 Y1072 L1117 M1118	L1045-M1074 HydrophobicContact CD1-CE 3.9Å; L1045-M1074 HydrophobicContact CD1-SD 4.05Å; F1052-M1074 HydrophobicContact CE2-CE 3.72Å; F1052-M1074 HydrophobicContact CZ-CE 3.79Å; A1068-M1074 CarbonylContact C-O 3.31Å; A1068-M1074 HydrophobicContact CB-CB 4.35Å; A1068-M1074 PolarHBondContact O-N 3.31Å; L1069-M1074 WeakPolarHBondContact CA-O 3.38Å; L1069-M1074 PolarHBondContact N-O 2.9Å; Y1072-M1074 HydrophobicContact CD2-CE 3.81Å; Y1072-M1074 HydrophobicContact CG-CE 3.74Å; Y1072-M1074 PolarHBondContact O-N 3.13Å; M1074-L1117 WeakPolarHBondContact CA-O 3.31Å; M1074-M1118 HydrophobicContact CG-CG 4.45Å; M1074-M1118 HydrophobicContact SD-CE 3.82Å; M1074-M1118 HydrophobicContact SD-CG 3.83Å
1075	L	94.9	Very high	92.7	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	109.3	175.8	-170.3	79.3	0	0	0	108.9	C619 L629 M630 I631 N647 F1065 L1069 C1116 L1117	C619-L1075 HydrophobicContact CB-CD1 4.34Å; L629-L1075 HydrophobicContact CD1-CD1 4.39Å; M630-L1075 WeakPolarHBondContact O-CD2 3.36Å; I631-L1075 HydrophobicContact CB-CD2 4.3Å; I631-L1075 HydrophobicContact CG1-CD2 3.93Å; N647-L1075 HydrophobicContact CB-CB 4.35Å; F1065-L1075 HydrophobicContact CE2-CD1 3.56Å; F1065-L1075 HydrophobicContact CE2-CG 4.26Å; F1065-L1075 HydrophobicContact CZ-CD1 3.66Å; L1069-L1075 HydrophobicContact CD1-CD1 4.25Å; L1075-C1116 CarbonylContact O-C 3.55Å; L1075-C1116 VanDerWaalsContact O-CA 3.22Å; L1075-C1116 WeakPolarHBondContact O-CA 3.5Å; L1075-L1117 HydrophobicContact CB-CB 4.3Å; L1075-L1117 HydrophobicContact CD2-CD1 4.15Å; L1075-L1117 PolarHBondContact N-O 2.82Å; L1075-L1117 PolarHBondContact O-N 2.95Å
1076	C	95.4	Very high	91.8	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.007	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	138.3	168.8	-60.5	0	0	0	0	109.4	Y1061 F1065 I1114 F1115	Y1061-C1076 HydrophobicContact CE2-CB 4.4Å; Y1061-C1076 PolarHBondContact OH-O 3.49Å; F1065-C1076 HydrophobicContact CD2-CB 4.15Å; F1065-C1076 WeakPolarHBondContact CD2-O 3.38Å; F1065-C1076 WeakPolarHBondContact CE2-O 3.33Å; C1076-I1114 HydrophobicContact CB-CG2 4.03Å; C1076-F1115 WeakPolarHBondContact CA-O 3.46Å
1077	F	93.2	Very high	91	Very high	8 Å²	8	34.3 Å²	34.3	4%	0.035	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	-3.2	-177.6	62.2	-91	0	0	0	115.4	L568 M571 L629 I631 V1042 Y1061 N1101 F1115 L1117	L568-F1077 HydrophobicContact CD1-CE2 3.6Å; L568-F1077 HydrophobicContact CD1-CZ 3.7Å; M571-F1077 HydrophobicContact CE-CD2 4.49Å; M571-F1077 HydrophobicContact SD-CD2 3.42Å; M571-F1077 WeakPolarHBondContact SD-CD2 3.08Å; M571-F1077 HydrophobicContact SD-CE2 3.41Å; M571-F1077 WeakPolarHBondContact SD-CE2 3.3Å; L629-F1077 HydrophobicContact CD2-CB 3.81Å; I631-F1077 HydrophobicContact CD1-CB 4.35Å; V1042-F1077 HydrophobicContact CG1-CZ 4.03Å; Y1061-F1077 WeakPolarHBondContact OH-CA 3.48Å; Y1061-F1077 PolarHBondContact OH-N 2.93Å; F1077-N1101 PolarHBondContact O-N 2.95Å; F1077-F1115 HydrophobicContact CD1-CB 4.5Å; F1077-F1115 HydrophobicContact CD2-CB 4.18Å; F1077-F1115 HydrophobicContact CE1-CB 4.16Å; F1077-F1115 HydrophobicContact CE2-CB 3.83Å; F1077-F1115 HydrophobicContact CE2-CG 4.48Å; F1077-F1115 HydrophobicContact CZ-CB 3.82Å; F1077-F1115 PolarHBondContact N-O 3.14Å; F1077-L1117 HydrophobicContact CD1-CG 4.05Å; F1077-L1117 HydrophobicContact CE1-CD2 3.97Å; F1077-L1117 HydrophobicContact CE1-CG 3.77Å
1078	G	95.8	Very high	89.9	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.2	-179.2	167.7	0	0	0	0	0	113.5	Y1061 I1099 F1115	Y1061-G1078 PolarHBondContact OH-N 3.39Å; G1078-I1099 CarbonylContact C-O 3.42Å; G1078-I1099 WeakPolarHBondContact CA-O 3.4Å; G1078-F1115 PolarHBondContact O-N 3.44Å
1079	I	96.4	Very high	88.9	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	147.6	-178.2	-56.5	169.8	0	0	0	109.1	Y1061 R1081 I1099 P1102 F1106 L1108 D1112 I1114	Y1061-I1079 HydrophobicContact CD2-CD1 3.81Å; Y1061-I1079 HydrophobicContact CD2-CG1 3.94Å; Y1061-I1079 HydrophobicContact CE2-CD1 4.31Å; Y1061-I1079 HydrophobicContact CE2-CG1 3.95Å; Y1061-I1079 HydrophobicContact CG-CD1 4.49Å; I1079-R1081 HydrophobicContact CG2-CB 4.09Å; I1079-I1099 HydrophobicContact CB-CB 4.31Å; I1079-I1099 PolarHBondContact N-O 3.36Å; I1079-I1099 PolarHBondContact O-N 3.33Å; I1079-P1102 HydrophobicContact CD1-CB 4.27Å; I1079-P1102 HydrophobicContact CD1-CG 3.69Å; I1079-P1102 HydrophobicContact CG1-CG 3.97Å; I1079-F1106 HydrophobicContact CD1-CD1 3.54Å; I1079-F1106 HydrophobicContact CD1-CE1 3.56Å; I1079-L1108 HydrophobicContact CD1-CD2 3.86Å; I1079-D1112 HydrophobicContact CG2-CB 3.9Å; I1079-I1114 HydrophobicContact CB-CD1 4.35Å; I1079-I1114 HydrophobicContact CG1-CD1 3.77Å; I1079-I1114 HydrophobicContact CG2-CD1 4.19Å
1080	Y	96.8	Very high	87.9	Confident	4 Å²	4	48.1 Å²	48.1	2%	0.016	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	85	172.6	-167.8	-133.9	0	0	0	108.8	Q566 C976 R1096 Y1097 V1098 L1113 F1115	Q566-Y1080 HydrophobicContact CB-CE1 4.05Å; Q566-Y1080 VanDerWaalsContact CD-OH 3.26Å; Q566-Y1080 HydrophobicContact CG-CE1 4.17Å; Q566-Y1080 WeakPolarHBondContact CG-OH 3.39Å; C976-Y1080 PolarHBondContact O-OH 3.26Å; Y1080-R1096 HydrophobicContact CD1-CB 3.78Å; Y1080-R1096 VanDerWaalsContact CD1-CD 3.5Å; Y1080-R1096 HydrophobicContact CD1-CG 4.29Å; Y1080-R1096 HydrophobicContact CD2-CB 3.78Å; Y1080-R1096 HydrophobicContact CE1-CB 3.57Å; Y1080-R1096 HydrophobicContact CE1-CG 4.2Å; Y1080-R1096 HydrophobicContact CE2-CB 3.57Å; Y1080-R1096 WeakPolarHBondContact CE2-O 3.48Å; Y1080-R1096 HydrophobicContact CG-CB 3.87Å; Y1080-R1096 VanDerWaalsContact CZ-CB 3.44Å; Y1080-R1096 PolarHBondContact O-NH1 2.8Å; Y1080-R1096 PolarHBondContact OH-O 3.04Å; Y1080-Y1097 CarbonylContact C-O 3.2Å; Y1080-Y1097 WeakPolarHBondContact CA-O 3.15Å; Y1080-Y1097 WeakPolarHBondContact CD2-O 3.25Å; Y1080-V1098 HydrophobicContact CD2-CG2 4.03Å; Y1080-V1098 HydrophobicContact CE2-CG2 4.23Å; Y1080-L1113 HydrophobicContact CD1-CB 4.49Å; Y1080-L1113 HydrophobicContact CD1-CD1 4.2Å; Y1080-L1113 PolarHBondContact N-O 2.84Å; Y1080-L1113 PolarHBondContact O-N 3.28Å; Y1080-F1115 HydrophobicContact CD2-CE2 4.28Å; Y1080-F1115 HydrophobicContact CD2-CZ 4.22Å; Y1080-F1115 HydrophobicContact CG-CE2 4.16Å; Y1080-F1115 HydrophobicContact CG-CZ 4.14Å
1081	R	95.1	Very high	87.3	Confident	20 Å²	20	44.8 Å²	44.8	8%	0.075	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	141.2	-167	173.5	160.4	-71.3	175.6	3.4	111.1	I1079 R1083 A1085 R1096 Y1097 I1099 F1106 E1107 D1112	I1079-R1081 HydrophobicContact CG2-CB 4.09Å; R1081-R1083 PolarHBondContact O-N 3.12Å; R1081-A1085 HydrophobicContact CG-CB 4.05Å; R1081-R1096 CarbonylContact O-C 3.35Å; R1081-R1096 WeakPolarHBondContact O-CA 3.27Å; R1081-R1096 WeakPolarHBondContact O-CB 3.19Å; R1081-Y1097 HydrophobicContact CB-CE1 4.12Å; R1081-Y1097 HydrophobicContact CG-CE1 3.98Å; R1081-Y1097 PolarHBondContact N-O 3.04Å; R1081-Y1097 VanDerWaalsContact O-CD1 3.29Å; R1081-Y1097 WeakPolarHBondContact O-CD1 3.36Å; R1081-Y1097 PolarHBondContact O-N 3.37Å; R1081-I1099 HydrophobicContact CB-CD1 4.14Å; R1081-F1106 VanDerWaalsContact NH1-CE1 3.26Å; R1081-E1107 PolarHBondContact NH2-O 2.86Å; R1081-D1112 WeakPolarHBondContact CA-OD1 3.38Å; R1081-D1112 WeakPolarHBondContact CB-OD1 3.48Å; R1081-D1112 WeakPolarHBondContact CG-OD1 3.44Å; R1081-D1112 IonicContact CZ-OD2 3.3Å; R1081-D1112 IonicContact NE-OD1 2.77Å; R1081-D1112 PolarHBondContact NE-OD1 3.11Å; R1081-D1112 IonicContact NE-OD2 2.74Å; R1081-D1112 PolarHBondContact NE-OD2 3.33Å; R1081-D1112 IonicContact NH2-OD2 3.98Å; R1081-D1112 PolarHBondContact NH2-OD2 3.48Å
1082	L	93.3	Very high	86.8	Confident	33 Å²	33	49.2 Å²	49.2	17%	0.173	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	134	173	-76	165.9	0	0	0	110.3	D1084 A1085 T1094 K1095 R1096 T1111	L1082-D1084 VanDerWaalsContact C-N 3.28Å; L1082-D1084 PolarHBondContact O-N 3.19Å; L1082-A1085 HydrophobicContact CB-CB 4.09Å; L1082-A1085 WeakPolarHBondContact O-CB 3.43Å; L1082-A1085 PolarHBondContact O-N 3.31Å; L1082-A1085 VanDerWaalsContact O-N 3.12Å; L1082-T1094 WeakPolarHBondContact CD2-O 3.47Å; L1082-K1095 WeakPolarHBondContact CA-O 3.48Å; L1082-R1096 HydrophobicContact CD2-CG 3.68Å; L1082-R1096 HydrophobicContact CG-CG 4.04Å; L1082-T1111 HydrophobicContact CD1-CG2 4.35Å
1083	R	89.6	Confident	86.5	Confident	31 Å²	31	45.6 Å²	45.6	12%	0.117	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-51.1	-50.4	-178.6	-170.2	-168.6	67.4	-165.8	-5.8	111.2	W589 D959 R1081 A1085 H1086 C1093 K1095 Y1097	W589-R1083 HydrophobicContact CB-CG 4.02Å; W589-R1083 HydrophobicContact CD2-CG 4.49Å; W589-R1083 HydrophobicContact CG-CG 3.78Å; D959-R1083 IonicContact OD2-CZ 2.79Å; D959-R1083 IonicContact OD2-NH1 3.26Å; D959-R1083 PolarHBondContact OD2-NH1 3.07Å; D959-R1083 IonicContact OD2-NH2 2.72Å; R1081-R1083 PolarHBondContact O-N 3.12Å; R1083-A1085 VanDerWaalsContact C-N 3.29Å; R1083-A1085 PolarHBondContact O-N 3.03Å; R1083-H1086 PolarHBondContact O-CE1 3.28Å; R1083-H1086 PolarHBondContact O-ND1 3.44Å; R1083-C1093 PolarHBondContact NH2-SG 2.87Å; R1083-C1093 VanDerWaalsContact NH2-SG 3.45Å; R1083-K1095 PolarHBondContact N-O 3.39Å; R1083-Y1097 HydrophobicContact CB-CD1 4.4Å
1084	D	86.7	Confident	86.3	Confident	24 Å²	24	47.1 Å²	47.1	13%	0.128	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-86.5	8.3	-172.6	-59.6	-3.4	0	0	0	113	L1082 H1086 L1087 S1091 C1093	L1082-D1084 VanDerWaalsContact C-N 3.28Å; L1082-D1084 PolarHBondContact O-N 3.19Å; D1084-H1086 PolarHBondContact O-N 3.42Å; D1084-L1087 HydrophobicContact CB-CD1 4.04Å; D1084-L1087 WeakPolarHBondContact O-CB 3.42Å; D1084-L1087 PolarHBondContact O-N 3.15Å; D1084-L1087 VanDerWaalsContact O-N 3.09Å; D1084-S1091 WeakPolarHBondContact OD2-CB 3.31Å; D1084-S1091 PolarHBondContact OD2-OG 3.41Å; D1084-C1093 WeakPolarHBondContact OD2-CB 3.46Å
1085	A	80.6	Confident	86.2	Confident	36 Å²	36	48 Å²	48	30%	0.298	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-64	-23.7	-176.3	0	0	0	0	0	114.8	R1081 L1082 R1083 L1087	R1081-A1085 HydrophobicContact CG-CB 4.05Å; L1082-A1085 HydrophobicContact CB-CB 4.09Å; L1082-A1085 WeakPolarHBondContact O-CB 3.43Å; L1082-A1085 PolarHBondContact O-N 3.31Å; L1082-A1085 VanDerWaalsContact O-N 3.12Å; R1083-A1085 VanDerWaalsContact C-N 3.29Å; R1083-A1085 PolarHBondContact O-N 3.03Å; A1085-L1087 VanDerWaalsContact C-N 3.34Å
1086	H	76.4	Confident	86.2	Confident	54 Å²	54	49.9 Å²	49.9	25%	0.25	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-83.5	-11.7	178.2	64.2	-77.9	0	0	0	112.6	D587 R1083 D1084	D587-H1086 PolarHBondContact O-CD2 3.35Å; D587-H1086 PolarHBondContact O-NE2 3.37Å; R1083-H1086 PolarHBondContact O-CE1 3.28Å; R1083-H1086 PolarHBondContact O-ND1 3.44Å; D1084-H1086 PolarHBondContact O-N 3.42Å
1087	L	77.9	Confident	86.2	Confident	82 Å²	82	49.9 Å²	49.9	43%	0.429	28%	0.284	S	S	.	.	S	Bend	trans	-85.5	138.4	-177.2	-59.6	177.6	0	0	0	111.3	D1084 A1085 T1089	D1084-L1087 HydrophobicContact CB-CD1 4.04Å; D1084-L1087 WeakPolarHBondContact O-CB 3.42Å; D1084-L1087 PolarHBondContact O-N 3.15Å; D1084-L1087 VanDerWaalsContact O-N 3.09Å; A1085-L1087 VanDerWaalsContact C-N 3.34Å; L1087-T1089 PolarHBondContact O-N 2.97Å
1088	S	70.8	Confident	86.4	Confident	127 Å²	127	49.5 Å²	49.5	89%	0.888	28%	0.283	S	S	*	.	S	Bend	trans	-69	-11.3	178.1	58.3	0	0	0	0	114.5
1089	T	73.1	Confident	86.5	Confident	95 Å²	95	49.5 Å²	49.5	58%	0.583	28%	0.283	S	S	*	.	S	Bend	trans	-106.1	121.7	179.9	47.3	0	0	0	0	110.5	L1087 S1091	L1087-T1089 PolarHBondContact O-N 2.97Å; T1089-S1091 PolarHBondContact O-N 3.49Å
1090	P	73.1	Confident	86.4	Confident	130 Å²	130	49.6 Å²	49.6	84%	0.844	28%	0.283	S	S	*	.			trans	-67.4	109	-178.7	26.3	-33.6	0	0	0	111.5
1091	S	78.8	Confident	86.4	Confident	57 Å²	57	50.5 Å²	50.5	40%	0.399	29%	0.288	S	S	.	.			trans	-81.8	158.9	173.2	-179	0	0	0	0	111.6	D1084 T1089 C1093	D1084-S1091 WeakPolarHBondContact OD2-CB 3.31Å; D1084-S1091 PolarHBondContact OD2-OG 3.41Å; T1089-S1091 PolarHBondContact O-N 3.49Å; S1091-C1093 WeakPolarHBondContact OG-CB 3.35Å; S1091-C1093 PolarHBondContact OG-N 2.6Å; S1091-C1093 VanDerWaalsContact OG-N 3.11Å
1092	Q	79.4	Confident	86.4	Confident	178 Å²	178	49.6 Å²	49.6	83%	0.832	29%	0.285	S	S	*	.			trans	-92.6	1.7	169.7	-65.1	-65	-54.6	0	0	112.4	T1094	Q1092-T1094 PolarHBondContact O-N 2.81Å
1093	C	84.3	Confident	86.4	Confident	28 Å²	28	50.8 Å²	50.8	19%	0.189	29%	0.294	C	S	.	.			trans	-67.9	119.3	178.6	-170.2	0	0	0	0	110.9	R1083 D1084 S1091	R1083-C1093 PolarHBondContact NH2-SG 2.87Å; R1083-C1093 VanDerWaalsContact NH2-SG 3.45Å; D1084-C1093 WeakPolarHBondContact OD2-CB 3.46Å; S1091-C1093 WeakPolarHBondContact OG-CB 3.35Å; S1091-C1093 PolarHBondContact OG-N 2.6Å; S1091-C1093 VanDerWaalsContact OG-N 3.11Å
1094	T	87.6	Confident	86.6	Confident	68 Å²	68	52.2 Å²	52.2	42%	0.417	30%	0.3	S	S	.	.			trans	-91.6	-2.6	179.5	56.9	0	0	0	0	113.3	N940 L1082 Q1092	N940-T1094 VanDerWaalsContact OD1-CG2 3.26Å; N940-T1094 WeakPolarHBondContact OD1-CG2 3.4Å; N940-T1094 PolarHBondContact OD1-OG1 2.71Å; L1082-T1094 WeakPolarHBondContact CD2-O 3.47Å; Q1092-T1094 PolarHBondContact O-N 2.81Å
1095	K	91.6	Very high	86.9	Confident	33 Å²	33	58.2 Å²	58.2	14%	0.143	33%	0.327	C	S	.	.			trans	-62.4	138.2	179.7	-64	-179.8	-178.2	-177.5	0	111	D957 D959 Q972 L1082 R1083	D957-K1095 IonicContact OD1-NZ 3.99Å; D957-K1095 PolarHBondContact OD1-NZ 3.21Å; D957-K1095 IonicContact OD2-NZ 3.71Å; D957-K1095 PolarHBondContact OD2-NZ 3.29Å; D959-K1095 VanDerWaalsContact CG-NZ 3.3Å; D959-K1095 IonicContact OD1-NZ 2.74Å; D959-K1095 PolarHBondContact OD1-NZ 3.11Å; D959-K1095 IonicContact OD2-NZ 3.61Å; D959-K1095 PolarHBondContact OD2-NZ 3.19Å; Q972-K1095 VanDerWaalsContact NE2-NZ 3.14Å; L1082-K1095 WeakPolarHBondContact CA-O 3.48Å; R1083-K1095 PolarHBondContact N-O 3.39Å
1096	R	94.6	Very high	87.6	Confident	38 Å²	38	57.3 Å²	57.3	14%	0.143	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	144.4	-179.9	-67.8	170.4	178.3	-86.2	-1.7	109.4	C976 Y1080 R1081 L1082 T1111	C976-R1096 WeakPolarHBondContact CA-O 3.47Å; C976-R1096 VanDerWaalsContact CB-O 3.22Å; C976-R1096 WeakPolarHBondContact CB-O 3.26Å; C976-R1096 PolarHBondContact SG-O 2.99Å; C976-R1096 VanDerWaalsContact SG-O 3.35Å; Y1080-R1096 HydrophobicContact CD1-CB 3.78Å; Y1080-R1096 VanDerWaalsContact CD1-CD 3.5Å; Y1080-R1096 HydrophobicContact CD1-CG 4.29Å; Y1080-R1096 HydrophobicContact CD2-CB 3.78Å; Y1080-R1096 HydrophobicContact CE1-CB 3.57Å; Y1080-R1096 HydrophobicContact CE1-CG 4.2Å; Y1080-R1096 HydrophobicContact CE2-CB 3.57Å; Y1080-R1096 WeakPolarHBondContact CE2-O 3.48Å; Y1080-R1096 HydrophobicContact CG-CB 3.87Å; Y1080-R1096 VanDerWaalsContact CZ-CB 3.44Å; Y1080-R1096 PolarHBondContact O-NH1 2.8Å; Y1080-R1096 PolarHBondContact OH-O 3.04Å; R1081-R1096 CarbonylContact O-C 3.35Å; R1081-R1096 WeakPolarHBondContact O-CA 3.27Å; R1081-R1096 WeakPolarHBondContact O-CB 3.19Å; L1082-R1096 HydrophobicContact CD2-CG 3.68Å; L1082-R1096 HydrophobicContact CG-CG 4.04Å; R1096-T1111 VanDerWaalsContact CZ-O 3.24Å; R1096-T1111 PolarHBondContact NH1-O 3.31Å; R1096-T1111 PolarHBondContact NH2-O 3.48Å
1097	Y	95.9	Very high	88.4	Confident	1 Å²	1	61 Å²	61	0%	0.004	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	159.8	175.8	67.9	-81.8	0	0	0	110.8	W589 Y592 A975 Y1080 R1081 R1083 I1099	W589-Y1097 HydrophobicContact CB-CD1 3.99Å; W589-Y1097 HydrophobicContact CB-CE1 3.71Å; W589-Y1097 HydrophobicContact CB-CE2 4.49Å; W589-Y1097 HydrophobicContact CE3-CD2 4.41Å; W589-Y1097 HydrophobicContact CE3-CG 4.26Å; W589-Y1097 WeakPolarHBondContact O-CE2 3.03Å; Y592-Y1097 WeakPolarHBondContact CB-OH 3.45Å; A975-Y1097 WeakPolarHBondContact O-CA 3.31Å; Y1080-Y1097 CarbonylContact C-O 3.2Å; Y1080-Y1097 WeakPolarHBondContact CA-O 3.15Å; Y1080-Y1097 WeakPolarHBondContact CD2-O 3.25Å; R1081-Y1097 HydrophobicContact CB-CE1 4.12Å; R1081-Y1097 HydrophobicContact CG-CE1 3.98Å; R1081-Y1097 PolarHBondContact N-O 3.04Å; R1081-Y1097 VanDerWaalsContact O-CD1 3.29Å; R1081-Y1097 WeakPolarHBondContact O-CD1 3.36Å; R1081-Y1097 PolarHBondContact O-N 3.37Å; R1083-Y1097 HydrophobicContact CB-CD1 4.4Å; Y1097-I1099 HydrophobicContact CD2-CG1 4.04Å; Y1097-I1099 HydrophobicContact CE2-CD1 3.71Å; Y1097-I1099 HydrophobicContact CE2-CG1 3.58Å
1098	V	97.1	Very high	89.1	Confident	1 Å²	1	57.2 Å²	57.2	1%	0.006	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	136.3	-174.2	175.9	0	0	0	0	111.5	G567 T570 M571 Y593 A975 Y1080 F1115	G567-V1098 WeakPolarHBondContact O-CG2 3.37Å; T570-V1098 HydrophobicContact CG2-CG2 4.35Å; M571-V1098 HydrophobicContact CB-CG1 3.73Å; M571-V1098 HydrophobicContact CE-CG1 3.59Å; M571-V1098 HydrophobicContact CG-CG1 4.13Å; Y593-V1098 VanDerWaalsContact CD2-O 3.3Å; Y593-V1098 WeakPolarHBondContact CD2-O 3.48Å; A975-V1098 PolarHBondContact O-N 2.83Å; Y1080-V1098 HydrophobicContact CD2-CG2 4.03Å; Y1080-V1098 HydrophobicContact CE2-CG2 4.23Å; V1098-F1115 HydrophobicContact CG1-CE2 4.45Å; V1098-F1115 HydrophobicContact CG2-CE2 4.46Å; V1098-F1115 HydrophobicContact CG2-CZ 4.44Å
1099	I	96.8	Very high	90.1	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	110.6	168	-53.5	173.8	0	0	0	107.9	G1078 I1079 R1081 Y1097 P1102 F1106	G1078-I1099 CarbonylContact C-O 3.42Å; G1078-I1099 WeakPolarHBondContact CA-O 3.4Å; I1079-I1099 HydrophobicContact CB-CB 4.31Å; I1079-I1099 PolarHBondContact N-O 3.36Å; I1079-I1099 PolarHBondContact O-N 3.33Å; R1081-I1099 HydrophobicContact CB-CD1 4.14Å; Y1097-I1099 HydrophobicContact CD2-CG1 4.04Å; Y1097-I1099 HydrophobicContact CE2-CD1 3.71Å; Y1097-I1099 HydrophobicContact CE2-CG1 3.58Å; I1099-P1102 HydrophobicContact CG2-CB 4.08Å; I1099-P1102 HydrophobicContact CG2-CG 4.49Å; I1099-F1106 HydrophobicContact CD1-CE1 4.19Å; I1099-F1106 HydrophobicContact CD1-CZ 3.77Å
1100	T	96.1	Very high	90.8	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.006	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	136.2	179.9	-42.1	0	0	0	0	110.5	M571 L575 G596 N599 I663	M571-T1100 HydrophobicContact CG-CG2 3.79Å; M571-T1100 HydrophobicContact SD-CG2 4.17Å; L575-T1100 HydrophobicContact CD1-CG2 4.38Å; L575-T1100 HydrophobicContact CD2-CG2 3.84Å; L575-T1100 HydrophobicContact CG-CG2 4.2Å; G596-T1100 WeakPolarHBondContact CA-O 3.41Å; N599-T1100 PolarHBondContact ND2-O 3.42Å; I663-T1100 HydrophobicContact CD1-CG2 4.46Å
1101	N	95.6	Very high	91.7	Very high	24 Å²	24	46.4 Å²	46.4	13%	0.128	24%	0.241	C	C	.	.	S	Bend	trans	43.4	56.1	172.4	-173.3	42.9	0	0	0	115.5	N599 L629 I663 F1077	N599-N1101 PolarHBondContact OD1-ND2 2.71Å; L629-N1101 VanDerWaalsContact CB-OD1 3.29Å; L629-N1101 WeakPolarHBondContact CB-OD1 3.46Å; L629-N1101 HydrophobicContact CD2-CB 4.02Å; L629-N1101 WeakPolarHBondContact CD2-OD1 3.46Å; I663-N1101 HydrophobicContact CG2-CB 3.74Å; F1077-N1101 PolarHBondContact O-N 2.95Å
1102	P	95.2	Very high	92.4	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.006	22%	0.223	C	C	.	.			trans	-65	152.2	178.5	26.4	-32.4	0	0	0	111.9	Y1061 I1079 I1099 F1106	Y1061-P1102 HydrophobicContact CD1-CG 3.75Å; Y1061-P1102 HydrophobicContact CD2-CG 3.85Å; Y1061-P1102 HydrophobicContact CE1-CG 3.74Å; Y1061-P1102 HydrophobicContact CE2-CG 3.82Å; Y1061-P1102 HydrophobicContact CG-CG 3.8Å; I1079-P1102 HydrophobicContact CD1-CB 4.27Å; I1079-P1102 HydrophobicContact CD1-CG 3.69Å; I1079-P1102 HydrophobicContact CG1-CG 3.97Å; I1099-P1102 HydrophobicContact CG2-CB 4.08Å; I1099-P1102 HydrophobicContact CG2-CG 4.49Å; P1102-F1106 HydrophobicContact CB-CB 3.98Å; P1102-F1106 HydrophobicContact CB-CD1 3.99Å; P1102-F1106 HydrophobicContact CB-CD2 4.09Å; P1102-F1106 HydrophobicContact CB-CE1 4.48Å; P1102-F1106 HydrophobicContact CB-CG 3.77Å
1103	P	93.5	Very high	93.1	Very high	57 Å²	57	37.1 Å²	37.1	37%	0.37	19%	0.193	S	C	.	.			trans	-66.7	163.8	-176.9	27.2	-35	0	0	0	113	E595 E1105 F1106	E595-P1103 WeakPolarHBondContact OE1-CD 3.09Å; E595-P1103 WeakPolarHBondContact OE1-CG 3.44Å; P1103-E1105 VanDerWaalsContact C-N 3.32Å; P1103-E1105 PolarHBondContact O-N 3.36Å; P1103-F1106 HydrophobicContact CG-CB 4.11Å; P1103-F1106 HydrophobicContact CG-CD2 4.22Å; P1103-F1106 WeakPolarHBondContact O-CB 3.31Å; P1103-F1106 PolarHBondContact O-N 2.96Å; P1103-F1106 VanDerWaalsContact O-N 3.07Å
1104	Y	92.8	Very high	93.7	Very high	62 Å²	62	35.9 Å²	35.9	24%	0.243	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-47.4	-178	-166.8	-77.6	0	0	0	113.1	F623 V624 G1062 D1063 F1106	F623-Y1104 HydrophobicContact CD1-CD2 4.06Å; F623-Y1104 AromaticContact CE1-CD2 3.73Å; F623-Y1104 HydrophobicContact CE1-CD2 3.73Å; F623-Y1104 HydrophobicContact CE1-CE2 4.41Å; V624-Y1104 HydrophobicContact CG2-CE2 4.01Å; G1062-Y1104 PolarHBondContact N-O 2.93Å; D1063-Y1104 PolarHBondContact OD1-OH 3.12Å; Y1104-F1106 PolarHBondContact O-N 2.89Å
1105	E	93.9	Very high	94.1	Very high	149 Å²	149	32.6 Å²	32.6	70%	0.696	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.4	8.4	-176.9	-49.3	-60.8	146.6	0	0	113.6	P1103 E1107	P1103-E1105 VanDerWaalsContact C-N 3.32Å; P1103-E1105 PolarHBondContact O-N 3.36Å; E1105-E1107 PolarHBondContact O-N 2.89Å
1106	F	94.6	Very high	94.3	Very high	17 Å²	17	31 Å²	31	8%	0.075	16%	0.157	C	C	.	.	P	Polyproline II helix	trans	-69	123.2	-176.6	-165.9	-94.9	0	0	0	111.1	Y592 Y1061 I1079 R1081 I1099 P1102 P1103 Y1104	Y592-F1106 AromaticContact CD1-CE2 3.83Å; Y592-F1106 HydrophobicContact CD1-CE2 3.83Å; Y592-F1106 HydrophobicContact CD1-CZ 4.01Å; Y592-F1106 HydrophobicContact CE1-CE2 4.32Å; Y1061-F1106 PolarHBondContact N-O 2.84Å; I1079-F1106 HydrophobicContact CD1-CD1 3.54Å; I1079-F1106 HydrophobicContact CD1-CE1 3.56Å; R1081-F1106 VanDerWaalsContact NH1-CE1 3.26Å; I1099-F1106 HydrophobicContact CD1-CE1 4.19Å; I1099-F1106 HydrophobicContact CD1-CZ 3.77Å; P1102-F1106 HydrophobicContact CB-CB 3.98Å; P1102-F1106 HydrophobicContact CB-CD1 3.99Å; P1102-F1106 HydrophobicContact CB-CD2 4.09Å; P1102-F1106 HydrophobicContact CB-CE1 4.48Å; P1102-F1106 HydrophobicContact CB-CG 3.77Å; P1103-F1106 HydrophobicContact CG-CB 4.11Å; P1103-F1106 HydrophobicContact CG-CD2 4.22Å; P1103-F1106 WeakPolarHBondContact O-CB 3.31Å; P1103-F1106 PolarHBondContact O-N 2.96Å; P1103-F1106 VanDerWaalsContact O-N 3.07Å; Y1104-F1106 PolarHBondContact O-N 2.89Å
1107	E	93.2	Very high	94.3	Very high	132 Å²	132	29.4 Å²	29.4	62%	0.617	15%	0.151	S	C	*	.	B	Isolated β-bridge	trans	-70.1	131.5	-178.4	-174.8	174.4	-173.4	0	0	111.4	R1081 E1105	R1081-E1107 PolarHBondContact NH2-O 2.86Å; E1105-E1107 PolarHBondContact O-N 2.89Å
1108	L	92.8	Very high	94	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.01	16%	0.163	C	C	.	.	P	Polyproline II helix	trans	-91	146	175.7	-65.3	174.8	0	0	0	111.8	L1047 G1059 Y1061 L1064 I1079 I1114	L1047-L1108 HydrophobicContact CD1-CB 4.22Å; L1047-L1108 HydrophobicContact CD1-CD1 4.11Å; L1047-L1108 HydrophobicContact CD1-CD2 4.23Å; L1047-L1108 HydrophobicContact CD1-CG 4.43Å; G1059-L1108 WeakPolarHBondContact O-CB 3.34Å; G1059-L1108 WeakPolarHBondContact O-CG 3.46Å; G1059-L1108 PolarHBondContact O-N 2.84Å; Y1061-L1108 HydrophobicContact CD2-CD2 4.21Å; L1064-L1108 HydrophobicContact CB-CD1 3.96Å; L1064-L1108 HydrophobicContact CD2-CD1 3.8Å; L1064-L1108 HydrophobicContact CD2-CD2 4.49Å; L1064-L1108 HydrophobicContact CG-CD1 4.47Å; I1079-L1108 HydrophobicContact CD1-CD2 3.86Å; L1108-I1114 HydrophobicContact CD2-CD1 4.21Å
1109	V	91.3	Very high	93.6	Very high	39 Å²	39	34.1 Å²	34.1	24%	0.236	17%	0.174	C	C	.	.			trans	-111.1	137.9	172.2	-177.5	0	0	0	0	107.5	G1056 T1111 D1112	G1056-V1109 CarbonylContact O-C 3.57Å; V1109-T1111 WeakPolarHBondContact CG1-OG1 3.43Å; V1109-T1111 PolarHBondContact O-N 3.22Å; V1109-D1112 PolarHBondContact N-OD2 3.46Å; V1109-D1112 VanDerWaalsContact O-CB 3.29Å; V1109-D1112 WeakPolarHBondContact O-CB 3.28Å; V1109-D1112 PolarHBondContact O-N 3.34Å
1110	P	89.4	Confident	93.1	Very high	42 Å²	42	34.9 Å²	34.9	27%	0.273	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-21.7	-172.1	24.4	-34.4	0	0	0	113.1	L1047 L1048 G1056 D1112	L1047-P1110 CarbonylContact C-O 3.42Å; L1047-P1110 WeakPolarHBondContact CB-O 3.48Å; L1048-P1110 HydrophobicContact CD2-CB 4.45Å; L1048-P1110 WeakPolarHBondContact CG-O 3.43Å; L1048-P1110 PolarHBondContact N-O 3.09Å; L1048-P1110 VanDerWaalsContact N-O 3.16Å; G1056-P1110 WeakPolarHBondContact O-CD 3.33Å; G1056-P1110 VanDerWaalsContact O-N 3.14Å; P1110-D1112 VanDerWaalsContact C-N 3.31Å; P1110-D1112 PolarHBondContact O-N 2.84Å
1111	T	90.9	Very high	92.2	Very high	45 Å²	45	38.9 Å²	38.9	28%	0.276	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-5.7	174.9	54.5	0	0	0	0	114.6	L1048 L1082 R1096 V1109	L1048-T1111 HydrophobicContact CD2-CG2 4.42Å; L1082-T1111 HydrophobicContact CD1-CG2 4.35Å; R1096-T1111 VanDerWaalsContact CZ-O 3.24Å; R1096-T1111 PolarHBondContact NH1-O 3.31Å; R1096-T1111 PolarHBondContact NH2-O 3.48Å; V1109-T1111 WeakPolarHBondContact CG1-OG1 3.43Å; V1109-T1111 PolarHBondContact O-N 3.22Å
1112	D	93.5	Very high	90.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.214	C	C	.	.			trans	-67.2	149.2	-177.6	-72.9	-28.2	0	0	0	112.4	L1047 I1079 R1081 V1109 P1110 I1114	L1047-D1112 HydrophobicContact CD1-CB 4.2Å; L1047-D1112 PolarHBondContact N-O 3.36Å; I1079-D1112 HydrophobicContact CG2-CB 3.9Å; R1081-D1112 WeakPolarHBondContact CA-OD1 3.38Å; R1081-D1112 WeakPolarHBondContact CB-OD1 3.48Å; R1081-D1112 WeakPolarHBondContact CG-OD1 3.44Å; R1081-D1112 IonicContact CZ-OD2 3.3Å; R1081-D1112 IonicContact NE-OD1 2.77Å; R1081-D1112 PolarHBondContact NE-OD1 3.11Å; R1081-D1112 IonicContact NE-OD2 2.74Å; R1081-D1112 PolarHBondContact NE-OD2 3.33Å; R1081-D1112 IonicContact NH2-OD2 3.98Å; R1081-D1112 PolarHBondContact NH2-OD2 3.48Å; V1109-D1112 PolarHBondContact N-OD2 3.46Å; V1109-D1112 VanDerWaalsContact O-CB 3.29Å; V1109-D1112 WeakPolarHBondContact O-CB 3.28Å; V1109-D1112 PolarHBondContact O-N 3.34Å; P1110-D1112 VanDerWaalsContact C-N 3.31Å; P1110-D1112 PolarHBondContact O-N 2.84Å; D1112-I1114 HydrophobicContact CB-CD1 4.46Å
1113	L	95.3	Very high	88.3	Confident	39 Å²	39	47.5 Å²	47.5	20%	0.204	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	135.4	167.2	-60.5	179.3	0	0	0	108.3	L1045 A1046 Y1080	L1045-L1113 CarbonylContact O-C 3.56Å; L1045-L1113 WeakPolarHBondContact O-CA 3.43Å; A1046-L1113 HydrophobicContact CB-CD2 3.7Å; Y1080-L1113 HydrophobicContact CD1-CB 4.49Å; Y1080-L1113 HydrophobicContact CD1-CD1 4.2Å; Y1080-L1113 PolarHBondContact N-O 2.84Å; Y1080-L1113 PolarHBondContact O-N 3.28Å
1114	I	95.9	Very high	86.2	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.01	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	125.1	-172.5	-54.7	-65.5	0	0	0	109.9	Q1044 L1045 L1047 L1064 C1076 I1079 L1108 D1112 C1116	Q1044-I1114 WeakPolarHBondContact CA-O 3.49Å; L1045-I1114 PolarHBondContact N-O 2.99Å; L1045-I1114 PolarHBondContact O-N 3.42Å; L1047-I1114 HydrophobicContact CD1-CD1 4.1Å; L1047-I1114 HydrophobicContact CD1-CG1 4.1Å; L1047-I1114 HydrophobicContact CD2-CG1 3.97Å; L1047-I1114 HydrophobicContact CG-CD1 4.44Å; L1047-I1114 HydrophobicContact CG-CG1 3.91Å; L1064-I1114 HydrophobicContact CD2-CD1 3.99Å; L1064-I1114 HydrophobicContact CD2-CG1 3.88Å; L1064-I1114 HydrophobicContact CD2-CG2 4.25Å; C1076-I1114 HydrophobicContact CB-CG2 4.03Å; I1079-I1114 HydrophobicContact CB-CD1 4.35Å; I1079-I1114 HydrophobicContact CG1-CD1 3.77Å; I1079-I1114 HydrophobicContact CG2-CD1 4.19Å; L1108-I1114 HydrophobicContact CD2-CD1 4.21Å; D1112-I1114 HydrophobicContact CB-CD1 4.46Å; I1114-C1116 PolarHBondContact O-N 3.07Å
1115	F	96.9	Very high	83.4	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	124.5	172.9	-68.8	-81.2	0	0	0	109.9	A565 Q566 L568 M571 Q1044 C1076 F1077 G1078 Y1080 V1098	A565-F1115 HydrophobicContact CB-CD1 4.13Å; A565-F1115 HydrophobicContact CB-CE1 4.09Å; Q566-F1115 WeakPolarHBondContact O-CE1 3.48Å; Q566-F1115 VanDerWaalsContact O-CZ 3.22Å; Q566-F1115 WeakPolarHBondContact O-CZ 3.5Å; L568-F1115 HydrophobicContact CB-CE1 4.18Å; L568-F1115 HydrophobicContact CD1-CD1 3.97Å; L568-F1115 HydrophobicContact CD1-CE1 4.21Å; M571-F1115 HydrophobicContact CE-CB 4.31Å; M571-F1115 HydrophobicContact CE-CD2 3.27Å; M571-F1115 HydrophobicContact CE-CE2 3.52Å; M571-F1115 HydrophobicContact CE-CG 3.85Å; M571-F1115 HydrophobicContact CE-CZ 4.32Å; Q1044-F1115 HydrophobicContact CG-CD1 4.09Å; Q1044-F1115 HydrophobicContact CG-CE1 4.24Å; C1076-F1115 WeakPolarHBondContact CA-O 3.46Å; F1077-F1115 HydrophobicContact CD1-CB 4.5Å; F1077-F1115 HydrophobicContact CD2-CB 4.18Å; F1077-F1115 HydrophobicContact CE1-CB 4.16Å; F1077-F1115 HydrophobicContact CE2-CB 3.83Å; F1077-F1115 HydrophobicContact CE2-CG 4.48Å; F1077-F1115 HydrophobicContact CZ-CB 3.82Å; F1077-F1115 PolarHBondContact N-O 3.14Å; G1078-F1115 PolarHBondContact O-N 3.44Å; Y1080-F1115 HydrophobicContact CD2-CE2 4.28Å; Y1080-F1115 HydrophobicContact CD2-CZ 4.22Å; Y1080-F1115 HydrophobicContact CG-CE2 4.16Å; Y1080-F1115 HydrophobicContact CG-CZ 4.14Å; V1098-F1115 HydrophobicContact CG1-CE2 4.45Å; V1098-F1115 HydrophobicContact CG2-CE2 4.46Å; V1098-F1115 HydrophobicContact CG2-CZ 4.44Å
1116	C	94.8	Very high	80.4	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	156.5	179.7	74.2	0	0	0	0	113.5	A1043 L1045 L1075 I1114	A1043-C1116 PolarHBondContact N-O 3.25Å; A1043-C1116 PolarHBondContact O-N 3.06Å; L1045-C1116 HydrophobicContact CD1-CB 4.27Å; L1075-C1116 CarbonylContact O-C 3.55Å; L1075-C1116 VanDerWaalsContact O-CA 3.22Å; L1075-C1116 WeakPolarHBondContact O-CA 3.5Å; I1114-C1116 PolarHBondContact O-N 3.07Å
1117	L	93.9	Very high	77.2	Confident	3 Å²	3	48 Å²	48	2%	0.016	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	105.5	168.1	-64.5	177.1	0	0	0	109.1	I631 I646 N647 L1005 C1040 R1041 V1042 M1074 L1075 F1077	I631-L1117 HydrophobicContact CG2-CD1 4.15Å; I646-L1117 HydrophobicContact CG2-CD1 3.63Å; N647-L1117 HydrophobicContact CB-CB 4.18Å; N647-L1117 HydrophobicContact CB-CD1 3.82Å; N647-L1117 PolarHBondContact ND2-O 3.16Å; L1005-L1117 HydrophobicContact CD1-CD2 4.24Å; C1040-L1117 HydrophobicContact CB-CB 4.18Å; R1041-L1117 WeakPolarHBondContact O-CA 3.37Å; V1042-L1117 HydrophobicContact CG2-CD2 3.86Å; M1074-L1117 WeakPolarHBondContact CA-O 3.31Å; L1075-L1117 HydrophobicContact CB-CB 4.3Å; L1075-L1117 HydrophobicContact CD2-CD1 4.15Å; L1075-L1117 PolarHBondContact N-O 2.82Å; L1075-L1117 PolarHBondContact O-N 2.95Å; F1077-L1117 HydrophobicContact CD1-CG 4.05Å; F1077-L1117 HydrophobicContact CE1-CD2 3.97Å; F1077-L1117 HydrophobicContact CE1-CG 3.77Å
1118	M	90.6	Very high	74.1	Confident	49 Å²	49	52.3 Å²	52.3	24%	0.241	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	139.8	175.4	-58.1	-174.4	79.2	0	0	110.7	C1040 R1041 A1043 M1074	C1040-M1118 CarbonylContact C-O 3.58Å; C1040-M1118 WeakPolarHBondContact CA-O 3.47Å; R1041-M1118 HydrophobicContact CG-CB 4Å; R1041-M1118 PolarHBondContact N-O 2.76Å; R1041-M1118 PolarHBondContact O-N 3.17Å; A1043-M1118 HydrophobicContact CB-CG 3.91Å; A1043-M1118 HydrophobicContact CB-SD 3.56Å; A1043-M1118 VanDerWaalsContact CB-SD 3.56Å; M1074-M1118 HydrophobicContact CG-CG 4.45Å; M1074-M1118 HydrophobicContact SD-CE 3.82Å; M1074-M1118 HydrophobicContact SD-CG 3.83Å
1119	Q	89.3	Confident	71	Confident	52 Å²	52	56.3 Å²	56.3	24%	0.243	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-68.5	158.5	168.2	-61.2	-63.1	-25.6	0	0	111.1	N647 C1040 N1073	N647-Q1119 PolarHBondContact ND2-NE2 3.04Å; N647-Q1119 PolarHBondContact O-NE2 2.98Å; C1040-Q1119 PolarHBondContact SG-NE2 3.31Å; N1073-Q1119 HydrophobicContact CB-CG 3.86Å; N1073-Q1119 PolarHBondContact O-NE2 3.09Å
1120	F	85.8	Confident	67.9	Low	16 Å²	16	58.8 Å²	58.8	7%	0.07	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-80.1	133.8	166.1	-174.8	-104.6	0	0	0	110	N810 H812 H1122	N810-F1120 VanDerWaalsContact O-CD2 3.29Å; N810-F1120 WeakPolarHBondContact O-CD2 3.36Å; H812-F1120 AromaticContact CE1-CE2 3.34Å; H812-F1120 WeakPolarHBondContact CE1-CE2 3.31Å; H812-F1120 AromaticContact CE1-CZ 3.61Å; H812-F1120 AromaticContact ND1-CE2 3.8Å; H812-F1120 AromaticContact NE2-CE2 3.65Å; H812-F1120 AromaticContact NE2-CZ 3.43Å; H812-F1120 WeakPolarHBondContact NE2-CZ 3.27Å; F1120-H1122 AromaticContact CD1-CE1 3.94Å; F1120-H1122 AromaticContact CE1-CE1 3.82Å; F1120-H1122 AromaticContact CE1-ND1 3.66Å
1121	D	76.5	Confident	65	Low	85 Å²	85	64.4 Å²	64.4	46%	0.455	36%	0.358	S	S	.	.			trans	-112.5	121.1	174.8	176.4	20.8	0	0	0	110.4	H812 N1123 A1124	H812-D1121 PolarHBondContact CE1-O 3.4Å; H812-D1121 VanDerWaalsContact CE1-O 3.3Å; H812-D1121 PolarHBondContact NE2-O 3.4Å; D1121-N1123 VanDerWaalsContact C-N 3.32Å; D1121-N1123 PolarHBondContact O-N 2.99Å; D1121-N1123 WeakPolarHBondContact OD1-CB 3.23Å; D1121-N1123 PolarHBondContact OD1-N 2.9Å; D1121-A1124 PolarHBondContact OD2-N 3.06Å
1122	H	63	Low	62	Low	99 Å²	99	66.4 Å²	66.4	46%	0.458	37%	0.374	S	S	.	.	S	Bend	trans	-70.1	-24.7	177.2	-65.9	-79.3	0	0	0	113.5	D1038 F1120	D1038-H1122 VanDerWaalsContact CG-NE2 3.26Å; D1038-H1122 IonicContact OD1-CD2 3.37Å; D1038-H1122 IonicContact OD1-CE1 3.43Å; D1038-H1122 PolarHBondContact OD1-CE1 3.36Å; D1038-H1122 IonicContact OD1-NE2 3.59Å; D1038-H1122 PolarHBondContact OD1-NE2 3.15Å; D1038-H1122 IonicContact OD2-CE1 2.76Å; D1038-H1122 IonicContact OD2-NE2 2.95Å; D1038-H1122 PolarHBondContact OD2-NE2 2.64Å; F1120-H1122 AromaticContact CD1-CE1 3.94Å; F1120-H1122 AromaticContact CE1-CE1 3.82Å; F1120-H1122 AromaticContact CE1-ND1 3.66Å
1123	N	47.4	Very low	58.9	Low	107 Å²	107	75 Å²	75	57%	0.572	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-87.7	-15.7	-170.3	-67.7	-32.3	0	0	0	114.1	D1121 G1125 Q1126 S1127	D1121-N1123 VanDerWaalsContact C-N 3.32Å; D1121-N1123 PolarHBondContact O-N 2.99Å; D1121-N1123 WeakPolarHBondContact OD1-CB 3.23Å; D1121-N1123 PolarHBondContact OD1-N 2.9Å; N1123-G1125 PolarHBondContact O-N 3.43Å; N1123-Q1126 PolarHBondContact O-N 2.8Å; N1123-S1127 PolarHBondContact O-N 2.98Å
1124	A	48	Very low	55.5	Low	37 Å²	37	79.3 Å²	79.3	31%	0.306	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-57.3	-22.6	178.6	0	0	0	0	0	113.9	D1121 S1127	D1121-A1124 PolarHBondContact OD2-N 3.06Å; A1124-S1127 PolarHBondContact O-OG 3.41Å
1125	G	34	Very low	52.1	Low	51 Å²	51	84.2 Å²	84.2	53%	0.526	48%	0.482	S	S	.	.	G	3₁₀ helix	trans	-76.7	-25.5	175.5	0	0	0	0	0	115.4	N1123	N1123-G1125 PolarHBondContact O-N 3.43Å
1126	Q	31	Very low	48.8	Very low	145 Å²	145	92.8 Å²	92.8	68%	0.678	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-28.5	-175.5	-69.2	-175.7	-9.2	0	0	113.1	N1123 R1128 A1129	N1123-Q1126 PolarHBondContact O-N 2.8Å; Q1126-R1128 VanDerWaalsContact C-N 3.26Å; Q1126-R1128 PolarHBondContact O-N 2.67Å; Q1126-A1129 PolarHBondContact O-N 2.86Å; Q1126-A1129 VanDerWaalsContact O-N 3.11Å
1127	S	27.2	Very low	45.5	Very low	63 Å²	63	98.1 Å²	98.1	44%	0.441	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.4	-19	-173	56.6	0	0	0	0	115.3	N1123 A1124	N1123-S1127 PolarHBondContact O-N 2.98Å; A1124-S1127 PolarHBondContact O-OG 3.41Å
1128	R	29.6	Very low	42.3	Very low	223 Å²	223	103.7 Å²	103.7	84%	0.842	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-12.7	173.9	-97.2	-176.8	169.7	173.7	-2.3	114.9	Q1126	Q1126-R1128 VanDerWaalsContact C-N 3.26Å; Q1126-R1128 PolarHBondContact O-N 2.67Å
1129	A	27.6	Very low	39.2	Very low	86 Å²	86	110.8 Å²	110.8	71%	0.711	63%	0.63	S	S	*	*	S	Bend	trans	-91	-9.6	179.4	0	0	0	0	0	113.9	Q1126	Q1126-A1129 PolarHBondContact O-N 2.86Å; Q1126-A1129 VanDerWaalsContact O-N 3.11Å
1130	S	26.3	Very low	36.2	Very low	91 Å²	91	114.2 Å²	114.2	64%	0.636	66%	0.66	S	S	*	*	S	Bend	trans	-125.9	22.4	-171.6	61.7	0	0	0	0	114.4
1131	L	27.3	Very low	33.3	Very low	160 Å²	160	118.9 Å²	118.9	84%	0.838	70%	0.695	S	S	*	*			trans	-112.9	32.5	175.6	-86.2	168	0	0	0	113.2
1132	S	27.6	Very low	30.9	Very low	87 Å²	87	120.2 Å²	120.2	61%	0.608	71%	0.711	S	S	*	*	S	Bend	trans	-125.6	129.1	160.3	53.7	0	0	0	0	109.6
1133	H	28.9	Very low	29.2	Very low	180 Å²	180	125.1 Å²	125.1	83%	0.833	73%	0.731	S	S	*	*			trans	72.8	93.6	-178.1	-53.6	-75.4	0	0	0	118.3
1134	S	23.9	Very low	28.3	Very low	129 Å²	129	129.4 Å²	129.4	90%	0.902	74%	0.744	S	S	*	*			trans	-167.3	48.5	133.5	43	0	0	0	0	113.5	H1136	S1134-H1136 PolarHBondContact O-N 3.31Å
1135	S	25	Very low	27.2	Very low	106 Å²	106	133.4 Å²	133.4	74%	0.741	77%	0.77	S	S	*	*			trans	-83.1	89.9	163.3	39.7	0	0	0	0	110.7
1136	H	28	Very low	26.8	Very low	180 Å²	180	136.5 Å²	136.5	83%	0.833	78%	0.784	S	S	*	*				164.9	144.2	123.5	-91.2	-69	0	0	0	115.3	S1134	S1134-H1136 PolarHBondContact O-N 3.31Å
1137	S	25.1	Very low	26.6	Very low	111 Å²	111	134.6 Å²	134.6	78%	0.776	79%	0.787	S	S	*	*			trans	75.3	111.7	157	74.9	0	0	0	0	119.2
1138	S	25.6	Very low	26.6	Very low	121 Å²	121	137.2 Å²	137.2	85%	0.846	80%	0.799	S	S	*	*				-161.7	142.1	102.3	35.5	0	0	0	0	111
1139	Q	26	Very low	26.6	Very low	197 Å²	197	134.8 Å²	134.8	92%	0.921	80%	0.797	S	S	*	*			trans	-70.9	141.2	172.5	-65.1	144.3	-51.8	0	0	109.3
1140	S	25.5	Very low	26.5	Very low	124 Å²	124	136 Å²	136	87%	0.867	80%	0.8	S	S	*	*			trans	-133.2	151.3	156.1	68.8	0	0	0	0	110.5
1141	S	24.9	Very low	26.5	Very low	115 Å²	115	139.2 Å²	139.2	80%	0.804	81%	0.809	S	S	*	*			trans	-99.2	147.9	-149.4	49.3	0	0	0	0	114.4
1142	S	28.1	Very low	27	Very low	113 Å²	113	136.3 Å²	136.3	79%	0.79	80%	0.8	S	S	*	*			trans	-65.4	136.2	169.8	52.7	0	0	0	0	112.4
1143	K	26.6	Very low	27	Very low	201 Å²	201	137 Å²	137	87%	0.874	81%	0.805	S	S	*	*			trans	-158.8	91.3	154.9	-113.1	168.5	-169.7	178.7	0	114.4
1144	K	27.4	Very low	26.9	Very low	197 Å²	197	134.7 Å²	134.7	86%	0.857	80%	0.803	S	S	*	*			trans	48.2	139.3	137.7	-72.8	-173.4	172.8	-176.7	0	123.5
1145	S	25.2	Very low	27.2	Very low	121 Å²	121	133.2 Å²	133.2	85%	0.846	80%	0.799	S	S	*	*			trans	85	143.6	145.6	74.1	0	0	0	0	117.7
1146	S	26.1	Very low	27.3	Very low	117 Å²	117	135.4 Å²	135.4	82%	0.818	80%	0.803	S	S	*	*			cis	-137	163.5	10.7	51.9	0	0	0	0	114.8
1147	S	27	Very low	27.3	Very low	105 Å²	105	137.9 Å²	137.9	73%	0.734	80%	0.804	S	S	*	*			trans	-77.5	163.2	-176.9	51.5	0	0	0	0	115.8
1148	V	26.6	Very low	28.4	Very low	117 Å²	117	137.2 Å²	137.2	71%	0.709	80%	0.798	S	S	*	*				-175.8	131.3	117.6	140.2	0	0	0	0	112.6
1149	H	29.6	Very low	28.5	Very low	172 Å²	172	139 Å²	139	80%	0.796	80%	0.798	S	S	*	*			trans	36.5	146.7	156.2	-59.3	-45.9	0	0	0	123
1150	S	26.1	Very low	28.7	Very low	111 Å²	111	140.2 Å²	140.2	78%	0.776	79%	0.794	S	S	*	*			cis	-163.5	149.8	-4.8	38	0	0	0	0	114
1151	I	26	Very low	29.3	Very low	160 Å²	160	139.9 Å²	139.9	82%	0.821	79%	0.789	S	S	*	*			trans	-74.4	175.7	171.9	-73.8	161.1	0	0	0	110.7
1152	P	38.9	Very low	29.5	Very low	99 Å²	99	143 Å²	143	64%	0.643	79%	0.788	S	S	*	*			cis	-140.3	171	4	24.6	0.9	0	0	0	120.2
1153	S	26.1	Very low	29.4	Very low	101 Å²	101	142.9 Å²	142.9	71%	0.706	79%	0.787	S	S	*	*			trans	62	147.3	136.6	70.4	0	0	0	0	120.8
1154	T	28.1	Very low	29.5	Very low	131 Å²	131	145 Å²	145	80%	0.804	79%	0.789	S	S	*	*				-169	169.9	50.7	33.3	0	0	0	0	108.7
1155	A	29.3	Very low	29.5	Very low	99 Å²	99	144.6 Å²	144.6	82%	0.818	79%	0.79	S	S	*	*			cis	-163.4	174.3	-15.9	0	0	0	0	0	109.3
1156	N	26.7	Very low	29.7	Very low	152 Å²	152	143.7 Å²	143.7	81%	0.813	78%	0.784	S	S	*	*			trans	-72.9	153	-174.4	-95.2	-48.1	0	0	0	116.7
1157	R	28.1	Very low	29.9	Very low	231 Å²	231	148.8 Å²	148.8	87%	0.872	79%	0.785	S	S	*	*			trans	88.3	162	136.5	-87.2	-166.2	172.8	-178.4	-0.8	121.1
1158	P	48.7	Very low	30.1	Very low	98 Å²	98	150.8 Å²	150.8	64%	0.636	79%	0.788	S	S	*	*			trans	-124.7	-175.9	-131.8	46.3	-34.7	0	0	0	114.4
1159	N	27	Very low	30.3	Very low	158 Å²	158	155.3 Å²	155.3	85%	0.845	80%	0.798	S	S	*	*				-177.9	148	128	-97.8	-29.4	0	0	0	115.3
1160	R	30.4	Very low	30.4	Very low	223 Å²	223	155.5 Å²	155.5	84%	0.842	80%	0.799	S	S	*	*			trans	-76.3	155.2	158.1	-143	-176.5	178.1	177.9	0.5	107.8
1161	P	38.8	Very low	30.5	Very low	117 Å²	117	158.2 Å²	158.2	76%	0.76	81%	0.805	S	S	*	*				-156.5	149.7	86.1	38.4	-18.2	0	0	0	118.8
1162	K	28	Very low	30.7	Very low	181 Å²	181	160.9 Å²	160.9	79%	0.787	81%	0.805	S	S	*	*			trans	42.4	128.9	137.2	-67.1	-172	173.9	-175.9	0	124.2
1163	S	27.5	Very low	30.3	Very low	109 Å²	109	163 Å²	163	76%	0.762	80%	0.804	S	S	*	*				90.2	125.5	122.7	68.1	0	0	0	0	122.4
1164	R	28.8	Very low	30.7	Very low	247 Å²	247	164.6 Å²	164.6	93%	0.932	80%	0.8	S	S	*	*				-161	144.8	111.5	-114.7	174.4	173.3	163.6	-2.2	113.5
1165	E	26.8	Very low	30.9	Very low	187 Å²	187	165 Å²	165	87%	0.874	80%	0.795	S	S	*	*			trans	-85.9	179.4	171.4	-54.4	158.3	127.5	0	0	109.2
1166	S	29.9	Very low	31.2	Very low	102 Å²	102	165.5 Å²	165.5	71%	0.713	79%	0.787	S	S	*	*			cis	-177.5	174.6	36.1	50.8	0	0	0	0	112.8
1167	R	29.5	Very low	31.6	Very low	224 Å²	224	167.7 Å²	167.7	85%	0.845	79%	0.785	S	S	*	*			trans	99	91.2	153.5	-72.2	-178.7	164.5	176.9	-3.4	121.5
1168	D	31.1	Very low	31.9	Very low	148 Å²	148	171.1 Å²	171.1	79%	0.791	80%	0.798	S	S	*	*				24.4	130.2	113.4	-55.7	-45.9	0	0	0	121.1
1169	K	30	Very low	31.1	Very low	212 Å²	212	174.8 Å²	174.8	92%	0.922	81%	0.806	S	S	*	*				-159.1	147.4	106.9	-113.4	176	-177.7	-179.6	0	114
1170	Q	32	Very low	31.3	Very low	175 Å²	175	175.6 Å²	175.6	82%	0.818	80%	0.804	S	S	*	*			trans	-84.1	161.1	-176.7	-59.1	159.3	-63.2	0	0	112.9
1171	N	28.2	Very low	31.4	Very low	169 Å²	169	173 Å²	173	90%	0.904	80%	0.802	S	S	*	*				-149	148	125	-113	-19.9	0	0	0	113.9
1172	R	31.6	Very low	30.9	Very low	215 Å²	215	176.3 Å²	176.3	81%	0.811	81%	0.805	S	S	*	*			trans	-81	170.8	178.2	-103.4	169.3	167.6	179.4	-5.2	110.2
1173	K	30.6	Very low	31.1	Very low	145 Å²	145	176 Å²	176	63%	0.63	81%	0.806	S	S	*	*			cis	-174	159.3	34.1	-135.5	168.9	179.7	-109.3	0	110.9
1174	E	34.1	Very low	31.4	Very low	134 Å²	134	180.5 Å²	180.5	63%	0.626	81%	0.809	S	S	*	*			trans	27.7	150.1	135	-67.6	170.2	166.3	0	0	121.3
1175	M	32	Very low	31.6	Very low	139 Å²	139	175.7 Å²	175.7	69%	0.685	80%	0.8	S	S	*	*			cis	-175.1	161.2	17.9	-138	-172.8	-78.6	0	0	113.2
1176	V	35.9	Very low	31.9	Very low	110 Å²	110	174.8 Å²	174.8	67%	0.667	80%	0.795	S	S	*	*			trans	54.2	155.6	159.4	-94.1	0	0	0	0	120.4
1177	Y	34.7	Very low	32.1	Very low	197 Å²	197	180.9 Å²	180.9	77%	0.773	80%	0.801	S	S	*	*			cis	-146.1	140.8	21.4	-127.5	-66.9	0	0	0	115
1178	R	35.3	Very low	32.3	Very low	303 Å²	303	177 Å²	177	100%	1.143	80%	0.797	S	S	*	*			trans	70.3	0	163.4	-101.3	173.7	-171.4	172.6	3.7	119.4

Retrieved 1,178 of 1,178 residues in 232.8 ms (Link to these results)

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