A0A087YSK5_POEFO Loading...

SLIT and NTRK like family member 3

AlphaFold DB , UniProt , Accession A0A087YSK5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 906 aa.

						>A0A087YSK5_POEFO|A0A087YSK5
MLWVTLLSTIALGWTTPIPLLEDSEEIDEPCFEPCDCEVKEGIFHVHCDSKGFTNVSQISQIWSRPFKLNLQRNLMRKLYFNSFLHLNNAISINLGNNALQDIHAGAFNGLGILKRLFLHENKLEVFRNDTFLGLESLEYLQADYNVIKRIESGAFRHLHKLRVLILNDNLIPMLPNYLFRSVSLTHLDLRGNRLKTLQYKGTLEYVGRSLMEIQLEENPWNCVCEIVQLKTWLERIPYTALVGEITCETPFHLHGKDLREIKRSELCPLLTDAEIEAKLGIPRVPFSNENTWPTKPSSMLSPFHNTASSVEYKDRPAKPTKKPTRRPTKNPPTPRSIYPGLNQPPIAGYQTRPPIPIICPANCICNLHINDLGLTVNCKDKGFHNISELLPRPLNAKKLYLSGNLIQKIYRSDFWNFSSLDLLHLGNNQISYVQEGAFINLPNLKSLYLNGNDIERLSPGMFRGLQMLSYLYFEYNVIREIQSHSFSLMPNLQLVFLNNNLLRSLPNDAFAGTNLARLNLRRNHFVSLPVHGVLEHLTSIVQIDLHQNPWDCSCDIIPLKQWLEKLSSVIVVGEVTCNTPEYAFGKDLRSLEVEVICPELKYSSGPSPALPGGDDLTTGSSELGESSRRGAVPLSVLILSLLILFISAVFVTAGLFAFVLRRRKKLPFRKRSEVDLTGIQMQCRIFEDPPRQSCAGNPGTPEKPTPSLHTHSHTTHTHGHGHVYDYIPHPVTQMCNNPIYKPREGEIAEEEMAQFSEKKDNGSSSNSNYRTLLEKEREWTLAVSNSQLNTIVTVNHTTADISGFHENGGLCPTVIDSQRPTPTVGFVDCLYGTVPKLKDMHVAHAHPPGMQYPDLQQDARLKETLLFTAGKGCYHDPSQSDYLELRAKLQTKPDYLEVLEKSYRF
					

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(Predicted Aligned Error values between residue pairs)

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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	52.3	Low	45.5	Very low	205 Å²	205	123 Å²	123	100%	1.01	66%	0.663	S	S	*	*				0	-67.6	0	-69.2	-47	-170.5	0	0	112.8	W3 V4	M1-W3 PolarHBondContact O-N 3.33Å; M1-V4 PolarHBondContact O-N 3.18Å
2	L	46	Very low	45.2	Very low	153 Å²	153	123.4 Å²	123.4	80%	0.801	66%	0.663	S	S	*	*	H	α-helix	trans	-54.7	-22.8	-173.5	-93	146	0	0	0	117.7	T5	L2-T5 PolarHBondContact O-OG1 2.82Å
3	W	39	Very low	44.6	Very low	219 Å²	219	118 Å²	118	83%	0.83	65%	0.654	S	S	*	*	H	α-helix	trans	-79.5	-23.7	174.6	-100	49.3	0	0	0	114.6	M1	M1-W3 PolarHBondContact O-N 3.33Å
4	V	48.6	Very low	44	Very low	106 Å²	106	126.4 Å²	126.4	64%	0.642	67%	0.671	S	S	*	*	H	α-helix	trans	-77	-36.1	-179.1	-178	0	0	0	0	110.5	M1 L6 S8	M1-V4 PolarHBondContact O-N 3.18Å; V4-L6 PolarHBondContact O-N 3.31Å; V4-S8 PolarHBondContact O-N 2.9Å
5	T	48.9	Very low	43.7	Very low	87 Å²	87	125.3 Å²	125.3	53%	0.534	67%	0.671	S	S	.	*	H	α-helix	trans	-65.1	-36.4	176.4	41.4	0	0	0	0	112.8	L2 S8 T9	L2-T5 PolarHBondContact O-OG1 2.82Å; T5-S8 PolarHBondContact O-N 3.49Å; T5-T9 PolarHBondContact O-N 2.82Å
6	L	43.8	Very low	43.3	Very low	113 Å²	113	124.5 Å²	124.5	59%	0.592	67%	0.673	S	S	*	*	H	α-helix	trans	-71.2	-32.3	-177.9	-158.7	77.7	0	0	0	113.2	V4 T9	V4-L6 PolarHBondContact O-N 3.31Å; L6-T9 PolarHBondContact O-OG1 2.94Å
7	L	45.2	Very low	42.8	Very low	116 Å²	116	124.2 Å²	124.2	61%	0.607	68%	0.679	S	S	*	*	H	α-helix	trans	-73.7	-33.9	174.8	-82.9	159.7	0	0	0	112.1	T9 I10 A11	L7-T9 PolarHBondContact O-N 3.49Å; L7-I10 PolarHBondContact O-N 3.18Å; L7-A11 PolarHBondContact O-N 3.44Å
8	S	42	Very low	42.3	Very low	68 Å²	68	125.4 Å²	125.4	48%	0.476	68%	0.682	S	S	.	*	H	α-helix	trans	-63.1	-39.9	177.8	-160.9	0	0	0	0	112.5	V4 T5 I10 A11 L12	V4-S8 PolarHBondContact O-N 2.9Å; T5-S8 PolarHBondContact O-N 3.49Å; S8-I10 VanDerWaalsContact C-N 3.29Å; S8-I10 PolarHBondContact O-N 3.35Å; S8-A11 PolarHBondContact O-N 3.22Å; S8-L12 PolarHBondContact O-N 3.04Å
9	T	46.5	Very low	41.7	Very low	98 Å²	98	124.3 Å²	124.3	60%	0.601	68%	0.682	S	S	*	*	H	α-helix	trans	-69.4	-23.6	178.7	46.6	0	0	0	0	114	T5 L6 L7	T5-T9 PolarHBondContact O-N 2.82Å; L6-T9 PolarHBondContact O-OG1 2.94Å; L7-T9 PolarHBondContact O-N 3.49Å
10	I	47.6	Very low	41.2	Very low	114 Å²	114	125.9 Å²	125.9	59%	0.585	69%	0.689	S	S	*	*	H	α-helix	trans	-80.4	-37.6	176.1	-63	169.8	0	0	0	110.3	L7 S8 L12 G13	L7-I10 PolarHBondContact O-N 3.18Å; S8-I10 VanDerWaalsContact C-N 3.29Å; S8-I10 PolarHBondContact O-N 3.35Å; I10-L12 VanDerWaalsContact C-N 3.31Å; I10-L12 PolarHBondContact O-N 2.85Å; I10-G13 PolarHBondContact O-N 3.02Å
11	A	40.9	Very low	40.7	Very low	74 Å²	74	127.2 Å²	127.2	61%	0.612	69%	0.694	S	S	*	*	H	α-helix	trans	-66.7	-27.6	-179.6	0	0	0	0	0	114.1	L7 S8	L7-A11 PolarHBondContact O-N 3.44Å; S8-A11 PolarHBondContact O-N 3.22Å
12	L	41.7	Very low	39.8	Very low	128 Å²	128	125.7 Å²	125.7	67%	0.67	69%	0.685	S	S	*	*	G	3₁₀ helix	trans	-87.5	-5.1	179.3	-72.9	165	0	0	0	114.2	S8 I10 W14	S8-L12 PolarHBondContact O-N 3.04Å; I10-L12 VanDerWaalsContact C-N 3.31Å; I10-L12 PolarHBondContact O-N 2.85Å; L12-W14 VanDerWaalsContact C-N 3.34Å
13	G	37.3	Very low	39.2	Very low	53 Å²	53	125 Å²	125	55%	0.546	68%	0.682	S	S	.	*	G	3₁₀ helix	trans	-83.6	-3	179.4	0	0	0	0	0	115.3	I10	I10-G13 PolarHBondContact O-N 3.02Å
14	W	36.7	Very low	39	Very low	236 Å²	236	119.5 Å²	119.5	89%	0.894	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-118	18.7	-172.5	-84.5	56.2	0	0	0	113.4	L12	L12-W14 VanDerWaalsContact C-N 3.34Å
15	T	39.4	Very low	38.5	Very low	109 Å²	109	121.8 Å²	121.8	67%	0.669	68%	0.68	S	S	*	*			trans	-121.6	41.5	176.4	62.7	0	0	0	0	112.7
16	T	37.1	Very low	38.3	Very low	113 Å²	113	124.5 Å²	124.5	69%	0.693	69%	0.687	S	S	*	*	S	Bend	trans	-88	127.3	149.3	44.5	0	0	0	0	107.8	I18	T16-I18 PolarHBondContact O-N 2.85Å
17	P	34.5	Very low	38.3	Very low	120 Å²	120	124.7 Å²	124.7	78%	0.779	69%	0.688	S	S	*	*			trans	-64.7	110.1	164.2	27.8	-30.7	0	0	0	106.9	P19	P17-P19 WeakPolarHBondContact O-CD 3.42Å
18	I	33.7	Very low	38.5	Very low	145 Å²	145	126 Å²	126	74%	0.744	70%	0.695	S	S	*	*			trans	-56.1	122.7	152.3	-58.8	173.6	0	0	0	104	T16 L20	T16-I18 PolarHBondContact O-N 2.85Å; I18-L20 PolarHBondContact O-N 3.05Å
19	P	31.7	Very low	39.4	Very low	104 Å²	104	124.2 Å²	124.2	68%	0.675	68%	0.679	S	S	*	*			trans	-59.2	115.7	168.6	26	-31.4	0	0	0	105.9	P17 L21	P17-P19 WeakPolarHBondContact O-CD 3.42Å; P19-L21 PolarHBondContact O-N 2.63Å
20	L	30.7	Very low	40.1	Very low	157 Å²	157	123.5 Å²	123.5	82%	0.822	68%	0.676	S	S	*	*			trans	-50.8	130.9	154.7	-73.7	165	0	0	0	105	I18 E22	I18-L20 PolarHBondContact O-N 3.05Å; L20-E22 PolarHBondContact O-N 3.39Å
21	L	31.6	Very low	41.2	Very low	153 Å²	153	120.5 Å²	120.5	80%	0.801	67%	0.665	S	S	*	*			trans	-66.4	92.4	154.7	-82.5	81.6	0	0	0	104.7	P19 D23	P19-L21 PolarHBondContact O-N 2.63Å; L21-D23 PolarHBondContact O-N 3.4Å
22	E	32.8	Very low	42.6	Very low	173 Å²	173	119.6 Å²	119.6	81%	0.808	65%	0.647	S	S	*	*	S	Bend	trans	-45.2	127.5	141.4	-68.1	176.9	130.1	0	0	106.1	L20	L20-E22 PolarHBondContact O-N 3.39Å
23	D	34.2	Very low	43.7	Very low	140 Å²	140	121.9 Å²	121.9	75%	0.749	65%	0.654	S	S	*	*			trans	49.3	78.7	172.3	-47.9	-26.4	0	0	0	113.9	L21 E25	L21-D23 PolarHBondContact O-N 3.4Å; D23-E25 PolarHBondContact O-N 3.5Å
24	S	35.1	Very low	45.5	Very low	102 Å²	102	122.8 Å²	122.8	71%	0.713	65%	0.651	S	S	*	*				-57.5	96.5	128.2	59.1	0	0	0	0	105.8	E26	S24-E26 PolarHBondContact O-N 2.98Å; S24-E26 VanDerWaalsContact O-N 3.16Å
25	E	37.1	Very low	47.7	Very low	154 Å²	154	111.8 Å²	111.8	72%	0.72	61%	0.61	S	S	*	*			trans	-41.3	125.3	-178.7	-65.6	175.2	127.3	0	0	108.5	D23 I27	D23-E25 PolarHBondContact O-N 3.5Å; E25-I27 HydrophobicContact CB-CG1 4.38Å; E25-I27 PolarHBondContact O-N 3Å
26	E	43.9	Very low	49.8	Very low	145 Å²	145	110.8 Å²	110.8	68%	0.678	60%	0.6	S	S	*	*			trans	-68.7	83.6	162.8	-70.5	-149.9	102.1	0	0	106.6	S24 D28 R65	S24-E26 PolarHBondContact O-N 2.98Å; S24-E26 VanDerWaalsContact O-N 3.16Å; E26-D28 PolarHBondContact O-N 3.28Å; E26-R65 IonicContact OE1-NH1 2.64Å
27	I	45.6	Very low	52.1	Low	117 Å²	117	107 Å²	107	60%	0.6	58%	0.578	S	S	*	*			trans	-57.2	95.4	155.9	-58.4	174	0	0	0	103.9	E25 E29	E25-I27 HydrophobicContact CB-CG1 4.38Å; E25-I27 PolarHBondContact O-N 3Å; I27-E29 PolarHBondContact O-N 3.2Å
28	D	49.2	Very low	54.4	Low	144 Å²	144	103.5 Å²	103.5	77%	0.77	55%	0.552	S	S	*	*			trans	-54.1	92.8	165.2	-81	-41.8	0	0	0	106.6	E26 P30	E26-D28 PolarHBondContact O-N 3.28Å; D28-P30 WeakPolarHBondContact O-CD 3.49Å
29	E	60	Low	56.6	Low	29 Å²	29	100.5 Å²	100.5	14%	0.136	54%	0.54	C	S	.	.			trans	-62.2	107.7	175.2	-68.2	-158.2	115.4	0	0	106.4	I27 C31 S64 R65	I27-E29 PolarHBondContact O-N 3.2Å; E29-C31 PolarHBondContact O-N 3.29Å; E29-C31 VanDerWaalsContact O-N 3.08Å; E29-S64 VanDerWaalsContact CD-OG 3.3Å; E29-S64 WeakPolarHBondContact OE1-CA 3.39Å; E29-S64 VanDerWaalsContact OE1-CB 3.24Å; E29-S64 WeakPolarHBondContact OE1-CB 3.35Å; E29-S64 PolarHBondContact OE1-N 3.05Å; E29-S64 PolarHBondContact OE1-OG 3.08Å; E29-R65 WeakPolarHBondContact OE2-CG 3.32Å; E29-R65 PolarHBondContact OE2-N 2.8Å
30	P	60.9	Low	58.4	Low	83 Å²	83	99.9 Å²	99.9	54%	0.539	53%	0.526	S	S	.	.			trans	-64.5	122	-160.6	23.2	-33	0	0	0	109.1	D28 F32	D28-P30 WeakPolarHBondContact O-CD 3.49Å; P30-F32 PolarHBondContact O-N 3.26Å
31	C	70.5	Confident	59.9	Low	51 Å²	51	100.5 Å²	100.5	35%	0.345	53%	0.525	S	S	.	.			trans	-61.6	135.7	176	-172.1	0	0	0	0	109.2	E29 E33 C35 C37	E29-C31 PolarHBondContact O-N 3.29Å; E29-C31 VanDerWaalsContact O-N 3.08Å; C31-E33 PolarHBondContact O-N 2.65Å; C31-C35 PolarHBondContact SG-O 3.25Å; C31-C37 VanDerWaalsContact CA-SG 3.51Å; C31-C37 HydrophobicContact CB-CB 3.67Å; C31-C37 WeakPolarHBondContact CB-SG 2.97Å; C31-C37 WeakPolarHBondContact SG-CB 3.23Å; C31-C37 PolarHBondContact SG-N 2.76Å; C31-C37 CovalentContact SG-SG 2.04Å; C31-C37 PolarHBondContact SG-SG 3.23Å
32	F	70.8	Confident	61.7	Low	56 Å²	56	95.8 Å²	95.8	25%	0.246	51%	0.513	C	S	.	.			trans	-81.8	97.7	-175.1	178.8	-96.6	0	0	0	110.1	P30 C35 F53 Q58 W63	P30-F32 PolarHBondContact O-N 3.26Å; F32-C35 WeakPolarHBondContact O-CA 3.46Å; F32-C35 WeakPolarHBondContact O-CB 3.21Å; F32-C35 PolarHBondContact O-N 2.85Å; F32-F53 HydrophobicContact CE1-CE1 4.08Å; F32-F53 HydrophobicContact CE1-CZ 4.09Å; F32-Q58 VanDerWaalsContact CE1-O 3.23Å; F32-Q58 WeakPolarHBondContact CE1-O 3.25Å; F32-Q58 WeakPolarHBondContact CZ-O 3.39Å; F32-W63 HydrophobicContact CB-CZ2 4.38Å
33	E	65.5	Low	63.6	Low	175 Å²	175	89.6 Å²	89.6	82%	0.818	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	135.9	170.4	-69.8	-168.4	159.6	0	0	110.5	C31	C31-E33 PolarHBondContact O-N 2.65Å
34	P	73.7	Confident	66	Low	72 Å²	72	83.7 Å²	83.7	47%	0.468	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	cis	-94.4	18.3	9.9	39.2	-39.6	0	0	0	114.9	K51 F53	P34-K51 HydrophobicContact CG-CB 4.13Å; P34-K51 HydrophobicContact CG-CG 4.37Å; P34-K51 VanDerWaalsContact O-CD 3.32Å; P34-K51 WeakPolarHBondContact O-CD 3.32Å; P34-K51 WeakPolarHBondContact O-CE 3.31Å; P34-K51 PolarHBondContact O-NZ 2.79Å; P34-F53 HydrophobicContact CG-CZ 4.2Å
35	C	83.9	Confident	68.2	Low	6 Å²	6	80.6 Å²	80.6	4%	0.041	43%	0.427	C	S	.	.	S	Bend	trans	-76.3	156.1	172.2	-50	0	0	0	0	111.6	C31 F32 V46 H47 C48	C31-C35 PolarHBondContact SG-O 3.25Å; F32-C35 WeakPolarHBondContact O-CA 3.46Å; F32-C35 WeakPolarHBondContact O-CB 3.21Å; F32-C35 PolarHBondContact O-N 2.85Å; C35-V46 HydrophobicContact CB-CG1 4.37Å; C35-H47 WeakPolarHBondContact CA-O 3.24Å; C35-H47 WeakPolarHBondContact CB-O 3.3Å; C35-C48 HydrophobicContact CB-CB 3.99Å; C35-C48 WeakPolarHBondContact CB-SG 3.42Å; C35-C48 WeakPolarHBondContact SG-CA 3.2Å; C35-C48 WeakPolarHBondContact SG-CB 3.46Å; C35-C48 CovalentContact SG-SG 2.03Å; C35-C48 PolarHBondContact SG-SG 3.09Å
36	D	83.8	Confident	70.6	Confident	87 Å²	87	73.2 Å²	73.2	47%	0.465	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	146.3	175.2	-42.9	-74.3	0	0	0	109	H47 K51	D36-H47 HydrophobicContact CB-CB 4.36Å; D36-H47 PolarHBondContact N-O 2.67Å; D36-H47 WeakPolarHBondContact O-CA 3.35Å; D36-H47 WeakPolarHBondContact O-CB 3.36Å; D36-H47 PolarHBondContact O-N 2.81Å; D36-K51 IonicContact OD1-NZ 2.65Å; D36-K51 IonicContact OD2-NZ 2.85Å; D36-K51 PolarHBondContact OD2-NZ 2.95Å
37	C	84.8	Confident	72.5	Confident	34 Å²	34	67.9 Å²	67.9	23%	0.23	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	141.4	-175.7	-48.6	0	0	0	0	112.8	C31 F44 H45	C31-C37 VanDerWaalsContact CA-SG 3.51Å; C31-C37 HydrophobicContact CB-CB 3.67Å; C31-C37 WeakPolarHBondContact CB-SG 2.97Å; C31-C37 WeakPolarHBondContact SG-CB 3.23Å; C31-C37 PolarHBondContact SG-N 2.76Å; C31-C37 CovalentContact SG-SG 2.04Å; C31-C37 PolarHBondContact SG-SG 3.23Å; C37-F44 HydrophobicContact CB-CE1 3.92Å; C37-F44 HydrophobicContact CB-CE2 3.78Å; C37-F44 HydrophobicContact CB-CZ 3.35Å; C37-H45 CarbonylContact C-O 3.57Å; C37-H45 VanDerWaalsContact CA-O 3.27Å; C37-H45 WeakPolarHBondContact CA-O 3.28Å
38	E	82.4	Confident	74.5	Confident	47 Å²	47	62.3 Å²	62.3	22%	0.22	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	140.3	-178.6	-57.1	177.4	152.1	0	0	110.7	K40 H45	E38-K40 IonicContact OE1-NZ 2.72Å; E38-K40 VanDerWaalsContact OE2-CE 3.25Å; E38-K40 WeakPolarHBondContact OE2-CE 3.4Å; E38-K40 IonicContact OE2-NZ 2.73Å; E38-K40 PolarHBondContact OE2-NZ 2.68Å; E38-H45 HydrophobicContact CB-CB 4.3Å; E38-H45 PolarHBondContact N-O 3.48Å; E38-H45 PolarHBondContact O-N 3.18Å
39	V	79.5	Confident	76.3	Confident	82 Å²	82	56.7 Å²	56.7	50%	0.497	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	119.6	168.7	-173.2	0	0	0	0	108.9	F44	V39-F44 HydrophobicContact CG2-CD2 3.93Å; V39-F44 HydrophobicContact CG2-CE2 4.2Å
40	K	69.5	Low	77.5	Confident	90 Å²	90	58.1 Å²	58.1	39%	0.391	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	120.8	178.1	-78.4	174.9	173.8	163.9	0	110.6	E38 G42 I43	E38-K40 IonicContact OE1-NZ 2.72Å; E38-K40 VanDerWaalsContact OE2-CE 3.25Å; E38-K40 WeakPolarHBondContact OE2-CE 3.4Å; E38-K40 IonicContact OE2-NZ 2.73Å; E38-K40 PolarHBondContact OE2-NZ 2.68Å; K40-G42 PolarHBondContact O-N 3.22Å; K40-G42 VanDerWaalsContact O-N 3.14Å; K40-I43 PolarHBondContact N-O 2.98Å; K40-I43 PolarHBondContact O-N 3.41Å; K40-I43 VanDerWaalsContact O-O 3.06Å
41	E	63.7	Low	78.7	Confident	171 Å²	171	57.7 Å²	57.7	80%	0.799	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	28.6	-179	-56.1	-179	151.8	0	0	114.2	I43	E41-I43 VanDerWaalsContact C-N 3.29Å; E41-I43 PolarHBondContact O-N 3.1Å
42	G	68.5	Low	79.5	Confident	53 Å²	53	57 Å²	57	55%	0.546	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.3	0.4	-175.9	0	0	0	0	0	115.1	K40	K40-G42 PolarHBondContact O-N 3.22Å; K40-G42 VanDerWaalsContact O-N 3.14Å
43	I	72.6	Confident	80.3	Confident	44 Å²	44	55 Å²	55	23%	0.226	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	136.4	171.9	-61.3	175	0	0	0	108.6	K40 E41 P66 K68 I91	K40-I43 PolarHBondContact N-O 2.98Å; K40-I43 PolarHBondContact O-N 3.41Å; K40-I43 VanDerWaalsContact O-O 3.06Å; E41-I43 VanDerWaalsContact C-N 3.29Å; E41-I43 PolarHBondContact O-N 3.1Å; I43-P66 WeakPolarHBondContact CG2-O 3.34Å; I43-K68 HydrophobicContact CG2-CG 4.08Å; I43-I91 HydrophobicContact CD1-CD1 4.06Å; I43-I91 HydrophobicContact CG1-CD1 4.37Å; I43-I91 HydrophobicContact CG2-CD1 4.3Å
44	F	84.8	Confident	81.4	Confident	16 Å²	16	50.3 Å²	50.3	7%	0.07	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	134.7	176.5	-160.9	-128.4	0	0	0	110.4	C37 V39 V46 W63 P66 F67 K68	C37-F44 HydrophobicContact CB-CE1 3.92Å; C37-F44 HydrophobicContact CB-CE2 3.78Å; C37-F44 HydrophobicContact CB-CZ 3.35Å; V39-F44 HydrophobicContact CG2-CD2 3.93Å; V39-F44 HydrophobicContact CG2-CE2 4.2Å; F44-V46 HydrophobicContact CD1-CG2 3.47Å; F44-V46 VanDerWaalsContact CD1-CG2 3.47Å; F44-V46 HydrophobicContact CE1-CG2 3.66Å; F44-V46 HydrophobicContact CG-CG2 4.43Å; F44-W63 AromaticContact CD1-CD1 3.98Å; F44-W63 HydrophobicContact CD1-CG 4.33Å; F44-W63 AromaticContact CE1-CD1 3.66Å; F44-W63 HydrophobicContact CE1-CG 4.39Å; F44-W63 AromaticContact CE1-NE1 3.57Å; F44-P66 PolarHBondContact N-O 2.94Å; F44-F67 HydrophobicContact CB-CB 3.86Å; F44-F67 HydrophobicContact CD1-CB 4.45Å; F44-F67 CarbonylContact O-C 3.52Å; F44-F67 WeakPolarHBondContact O-CA 3.37Å; F44-F67 WeakPolarHBondContact O-CB 3.38Å; F44-K68 PolarHBondContact O-N 2.77Å
45	H	81.9	Confident	82	Confident	36 Å²	36	48.8 Å²	48.8	17%	0.167	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	117.3	179.2	-84.9	-131.8	0	0	0	108.3	C37 E38 K68	C37-H45 CarbonylContact C-O 3.57Å; C37-H45 VanDerWaalsContact CA-O 3.27Å; C37-H45 WeakPolarHBondContact CA-O 3.28Å; E38-H45 HydrophobicContact CB-CB 4.3Å; E38-H45 PolarHBondContact N-O 3.48Å; E38-H45 PolarHBondContact O-N 3.18Å; H45-K68 PolarHBondContact CE1-NZ 3.46Å; H45-K68 PolarHBondContact NE2-NZ 3.17Å
46	V	86.2	Confident	82.1	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	114.3	-174.7	-175.1	0	0	0	0	109.6	C35 F44 W63 K68 L69 N70	C35-V46 HydrophobicContact CB-CG1 4.37Å; F44-V46 HydrophobicContact CD1-CG2 3.47Å; F44-V46 VanDerWaalsContact CD1-CG2 3.47Å; F44-V46 HydrophobicContact CE1-CG2 3.66Å; F44-V46 HydrophobicContact CG-CG2 4.43Å; V46-W63 HydrophobicContact CG1-CH2 3.95Å; V46-W63 HydrophobicContact CG1-CZ2 4.05Å; V46-W63 HydrophobicContact CG2-CH2 4.33Å; V46-W63 HydrophobicContact CG2-CZ2 4.16Å; V46-K68 PolarHBondContact N-O 3.03Å; V46-L69 HydrophobicContact CB-CD1 3.88Å; V46-L69 HydrophobicContact CG1-CD1 3.68Å; V46-N70 PolarHBondContact O-N 3.24Å
47	H	85.3	Confident	82	Confident	33 Å²	33	48 Å²	48	15%	0.153	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	91.1	-175.1	-69.5	-105	0	0	0	109.9	C35 D36	C35-H47 WeakPolarHBondContact CA-O 3.24Å; C35-H47 WeakPolarHBondContact CB-O 3.3Å; D36-H47 HydrophobicContact CB-CB 4.36Å; D36-H47 PolarHBondContact N-O 2.67Å; D36-H47 WeakPolarHBondContact O-CA 3.35Å; D36-H47 WeakPolarHBondContact O-CB 3.36Å; D36-H47 PolarHBondContact O-N 2.81Å
48	C	87.6	Confident	81.8	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	29%	0.285	C	S	.	.			trans	-106.1	22	178.7	-70.4	0	0	0	0	112.1	C35 F53 L69 N70 L71 N74	C35-C48 HydrophobicContact CB-CB 3.99Å; C35-C48 WeakPolarHBondContact CB-SG 3.42Å; C35-C48 WeakPolarHBondContact SG-CA 3.2Å; C35-C48 WeakPolarHBondContact SG-CB 3.46Å; C35-C48 CovalentContact SG-SG 2.03Å; C35-C48 PolarHBondContact SG-SG 3.09Å; C48-F53 HydrophobicContact CB-CD2 4.34Å; C48-F53 HydrophobicContact CB-CE2 3.8Å; C48-L69 HydrophobicContact CB-CD1 4.28Å; C48-N70 CarbonylContact C-O 3.25Å; C48-N70 VanDerWaalsContact C-O 3.22Å; C48-N70 VanDerWaalsContact CA-O 3.25Å; C48-N70 WeakPolarHBondContact CA-O 3.32Å; C48-N70 VanDerWaalsContact CB-O 3.31Å; C48-N70 WeakPolarHBondContact CB-O 3.44Å; C48-N70 PolarHBondContact N-O 2.96Å; C48-L71 HydrophobicContact CB-CD2 3.42Å; C48-L71 VanDerWaalsContact CB-CD2 3.42Å; C48-L71 HydrophobicContact CB-CG 4.21Å; C48-N74 PolarHBondContact O-ND2 3.33Å
49	D	85.8	Confident	81.5	Confident	25 Å²	25	48.2 Å²	48.2	13%	0.134	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	151.2	-175.7	76.6	-90	0	0	0	112.9	K51 N70 Q72	D49-K51 WeakPolarHBondContact O-CD 3.21Å; D49-K51 WeakPolarHBondContact O-CE 3.42Å; D49-K51 VanDerWaalsContact O-CG 3.28Å; D49-K51 WeakPolarHBondContact O-CG 3.39Å; D49-K51 PolarHBondContact O-N 2.88Å; D49-N70 PolarHBondContact N-O 3.15Å; D49-Q72 WeakPolarHBondContact CA-O 3.46Å; D49-Q72 HydrophobicContact CB-CG 3.46Å; D49-Q72 VanDerWaalsContact CB-CG 3.46Å
50	S	85.7	Confident	80.8	Confident	60 Å²	60	47.8 Å²	47.8	42%	0.42	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	61	2	173.3	-43.8	0	0	0	0	115.9	G52 Q72	S50-G52 VanDerWaalsContact C-N 3.28Å; S50-G52 PolarHBondContact O-N 3.26Å; S50-Q72 PolarHBondContact N-O 3.17Å; S50-Q72 VanDerWaalsContact N-O 3.09Å
51	K	86.6	Confident	80.9	Confident	73 Å²	73	46.4 Å²	46.4	32%	0.317	27%	0.271	S	S	.	.	S	Bend	trans	-75.9	-7	-175.5	-46.3	-60.6	175.4	148	0	114.4	P34 D36 D49 F53 N74	P34-K51 HydrophobicContact CG-CB 4.13Å; P34-K51 HydrophobicContact CG-CG 4.37Å; P34-K51 VanDerWaalsContact O-CD 3.32Å; P34-K51 WeakPolarHBondContact O-CD 3.32Å; P34-K51 WeakPolarHBondContact O-CE 3.31Å; P34-K51 PolarHBondContact O-NZ 2.79Å; D36-K51 IonicContact OD1-NZ 2.65Å; D36-K51 IonicContact OD2-NZ 2.85Å; D36-K51 PolarHBondContact OD2-NZ 2.95Å; D49-K51 WeakPolarHBondContact O-CD 3.21Å; D49-K51 WeakPolarHBondContact O-CE 3.42Å; D49-K51 VanDerWaalsContact O-CG 3.28Å; D49-K51 WeakPolarHBondContact O-CG 3.39Å; D49-K51 PolarHBondContact O-N 2.88Å; K51-F53 HydrophobicContact CB-CD2 3.91Å; K51-F53 HydrophobicContact CB-CE2 3.58Å; K51-F53 HydrophobicContact CB-CZ 4.24Å; K51-F53 HydrophobicContact CG-CE2 3.87Å; K51-N74 PolarHBondContact N-OD1 2.03Å
52	G	86.3	Confident	81.2	Confident	36 Å²	36	43.4 Å²	43.4	37%	0.371	26%	0.259	S	S	.	.			trans	88.9	15.1	175.7	0	0	0	0	0	116.1	S50 T54 N74	S50-G52 VanDerWaalsContact C-N 3.28Å; S50-G52 PolarHBondContact O-N 3.26Å; G52-T54 PolarHBondContact O-N 2.79Å; G52-N74 PolarHBondContact N-OD1 2.9Å
53	F	88.9	Confident	81.6	Confident	14 Å²	14	40.9 Å²	40.9	6%	0.061	23%	0.233	C	C	.	.			trans	-58.1	135.8	-178.9	-66.5	-68.6	0	0	0	112.7	F32 P34 C48 K51 Q58 I59 L71 N74 L75 M76	F32-F53 HydrophobicContact CE1-CE1 4.08Å; F32-F53 HydrophobicContact CE1-CZ 4.09Å; P34-F53 HydrophobicContact CG-CZ 4.2Å; C48-F53 HydrophobicContact CB-CD2 4.34Å; C48-F53 HydrophobicContact CB-CE2 3.8Å; K51-F53 HydrophobicContact CB-CD2 3.91Å; K51-F53 HydrophobicContact CB-CE2 3.58Å; K51-F53 HydrophobicContact CB-CZ 4.24Å; K51-F53 HydrophobicContact CG-CE2 3.87Å; F53-Q58 HydrophobicContact CD1-CB 3.82Å; F53-Q58 HydrophobicContact CE1-CB 4.22Å; F53-I59 HydrophobicContact CB-CD1 4.3Å; F53-I59 HydrophobicContact CD1-CD1 3.92Å; F53-I59 HydrophobicContact CD1-CG1 4.27Å; F53-I59 HydrophobicContact CD2-CD1 4.21Å; F53-I59 HydrophobicContact CE1-CD1 4.25Å; F53-I59 HydrophobicContact CE1-CG1 4.08Å; F53-I59 HydrophobicContact CE2-CG1 4.34Å; F53-I59 HydrophobicContact CG-CD1 3.89Å; F53-I59 HydrophobicContact CG-CG1 4.48Å; F53-I59 HydrophobicContact CZ-CG1 4.12Å; F53-L71 HydrophobicContact CD2-CD2 4.1Å; F53-N74 HydrophobicContact CB-CB 4.24Å; F53-N74 PolarHBondContact N-OD1 3.41Å; F53-L75 CarbonylContact O-C 3.53Å; F53-L75 WeakPolarHBondContact O-CA 3.39Å; F53-L75 PolarHBondContact O-N 2.04Å; F53-M76 HydrophobicContact CB-CE 3.64Å; F53-M76 HydrophobicContact CG-CE 4.49Å; F53-M76 PolarHBondContact O-N 3.08Å
54	T	88.1	Confident	81.7	Confident	78 Å²	78	42.8 Å²	42.8	48%	0.479	25%	0.25	S	S	.	.			trans	-106.6	-20.1	179.5	59.5	0	0	0	0	113.4	G52 Q58 L75	G52-T54 PolarHBondContact O-N 2.79Å; T54-Q58 PolarHBondContact OG1-OE1 2.79Å; T54-L75 HydrophobicContact CG2-CB 4.07Å
55	N	85.9	Confident	81.6	Confident	40 Å²	40	45.6 Å²	45.6	21%	0.214	26%	0.26	C	S	.	.			trans	-147.3	143.4	178.8	-168.1	-6.7	0	0	0	110.9	S57 Q58	N55-S57 PolarHBondContact ND2-OG 2.81Å; N55-S57 PolarHBondContact O-N 3.02Å; N55-S57 PolarHBondContact OD1-N 2.95Å; N55-Q58 VanDerWaalsContact N-OE1 3.13Å; N55-Q58 VanDerWaalsContact O-CB 3.32Å; N55-Q58 WeakPolarHBondContact O-CB 3.02Å; N55-Q58 WeakPolarHBondContact O-CG 3.01Å; N55-Q58 PolarHBondContact O-N 3.08Å; N55-Q58 PolarHBondContact O-OE1 3.34Å
56	V	86	Confident	81.7	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.006	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-60.4	-27.5	176.4	-171.4	0	0	0	0	111.7	Q58 I59 M76 L79 S83 F84 L87	V56-Q58 PolarHBondContact O-N 2.83Å; V56-I59 CarbonylContact O-C 3.42Å; V56-I59 WeakPolarHBondContact O-CA 3.17Å; V56-I59 PolarHBondContact O-N 3.08Å; V56-M76 HydrophobicContact CG2-CE 4.34Å; V56-M76 HydrophobicContact CG2-SD 3.79Å; V56-L79 HydrophobicContact CG2-CD2 3.62Å; V56-S83 VanDerWaalsContact CG1-O 3.32Å; V56-S83 WeakPolarHBondContact CG1-O 3.47Å; V56-F84 HydrophobicContact CB-CZ 4.42Å; V56-F84 HydrophobicContact CG1-CD1 3.94Å; V56-F84 HydrophobicContact CG1-CE1 3.78Å; V56-F84 HydrophobicContact CG1-CE2 4.39Å; V56-F84 HydrophobicContact CG1-CG 4.29Å; V56-F84 HydrophobicContact CG1-CZ 4.02Å; V56-F84 HydrophobicContact CG2-CE1 4.11Å; V56-F84 HydrophobicContact CG2-CE2 3.86Å; V56-F84 HydrophobicContact CG2-CZ 3.53Å; V56-L87 HydrophobicContact CG1-CD1 3.97Å
57	S	80.8	Confident	81.7	Confident	76 Å²	76	46.7 Å²	46.7	53%	0.531	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-62.2	-10	174.3	72.4	0	0	0	0	114.4	N55 I59	N55-S57 PolarHBondContact ND2-OG 2.81Å; N55-S57 PolarHBondContact O-N 3.02Å; N55-S57 PolarHBondContact OD1-N 2.95Å; S57-I59 VanDerWaalsContact C-N 3.31Å
58	Q	81.3	Confident	81.8	Confident	82 Å²	82	48.3 Å²	48.3	38%	0.383	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-81.5	-12.1	170.9	-59	178.2	-68.6	0	0	112.4	F32 F53 T54 N55 V56	F32-Q58 VanDerWaalsContact CE1-O 3.23Å; F32-Q58 WeakPolarHBondContact CE1-O 3.25Å; F32-Q58 WeakPolarHBondContact CZ-O 3.39Å; F53-Q58 HydrophobicContact CD1-CB 3.82Å; F53-Q58 HydrophobicContact CE1-CB 4.22Å; T54-Q58 PolarHBondContact OG1-OE1 2.79Å; N55-Q58 VanDerWaalsContact N-OE1 3.13Å; N55-Q58 VanDerWaalsContact O-CB 3.32Å; N55-Q58 WeakPolarHBondContact O-CB 3.02Å; N55-Q58 WeakPolarHBondContact O-CG 3.01Å; N55-Q58 PolarHBondContact O-N 3.08Å; N55-Q58 PolarHBondContact O-OE1 3.34Å; V56-Q58 PolarHBondContact O-N 2.83Å
59	I	77.3	Confident	81.9	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.01	28%	0.278	C	S	.	.			trans	-115.9	65.5	174.9	-49.5	96.2	0	0	0	107.7	F53 V56 S57 Q61 W63 L71 M76	F53-I59 HydrophobicContact CB-CD1 4.3Å; F53-I59 HydrophobicContact CD1-CD1 3.92Å; F53-I59 HydrophobicContact CD1-CG1 4.27Å; F53-I59 HydrophobicContact CD2-CD1 4.21Å; F53-I59 HydrophobicContact CE1-CD1 4.25Å; F53-I59 HydrophobicContact CE1-CG1 4.08Å; F53-I59 HydrophobicContact CE2-CG1 4.34Å; F53-I59 HydrophobicContact CG-CD1 3.89Å; F53-I59 HydrophobicContact CG-CG1 4.48Å; F53-I59 HydrophobicContact CZ-CG1 4.12Å; V56-I59 CarbonylContact O-C 3.42Å; V56-I59 WeakPolarHBondContact O-CA 3.17Å; V56-I59 PolarHBondContact O-N 3.08Å; S57-I59 VanDerWaalsContact C-N 3.31Å; I59-Q61 VanDerWaalsContact C-N 3.31Å; I59-Q61 PolarHBondContact O-N 3.38Å; I59-W63 HydrophobicContact CG2-CH2 3.68Å; I59-W63 HydrophobicContact CG2-CZ3 4.27Å; I59-L71 HydrophobicContact CD1-CD2 3.74Å; I59-L71 HydrophobicContact CG1-CD2 4.18Å; I59-M76 HydrophobicContact CD1-CE 3.68Å
60	S	64.4	Low	82	Confident	74 Å²	74	48 Å²	48	52%	0.517	28%	0.276	S	S	.	.			trans	-91.3	22.1	-173.1	68.2	0	0	0	0	114.3
61	Q	70.2	Confident	82.2	Confident	61 Å²	61	45.2 Å²	45.2	29%	0.285	26%	0.256	S	S	.	.			trans	-80.9	140.8	-177.4	-164.3	64.6	4.3	0	0	110.9	I59 W63 L87	I59-Q61 VanDerWaalsContact C-N 3.31Å; I59-Q61 PolarHBondContact O-N 3.38Å; Q61-W63 HydrophobicContact CB-CD2 4.45Å; Q61-W63 HydrophobicContact CB-CH2 4.2Å; Q61-W63 HydrophobicContact CB-CZ2 3.81Å; Q61-W63 HydrophobicContact CG-CD2 4.45Å; Q61-W63 HydrophobicContact CG-CZ2 4.12Å; Q61-L87 WeakPolarHBondContact O-CD2 3.37Å
62	I	70.6	Confident	82.3	Confident	107 Å²	107	42.2 Å²	42.2	55%	0.549	24%	0.243	S	C	.	.			trans	-98.1	120.4	171.8	-60.6	170.9	0	0	0	107.3	H86	I62-H86 HydrophobicContact CG1-CB 4.05Å
63	W	76.6	Confident	82.4	Confident	1 Å²	1	45 Å²	45	0%	0.004	24%	0.242	C	C	.	.			trans	-105.1	124.3	174.6	-65.5	-67.8	0	0	0	109.7	F32 F44 V46 I59 Q61 F67 L87 N89	F32-W63 HydrophobicContact CB-CZ2 4.38Å; F44-W63 AromaticContact CD1-CD1 3.98Å; F44-W63 HydrophobicContact CD1-CG 4.33Å; F44-W63 AromaticContact CE1-CD1 3.66Å; F44-W63 HydrophobicContact CE1-CG 4.39Å; F44-W63 AromaticContact CE1-NE1 3.57Å; V46-W63 HydrophobicContact CG1-CH2 3.95Å; V46-W63 HydrophobicContact CG1-CZ2 4.05Å; V46-W63 HydrophobicContact CG2-CH2 4.33Å; V46-W63 HydrophobicContact CG2-CZ2 4.16Å; I59-W63 HydrophobicContact CG2-CH2 3.68Å; I59-W63 HydrophobicContact CG2-CZ3 4.27Å; Q61-W63 HydrophobicContact CB-CD2 4.45Å; Q61-W63 HydrophobicContact CB-CH2 4.2Å; Q61-W63 HydrophobicContact CB-CZ2 3.81Å; Q61-W63 HydrophobicContact CG-CD2 4.45Å; Q61-W63 HydrophobicContact CG-CZ2 4.12Å; W63-F67 HydrophobicContact CB-CD1 3.82Å; W63-F67 HydrophobicContact CB-CE1 4.04Å; W63-F67 HydrophobicContact CE3-CD1 4.21Å; W63-F67 HydrophobicContact CE3-CD2 4.05Å; W63-F67 AromaticContact CE3-CE1 3.83Å; W63-F67 HydrophobicContact CE3-CE1 3.83Å; W63-F67 AromaticContact CE3-CE2 3.66Å; W63-F67 HydrophobicContact CE3-CE2 3.66Å; W63-F67 HydrophobicContact CE3-CG 4.31Å; W63-F67 AromaticContact CE3-CZ 3.55Å; W63-F67 HydrophobicContact CE3-CZ 3.55Å; W63-F67 HydrophobicContact CZ3-CD2 4.4Å; W63-F67 AromaticContact CZ3-CE2 3.86Å; W63-F67 HydrophobicContact CZ3-CE2 3.86Å; W63-F67 HydrophobicContact CZ3-CZ 4.07Å; W63-L87 HydrophobicContact CE3-CD2 3.93Å; W63-L87 HydrophobicContact CZ3-CD2 3.62Å; W63-N89 PolarHBondContact O-ND2 3.31Å
64	S	76.4	Confident	82.5	Confident	83 Å²	83	44.5 Å²	44.5	58%	0.58	24%	0.24	S	C	*	.	S	Bend	trans	-77.8	-29.5	-179	68.8	0	0	0	0	112.4	E29 N89	E29-S64 VanDerWaalsContact CD-OG 3.3Å; E29-S64 WeakPolarHBondContact OE1-CA 3.39Å; E29-S64 VanDerWaalsContact OE1-CB 3.24Å; E29-S64 WeakPolarHBondContact OE1-CB 3.35Å; E29-S64 PolarHBondContact OE1-N 3.05Å; E29-S64 PolarHBondContact OE1-OG 3.08Å; S64-N89 PolarHBondContact O-ND2 3.39Å; S64-N89 VanDerWaalsContact O-ND2 3.13Å
65	R	80.7	Confident	82.7	Confident	76 Å²	76	45.5 Å²	45.5	29%	0.287	24%	0.242	S	C	.	.	S	Bend	trans	-81.4	148.2	175.5	-58.9	-179	-169.9	-160.3	6.5	110.8	E26 E29	E26-R65 IonicContact OE1-NH1 2.64Å; E29-R65 WeakPolarHBondContact OE2-CG 3.32Å; E29-R65 PolarHBondContact OE2-N 2.8Å
66	P	84.4	Confident	82.9	Confident	58 Å²	58	43.7 Å²	43.7	38%	0.377	23%	0.232	S	C	.	.			trans	-63	136.3	173.4	-20.1	32.8	0	0	0	111.6	I43 F44 N89 I91	I43-P66 WeakPolarHBondContact CG2-O 3.34Å; F44-P66 PolarHBondContact N-O 2.94Å; P66-N89 WeakPolarHBondContact CA-O 3.36Å; P66-I91 HydrophobicContact CB-CD1 3.6Å; P66-I91 HydrophobicContact CB-CG1 4.07Å
67	F	87.3	Confident	83.1	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	161.8	-169	69.5	-89.5	0	0	0	116	F44 W63 L69 L87 N89 A90 I91	F44-F67 HydrophobicContact CB-CB 3.86Å; F44-F67 HydrophobicContact CD1-CB 4.45Å; F44-F67 CarbonylContact O-C 3.52Å; F44-F67 WeakPolarHBondContact O-CA 3.37Å; F44-F67 WeakPolarHBondContact O-CB 3.38Å; W63-F67 HydrophobicContact CB-CD1 3.82Å; W63-F67 HydrophobicContact CB-CE1 4.04Å; W63-F67 HydrophobicContact CE3-CD1 4.21Å; W63-F67 HydrophobicContact CE3-CD2 4.05Å; W63-F67 AromaticContact CE3-CE1 3.83Å; W63-F67 HydrophobicContact CE3-CE1 3.83Å; W63-F67 AromaticContact CE3-CE2 3.66Å; W63-F67 HydrophobicContact CE3-CE2 3.66Å; W63-F67 HydrophobicContact CE3-CG 4.31Å; W63-F67 AromaticContact CE3-CZ 3.55Å; W63-F67 HydrophobicContact CE3-CZ 3.55Å; W63-F67 HydrophobicContact CZ3-CD2 4.4Å; W63-F67 AromaticContact CZ3-CE2 3.86Å; W63-F67 HydrophobicContact CZ3-CE2 3.86Å; W63-F67 HydrophobicContact CZ3-CZ 4.07Å; F67-L69 HydrophobicContact CD2-CB 4.05Å; F67-L69 HydrophobicContact CE2-CB 3.93Å; F67-L69 HydrophobicContact CE2-CD2 4.25Å; F67-L87 HydrophobicContact CZ-CB 3.96Å; F67-L87 HydrophobicContact CZ-CD2 4Å; F67-N89 HydrophobicContact CD1-CB 3.92Å; F67-N89 VanDerWaalsContact CE1-C 3.46Å; F67-N89 HydrophobicContact CE1-CB 3.84Å; F67-N89 PolarHBondContact N-O 3.16Å; F67-A90 HydrophobicContact CD2-CB 4.28Å; F67-A90 HydrophobicContact CE1-CB 4.18Å; F67-A90 HydrophobicContact CE2-CB 3.67Å; F67-A90 HydrophobicContact CZ-CB 3.61Å; F67-A90 CarbonylContact O-C 3.22Å; F67-A90 WeakPolarHBondContact O-CA 3.3Å; F67-I91 PolarHBondContact O-N 2.58Å
68	K	87.3	Confident	83.7	Confident	67 Å²	67	51.5 Å²	51.5	29%	0.291	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	126.7	171.1	-56.5	-178.6	-165.1	140.8	0	108.6	I43 F44 H45 V46 S92	I43-K68 HydrophobicContact CG2-CG 4.08Å; F44-K68 PolarHBondContact O-N 2.77Å; H45-K68 PolarHBondContact CE1-NZ 3.46Å; H45-K68 PolarHBondContact NE2-NZ 3.17Å; V46-K68 PolarHBondContact N-O 3.03Å; K68-S92 CarbonylContact C-O 3.57Å; K68-S92 WeakPolarHBondContact CA-O 3.42Å
69	L	89.4	Confident	84.2	Confident	3 Å²	3	47.6 Å²	47.6	2%	0.016	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	119.3	-173	174.1	60.4	0	0	0	111.1	V46 C48 F67 L71 L87 S92 I93 N94	V46-L69 HydrophobicContact CB-CD1 3.88Å; V46-L69 HydrophobicContact CG1-CD1 3.68Å; C48-L69 HydrophobicContact CB-CD1 4.28Å; F67-L69 HydrophobicContact CD2-CB 4.05Å; F67-L69 HydrophobicContact CE2-CB 3.93Å; F67-L69 HydrophobicContact CE2-CD2 4.25Å; L69-L71 HydrophobicContact CD1-CD1 4.35Å; L69-L71 HydrophobicContact CD1-CG 4.03Å; L69-L71 HydrophobicContact CD2-CD1 3.73Å; L69-L71 HydrophobicContact CD2-CG 4.3Å; L69-L71 HydrophobicContact CG-CD1 3.9Å; L69-L71 HydrophobicContact CG-CG 3.95Å; L69-L87 HydrophobicContact CD2-CD1 4.1Å; L69-S92 PolarHBondContact N-O 2.86Å; L69-I93 HydrophobicContact CB-CG1 4.35Å; L69-I93 WeakPolarHBondContact O-CA 3.42Å; L69-N94 PolarHBondContact O-N 3.2Å
70	N	87.9	Confident	84.8	Confident	17 Å²	17	52.8 Å²	52.8	9%	0.091	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	112.3	175.8	-164.5	5.7	0	0	0	110.2	V46 C48 D49 Q72 N94 E575	V46-N70 PolarHBondContact O-N 3.24Å; C48-N70 CarbonylContact C-O 3.25Å; C48-N70 VanDerWaalsContact C-O 3.22Å; C48-N70 VanDerWaalsContact CA-O 3.25Å; C48-N70 WeakPolarHBondContact CA-O 3.32Å; C48-N70 VanDerWaalsContact CB-O 3.31Å; C48-N70 WeakPolarHBondContact CB-O 3.44Å; C48-N70 PolarHBondContact N-O 2.96Å; D49-N70 PolarHBondContact N-O 3.15Å; N70-Q72 PolarHBondContact ND2-NE2 2.96Å; N70-Q72 VanDerWaalsContact OD1-CG 3.29Å; N70-Q72 WeakPolarHBondContact OD1-CG 3.46Å; N70-N94 WeakPolarHBondContact OD1-CB 3.01Å; N70-N94 PolarHBondContact OD1-ND2 2.9Å; N70-E575 PolarHBondContact ND2-OE1 2.88Å
71	L	89.9	Confident	85.9	Confident	0 Å²	0	56 Å²	56	0%	0	26%	0.259	C	S	.	.			trans	-119.9	18.3	-179.6	-77.6	167.5	0	0	0	112.2	C48 F53 I59 L69 N74 M76 N94 L95 N98	C48-L71 HydrophobicContact CB-CD2 3.42Å; C48-L71 VanDerWaalsContact CB-CD2 3.42Å; C48-L71 HydrophobicContact CB-CG 4.21Å; F53-L71 HydrophobicContact CD2-CD2 4.1Å; I59-L71 HydrophobicContact CD1-CD2 3.74Å; I59-L71 HydrophobicContact CG1-CD2 4.18Å; L69-L71 HydrophobicContact CD1-CD1 4.35Å; L69-L71 HydrophobicContact CD1-CG 4.03Å; L69-L71 HydrophobicContact CD2-CD1 3.73Å; L69-L71 HydrophobicContact CD2-CG 4.3Å; L69-L71 HydrophobicContact CG-CD1 3.9Å; L69-L71 HydrophobicContact CG-CG 3.95Å; L71-N74 VanDerWaalsContact C-ND2 3.31Å; L71-N74 PolarHBondContact O-ND2 3.15Å; L71-M76 HydrophobicContact CD1-CE 4.13Å; L71-M76 HydrophobicContact CD2-CE 3.87Å; L71-M76 HydrophobicContact CG-CE 4.46Å; L71-N94 CarbonylContact C-O 3.47Å; L71-N94 WeakPolarHBondContact CA-O 3.05Å; L71-N94 WeakPolarHBondContact CB-O 3.49Å; L71-N94 PolarHBondContact N-O 3.22Å; L71-L95 HydrophobicContact CB-CD2 3.93Å; L71-L95 HydrophobicContact CD1-CD2 4.04Å; L71-N98 PolarHBondContact O-ND2 3.17Å
72	Q	89	Confident	86.7	Confident	11 Å²	11	56 Å²	56	5%	0.051	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	163.5	179.3	68.8	179.9	-15.6	0	0	113.8	D49 S50 N70 N74 N94 G96 E575	D49-Q72 WeakPolarHBondContact CA-O 3.46Å; D49-Q72 HydrophobicContact CB-CG 3.46Å; D49-Q72 VanDerWaalsContact CB-CG 3.46Å; S50-Q72 PolarHBondContact N-O 3.17Å; S50-Q72 VanDerWaalsContact N-O 3.09Å; N70-Q72 PolarHBondContact ND2-NE2 2.96Å; N70-Q72 VanDerWaalsContact OD1-CG 3.29Å; N70-Q72 WeakPolarHBondContact OD1-CG 3.46Å; Q72-N74 PolarHBondContact O-N 3.22Å; Q72-N74 PolarHBondContact O-ND2 2.84Å; Q72-N94 PolarHBondContact N-O 3.15Å; Q72-G96 WeakPolarHBondContact CA-O 3.04Å; Q72-G96 WeakPolarHBondContact CB-O 3.19Å; Q72-E575 PolarHBondContact NE2-OE1 3.28Å; Q72-E575 PolarHBondContact NE2-OE2 3.03Å; Q72-E575 PolarHBondContact OE1-OE2 3.13Å
73	R	87.9	Confident	87.4	Confident	93 Å²	93	51.9 Å²	51.9	35%	0.351	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	19.1	173.5	-52	179.1	-154.9	-178.7	11.4	114.3	G96 N97 E575	R73-G96 PolarHBondContact N-O 2.76Å; R73-N97 WeakPolarHBondContact CA-O 3.45Å; R73-N97 HydrophobicContact CG-CB 4.49Å; R73-N97 PolarHBondContact N-O 3.08Å; R73-E575 IonicContact NH2-OE2 3.19Å; R73-E575 PolarHBondContact NH2-OE2 3.35Å
74	N	91.3	Very high	88	Confident	4 Å²	4	51.9 Å²	51.9	2%	0.021	24%	0.242	C	C	.	.	S	Bend	trans	-92.7	-169.2	173	-75.8	-65.1	0	0	0	110.3	C48 K51 G52 F53 L71 Q72 N98	C48-N74 PolarHBondContact O-ND2 3.33Å; K51-N74 PolarHBondContact N-OD1 2.03Å; G52-N74 PolarHBondContact N-OD1 2.9Å; F53-N74 HydrophobicContact CB-CB 4.24Å; F53-N74 PolarHBondContact N-OD1 3.41Å; L71-N74 VanDerWaalsContact C-ND2 3.31Å; L71-N74 PolarHBondContact O-ND2 3.15Å; Q72-N74 PolarHBondContact O-N 3.22Å; Q72-N74 PolarHBondContact O-ND2 2.84Å; N74-N98 VanDerWaalsContact C-OD1 3.22Å; N74-N98 WeakPolarHBondContact CB-OD1 3.46Å; N74-N98 WeakPolarHBondContact O-CA 3.42Å; N74-N98 PolarHBondContact O-OD1 2.83Å
75	L	91.4	Very high	88.4	Confident	100 Å²	100	52 Å²	52	52%	0.524	24%	0.236	S	C	.	.			trans	-116.3	27.1	-170.7	-61.3	175.4	0	0	0	112.5	F53 T54 R77	F53-L75 CarbonylContact O-C 3.53Å; F53-L75 WeakPolarHBondContact O-CA 3.39Å; F53-L75 PolarHBondContact O-N 2.04Å; T54-L75 HydrophobicContact CG2-CB 4.07Å; L75-R77 PolarHBondContact O-N 3.02Å
76	M	90.5	Very high	88.5	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.005	24%	0.244	C	C	.	.			trans	-74.4	81.3	-175.5	-60.1	-168.4	180	0	0	112.6	F53 V56 I59 L71 K78 L95 N98 L100	F53-M76 HydrophobicContact CB-CE 3.64Å; F53-M76 HydrophobicContact CG-CE 4.49Å; F53-M76 PolarHBondContact O-N 3.08Å; V56-M76 HydrophobicContact CG2-CE 4.34Å; V56-M76 HydrophobicContact CG2-SD 3.79Å; I59-M76 HydrophobicContact CD1-CE 3.68Å; L71-M76 HydrophobicContact CD1-CE 4.13Å; L71-M76 HydrophobicContact CD2-CE 3.87Å; L71-M76 HydrophobicContact CG-CE 4.46Å; M76-K78 VanDerWaalsContact C-N 3.31Å; M76-K78 PolarHBondContact O-N 3.34Å; M76-L95 HydrophobicContact SD-CD2 4.02Å; M76-N98 HydrophobicContact CB-CB 4.33Å; M76-N98 VanDerWaalsContact CB-OD1 3.32Å; M76-N98 WeakPolarHBondContact CB-OD1 3.42Å; M76-N98 WeakPolarHBondContact CG-OD1 3.36Å; M76-N98 PolarHBondContact N-OD1 2.64Å; M76-L100 WeakPolarHBondContact O-CA 3.4Å; M76-L100 WeakPolarHBondContact O-CB 3.37Å; M76-L100 VanDerWaalsContact O-CD1 3.3Å; M76-L100 WeakPolarHBondContact O-CD1 3.14Å
77	R	91.1	Very high	88.5	Confident	171 Å²	171	50.4 Å²	50.4	65%	0.645	23%	0.226	S	C	*	.			trans	-66.8	-25.2	-177.9	-65.2	-176.4	-177	-173.7	0.7	114.8	L75 Q101	L75-R77 PolarHBondContact O-N 3.02Å; R77-Q101 PolarHBondContact O-N 2.82Å
78	K	91.9	Very high	88.4	Confident	71 Å²	71	53.8 Å²	53.8	31%	0.309	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	147	179.1	-68	-158.2	172.5	-142.8	0	111.6	M76 Y80 D102	M76-K78 VanDerWaalsContact C-N 3.31Å; M76-K78 PolarHBondContact O-N 3.34Å; K78-Y80 HydrophobicContact CB-CE2 4.36Å; K78-D102 WeakPolarHBondContact CA-O 3.32Å; K78-D102 HydrophobicContact CD-CB 4.15Å; K78-D102 HydrophobicContact CG-CB 4.16Å; K78-D102 IonicContact NZ-OD2 2.69Å; K78-D102 PolarHBondContact NZ-OD2 3.08Å
79	L	92.8	Very high	88.5	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	128.7	167.2	-58.2	176.2	0	0	0	109.5	V56 F84 L95 L100 D102 I103 H104 A107 F108	V56-L79 HydrophobicContact CG2-CD2 3.62Å; L79-F84 HydrophobicContact CD1-CE2 4.07Å; L79-F84 HydrophobicContact CD1-CZ 4.41Å; L79-F84 HydrophobicContact CD2-CE2 4.01Å; L79-F84 HydrophobicContact CD2-CZ 4.14Å; L79-L95 HydrophobicContact CD1-CD1 4.19Å; L79-L100 HydrophobicContact CD1-CD1 4.48Å; L79-L100 HydrophobicContact CD1-CD2 3.87Å; L79-L100 HydrophobicContact CG-CD1 3.84Å; L79-L100 HydrophobicContact CG-CD2 4.13Å; L79-D102 PolarHBondContact N-O 2.89Å; L79-D102 VanDerWaalsContact N-O 3.08Å; L79-I103 HydrophobicContact CB-CG2 4.34Å; L79-I103 HydrophobicContact CD1-CD1 4.31Å; L79-I103 HydrophobicContact CD1-CG1 4.14Å; L79-I103 HydrophobicContact CD1-CG2 4.43Å; L79-H104 WeakPolarHBondContact O-CB 3.45Å; L79-H104 PolarHBondContact O-N 2.79Å; L79-A107 HydrophobicContact CB-CB 3.94Å; L79-F108 HydrophobicContact CD1-CE1 3.83Å; L79-F108 HydrophobicContact CD1-CZ 3.79Å
80	Y	90.1	Very high	88.5	Confident	110 Å²	110	52.5 Å²	52.5	43%	0.431	24%	0.24	S	C	.	.			trans	-95.1	164.8	-178.5	-64.5	-82.6	0	0	0	111.6	K78 N82 S83 A107	K78-Y80 HydrophobicContact CB-CE2 4.36Å; Y80-N82 PolarHBondContact O-N 3.34Å; Y80-S83 VanDerWaalsContact C-OG 3.3Å; Y80-S83 WeakPolarHBondContact CA-OG 3.15Å; Y80-S83 PolarHBondContact N-OG 3.22Å; Y80-S83 WeakPolarHBondContact O-CB 3.24Å; Y80-S83 PolarHBondContact O-N 2.71Å; Y80-S83 PolarHBondContact O-OG 2.89Å; Y80-A107 WeakPolarHBondContact O-CA 3.32Å; Y80-A107 VanDerWaalsContact O-CB 3.24Å; Y80-A107 WeakPolarHBondContact O-CB 3.43Å
81	F	88	Confident	88.6	Confident	143 Å²	143	53.2 Å²	53.2	63%	0.627	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.9	140.4	175.5	73.5	-83.9	0	0	0	111.4	S83	F81-S83 PolarHBondContact O-N 2.89Å
82	N	87	Confident	88.6	Confident	59 Å²	59	53.9 Å²	53.9	32%	0.316	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	20.6	178.1	-59.6	-5.5	0	0	0	115.6	Y80 F84 L85 G106 N109	Y80-N82 PolarHBondContact O-N 3.34Å; N82-F84 PolarHBondContact O-N 3.26Å; N82-L85 HydrophobicContact CB-CB 4.26Å; N82-L85 VanDerWaalsContact O-CB 3.3Å; N82-L85 WeakPolarHBondContact O-CB 3.24Å; N82-L85 PolarHBondContact O-N 3.21Å; N82-L85 VanDerWaalsContact O-N 3.08Å; N82-G106 PolarHBondContact N-O 3.46Å; N82-N109 WeakPolarHBondContact OD1-CB 3.5Å; N82-N109 PolarHBondContact OD1-ND2 3.36Å
83	S	84.7	Confident	88.8	Confident	22 Å²	22	53.4 Å²	53.4	15%	0.154	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-27.9	-177.5	-68.9	0	0	0	0	113.7	V56 Y80 F81 A107	V56-S83 VanDerWaalsContact CG1-O 3.32Å; V56-S83 WeakPolarHBondContact CG1-O 3.47Å; Y80-S83 VanDerWaalsContact C-OG 3.3Å; Y80-S83 WeakPolarHBondContact CA-OG 3.15Å; Y80-S83 PolarHBondContact N-OG 3.22Å; Y80-S83 WeakPolarHBondContact O-CB 3.24Å; Y80-S83 PolarHBondContact O-N 2.71Å; Y80-S83 PolarHBondContact O-OG 2.89Å; F81-S83 PolarHBondContact O-N 2.89Å; S83-A107 PolarHBondContact N-O 2.9Å
84	F	88.8	Confident	88.9	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.6	16.6	-177.2	-62.3	-97.4	0	0	0	113.5	V56 L79 N82 H86 L87 I93 L95 A107 F108 L111	V56-F84 HydrophobicContact CB-CZ 4.42Å; V56-F84 HydrophobicContact CG1-CD1 3.94Å; V56-F84 HydrophobicContact CG1-CE1 3.78Å; V56-F84 HydrophobicContact CG1-CE2 4.39Å; V56-F84 HydrophobicContact CG1-CG 4.29Å; V56-F84 HydrophobicContact CG1-CZ 4.02Å; V56-F84 HydrophobicContact CG2-CE1 4.11Å; V56-F84 HydrophobicContact CG2-CE2 3.86Å; V56-F84 HydrophobicContact CG2-CZ 3.53Å; L79-F84 HydrophobicContact CD1-CE2 4.07Å; L79-F84 HydrophobicContact CD1-CZ 4.41Å; L79-F84 HydrophobicContact CD2-CE2 4.01Å; L79-F84 HydrophobicContact CD2-CZ 4.14Å; N82-F84 PolarHBondContact O-N 3.26Å; F84-H86 PolarHBondContact O-N 3.25Å; F84-H86 VanDerWaalsContact O-N 3.16Å; F84-L87 HydrophobicContact CB-CB 4.38Å; F84-L87 HydrophobicContact CB-CD1 4.44Å; F84-L87 HydrophobicContact CD1-CD1 3.66Å; F84-L87 HydrophobicContact CE1-CD1 4.38Å; F84-L87 HydrophobicContact CG-CD1 4.41Å; F84-L87 WeakPolarHBondContact O-CB 3.3Å; F84-L87 PolarHBondContact O-N 2.97Å; F84-I93 HydrophobicContact CD1-CD1 3.81Å; F84-I93 HydrophobicContact CE1-CD1 4.05Å; F84-I93 HydrophobicContact CE1-CG2 4.3Å; F84-L95 HydrophobicContact CE1-CD1 4.39Å; F84-L95 HydrophobicContact CZ-CD1 3.8Å; F84-L95 HydrophobicContact CZ-CD2 4.37Å; F84-A107 WeakPolarHBondContact CD2-O 3.42Å; F84-F108 AromaticContact CD2-CD1 3.89Å; F84-F108 HydrophobicContact CD2-CD1 3.89Å; F84-F108 HydrophobicContact CD2-CE1 4.38Å; F84-F108 AromaticContact CE2-CD1 3.88Å; F84-F108 HydrophobicContact CE2-CD1 3.88Å; F84-F108 AromaticContact CE2-CE1 3.89Å; F84-F108 HydrophobicContact CE2-CE1 3.89Å; F84-F108 HydrophobicContact CZ-CE1 4.3Å; F84-L111 HydrophobicContact CB-CD1 3.58Å; F84-L111 HydrophobicContact CB-CD2 3.97Å; F84-L111 HydrophobicContact CB-CG 3.67Å; F84-L111 HydrophobicContact CD1-CD1 3.96Å; F84-L111 HydrophobicContact CD2-CD1 4.31Å; F84-L111 HydrophobicContact CG-CD1 3.7Å; F84-L111 HydrophobicContact CG-CG 4.34Å
85	L	85.4	Confident	89	Confident	86 Å²	86	49.8 Å²	49.8	45%	0.45	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-32.6	-173.7	-174.4	65.4	0	0	0	113.8	N82 L87	N82-L85 HydrophobicContact CB-CB 4.26Å; N82-L85 VanDerWaalsContact O-CB 3.3Å; N82-L85 WeakPolarHBondContact O-CB 3.24Å; N82-L85 PolarHBondContact O-N 3.21Å; N82-L85 VanDerWaalsContact O-N 3.08Å; L85-L87 VanDerWaalsContact C-N 3.32Å
86	H	81.8	Confident	89	Confident	99 Å²	99	45 Å²	45	46%	0.458	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-6.2	178.7	-58.9	-69.5	0	0	0	113.7	I62 F84	I62-H86 HydrophobicContact CG1-CB 4.05Å; F84-H86 PolarHBondContact O-N 3.25Å; F84-H86 VanDerWaalsContact O-N 3.16Å
87	L	85.2	Confident	89	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.005	22%	0.223	C	C	.	.			trans	-105.9	28	-169.9	-57.8	-179.7	0	0	0	111.8	V56 Q61 W63 F67 L69 F84 L85 N89 A90 L111	V56-L87 HydrophobicContact CG1-CD1 3.97Å; Q61-L87 WeakPolarHBondContact O-CD2 3.37Å; W63-L87 HydrophobicContact CE3-CD2 3.93Å; W63-L87 HydrophobicContact CZ3-CD2 3.62Å; F67-L87 HydrophobicContact CZ-CB 3.96Å; F67-L87 HydrophobicContact CZ-CD2 4Å; L69-L87 HydrophobicContact CD2-CD1 4.1Å; F84-L87 HydrophobicContact CB-CB 4.38Å; F84-L87 HydrophobicContact CB-CD1 4.44Å; F84-L87 HydrophobicContact CD1-CD1 3.66Å; F84-L87 HydrophobicContact CE1-CD1 4.38Å; F84-L87 HydrophobicContact CG-CD1 4.41Å; F84-L87 WeakPolarHBondContact O-CB 3.3Å; F84-L87 PolarHBondContact O-N 2.97Å; L85-L87 VanDerWaalsContact C-N 3.32Å; L87-N89 PolarHBondContact O-N 3.28Å; L87-N89 VanDerWaalsContact O-N 3.11Å; L87-A90 VanDerWaalsContact O-CB 3.3Å; L87-A90 WeakPolarHBondContact O-CB 3.36Å; L87-A90 PolarHBondContact O-N 2.85Å; L87-L111 HydrophobicContact CB-CD2 4.19Å; L87-L111 VanDerWaalsContact O-CD2 3.24Å; L87-L111 WeakPolarHBondContact O-CD2 3.41Å
88	N	85.8	Confident	89	Confident	72 Å²	72	39.6 Å²	39.6	39%	0.385	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-30	-173.8	63.9	-20.7	0	0	0	115.1	A90 G110 I113	N88-A90 VanDerWaalsContact C-N 3.34Å; N88-G110 WeakPolarHBondContact CA-O 3.48Å; N88-I113 WeakPolarHBondContact O-CG1 3.26Å
89	N	88.6	Confident	89	Confident	42 Å²	42	38 Å²	38	23%	0.225	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	7.9	-179.8	-74.6	-30.4	0	0	0	114.5	W63 S64 P66 F67 L87 I91	W63-N89 PolarHBondContact O-ND2 3.31Å; S64-N89 PolarHBondContact O-ND2 3.39Å; S64-N89 VanDerWaalsContact O-ND2 3.13Å; P66-N89 WeakPolarHBondContact CA-O 3.36Å; F67-N89 HydrophobicContact CD1-CB 3.92Å; F67-N89 VanDerWaalsContact CE1-C 3.46Å; F67-N89 HydrophobicContact CE1-CB 3.84Å; F67-N89 PolarHBondContact N-O 3.16Å; L87-N89 PolarHBondContact O-N 3.28Å; L87-N89 VanDerWaalsContact O-N 3.11Å; N89-I91 PolarHBondContact O-N 3.19Å
90	A	89.6	Confident	89	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	123.3	177.8	0	0	0	0	0	112.3	F67 L87 N88 I93 L111 L114	F67-A90 HydrophobicContact CD2-CB 4.28Å; F67-A90 HydrophobicContact CE1-CB 4.18Å; F67-A90 HydrophobicContact CE2-CB 3.67Å; F67-A90 HydrophobicContact CZ-CB 3.61Å; F67-A90 CarbonylContact O-C 3.22Å; F67-A90 WeakPolarHBondContact O-CA 3.3Å; L87-A90 VanDerWaalsContact O-CB 3.3Å; L87-A90 WeakPolarHBondContact O-CB 3.36Å; L87-A90 PolarHBondContact O-N 2.85Å; N88-A90 VanDerWaalsContact C-N 3.34Å; A90-I93 HydrophobicContact CB-CD1 3.84Å; A90-I93 HydrophobicContact CB-CG1 4Å; A90-L111 HydrophobicContact CB-CD2 3.96Å; A90-L114 HydrophobicContact CB-CD1 3.9Å; A90-L114 WeakPolarHBondContact O-CA 3.44Å; A90-L114 WeakPolarHBondContact O-CD1 3.39Å
91	I	89.1	Confident	89.2	Confident	33 Å²	33	37.8 Å²	37.8	17%	0.169	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	-37.2	170.4	-64	175.5	0	0	0	111	I43 P66 F67 N89 K115 R116	I43-I91 HydrophobicContact CD1-CD1 4.06Å; I43-I91 HydrophobicContact CG1-CD1 4.37Å; I43-I91 HydrophobicContact CG2-CD1 4.3Å; P66-I91 HydrophobicContact CB-CD1 3.6Å; P66-I91 HydrophobicContact CB-CG1 4.07Å; F67-I91 PolarHBondContact O-N 2.58Å; N89-I91 PolarHBondContact O-N 3.19Å; I91-K115 HydrophobicContact CG2-CB 4.44Å; I91-K115 HydrophobicContact CG2-CD 4.21Å; I91-K115 PolarHBondContact O-N 3.18Å; I91-R116 PolarHBondContact O-N 2.83Å
92	S	90.4	Very high	89.2	Confident	14 Å²	14	32.5 Å²	32.5	10%	0.098	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	134.7	-174.7	-174.9	0	0	0	0	111	K68 L69 R116	K68-S92 CarbonylContact C-O 3.57Å; K68-S92 WeakPolarHBondContact CA-O 3.42Å; L69-S92 PolarHBondContact N-O 2.86Å; S92-R116 WeakPolarHBondContact CA-O 3.27Å
93	I	92.6	Very high	89.6	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	123.3	176.6	-72.4	171.9	0	0	0	109.4	L69 F84 A90 L95 L111 L114 R116 L117 F118	L69-I93 HydrophobicContact CB-CG1 4.35Å; L69-I93 WeakPolarHBondContact O-CA 3.42Å; F84-I93 HydrophobicContact CD1-CD1 3.81Å; F84-I93 HydrophobicContact CE1-CD1 4.05Å; F84-I93 HydrophobicContact CE1-CG2 4.3Å; A90-I93 HydrophobicContact CB-CD1 3.84Å; A90-I93 HydrophobicContact CB-CG1 4Å; I93-L95 HydrophobicContact CG2-CD1 3.68Å; I93-L95 HydrophobicContact CG2-CG 3.73Å; I93-L111 HydrophobicContact CD1-CD1 3.67Å; I93-L111 HydrophobicContact CD1-CD2 3.71Å; I93-L111 HydrophobicContact CD1-CG 4.37Å; I93-L114 HydrophobicContact CB-CD1 4.09Å; I93-L114 HydrophobicContact CB-CD2 4.49Å; I93-L114 HydrophobicContact CD1-CD1 3.82Å; I93-L114 HydrophobicContact CD1-CD2 4.47Å; I93-L114 HydrophobicContact CG1-CD1 3.7Å; I93-R116 PolarHBondContact N-O 2.95Å; I93-L117 HydrophobicContact CB-CD1 4.33Å; I93-L117 HydrophobicContact CG2-CD1 4.19Å; I93-F118 PolarHBondContact O-N 3.5Å; I93-F118 VanDerWaalsContact O-N 3.07Å
94	N	91.1	Very high	89.9	Confident	20 Å²	20	32.4 Å²	32.4	11%	0.107	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	118.2	171.3	-177.6	10.9	0	0	0	111	L69 N70 L71 Q72 G96 F118	L69-N94 PolarHBondContact O-N 3.2Å; N70-N94 WeakPolarHBondContact OD1-CB 3.01Å; N70-N94 PolarHBondContact OD1-ND2 2.9Å; L71-N94 CarbonylContact C-O 3.47Å; L71-N94 WeakPolarHBondContact CA-O 3.05Å; L71-N94 WeakPolarHBondContact CB-O 3.49Å; L71-N94 PolarHBondContact N-O 3.22Å; Q72-N94 PolarHBondContact N-O 3.15Å; N94-G96 PolarHBondContact OD1-N 2.87Å; N94-F118 HydrophobicContact CB-CB 4.22Å; N94-F118 HydrophobicContact CB-CD2 4.16Å; N94-F118 HydrophobicContact CB-CG 4.45Å; N94-F118 WeakPolarHBondContact OD1-CB 3.03Å
95	L	93.7	Very high	89.8	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.005	19%	0.187	C	C	.	.			trans	-120.1	19.6	176.9	-69.6	159	0	0	0	111.2	L71 M76 L79 F84 I93 N98 F108 L117 F118 L119 N122	L71-L95 HydrophobicContact CB-CD2 3.93Å; L71-L95 HydrophobicContact CD1-CD2 4.04Å; M76-L95 HydrophobicContact SD-CD2 4.02Å; L79-L95 HydrophobicContact CD1-CD1 4.19Å; F84-L95 HydrophobicContact CE1-CD1 4.39Å; F84-L95 HydrophobicContact CZ-CD1 3.8Å; F84-L95 HydrophobicContact CZ-CD2 4.37Å; I93-L95 HydrophobicContact CG2-CD1 3.68Å; I93-L95 HydrophobicContact CG2-CG 3.73Å; L95-N98 PolarHBondContact O-ND2 3.3Å; L95-F108 HydrophobicContact CD1-CE1 4.21Å; L95-L117 HydrophobicContact CD1-CD1 4.29Å; L95-F118 PolarHBondContact N-O 3.47Å; L95-L119 HydrophobicContact CB-CD2 4.05Å; L95-L119 HydrophobicContact CD1-CD2 4.25Å; L95-N122 PolarHBondContact O-ND2 3.48Å
96	G	91.3	Very high	89.9	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.167	C	C	.	.			trans	-61.3	151.5	179.8	0	0	0	0	0	113.3	Q72 R73 N94 N98 H120	Q72-G96 WeakPolarHBondContact CA-O 3.04Å; Q72-G96 WeakPolarHBondContact CB-O 3.19Å; R73-G96 PolarHBondContact N-O 2.76Å; N94-G96 PolarHBondContact OD1-N 2.87Å; G96-N98 VanDerWaalsContact C-N 3.35Å; G96-N98 PolarHBondContact O-N 3.11Å; G96-N98 PolarHBondContact O-ND2 3.19Å; G96-H120 CarbonylContact C-O 3.36Å; G96-H120 WeakPolarHBondContact CA-O 3.38Å
97	N	90.1	Very high	90.4	Very high	56 Å²	56	25.9 Å²	25.9	30%	0.299	15%	0.145	S	C	.	.	S	Bend	trans	52.1	47.6	175	-154.3	-36.7	0	0	0	113.5	R73 H120 E121	R73-N97 WeakPolarHBondContact CA-O 3.45Å; R73-N97 HydrophobicContact CG-CB 4.49Å; R73-N97 PolarHBondContact N-O 3.08Å; N97-H120 PolarHBondContact N-O 3.23Å; N97-E121 WeakPolarHBondContact CA-O 3.37Å; N97-E121 HydrophobicContact CB-CB 4.12Å; N97-E121 PolarHBondContact ND2-OE2 2.84Å
98	N	90.6	Very high	90.8	Very high	2 Å²	2	25.8 Å²	25.8	1%	0.011	15%	0.145	C	C	.	.	S	Bend	trans	-106.7	-1.3	178.8	-98.2	-90.3	0	0	0	113.8	L71 N74 M76 L95 G96 L100 N122	L71-N98 PolarHBondContact O-ND2 3.17Å; N74-N98 VanDerWaalsContact C-OD1 3.22Å; N74-N98 WeakPolarHBondContact CB-OD1 3.46Å; N74-N98 WeakPolarHBondContact O-CA 3.42Å; N74-N98 PolarHBondContact O-OD1 2.83Å; M76-N98 HydrophobicContact CB-CB 4.33Å; M76-N98 VanDerWaalsContact CB-OD1 3.32Å; M76-N98 WeakPolarHBondContact CB-OD1 3.42Å; M76-N98 WeakPolarHBondContact CG-OD1 3.36Å; M76-N98 PolarHBondContact N-OD1 2.64Å; L95-N98 PolarHBondContact O-ND2 3.3Å; G96-N98 VanDerWaalsContact C-N 3.35Å; G96-N98 PolarHBondContact O-N 3.11Å; G96-N98 PolarHBondContact O-ND2 3.19Å; N98-L100 HydrophobicContact CB-CB 4.37Å; N98-L100 PolarHBondContact O-N 2.86Å; N98-N122 WeakPolarHBondContact CA-OD1 3.29Å; N98-N122 WeakPolarHBondContact CB-OD1 3.13Å; N98-N122 PolarHBondContact N-OD1 3.3Å
99	A	91.4	Very high	91	Very high	38 Å²	38	24.5 Å²	24.5	31%	0.314	14%	0.138	S	C	.	.			trans	52.2	30.4	-165.6	0	0	0	0	0	113.6	Q101 N122 K123	A99-Q101 PolarHBondContact O-N 2.81Å; A99-N122 PolarHBondContact N-OD1 2.87Å; A99-N122 VanDerWaalsContact N-OD1 3.1Å; A99-K123 HydrophobicContact CB-CD 4.36Å
100	L	94.8	Very high	90.8	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.005	14%	0.144	C	C	.	.			trans	-62.8	124.8	179.9	177.3	61.8	0	0	0	110.7	M76 L79 N98 I103 L119 N122 K123 L124	M76-L100 WeakPolarHBondContact O-CA 3.4Å; M76-L100 WeakPolarHBondContact O-CB 3.37Å; M76-L100 VanDerWaalsContact O-CD1 3.3Å; M76-L100 WeakPolarHBondContact O-CD1 3.14Å; L79-L100 HydrophobicContact CD1-CD1 4.48Å; L79-L100 HydrophobicContact CD1-CD2 3.87Å; L79-L100 HydrophobicContact CG-CD1 3.84Å; L79-L100 HydrophobicContact CG-CD2 4.13Å; N98-L100 HydrophobicContact CB-CB 4.37Å; N98-L100 PolarHBondContact O-N 2.86Å; L100-I103 HydrophobicContact CD1-CG1 4.49Å; L100-I103 HydrophobicContact CD2-CD1 4Å; L100-I103 HydrophobicContact CD2-CG1 4.01Å; L100-I103 HydrophobicContact CG-CG1 4.41Å; L100-L119 HydrophobicContact CD2-CD2 4.12Å; L100-N122 HydrophobicContact CB-CB 4.27Å; L100-N122 WeakPolarHBondContact CB-OD1 3.5Å; L100-N122 PolarHBondContact N-OD1 2.94Å; L100-K123 CarbonylContact O-C 3.56Å; L100-K123 VanDerWaalsContact O-CA 3.29Å; L100-K123 WeakPolarHBondContact O-CA 3.47Å; L100-K123 PolarHBondContact O-N 3.21Å; L100-L124 HydrophobicContact CD2-CD2 4.15Å; L100-L124 HydrophobicContact CG-CD2 3.84Å; L100-L124 PolarHBondContact O-N 3.18Å
101	Q	92.6	Very high	90.8	Very high	105 Å²	105	24.1 Å²	24.1	49%	0.491	14%	0.144	S	C	.	.			trans	-105.1	-34.5	-175.4	-65.3	177.3	-1.2	0	0	113.5	R77 A99 K123	R77-Q101 PolarHBondContact O-N 2.82Å; A99-Q101 PolarHBondContact O-N 2.81Å; Q101-K123 HydrophobicContact CG-CB 4.09Å
102	D	89.4	Confident	90.8	Very high	31 Å²	31	24.1 Å²	24.1	17%	0.166	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	135.8	-167.2	-163.7	14.2	0	0	0	111.4	K78 L79 R128	K78-D102 WeakPolarHBondContact CA-O 3.32Å; K78-D102 HydrophobicContact CD-CB 4.15Å; K78-D102 HydrophobicContact CG-CB 4.16Å; K78-D102 IonicContact NZ-OD2 2.69Å; K78-D102 PolarHBondContact NZ-OD2 3.08Å; L79-D102 PolarHBondContact N-O 2.89Å; L79-D102 VanDerWaalsContact N-O 3.08Å; D102-R128 IonicContact OD1-CZ 2.67Å; D102-R128 VanDerWaalsContact OD1-CZ 3.28Å; D102-R128 IonicContact OD1-NH1 2.68Å; D102-R128 PolarHBondContact OD1-NH1 3.43Å; D102-R128 IonicContact OD1-NH2 3.78Å; D102-R128 PolarHBondContact OD1-NH2 3.26Å
103	I	94.1	Very high	90.8	Very high	3 Å²	3	27.2 Å²	27.2	2%	0.015	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	115.3	179.7	-57.3	178.7	0	0	0	106.9	L79 L100 A107 F108 L119 L124 R128 T131	L79-I103 HydrophobicContact CB-CG2 4.34Å; L79-I103 HydrophobicContact CD1-CD1 4.31Å; L79-I103 HydrophobicContact CD1-CG1 4.14Å; L79-I103 HydrophobicContact CD1-CG2 4.43Å; L100-I103 HydrophobicContact CD1-CG1 4.49Å; L100-I103 HydrophobicContact CD2-CD1 4Å; L100-I103 HydrophobicContact CD2-CG1 4.01Å; L100-I103 HydrophobicContact CG-CG1 4.41Å; I103-A107 HydrophobicContact CG2-CB 3.83Å; I103-F108 HydrophobicContact CD1-CE2 4.24Å; I103-F108 HydrophobicContact CD1-CZ 4.15Å; I103-F108 HydrophobicContact CG2-CE2 3.9Å; I103-F108 HydrophobicContact CG2-CZ 4.34Å; I103-L119 HydrophobicContact CD1-CD1 4.47Å; I103-L124 HydrophobicContact CD1-CD1 4.16Å; I103-L124 HydrophobicContact CD1-CD2 3.93Å; I103-L124 HydrophobicContact CG1-CD2 3.88Å; I103-R128 PolarHBondContact O-NH1 3.07Å; I103-T131 HydrophobicContact CB-CG2 4.16Å; I103-T131 HydrophobicContact CD1-CG2 4.17Å; I103-T131 HydrophobicContact CG2-CG2 4.16Å
104	H	91.6	Very high	90.9	Very high	76 Å²	76	27.2 Å²	27.2	35%	0.352	17%	0.166	S	C	.	.			trans	-68.7	152.4	175.7	-85.6	-115.1	0	0	0	111.7	L79 G106 A107	L79-H104 WeakPolarHBondContact O-CB 3.45Å; L79-H104 PolarHBondContact O-N 2.79Å; H104-G106 PolarHBondContact O-N 3.4Å; H104-A107 WeakPolarHBondContact O-CB 3.29Å; H104-A107 PolarHBondContact O-N 2.99Å; H104-A107 VanDerWaalsContact O-N 3.08Å
105	A	87.1	Confident	90.7	Very high	46 Å²	46	30 Å²	30	38%	0.38	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49	128.9	172.3	0	0	0	0	0	111.3	A107 D130	A105-A107 VanDerWaalsContact C-N 3.26Å; A105-A107 PolarHBondContact O-N 3.47Å; A105-D130 HydrophobicContact CB-CB 3.89Å; A105-D130 VanDerWaalsContact CB-CG 3.48Å; A105-D130 VanDerWaalsContact CB-OD2 3.24Å; A105-D130 WeakPolarHBondContact CB-OD2 3.33Å
106	G	87	Confident	90.5	Very high	2 Å²	2	32.8 Å²	32.8	2%	0.021	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.8	23.9	179.3	0	0	0	0	0	114.9	N82 H104 F108 N109 D130	N82-G106 PolarHBondContact N-O 3.46Å; H104-G106 PolarHBondContact O-N 3.4Å; G106-F108 PolarHBondContact O-N 2.93Å; G106-N109 WeakPolarHBondContact CA-OD1 3.46Å; G106-N109 VanDerWaalsContact O-CB 3.3Å; G106-N109 WeakPolarHBondContact O-CB 3.37Å; G106-N109 PolarHBondContact O-N 3.03Å; G106-N109 PolarHBondContact O-ND2 3.04Å; G106-D130 PolarHBondContact N-O 2.97Å
107	A	92	Very high	90.6	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-41	173.1	0	0	0	0	0	112.2	L79 Y80 S83 F84 I103 H104 A105 N109	L79-A107 HydrophobicContact CB-CB 3.94Å; Y80-A107 WeakPolarHBondContact O-CA 3.32Å; Y80-A107 VanDerWaalsContact O-CB 3.24Å; Y80-A107 WeakPolarHBondContact O-CB 3.43Å; S83-A107 PolarHBondContact N-O 2.9Å; F84-A107 WeakPolarHBondContact CD2-O 3.42Å; I103-A107 HydrophobicContact CG2-CB 3.83Å; H104-A107 WeakPolarHBondContact O-CB 3.29Å; H104-A107 PolarHBondContact O-N 2.99Å; H104-A107 VanDerWaalsContact O-N 3.08Å; A105-A107 VanDerWaalsContact C-N 3.26Å; A105-A107 PolarHBondContact O-N 3.47Å; A107-N109 VanDerWaalsContact C-N 3.28Å; A107-N109 PolarHBondContact O-N 3.21Å
108	F	93.6	Very high	90.7	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	12.3	179.1	-56.2	-61.6	0	0	0	114.3	L79 F84 L95 I103 G106 G110 L111 L117 T131 F132 L135	L79-F108 HydrophobicContact CD1-CE1 3.83Å; L79-F108 HydrophobicContact CD1-CZ 3.79Å; F84-F108 AromaticContact CD2-CD1 3.89Å; F84-F108 HydrophobicContact CD2-CD1 3.89Å; F84-F108 HydrophobicContact CD2-CE1 4.38Å; F84-F108 AromaticContact CE2-CD1 3.88Å; F84-F108 HydrophobicContact CE2-CD1 3.88Å; F84-F108 AromaticContact CE2-CE1 3.89Å; F84-F108 HydrophobicContact CE2-CE1 3.89Å; F84-F108 HydrophobicContact CZ-CE1 4.3Å; L95-F108 HydrophobicContact CD1-CE1 4.21Å; I103-F108 HydrophobicContact CD1-CE2 4.24Å; I103-F108 HydrophobicContact CD1-CZ 4.15Å; I103-F108 HydrophobicContact CG2-CE2 3.9Å; I103-F108 HydrophobicContact CG2-CZ 4.34Å; G106-F108 PolarHBondContact O-N 2.93Å; F108-G110 PolarHBondContact O-N 3.3Å; F108-L111 HydrophobicContact CB-CD1 3.98Å; F108-L111 HydrophobicContact CD1-CD1 3.81Å; F108-L111 HydrophobicContact CG-CD1 4.35Å; F108-L111 WeakPolarHBondContact O-CB 3.49Å; F108-L111 PolarHBondContact O-N 3.15Å; F108-L111 VanDerWaalsContact O-N 3.15Å; F108-L117 HydrophobicContact CE1-CD1 4.46Å; F108-L117 HydrophobicContact CE1-CD2 4.37Å; F108-L117 HydrophobicContact CE2-CD2 4.3Å; F108-L117 HydrophobicContact CZ-CD2 4.06Å; F108-T131 VanDerWaalsContact CD2-O 3.23Å; F108-T131 WeakPolarHBondContact CD2-O 3.45Å; F108-T131 WeakPolarHBondContact CE2-O 3.33Å; F108-F132 HydrophobicContact CE2-CD1 4.23Å; F108-L135 HydrophobicContact CB-CD1 4.01Å; F108-L135 HydrophobicContact CB-CD2 3.91Å; F108-L135 HydrophobicContact CB-CG 3.77Å; F108-L135 HydrophobicContact CD2-CD1 3.72Å; F108-L135 HydrophobicContact CD2-CG 4.4Å; F108-L135 HydrophobicContact CE2-CD1 4.31Å; F108-L135 HydrophobicContact CG-CD1 3.87Å; F108-L135 HydrophobicContact CG-CD2 4.4Å; F108-L135 HydrophobicContact CG-CG 4.21Å
109	N	90.1	Very high	90.9	Very high	45 Å²	45	31.5 Å²	31.5	24%	0.241	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	132.5	173.5	-74.7	-14.2	0	0	0	110.7	N82 G106 A107	N82-N109 WeakPolarHBondContact OD1-CB 3.5Å; N82-N109 PolarHBondContact OD1-ND2 3.36Å; G106-N109 WeakPolarHBondContact CA-OD1 3.46Å; G106-N109 VanDerWaalsContact O-CB 3.3Å; G106-N109 WeakPolarHBondContact O-CB 3.37Å; G106-N109 PolarHBondContact O-N 3.03Å; G106-N109 PolarHBondContact O-ND2 3.04Å; A107-N109 VanDerWaalsContact C-N 3.28Å; A107-N109 PolarHBondContact O-N 3.21Å
110	G	83.9	Confident	90.9	Very high	34 Å²	34	30.5 Å²	30.5	35%	0.351	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	104	-25.8	-173.7	0	0	0	0	0	113.8	N88 F108 G112	N88-G110 WeakPolarHBondContact CA-O 3.48Å; F108-G110 PolarHBondContact O-N 3.3Å; G110-G112 PolarHBondContact O-N 3.13Å
111	L	91.3	Very high	90.7	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.172	C	C	.	.			trans	-81.5	39	-174.9	-63.9	177.6	0	0	0	114.5	F84 L87 A90 I93 F108 I113 L114 G134 L135	F84-L111 HydrophobicContact CB-CD1 3.58Å; F84-L111 HydrophobicContact CB-CD2 3.97Å; F84-L111 HydrophobicContact CB-CG 3.67Å; F84-L111 HydrophobicContact CD1-CD1 3.96Å; F84-L111 HydrophobicContact CD2-CD1 4.31Å; F84-L111 HydrophobicContact CG-CD1 3.7Å; F84-L111 HydrophobicContact CG-CG 4.34Å; L87-L111 HydrophobicContact CB-CD2 4.19Å; L87-L111 VanDerWaalsContact O-CD2 3.24Å; L87-L111 WeakPolarHBondContact O-CD2 3.41Å; A90-L111 HydrophobicContact CB-CD2 3.96Å; I93-L111 HydrophobicContact CD1-CD1 3.67Å; I93-L111 HydrophobicContact CD1-CD2 3.71Å; I93-L111 HydrophobicContact CD1-CG 4.37Å; F108-L111 HydrophobicContact CB-CD1 3.98Å; F108-L111 HydrophobicContact CD1-CD1 3.81Å; F108-L111 HydrophobicContact CG-CD1 4.35Å; F108-L111 WeakPolarHBondContact O-CB 3.49Å; F108-L111 PolarHBondContact O-N 3.15Å; F108-L111 VanDerWaalsContact O-N 3.15Å; L111-I113 PolarHBondContact O-N 3.11Å; L111-I113 VanDerWaalsContact O-N 3.11Å; L111-L114 HydrophobicContact CB-CB 4.13Å; L111-L114 HydrophobicContact CD1-CD2 4.38Å; L111-L114 WeakPolarHBondContact O-CB 3.31Å; L111-L114 PolarHBondContact O-N 3.25Å; L111-L114 VanDerWaalsContact O-N 3.07Å; L111-G134 CarbonylContact C-O 3.45Å; L111-L135 HydrophobicContact CB-CD2 3.64Å; L111-L135 HydrophobicContact CD1-CD2 4.17Å
112	G	88.3	Confident	90.7	Very high	32 Å²	32	26.7 Å²	26.7	33%	0.33	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-20.9	-171.4	0	0	0	0	0	115.5	G110 G134 S137	G110-G112 PolarHBondContact O-N 3.13Å; G112-G134 WeakPolarHBondContact CA-O 3.48Å; G112-G134 PolarHBondContact N-O 2.84Å; G112-S137 WeakPolarHBondContact O-CB 3.44Å; G112-S137 PolarHBondContact O-N 2.73Å; G112-S137 PolarHBondContact O-OG 3.16Å
113	I	90.8	Very high	91	Very high	79 Å²	79	29.4 Å²	29.4	41%	0.405	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-3.4	177.8	76.4	175.2	0	0	0	114.1	N88 L111 K115	N88-I113 WeakPolarHBondContact O-CG1 3.26Å; L111-I113 PolarHBondContact O-N 3.11Å; L111-I113 VanDerWaalsContact O-N 3.11Å; I113-K115 PolarHBondContact O-N 2.92Å
114	L	93.9	Very high	91	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.161	C	C	.	.			trans	-61.3	124.3	-175.5	-168.4	82.4	0	0	0	110.5	A90 I93 L111 L117 L135 S137 L138	A90-L114 HydrophobicContact CB-CD1 3.9Å; A90-L114 WeakPolarHBondContact O-CA 3.44Å; A90-L114 WeakPolarHBondContact O-CD1 3.39Å; I93-L114 HydrophobicContact CB-CD1 4.09Å; I93-L114 HydrophobicContact CB-CD2 4.49Å; I93-L114 HydrophobicContact CD1-CD1 3.82Å; I93-L114 HydrophobicContact CD1-CD2 4.47Å; I93-L114 HydrophobicContact CG1-CD1 3.7Å; L111-L114 HydrophobicContact CB-CB 4.13Å; L111-L114 HydrophobicContact CD1-CD2 4.38Å; L111-L114 WeakPolarHBondContact O-CB 3.31Å; L111-L114 PolarHBondContact O-N 3.25Å; L111-L114 VanDerWaalsContact O-N 3.07Å; L114-L117 HydrophobicContact CD2-CB 4.06Å; L114-L117 HydrophobicContact CD2-CD1 4.41Å; L114-L135 HydrophobicContact CB-CD2 4.04Å; L114-L135 HydrophobicContact CD2-CD2 3.59Å; L114-L135 HydrophobicContact CG-CD2 4.43Å; L114-S137 CarbonylContact O-C 3.48Å; L114-L138 HydrophobicContact CD2-CD1 4.06Å; L114-L138 HydrophobicContact CG-CD1 4.33Å; L114-L138 WeakPolarHBondContact O-CA 3.14Å; L114-L138 PolarHBondContact O-N 3.49Å; L114-L138 VanDerWaalsContact O-N 3.14Å
115	K	88.2	Confident	91.1	Very high	80 Å²	80	30 Å²	30	35%	0.348	16%	0.164	S	C	.	.			trans	-96.6	-34.3	179.9	-76.5	171.8	160.3	-86.8	0	113	I91 I113 E139 Y140	I91-K115 HydrophobicContact CG2-CB 4.44Å; I91-K115 HydrophobicContact CG2-CD 4.21Å; I91-K115 PolarHBondContact O-N 3.18Å; I113-K115 PolarHBondContact O-N 2.92Å; K115-E139 WeakPolarHBondContact CG-OE2 3.41Å; K115-E139 IonicContact NZ-OE1 3.49Å; K115-E139 PolarHBondContact NZ-OE1 2.73Å; K115-E139 IonicContact NZ-OE2 3.99Å; K115-E139 PolarHBondContact NZ-OE2 2.94Å; K115-E139 PolarHBondContact O-N 3.16Å; K115-Y140 PolarHBondContact O-N 3.38Å
116	R	87.6	Confident	91.4	Very high	58 Å²	58	29.9 Å²	29.9	22%	0.219	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	127.3	-171.3	-61.3	167.7	-175.3	-146.3	15.5	111	I91 S92 I93 F118 D895 E898	I91-R116 PolarHBondContact O-N 2.83Å; S92-R116 WeakPolarHBondContact CA-O 3.27Å; I93-R116 PolarHBondContact N-O 2.95Å; R116-F118 HydrophobicContact CB-CE2 3.89Å; R116-F118 HydrophobicContact CB-CZ 4.38Å; R116-D895 WeakPolarHBondContact CD-OD2 3.35Å; R116-D895 WeakPolarHBondContact CG-OD2 3.34Å; R116-D895 IonicContact CZ-OD2 3.6Å; R116-D895 IonicContact NE-OD2 2.66Å; R116-D895 PolarHBondContact NE-OD2 3.29Å; R116-D895 IonicContact NH1-OD2 3.88Å; R116-D895 PolarHBondContact NH1-OD2 3.19Å; R116-E898 IonicContact CZ-OE2 3.83Å; R116-E898 IonicContact NH1-OE2 2.9Å; R116-E898 PolarHBondContact NH1-OE2 3.24Å; R116-E898 IonicContact NH2-OE2 3.41Å; R116-E898 PolarHBondContact NH2-OE2 2.96Å
117	L	94.9	Very high	91.8	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	123.6	177.2	179.1	58.8	0	0	0	110.9	I93 L95 F108 L114 L119 F132 L135 L138 Y140 L141 Q142	I93-L117 HydrophobicContact CB-CD1 4.33Å; I93-L117 HydrophobicContact CG2-CD1 4.19Å; L95-L117 HydrophobicContact CD1-CD1 4.29Å; F108-L117 HydrophobicContact CE1-CD1 4.46Å; F108-L117 HydrophobicContact CE1-CD2 4.37Å; F108-L117 HydrophobicContact CE2-CD2 4.3Å; F108-L117 HydrophobicContact CZ-CD2 4.06Å; L114-L117 HydrophobicContact CD2-CB 4.06Å; L114-L117 HydrophobicContact CD2-CD1 4.41Å; L117-L119 HydrophobicContact CD1-CD2 4.46Å; L117-L119 HydrophobicContact CD1-CG 4.4Å; L117-L119 HydrophobicContact CD2-CD1 4.17Å; L117-L119 HydrophobicContact CG-CD1 4.32Å; L117-L119 HydrophobicContact CG-CG 4.17Å; L117-F132 HydrophobicContact CD2-CD1 4.35Å; L117-F132 HydrophobicContact CD2-CE1 4.36Å; L117-L135 HydrophobicContact CD2-CD1 3.62Å; L117-L138 HydrophobicContact CB-CD1 3.72Å; L117-L138 HydrophobicContact CB-CD2 4.36Å; L117-Y140 PolarHBondContact N-O 3.49Å; L117-Y140 VanDerWaalsContact N-O 3.09Å; L117-L141 HydrophobicContact CB-CD1 4.16Å; L117-L141 HydrophobicContact CD2-CD1 4.05Å; L117-L141 HydrophobicContact CG-CD1 4.11Å; L117-Q142 PolarHBondContact O-N 2.84Å; L117-Q142 VanDerWaalsContact O-N 3.07Å
118	F	92.4	Very high	91.9	Very high	32 Å²	32	33.7 Å²	33.7	14%	0.14	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	123.4	178.9	-51.6	-101.7	0	0	0	110.1	I93 N94 L95 R116 Y140 Q142	I93-F118 PolarHBondContact O-N 3.5Å; I93-F118 VanDerWaalsContact O-N 3.07Å; N94-F118 HydrophobicContact CB-CB 4.22Å; N94-F118 HydrophobicContact CB-CD2 4.16Å; N94-F118 HydrophobicContact CB-CG 4.45Å; N94-F118 WeakPolarHBondContact OD1-CB 3.03Å; L95-F118 PolarHBondContact N-O 3.47Å; R116-F118 HydrophobicContact CB-CE2 3.89Å; R116-F118 HydrophobicContact CB-CZ 4.38Å; F118-Y140 AromaticContact CD1-CE1 3.86Å; F118-Y140 HydrophobicContact CD1-CE1 3.86Å; F118-Y140 HydrophobicContact CE1-CD1 4.14Å; F118-Y140 AromaticContact CE1-CE1 3.41Å; F118-Y140 HydrophobicContact CE1-CE1 3.41Å; F118-Y140 VanDerWaalsContact CE1-CE1 3.41Å; F118-Y140 HydrophobicContact CZ-CD1 4.2Å; F118-Y140 AromaticContact CZ-CE1 3.91Å; F118-Y140 HydrophobicContact CZ-CE1 3.91Å; F118-Q142 HydrophobicContact CD1-CB 4.36Å; F118-Q142 VanDerWaalsContact CD1-OE1 3.25Å
119	L	94.9	Very high	91.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.191	C	C	.	.			trans	-127.4	16.9	-179.5	-66	169.8	0	0	0	111.9	L95 L100 I103 L117 N122 L124 F132 L141 Q142 A143 N146	L95-L119 HydrophobicContact CB-CD2 4.05Å; L95-L119 HydrophobicContact CD1-CD2 4.25Å; L100-L119 HydrophobicContact CD2-CD2 4.12Å; I103-L119 HydrophobicContact CD1-CD1 4.47Å; L117-L119 HydrophobicContact CD1-CD2 4.46Å; L117-L119 HydrophobicContact CD1-CG 4.4Å; L117-L119 HydrophobicContact CD2-CD1 4.17Å; L117-L119 HydrophobicContact CG-CD1 4.32Å; L117-L119 HydrophobicContact CG-CG 4.17Å; L119-N122 WeakPolarHBondContact O-CB 3.29Å; L119-N122 PolarHBondContact O-ND2 2.04Å; L119-L124 HydrophobicContact CB-CD1 4.32Å; L119-L124 HydrophobicContact CD1-CD1 4.33Å; L119-F132 HydrophobicContact CD1-CE1 3.91Å; L119-F132 HydrophobicContact CD1-CZ 4.44Å; L119-L141 HydrophobicContact CD1-CD1 4.29Å; L119-Q142 PolarHBondContact N-O 3Å; L119-A143 HydrophobicContact CB-CB 4.15Å; L119-N146 PolarHBondContact O-ND2 3.12Å
120	H	90.6	Very high	91.8	Very high	16 Å²	16	37.8 Å²	37.8	7%	0.074	19%	0.194	C	C	.	.			trans	-61.8	159.6	-174.5	65.8	68.6	0	0	0	114.3	G96 N97 N122 Q142 D144 T892	G96-H120 CarbonylContact C-O 3.36Å; G96-H120 WeakPolarHBondContact CA-O 3.38Å; N97-H120 PolarHBondContact N-O 3.23Å; H120-N122 VanDerWaalsContact C-N 3.26Å; H120-N122 PolarHBondContact O-N 3.15Å; H120-N122 PolarHBondContact O-ND2 3.27Å; H120-Q142 HydrophobicContact CB-CG 4.34Å; H120-D144 VanDerWaalsContact CA-O 3.28Å; H120-D144 WeakPolarHBondContact CA-O 3.47Å; H120-D144 VanDerWaalsContact CB-OD1 3.22Å; H120-D144 WeakPolarHBondContact CB-OD1 3.33Å; H120-T892 HydrophobicContact CB-CG2 4.29Å; H120-T892 WeakPolarHBondContact ND1-CG2 3.36Å
121	E	89.4	Confident	92.2	Very high	19 Å²	19	36.3 Å²	36.3	9%	0.089	18%	0.178	C	C	.	.	S	Bend	trans	52.3	38.6	176.2	-60.6	-171.1	166.9	0	0	113.5	N97 D144 Y145 R522 K889 L890 T892	N97-E121 WeakPolarHBondContact CA-O 3.37Å; N97-E121 HydrophobicContact CB-CB 4.12Å; N97-E121 PolarHBondContact ND2-OE2 2.84Å; E121-D144 PolarHBondContact N-O 3.02Å; E121-D144 VanDerWaalsContact N-O 3.12Å; E121-Y145 CarbonylContact C-O 3.22Å; E121-Y145 WeakPolarHBondContact CA-O 3.43Å; E121-Y145 PolarHBondContact N-O 3Å; E121-R522 IonicContact OE1-NH2 3.19Å; E121-R522 PolarHBondContact OE1-NH2 2.58Å; E121-K889 WeakPolarHBondContact OE1-CA 3.26Å; E121-L890 PolarHBondContact OE1-N 2.8Å; E121-T892 HydrophobicContact CG-CG2 3.95Å
122	N	94	Very high	92.4	Very high	7 Å²	7	36.4 Å²	36.4	4%	0.037	18%	0.179	C	C	.	.			trans	-112.7	-174.9	-179.7	-85.1	-58.3	0	0	0	112.2	L95 N98 A99 L100 L119 H120 L124 Y145 N146	L95-N122 PolarHBondContact O-ND2 3.48Å; N98-N122 WeakPolarHBondContact CA-OD1 3.29Å; N98-N122 WeakPolarHBondContact CB-OD1 3.13Å; N98-N122 PolarHBondContact N-OD1 3.3Å; A99-N122 PolarHBondContact N-OD1 2.87Å; A99-N122 VanDerWaalsContact N-OD1 3.1Å; L100-N122 HydrophobicContact CB-CB 4.27Å; L100-N122 WeakPolarHBondContact CB-OD1 3.5Å; L100-N122 PolarHBondContact N-OD1 2.94Å; L119-N122 WeakPolarHBondContact O-CB 3.29Å; L119-N122 PolarHBondContact O-ND2 2.04Å; H120-N122 VanDerWaalsContact C-N 3.26Å; H120-N122 PolarHBondContact O-N 3.15Å; H120-N122 PolarHBondContact O-ND2 3.27Å; N122-L124 HydrophobicContact CB-CG 4.45Å; N122-Y145 PolarHBondContact N-O 3.39Å; N122-N146 WeakPolarHBondContact CA-OD1 3.38Å; N122-N146 WeakPolarHBondContact CB-OD1 3.24Å; N122-N146 PolarHBondContact N-ND2 2.64Å; N122-N146 PolarHBondContact O-OD1 3.43Å
123	K	94.8	Very high	92.5	Very high	88 Å²	88	38 Å²	38	38%	0.383	18%	0.179	S	C	.	.			trans	-117.2	31.3	-175	-62.1	-169	175.2	-171.9	0	112.4	A99 L100 Q101 E885	A99-K123 HydrophobicContact CB-CD 4.36Å; L100-K123 CarbonylContact O-C 3.56Å; L100-K123 VanDerWaalsContact O-CA 3.29Å; L100-K123 WeakPolarHBondContact O-CA 3.47Å; L100-K123 PolarHBondContact O-N 3.21Å; Q101-K123 HydrophobicContact CG-CB 4.09Å; K123-E885 IonicContact NZ-OE1 3.2Å; K123-E885 PolarHBondContact NZ-OE1 2.88Å
124	L	95.4	Very high	92.4	Very high	4 Å²	4	35 Å²	35	2%	0.021	17%	0.167	C	C	.	.			trans	-72.3	127.7	-179.2	-63.2	172.4	0	0	0	111.7	L100 I103 L119 N122 F127 N146 V147 I148	L100-L124 HydrophobicContact CD2-CD2 4.15Å; L100-L124 HydrophobicContact CG-CD2 3.84Å; L100-L124 PolarHBondContact O-N 3.18Å; I103-L124 HydrophobicContact CD1-CD1 4.16Å; I103-L124 HydrophobicContact CD1-CD2 3.93Å; I103-L124 HydrophobicContact CG1-CD2 3.88Å; L119-L124 HydrophobicContact CB-CD1 4.32Å; L119-L124 HydrophobicContact CD1-CD1 4.33Å; N122-L124 HydrophobicContact CB-CG 4.45Å; L124-F127 HydrophobicContact CD1-CE1 4.11Å; L124-N146 VanDerWaalsContact CB-OD1 3.31Å; L124-N146 WeakPolarHBondContact CB-OD1 3.29Å; L124-N146 WeakPolarHBondContact CG-OD1 3.46Å; L124-N146 PolarHBondContact N-OD1 2.96Å; L124-N146 VanDerWaalsContact N-OD1 3.17Å; L124-V147 CarbonylContact O-C 3.52Å; L124-V147 WeakPolarHBondContact O-CG2 3.16Å; L124-V147 PolarHBondContact O-N 2.62Å; L124-I148 HydrophobicContact CB-CG1 4.43Å; L124-I148 WeakPolarHBondContact O-CG1 3.45Å; L124-I148 PolarHBondContact O-N 3.37Å; L124-I148 VanDerWaalsContact O-N 3.11Å
125	E	93.5	Very high	92.5	Very high	89 Å²	89	35 Å²	35	42%	0.416	17%	0.167	S	C	.	.			trans	-98.5	-29.8	179.8	-66.3	-150	170.5	0	0	115.5	V147 I148 K149	E125-V147 HydrophobicContact CG-CG2 3.94Å; E125-I148 CarbonylContact O-C 3.44Å; E125-I148 WeakPolarHBondContact O-CA 3.23Å; E125-K149 PolarHBondContact O-N 3.17Å; E125-K149 IonicContact OE1-NZ 3.01Å; E125-K149 PolarHBondContact OE1-NZ 3.41Å; E125-K149 WeakPolarHBondContact OE2-CE 3.22Å; E125-K149 IonicContact OE2-NZ 2.79Å; E125-K149 PolarHBondContact OE2-NZ 2.92Å
126	V	93.8	Very high	92.6	Very high	42 Å²	42	37 Å²	37	26%	0.255	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	132.2	-170.6	-176.3	0	0	0	0	111.2	R128 R150	V126-R128 HydrophobicContact CG1-CG 4.14Å; V126-R150 WeakPolarHBondContact CA-O 3.35Å; V126-R150 HydrophobicContact CG1-CB 4.31Å; V126-R150 HydrophobicContact CG2-CB 4.41Å
127	F	95.3	Very high	92.9	Very high	1 Å²	1	35.1 Å²	35.1	0%	0.004	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	115.4	163.2	-70.1	-7.2	0	0	0	109.8	L124 T131 F132 A143 I148 R150 I151 E152 A155 F156 L167	L124-F127 HydrophobicContact CD1-CE1 4.11Å; F127-T131 HydrophobicContact CD1-CG2 4.49Å; F127-F132 HydrophobicContact CB-CE2 4.27Å; F127-F132 HydrophobicContact CD1-CE2 4.18Å; F127-F132 HydrophobicContact CD1-CZ 4.08Å; F127-F132 AromaticContact CD2-CE2 3.66Å; F127-F132 HydrophobicContact CD2-CE2 3.66Å; F127-F132 AromaticContact CD2-CZ 3.95Å; F127-F132 HydrophobicContact CD2-CZ 3.95Å; F127-F132 HydrophobicContact CE1-CE2 4.41Å; F127-F132 AromaticContact CE1-CZ 3.89Å; F127-F132 HydrophobicContact CE1-CZ 3.89Å; F127-F132 AromaticContact CE2-CE2 3.91Å; F127-F132 HydrophobicContact CE2-CE2 3.91Å; F127-F132 AromaticContact CE2-CZ 3.73Å; F127-F132 HydrophobicContact CE2-CZ 3.73Å; F127-F132 AromaticContact CG-CE2 3.79Å; F127-F132 HydrophobicContact CG-CE2 3.79Å; F127-F132 HydrophobicContact CG-CZ 4.11Å; F127-F132 HydrophobicContact CZ-CE2 4.28Å; F127-F132 AromaticContact CZ-CZ 3.7Å; F127-F132 HydrophobicContact CZ-CZ 3.7Å; F127-A143 HydrophobicContact CE2-CB 4.47Å; F127-A143 HydrophobicContact CZ-CB 3.73Å; F127-I148 HydrophobicContact CD1-CD1 4.21Å; F127-I148 HydrophobicContact CD2-CD1 4.44Å; F127-I148 HydrophobicContact CE1-CD1 3.54Å; F127-I148 HydrophobicContact CE1-CG1 4.19Å; F127-I148 HydrophobicContact CE2-CD1 3.83Å; F127-I148 HydrophobicContact CZ-CD1 3.33Å; F127-I148 HydrophobicContact CZ-CG1 4.43Å; F127-R150 PolarHBondContact N-O 2.78Å; F127-R150 VanDerWaalsContact N-O 3.08Å; F127-I151 HydrophobicContact CB-CB 4.48Å; F127-I151 HydrophobicContact CB-CG1 4.25Å; F127-I151 HydrophobicContact CB-CG2 4.18Å; F127-I151 HydrophobicContact CD2-CD1 4.23Å; F127-I151 HydrophobicContact CD2-CG1 4.21Å; F127-E152 PolarHBondContact O-N 2.79Å; F127-A155 HydrophobicContact CB-CB 4.15Å; F127-F156 HydrophobicContact CD2-CE1 4Å; F127-F156 HydrophobicContact CD2-CZ 4.13Å; F127-F156 HydrophobicContact CE2-CE1 4.32Å; F127-F156 HydrophobicContact CE2-CZ 4.41Å; F127-L167 HydrophobicContact CE2-CD2 3.87Å; F127-L167 HydrophobicContact CZ-CD2 4.44Å
128	R	93.9	Very high	92.9	Very high	82 Å²	82	35.1 Å²	35.1	31%	0.309	17%	0.174	S	C	.	.			trans	-91.2	164.6	179.5	-55.2	179.6	-171.4	98.8	-1.6	110.8	D102 I103 V126 D130 T131 E152 A155	D102-R128 IonicContact OD1-CZ 2.67Å; D102-R128 VanDerWaalsContact OD1-CZ 3.28Å; D102-R128 IonicContact OD1-NH1 2.68Å; D102-R128 PolarHBondContact OD1-NH1 3.43Å; D102-R128 IonicContact OD1-NH2 3.78Å; D102-R128 PolarHBondContact OD1-NH2 3.26Å; I103-R128 PolarHBondContact O-NH1 3.07Å; V126-R128 HydrophobicContact CG1-CG 4.14Å; R128-D130 VanDerWaalsContact CB-OD1 3.24Å; R128-D130 WeakPolarHBondContact CB-OD1 3.46Å; R128-D130 PolarHBondContact O-N 2.97Å; R128-T131 WeakPolarHBondContact CB-OG1 3.24Å; R128-T131 PolarHBondContact N-OG1 2.02Å; R128-T131 PolarHBondContact O-N 3.38Å; R128-T131 PolarHBondContact O-OG1 3.12Å; R128-E152 VanDerWaalsContact CA-OE2 3.29Å; R128-E152 WeakPolarHBondContact CA-OE2 3.25Å; R128-A155 WeakPolarHBondContact O-CA 3.3Å; R128-A155 WeakPolarHBondContact O-CB 3.35Å
129	N	90.8	Very high	92.8	Very high	71 Å²	71	34.6 Å²	34.6	38%	0.38	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-20.1	178.1	-63.3	-51.7	0	0	0	114.9	E152 G154	N129-E152 PolarHBondContact N-OE2 2.77Å; N129-E152 PolarHBondContact ND2-OE2 2.91Å; N129-E152 WeakPolarHBondContact OD1-CB 3.48Å; N129-G154 WeakPolarHBondContact OD1-CA 3.09Å; N129-G154 PolarHBondContact OD1-N 3.06Å
130	D	89.9	Confident	92.6	Very high	60 Å²	60	34.6 Å²	34.6	32%	0.321	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.9	0.4	-174.4	52.3	13.9	0	0	0	113.8	A105 G106 R128 F132 L133	A105-D130 HydrophobicContact CB-CB 3.89Å; A105-D130 VanDerWaalsContact CB-CG 3.48Å; A105-D130 VanDerWaalsContact CB-OD2 3.24Å; A105-D130 WeakPolarHBondContact CB-OD2 3.33Å; G106-D130 PolarHBondContact N-O 2.97Å; R128-D130 VanDerWaalsContact CB-OD1 3.24Å; R128-D130 WeakPolarHBondContact CB-OD1 3.46Å; R128-D130 PolarHBondContact O-N 2.97Å; D130-F132 VanDerWaalsContact C-N 3.28Å; D130-F132 PolarHBondContact O-N 3.48Å; D130-L133 WeakPolarHBondContact O-CB 3.49Å; D130-L133 PolarHBondContact O-N 3.09Å
131	T	92.5	Very high	92.8	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.012	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-35.5	-178.6	-66.9	0	0	0	0	112.8	I103 F108 F127 R128	I103-T131 HydrophobicContact CB-CG2 4.16Å; I103-T131 HydrophobicContact CD1-CG2 4.17Å; I103-T131 HydrophobicContact CG2-CG2 4.16Å; F108-T131 VanDerWaalsContact CD2-O 3.23Å; F108-T131 WeakPolarHBondContact CD2-O 3.45Å; F108-T131 WeakPolarHBondContact CE2-O 3.33Å; F127-T131 HydrophobicContact CD1-CG2 4.49Å; R128-T131 WeakPolarHBondContact CB-OG1 3.24Å; R128-T131 PolarHBondContact N-OG1 2.02Å; R128-T131 PolarHBondContact O-N 3.38Å; R128-T131 PolarHBondContact O-OG1 3.12Å
132	F	94.6	Very high	92.9	Very high	3 Å²	3	33 Å²	33	1%	0.013	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.1	24.7	-179.1	-55.5	-73.9	0	0	0	113	F108 L117 L119 F127 D130 L135 L141 F156 L159	F108-F132 HydrophobicContact CE2-CD1 4.23Å; L117-F132 HydrophobicContact CD2-CD1 4.35Å; L117-F132 HydrophobicContact CD2-CE1 4.36Å; L119-F132 HydrophobicContact CD1-CE1 3.91Å; L119-F132 HydrophobicContact CD1-CZ 4.44Å; F127-F132 HydrophobicContact CB-CE2 4.27Å; F127-F132 HydrophobicContact CD1-CE2 4.18Å; F127-F132 HydrophobicContact CD1-CZ 4.08Å; F127-F132 AromaticContact CD2-CE2 3.66Å; F127-F132 HydrophobicContact CD2-CE2 3.66Å; F127-F132 AromaticContact CD2-CZ 3.95Å; F127-F132 HydrophobicContact CD2-CZ 3.95Å; F127-F132 HydrophobicContact CE1-CE2 4.41Å; F127-F132 AromaticContact CE1-CZ 3.89Å; F127-F132 HydrophobicContact CE1-CZ 3.89Å; F127-F132 AromaticContact CE2-CE2 3.91Å; F127-F132 HydrophobicContact CE2-CE2 3.91Å; F127-F132 AromaticContact CE2-CZ 3.73Å; F127-F132 HydrophobicContact CE2-CZ 3.73Å; F127-F132 AromaticContact CG-CE2 3.79Å; F127-F132 HydrophobicContact CG-CE2 3.79Å; F127-F132 HydrophobicContact CG-CZ 4.11Å; F127-F132 HydrophobicContact CZ-CE2 4.28Å; F127-F132 AromaticContact CZ-CZ 3.7Å; F127-F132 HydrophobicContact CZ-CZ 3.7Å; D130-F132 VanDerWaalsContact C-N 3.28Å; D130-F132 PolarHBondContact O-N 3.48Å; F132-L135 HydrophobicContact CB-CD1 4.17Å; F132-L135 HydrophobicContact CD1-CD1 4Å; F132-L135 PolarHBondContact O-N 3.37Å; F132-L141 HydrophobicContact CD1-CD2 4.46Å; F132-L141 HydrophobicContact CE1-CD1 4.02Å; F132-L141 HydrophobicContact CE1-CD2 3.99Å; F132-L141 HydrophobicContact CE2-CD2 4.32Å; F132-L141 HydrophobicContact CZ-CD2 3.91Å; F132-F156 HydrophobicContact CD2-CD1 4.18Å; F132-F156 HydrophobicContact CD2-CE1 4.23Å; F132-F156 HydrophobicContact CE2-CD1 4.28Å; F132-F156 AromaticContact CE2-CE1 3.86Å; F132-F156 HydrophobicContact CE2-CE1 3.86Å; F132-L159 HydrophobicContact CB-CD1 4.14Å; F132-L159 HydrophobicContact CB-CD2 3.99Å; F132-L159 HydrophobicContact CB-CG 4.38Å; F132-L159 HydrophobicContact CD2-CD1 4.48Å; F132-L159 HydrophobicContact CG-CD1 4.3Å
133	L	92.1	Very high	92.9	Very high	65 Å²	65	32.7 Å²	32.7	34%	0.34	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	133.8	174.8	-172.7	66.9	0	0	0	110.5	D130	D130-L133 WeakPolarHBondContact O-CB 3.49Å; D130-L133 PolarHBondContact O-N 3.09Å
134	G	88.8	Confident	92.6	Very high	15 Å²	15	28.5 Å²	28.5	16%	0.155	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	98.1	-11.7	-175.8	0	0	0	0	0	115.5	L111 G112 E136	L111-G134 CarbonylContact C-O 3.45Å; G112-G134 WeakPolarHBondContact CA-O 3.48Å; G112-G134 PolarHBondContact N-O 2.84Å; G134-E136 PolarHBondContact O-N 2.85Å
135	L	94.1	Very high	92.3	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.148	C	C	.	.			trans	-96.7	46.2	-172.5	-64.1	178	0	0	0	114.2	F108 L111 L114 L117 F132 S137 L138 L159	F108-L135 HydrophobicContact CB-CD1 4.01Å; F108-L135 HydrophobicContact CB-CD2 3.91Å; F108-L135 HydrophobicContact CB-CG 3.77Å; F108-L135 HydrophobicContact CD2-CD1 3.72Å; F108-L135 HydrophobicContact CD2-CG 4.4Å; F108-L135 HydrophobicContact CE2-CD1 4.31Å; F108-L135 HydrophobicContact CG-CD1 3.87Å; F108-L135 HydrophobicContact CG-CD2 4.4Å; F108-L135 HydrophobicContact CG-CG 4.21Å; L111-L135 HydrophobicContact CB-CD2 3.64Å; L111-L135 HydrophobicContact CD1-CD2 4.17Å; L114-L135 HydrophobicContact CB-CD2 4.04Å; L114-L135 HydrophobicContact CD2-CD2 3.59Å; L114-L135 HydrophobicContact CG-CD2 4.43Å; L117-L135 HydrophobicContact CD2-CD1 3.62Å; F132-L135 HydrophobicContact CB-CD1 4.17Å; F132-L135 HydrophobicContact CD1-CD1 4Å; F132-L135 PolarHBondContact O-N 3.37Å; L135-S137 VanDerWaalsContact C-N 3.26Å; L135-S137 PolarHBondContact O-N 2.91Å; L135-L138 HydrophobicContact CB-CB 4.24Å; L135-L138 HydrophobicContact CD1-CD2 4.39Å; L135-L138 WeakPolarHBondContact O-CB 3.16Å; L135-L138 PolarHBondContact O-N 3.06Å; L135-L159 HydrophobicContact CB-CD2 3.75Å; L135-L159 VanDerWaalsContact O-CD2 3.28Å; L135-L159 WeakPolarHBondContact O-CD2 3.24Å
136	E	90.9	Very high	92.3	Very high	123 Å²	123	25.5 Å²	25.5	58%	0.575	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	-25.5	-171.6	-63	-178.9	-167.2	0	0	114.4	G134	G134-E136 PolarHBondContact O-N 2.85Å
137	S	94.3	Very high	92.3	Very high	18 Å²	18	25.9 Å²	25.9	13%	0.126	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	4.9	177.8	-64	0	0	0	0	115.2	G112 L114 L135 E139 K161	G112-S137 WeakPolarHBondContact O-CB 3.44Å; G112-S137 PolarHBondContact O-N 2.73Å; G112-S137 PolarHBondContact O-OG 3.16Å; L114-S137 CarbonylContact O-C 3.48Å; L135-S137 VanDerWaalsContact C-N 3.26Å; L135-S137 PolarHBondContact O-N 2.91Å; S137-E139 PolarHBondContact O-N 3.24Å; S137-K161 PolarHBondContact OG-NZ 3.07Å
138	L	95.7	Very high	92.4	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.132	C	C	.	.			trans	-66.5	126.2	-172.8	-162.3	74.4	0	0	0	111.8	L114 L117 L135 L141 L159 K161 L162	L114-L138 HydrophobicContact CD2-CD1 4.06Å; L114-L138 HydrophobicContact CG-CD1 4.33Å; L114-L138 WeakPolarHBondContact O-CA 3.14Å; L114-L138 PolarHBondContact O-N 3.49Å; L114-L138 VanDerWaalsContact O-N 3.14Å; L117-L138 HydrophobicContact CB-CD1 3.72Å; L117-L138 HydrophobicContact CB-CD2 4.36Å; L135-L138 HydrophobicContact CB-CB 4.24Å; L135-L138 HydrophobicContact CD1-CD2 4.39Å; L135-L138 WeakPolarHBondContact O-CB 3.16Å; L135-L138 PolarHBondContact O-N 3.06Å; L138-L141 HydrophobicContact CD2-CB 3.97Å; L138-L141 HydrophobicContact CD2-CD1 4.29Å; L138-L141 HydrophobicContact CD2-CD2 4.5Å; L138-L141 HydrophobicContact CD2-CG 4.48Å; L138-L159 HydrophobicContact CB-CD2 4.24Å; L138-L159 HydrophobicContact CD2-CD1 4.36Å; L138-L159 HydrophobicContact CD2-CD2 4.26Å; L138-K161 CarbonylContact O-C 3.53Å; L138-L162 HydrophobicContact CD2-CD1 4.26Å; L138-L162 HydrophobicContact CG-CD1 4.36Å; L138-L162 VanDerWaalsContact O-CA 3.22Å; L138-L162 WeakPolarHBondContact O-CA 3.02Å; L138-L162 PolarHBondContact O-N 3.17Å
139	E	89.3	Confident	92.3	Very high	21 Å²	21	26.1 Å²	26.1	10%	0.098	14%	0.136	C	C	.	.			trans	-108	-36.2	-178.2	-72.1	164.6	179.7	0	0	111.2	K115 S137 K161 R163 V164 L897	K115-E139 WeakPolarHBondContact CG-OE2 3.41Å; K115-E139 IonicContact NZ-OE1 3.49Å; K115-E139 PolarHBondContact NZ-OE1 2.73Å; K115-E139 IonicContact NZ-OE2 3.99Å; K115-E139 PolarHBondContact NZ-OE2 2.94Å; K115-E139 PolarHBondContact O-N 3.16Å; S137-E139 PolarHBondContact O-N 3.24Å; E139-K161 HydrophobicContact CG-CB 3.98Å; E139-R163 PolarHBondContact O-N 3.39Å; E139-V164 PolarHBondContact O-N 3.13Å; E139-V164 VanDerWaalsContact O-N 3.14Å; E139-L897 VanDerWaalsContact C-CD1 3.4Å; E139-L897 HydrophobicContact CB-CD1 3.65Å; E139-L897 HydrophobicContact CB-CD2 3.81Å; E139-L897 HydrophobicContact CB-CG 4.39Å; E139-L897 HydrophobicContact CG-CD2 4.33Å; E139-L897 VanDerWaalsContact O-CD1 3.23Å; E139-L897 WeakPolarHBondContact O-CD1 3.48Å
140	Y	89.8	Confident	92.4	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	127	179.3	-178.1	-89.4	0	0	0	111.5	K115 L117 F118 Q142 V164 I166 P894 D895	K115-Y140 PolarHBondContact O-N 3.38Å; L117-Y140 PolarHBondContact N-O 3.49Å; L117-Y140 VanDerWaalsContact N-O 3.09Å; F118-Y140 AromaticContact CD1-CE1 3.86Å; F118-Y140 HydrophobicContact CD1-CE1 3.86Å; F118-Y140 HydrophobicContact CE1-CD1 4.14Å; F118-Y140 AromaticContact CE1-CE1 3.41Å; F118-Y140 HydrophobicContact CE1-CE1 3.41Å; F118-Y140 VanDerWaalsContact CE1-CE1 3.41Å; F118-Y140 HydrophobicContact CZ-CD1 4.2Å; F118-Y140 AromaticContact CZ-CE1 3.91Å; F118-Y140 HydrophobicContact CZ-CE1 3.91Å; Y140-Q142 HydrophobicContact CD1-CB 4.41Å; Y140-Q142 HydrophobicContact CE1-CB 3.51Å; Y140-Q142 PolarHBondContact OH-OE1 2.79Å; Y140-V164 HydrophobicContact CD2-CB 3.62Å; Y140-V164 HydrophobicContact CD2-CG1 3.52Å; Y140-V164 HydrophobicContact CD2-CG2 4.22Å; Y140-V164 HydrophobicContact CE2-CB 4.22Å; Y140-V164 HydrophobicContact CE2-CG1 3.58Å; Y140-V164 HydrophobicContact CG-CB 4.47Å; Y140-I166 HydrophobicContact CE2-CD1 4Å; Y140-I166 VanDerWaalsContact OH-CD1 3.32Å; Y140-I166 WeakPolarHBondContact OH-CD1 3.1Å; Y140-P894 PolarHBondContact OH-O 3.02Å; Y140-D895 HydrophobicContact CD2-CB 4.46Å; Y140-D895 VanDerWaalsContact CD2-OD1 3.24Å; Y140-D895 WeakPolarHBondContact CD2-OD1 3.48Å; Y140-D895 HydrophobicContact CE2-CB 4.15Å
141	L	95.4	Very high	92.6	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	122.9	172.1	179.5	58.2	0	0	0	110.8	L117 L119 F132 L138 F156 L159 L162 V164 L165 I166	L117-L141 HydrophobicContact CB-CD1 4.16Å; L117-L141 HydrophobicContact CD2-CD1 4.05Å; L117-L141 HydrophobicContact CG-CD1 4.11Å; L119-L141 HydrophobicContact CD1-CD1 4.29Å; F132-L141 HydrophobicContact CD1-CD2 4.46Å; F132-L141 HydrophobicContact CE1-CD1 4.02Å; F132-L141 HydrophobicContact CE1-CD2 3.99Å; F132-L141 HydrophobicContact CE2-CD2 4.32Å; F132-L141 HydrophobicContact CZ-CD2 3.91Å; L138-L141 HydrophobicContact CD2-CB 3.97Å; L138-L141 HydrophobicContact CD2-CD1 4.29Å; L138-L141 HydrophobicContact CD2-CD2 4.5Å; L138-L141 HydrophobicContact CD2-CG 4.48Å; L141-F156 HydrophobicContact CD2-CE1 4.12Å; L141-L159 HydrophobicContact CD2-CD1 4.32Å; L141-L162 HydrophobicContact CB-CD1 3.74Å; L141-V164 PolarHBondContact N-O 2.72Å; L141-L165 HydrophobicContact CB-CD1 4.2Å; L141-L165 HydrophobicContact CD2-CD1 3.97Å; L141-L165 HydrophobicContact CG-CD1 4.14Å; L141-L165 WeakPolarHBondContact O-CA 3.44Å; L141-I166 PolarHBondContact O-N 3.08Å
142	Q	91.9	Very high	92.7	Very high	2 Å²	2	29.7 Å²	29.7	1%	0.009	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	124.6	175.8	174.8	173.3	5.7	0	0	111.4	L117 F118 L119 H120 Y140 D144 I166 K893	L117-Q142 PolarHBondContact O-N 2.84Å; L117-Q142 VanDerWaalsContact O-N 3.07Å; F118-Q142 HydrophobicContact CD1-CB 4.36Å; F118-Q142 VanDerWaalsContact CD1-OE1 3.25Å; L119-Q142 PolarHBondContact N-O 3Å; H120-Q142 HydrophobicContact CB-CG 4.34Å; Y140-Q142 HydrophobicContact CD1-CB 4.41Å; Y140-Q142 HydrophobicContact CE1-CB 3.51Å; Y140-Q142 PolarHBondContact OH-OE1 2.79Å; Q142-D144 WeakPolarHBondContact CG-OD1 3.35Å; Q142-D144 PolarHBondContact NE2-OD1 3.24Å; Q142-D144 PolarHBondContact NE2-OD2 3.19Å; Q142-I166 HydrophobicContact CB-CB 4.31Å; Q142-I166 HydrophobicContact CG-CB 4.22Å; Q142-I166 HydrophobicContact CG-CG2 4.31Å; Q142-K893 PolarHBondContact NE2-O 3.24Å; Q142-K893 PolarHBondContact OE1-O 3.48Å
143	A	94.8	Very high	92.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.162	C	C	.	.			trans	-144.6	40	176.6	0	0	0	0	0	111.8	L119 F127 I148 I166 L167 N170	L119-A143 HydrophobicContact CB-CB 4.15Å; F127-A143 HydrophobicContact CE2-CB 4.47Å; F127-A143 HydrophobicContact CZ-CB 3.73Å; A143-I148 HydrophobicContact CB-CD1 4.42Å; A143-I166 PolarHBondContact N-O 3.23Å; A143-L167 HydrophobicContact CB-CD2 4.15Å; A143-N170 PolarHBondContact O-ND2 2.79Å
144	D	88.7	Confident	92.4	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.152	C	C	.	.			trans	-65.9	162.1	170.3	54.4	-28	0	0	0	112.2	H120 E121 Q142 N146 I166 N168	H120-D144 VanDerWaalsContact CA-O 3.28Å; H120-D144 WeakPolarHBondContact CA-O 3.47Å; H120-D144 VanDerWaalsContact CB-OD1 3.22Å; H120-D144 WeakPolarHBondContact CB-OD1 3.33Å; E121-D144 PolarHBondContact N-O 3.02Å; E121-D144 VanDerWaalsContact N-O 3.12Å; Q142-D144 WeakPolarHBondContact CG-OD1 3.35Å; Q142-D144 PolarHBondContact NE2-OD1 3.24Å; Q142-D144 PolarHBondContact NE2-OD2 3.19Å; D144-N146 PolarHBondContact O-N 3.35Å; D144-N146 PolarHBondContact O-ND2 2.99Å; D144-I166 HydrophobicContact CB-CG2 4.09Å; D144-N168 VanDerWaalsContact CA-O 3.28Å; D144-N168 WeakPolarHBondContact CA-O 3.34Å; D144-N168 WeakPolarHBondContact CB-ND2 3.01Å; D144-N168 WeakPolarHBondContact CB-O 3.34Å; D144-N168 WeakPolarHBondContact CB-OD1 3.01Å
145	Y	88.4	Confident	92.7	Very high	23 Å²	23	29.3 Å²	29.3	9%	0.09	15%	0.145	C	C	.	.	S	Bend	trans	53.7	50.6	178.4	-79	-102.1	0	0	0	112.8	E121 N122 N168 D169 R887 A888 L890 Q891	E121-Y145 CarbonylContact C-O 3.22Å; E121-Y145 WeakPolarHBondContact CA-O 3.43Å; E121-Y145 PolarHBondContact N-O 3Å; N122-Y145 PolarHBondContact N-O 3.39Å; Y145-N168 PolarHBondContact N-O 3.11Å; Y145-D169 HydrophobicContact CD2-CB 3.63Å; Y145-D169 HydrophobicContact CE1-CB 4.32Å; Y145-D169 HydrophobicContact CE2-CB 3.28Å; Y145-D169 WeakPolarHBondContact CE2-OD2 3.31Å; Y145-D169 HydrophobicContact CG-CB 4.22Å; Y145-D169 PolarHBondContact OH-OD1 2.84Å; Y145-R887 WeakPolarHBondContact CE1-O 3.46Å; Y145-A888 WeakPolarHBondContact CD1-O 3.45Å; Y145-L890 HydrophobicContact CE1-CB 3.91Å; Y145-Q891 HydrophobicContact CD2-CB 3.7Å; Y145-Q891 HydrophobicContact CD2-CG 4.39Å; Y145-Q891 VanDerWaalsContact CD2-N 3.35Å; Y145-Q891 WeakPolarHBondContact CD2-O 3.47Å; Y145-Q891 HydrophobicContact CE2-CB 3.23Å; Y145-Q891 HydrophobicContact CE2-CG 3.43Å; Y145-Q891 VanDerWaalsContact CE2-CG 3.43Å; Y145-Q891 VanDerWaalsContact CZ-N 3.25Å; Y145-Q891 PolarHBondContact OH-NE2 2.9Å
146	N	93.3	Very high	92.7	Very high	7 Å²	7	29.3 Å²	29.3	4%	0.037	15%	0.145	C	C	.	.	S	Bend	trans	-123.5	-178.9	173.9	-88.1	-97.5	0	0	0	109.7	L119 N122 L124 D144 I148 N170	L119-N146 PolarHBondContact O-ND2 3.12Å; N122-N146 WeakPolarHBondContact CA-OD1 3.38Å; N122-N146 WeakPolarHBondContact CB-OD1 3.24Å; N122-N146 PolarHBondContact N-ND2 2.64Å; N122-N146 PolarHBondContact O-OD1 3.43Å; L124-N146 VanDerWaalsContact CB-OD1 3.31Å; L124-N146 WeakPolarHBondContact CB-OD1 3.29Å; L124-N146 WeakPolarHBondContact CG-OD1 3.46Å; L124-N146 PolarHBondContact N-OD1 2.96Å; L124-N146 VanDerWaalsContact N-OD1 3.17Å; D144-N146 PolarHBondContact O-N 3.35Å; D144-N146 PolarHBondContact O-ND2 2.99Å; N146-I148 HydrophobicContact CB-CD1 4.21Å; N146-I148 HydrophobicContact CB-CG1 4.05Å; N146-N170 WeakPolarHBondContact CA-OD1 3.38Å; N146-N170 WeakPolarHBondContact CB-OD1 3.39Å; N146-N170 PolarHBondContact O-OD1 3.37Å
147	V	94.6	Very high	92.7	Very high	51 Å²	51	31.1 Å²	31.1	31%	0.309	15%	0.146	S	C	.	.			trans	-111.1	34.7	-179.9	-70.4	0	0	0	0	111.7	L124 E125 K149 L171	L124-V147 CarbonylContact O-C 3.52Å; L124-V147 WeakPolarHBondContact O-CG2 3.16Å; L124-V147 PolarHBondContact O-N 2.62Å; E125-V147 HydrophobicContact CG-CG2 3.94Å; V147-K149 WeakPolarHBondContact O-CG 3.17Å; V147-K149 PolarHBondContact O-N 3.12Å; V147-K149 VanDerWaalsContact O-N 3.08Å; V147-L171 HydrophobicContact CB-CD1 4.22Å; V147-L171 HydrophobicContact CG1-CD1 4.38Å
148	I	95.9	Very high	92.5	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	15%	0.152	C	C	.	.			trans	-66.9	111.9	-173.5	-58.8	164.6	0	0	0	109.6	L124 E125 F127 A143 N146 I151 L167 N170 L171 I172	L124-I148 HydrophobicContact CB-CG1 4.43Å; L124-I148 WeakPolarHBondContact O-CG1 3.45Å; L124-I148 PolarHBondContact O-N 3.37Å; L124-I148 VanDerWaalsContact O-N 3.11Å; E125-I148 CarbonylContact O-C 3.44Å; E125-I148 WeakPolarHBondContact O-CA 3.23Å; F127-I148 HydrophobicContact CD1-CD1 4.21Å; F127-I148 HydrophobicContact CD2-CD1 4.44Å; F127-I148 HydrophobicContact CE1-CD1 3.54Å; F127-I148 HydrophobicContact CE1-CG1 4.19Å; F127-I148 HydrophobicContact CE2-CD1 3.83Å; F127-I148 HydrophobicContact CZ-CD1 3.33Å; F127-I148 HydrophobicContact CZ-CG1 4.43Å; A143-I148 HydrophobicContact CB-CD1 4.42Å; N146-I148 HydrophobicContact CB-CD1 4.21Å; N146-I148 HydrophobicContact CB-CG1 4.05Å; I148-I151 HydrophobicContact CG2-CG1 3.96Å; I148-L167 HydrophobicContact CD1-CD2 4.46Å; I148-N170 HydrophobicContact CB-CB 4.37Å; I148-N170 VanDerWaalsContact CB-OD1 3.24Å; I148-N170 WeakPolarHBondContact CB-OD1 3.28Å; I148-N170 WeakPolarHBondContact CD1-OD1 3.34Å; I148-N170 WeakPolarHBondContact CG1-OD1 3.34Å; I148-N170 PolarHBondContact N-OD1 3.48Å; I148-L171 CarbonylContact O-C 3.58Å; I148-L171 VanDerWaalsContact O-CA 3.29Å; I148-L171 WeakPolarHBondContact O-CA 3.39Å; I148-L171 PolarHBondContact O-N 3.2Å; I148-I172 HydrophobicContact CB-CG1 4.34Å; I148-I172 HydrophobicContact CG2-CD1 4.42Å; I148-I172 HydrophobicContact CG2-CG1 4.07Å; I148-I172 WeakPolarHBondContact O-CG1 3.2Å; I148-I172 PolarHBondContact O-N 3.05Å; I148-I172 VanDerWaalsContact O-N 3.12Å
149	K	93.1	Very high	92.4	Very high	88 Å²	88	32.9 Å²	32.9	38%	0.383	15%	0.153	S	C	.	.			trans	-95.5	-26.1	178.5	-64.3	160.5	-159.9	172.5	0	112	E125 V147 L171 P173	E125-K149 PolarHBondContact O-N 3.17Å; E125-K149 IonicContact OE1-NZ 3.01Å; E125-K149 PolarHBondContact OE1-NZ 3.41Å; E125-K149 WeakPolarHBondContact OE2-CE 3.22Å; E125-K149 IonicContact OE2-NZ 2.79Å; E125-K149 PolarHBondContact OE2-NZ 2.92Å; V147-K149 WeakPolarHBondContact O-CG 3.17Å; V147-K149 PolarHBondContact O-N 3.12Å; V147-K149 VanDerWaalsContact O-N 3.08Å; K149-L171 HydrophobicContact CG-CB 4.18Å; K149-L171 HydrophobicContact CG-CD1 4.39Å; K149-P173 WeakPolarHBondContact O-CD 3.28Å
150	R	91.7	Very high	92.5	Very high	144 Å²	144	37.2 Å²	37.2	54%	0.543	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	142.1	-176.8	-76.6	179.8	55.3	-148	-14.3	111.8	V126 F127 E152	V126-R150 WeakPolarHBondContact CA-O 3.35Å; V126-R150 HydrophobicContact CG1-CB 4.31Å; V126-R150 HydrophobicContact CG2-CB 4.41Å; F127-R150 PolarHBondContact N-O 2.78Å; F127-R150 VanDerWaalsContact N-O 3.08Å; R150-E152 IonicContact NH2-OE1 3.6Å
151	I	95.7	Very high	92.6	Very high	11 Å²	11	42 Å²	42	6%	0.056	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	142.7	164.9	-58.6	179.9	0	0	0	106.5	F127 I148 A155 L167 I172 L175 P176 L179	F127-I151 HydrophobicContact CB-CB 4.48Å; F127-I151 HydrophobicContact CB-CG1 4.25Å; F127-I151 HydrophobicContact CB-CG2 4.18Å; F127-I151 HydrophobicContact CD2-CD1 4.23Å; F127-I151 HydrophobicContact CD2-CG1 4.21Å; I148-I151 HydrophobicContact CG2-CG1 3.96Å; I151-A155 HydrophobicContact CG2-CB 3.83Å; I151-L167 HydrophobicContact CD1-CD1 4.11Å; I151-I172 HydrophobicContact CD1-CD1 3.81Å; I151-L175 HydrophobicContact CD1-CD2 4.38Å; I151-P176 HydrophobicContact CB-CG 4.45Å; I151-P176 HydrophobicContact CG2-CG 4.42Å; I151-P176 WeakPolarHBondContact O-CG 3.41Å; I151-L179 HydrophobicContact CG2-CD1 3.63Å; I151-L179 HydrophobicContact CG2-CD2 4.03Å
152	E	93.8	Very high	92.5	Very high	52 Å²	52	42 Å²	42	24%	0.243	19%	0.194	C	C	.	.			trans	-92.3	149.7	173.3	-61.7	-170.5	152	0	0	111.6	F127 R128 N129 R150 G154 A155	F127-E152 PolarHBondContact O-N 2.79Å; R128-E152 VanDerWaalsContact CA-OE2 3.29Å; R128-E152 WeakPolarHBondContact CA-OE2 3.25Å; N129-E152 PolarHBondContact N-OE2 2.77Å; N129-E152 PolarHBondContact ND2-OE2 2.91Å; N129-E152 WeakPolarHBondContact OD1-CB 3.48Å; R150-E152 IonicContact NH2-OE1 3.6Å; E152-G154 PolarHBondContact O-N 3.07Å; E152-A155 VanDerWaalsContact O-CB 3.31Å; E152-A155 WeakPolarHBondContact O-CB 3.36Å; E152-A155 PolarHBondContact O-N 2.86Å
153	S	90.1	Very high	92.3	Very high	62 Å²	62	45.9 Å²	45.9	43%	0.434	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-21	-170.8	46.3	0	0	0	0	115.1	N177 L179	S153-N177 WeakPolarHBondContact CB-O 3.29Å; S153-L179 WeakPolarHBondContact O-CA 3.27Å
154	G	90.9	Very high	91.8	Very high	12 Å²	12	45.9 Å²	45.9	12%	0.124	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	3.4	176.2	0	0	0	0	0	114.9	N129 E152 F156 R157	N129-G154 WeakPolarHBondContact OD1-CA 3.09Å; N129-G154 PolarHBondContact OD1-N 3.06Å; E152-G154 PolarHBondContact O-N 3.07Å; G154-F156 PolarHBondContact O-N 2.85Å; G154-F156 VanDerWaalsContact O-N 3.13Å; G154-R157 WeakPolarHBondContact O-CB 3.44Å; G154-R157 PolarHBondContact O-N 3.26Å
155	A	94	Very high	92.1	Very high	2 Å²	2	45.9 Å²	45.9	2%	0.017	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-34.9	-173.2	0	0	0	0	0	113.9	F127 R128 I151 E152 L179	F127-A155 HydrophobicContact CB-CB 4.15Å; R128-A155 WeakPolarHBondContact O-CA 3.3Å; R128-A155 WeakPolarHBondContact O-CB 3.35Å; I151-A155 HydrophobicContact CG2-CB 3.83Å; E152-A155 VanDerWaalsContact O-CB 3.31Å; E152-A155 WeakPolarHBondContact O-CB 3.36Å; E152-A155 PolarHBondContact O-N 2.86Å; A155-L179 HydrophobicContact CB-CD1 4.38Å
156	F	94.4	Very high	92.1	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.5	13.6	177.2	-50	-37.4	0	0	0	113.4	F127 F132 L141 G154 H158 L159 L165 L167 L179 F180 V183	F127-F156 HydrophobicContact CD2-CE1 4Å; F127-F156 HydrophobicContact CD2-CZ 4.13Å; F127-F156 HydrophobicContact CE2-CE1 4.32Å; F127-F156 HydrophobicContact CE2-CZ 4.41Å; F132-F156 HydrophobicContact CD2-CD1 4.18Å; F132-F156 HydrophobicContact CD2-CE1 4.23Å; F132-F156 HydrophobicContact CE2-CD1 4.28Å; F132-F156 AromaticContact CE2-CE1 3.86Å; F132-F156 HydrophobicContact CE2-CE1 3.86Å; L141-F156 HydrophobicContact CD2-CE1 4.12Å; G154-F156 PolarHBondContact O-N 2.85Å; G154-F156 VanDerWaalsContact O-N 3.13Å; F156-H158 PolarHBondContact O-N 2.76Å; F156-H158 VanDerWaalsContact O-N 3.08Å; F156-L159 HydrophobicContact CB-CD1 4.14Å; F156-L159 HydrophobicContact CD1-CD1 3.74Å; F156-L159 HydrophobicContact CG-CD1 4.29Å; F156-L159 PolarHBondContact O-N 2.8Å; F156-L159 VanDerWaalsContact O-N 3.13Å; F156-L165 HydrophobicContact CD2-CD2 4.22Å; F156-L165 HydrophobicContact CE2-CD2 3.54Å; F156-L165 HydrophobicContact CZ-CD1 4.14Å; F156-L165 HydrophobicContact CZ-CD2 3.93Å; F156-L167 HydrophobicContact CZ-CD1 4.4Å; F156-L179 HydrophobicContact CD2-CD1 3.45Å; F156-L179 VanDerWaalsContact CD2-CD1 3.45Å; F156-L179 HydrophobicContact CD2-CD2 4.22Å; F156-L179 HydrophobicContact CD2-CG 3.67Å; F156-L179 HydrophobicContact CE2-CD1 3.75Å; F156-L179 HydrophobicContact CE2-CD2 3.89Å; F156-L179 HydrophobicContact CE2-CG 3.88Å; F156-L179 HydrophobicContact CG-CD1 4.07Å; F156-F180 HydrophobicContact CD2-CE1 4.39Å; F156-F180 HydrophobicContact CE2-CE1 4.3Å; F156-V183 HydrophobicContact CB-CG1 3.97Å
157	R	91.6	Very high	92.1	Very high	160 Å²	160	44.8 Å²	44.8	60%	0.604	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-30.2	-171	178.6	176.1	175.8	-177.1	-3.6	114.1	G154 H160 S182	G154-R157 WeakPolarHBondContact O-CB 3.44Å; G154-R157 PolarHBondContact O-N 3.26Å; R157-H160 PolarHBondContact O-CE1 3Å; R157-S182 WeakPolarHBondContact O-CB 3.24Å; R157-S182 PolarHBondContact O-OG 3.17Å
158	H	89.6	Confident	91.8	Very high	55 Å²	55	42.4 Å²	42.4	26%	0.255	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-4.1	-175.3	-49.1	109.2	0	0	0	113.4	F156 H160	F156-H158 PolarHBondContact O-N 2.76Å; F156-H158 VanDerWaalsContact O-N 3.08Å; H158-H160 PolarHBondContact O-CD2 3.05Å; H158-H160 PolarHBondContact O-N 2.89Å
159	L	93.6	Very high	91.5	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	20%	0.199	C	C	.	.			trans	-85.6	53.5	-172.2	-56.9	-175.2	0	0	0	112	F132 L135 L138 L141 F156 K161 L162 V183	F132-L159 HydrophobicContact CB-CD1 4.14Å; F132-L159 HydrophobicContact CB-CD2 3.99Å; F132-L159 HydrophobicContact CB-CG 4.38Å; F132-L159 HydrophobicContact CD2-CD1 4.48Å; F132-L159 HydrophobicContact CG-CD1 4.3Å; L135-L159 HydrophobicContact CB-CD2 3.75Å; L135-L159 VanDerWaalsContact O-CD2 3.28Å; L135-L159 WeakPolarHBondContact O-CD2 3.24Å; L138-L159 HydrophobicContact CB-CD2 4.24Å; L138-L159 HydrophobicContact CD2-CD1 4.36Å; L138-L159 HydrophobicContact CD2-CD2 4.26Å; L141-L159 HydrophobicContact CD2-CD1 4.32Å; F156-L159 HydrophobicContact CB-CD1 4.14Å; F156-L159 HydrophobicContact CD1-CD1 3.74Å; F156-L159 HydrophobicContact CG-CD1 4.29Å; F156-L159 PolarHBondContact O-N 2.8Å; F156-L159 VanDerWaalsContact O-N 3.13Å; L159-K161 PolarHBondContact O-N 2.99Å; L159-K161 VanDerWaalsContact O-N 3.08Å; L159-L162 HydrophobicContact CB-CB 4.02Å; L159-L162 HydrophobicContact CB-CD2 4.35Å; L159-L162 HydrophobicContact CD1-CD2 4.15Å; L159-L162 WeakPolarHBondContact O-CB 3.41Å; L159-L162 PolarHBondContact O-N 3.07Å; L159-V183 HydrophobicContact CB-CG1 4.21Å; L159-V183 WeakPolarHBondContact O-CG1 3.19Å
160	H	90.9	Very high	91.5	Very high	111 Å²	111	40.1 Å²	40.1	51%	0.514	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-20.9	-164.8	-63.6	-51.9	0	0	0	115.5	R157 H158 S182	R157-H160 PolarHBondContact O-CE1 3Å; H158-H160 PolarHBondContact O-CD2 3.05Å; H158-H160 PolarHBondContact O-N 2.89Å; H160-S182 PolarHBondContact ND1-O 2.96Å; H160-S182 VanDerWaalsContact ND1-O 3.14Å
161	K	92.2	Very high	91.6	Very high	102 Å²	102	36.5 Å²	36.5	44%	0.443	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-1.7	176.9	-56.1	-172.8	-159.9	162.3	0	113.9	S137 L138 E139 L159 R163	S137-K161 PolarHBondContact OG-NZ 3.07Å; L138-K161 CarbonylContact O-C 3.53Å; E139-K161 HydrophobicContact CG-CB 3.98Å; L159-K161 PolarHBondContact O-N 2.99Å; L159-K161 VanDerWaalsContact O-N 3.08Å; K161-R163 WeakPolarHBondContact O-CG 3.4Å; K161-R163 PolarHBondContact O-N 3.4Å
162	L	93.8	Very high	91.7	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.17	C	C	.	.			trans	-65.2	117.3	-171.1	-170.2	73.6	0	0	0	111.1	L138 L141 L159 V164 L165 V183 S184 L185	L138-L162 HydrophobicContact CD2-CD1 4.26Å; L138-L162 HydrophobicContact CG-CD1 4.36Å; L138-L162 VanDerWaalsContact O-CA 3.22Å; L138-L162 WeakPolarHBondContact O-CA 3.02Å; L138-L162 PolarHBondContact O-N 3.17Å; L141-L162 HydrophobicContact CB-CD1 3.74Å; L159-L162 HydrophobicContact CB-CB 4.02Å; L159-L162 HydrophobicContact CB-CD2 4.35Å; L159-L162 HydrophobicContact CD1-CD2 4.15Å; L159-L162 WeakPolarHBondContact O-CB 3.41Å; L159-L162 PolarHBondContact O-N 3.07Å; L162-V164 WeakPolarHBondContact CD1-O 3.41Å; L162-L165 HydrophobicContact CD2-CB 4.47Å; L162-V183 HydrophobicContact CB-CB 4.4Å; L162-V183 HydrophobicContact CB-CG1 4.3Å; L162-V183 HydrophobicContact CD2-CG1 4.4Å; L162-S184 CarbonylContact O-C 3.55Å; L162-S184 PolarHBondContact O-N 3.26Å; L162-L185 HydrophobicContact CD2-CD2 3.99Å; L162-L185 HydrophobicContact CG-CD2 3.93Å
163	R	86.4	Confident	91.5	Very high	82 Å²	82	36.3 Å²	36.3	31%	0.309	18%	0.176	S	C	.	.			trans	-106.7	-33	177.8	-50.2	-169.9	-168.7	155.3	3.2	112.1	E139 K161 L185 T186 H187 L897 E901	E139-R163 PolarHBondContact O-N 3.39Å; K161-R163 WeakPolarHBondContact O-CG 3.4Å; K161-R163 PolarHBondContact O-N 3.4Å; R163-L185 CarbonylContact O-C 3.39Å; R163-L185 WeakPolarHBondContact O-CA 3.46Å; R163-T186 HydrophobicContact CB-CG2 4.3Å; R163-T186 PolarHBondContact O-N 2.85Å; R163-T186 PolarHBondContact O-OG1 3.03Å; R163-H187 PolarHBondContact O-N 3.11Å; R163-H187 VanDerWaalsContact O-N 3.13Å; R163-L897 HydrophobicContact CB-CD1 4.29Å; R163-E901 IonicContact CZ-OE1 3.55Å; R163-E901 IonicContact NH1-OE1 3.82Å; R163-E901 PolarHBondContact NH1-OE1 2.91Å; R163-E901 IonicContact NH2-OE1 2.71Å
164	V	85.5	Confident	91.5	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.006	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	127.4	-175.1	-177.9	0	0	0	0	110.1	E139 Y140 L141 L162 I166 H187 L897 L900	E139-V164 PolarHBondContact O-N 3.13Å; E139-V164 VanDerWaalsContact O-N 3.14Å; Y140-V164 HydrophobicContact CD2-CB 3.62Å; Y140-V164 HydrophobicContact CD2-CG1 3.52Å; Y140-V164 HydrophobicContact CD2-CG2 4.22Å; Y140-V164 HydrophobicContact CE2-CB 4.22Å; Y140-V164 HydrophobicContact CE2-CG1 3.58Å; Y140-V164 HydrophobicContact CG-CB 4.47Å; L141-V164 PolarHBondContact N-O 2.72Å; L162-V164 WeakPolarHBondContact CD1-O 3.41Å; V164-I166 HydrophobicContact CG1-CD1 4.41Å; V164-I166 HydrophobicContact CG1-CG1 4.07Å; V164-H187 HydrophobicContact CG1-CB 4.27Å; V164-H187 HydrophobicContact CG2-CB 4.31Å; V164-L897 HydrophobicContact CB-CD1 4.33Å; V164-L897 HydrophobicContact CG2-CD1 3.79Å; V164-L897 HydrophobicContact CG2-CG 4.39Å; V164-L900 HydrophobicContact CG2-CD1 4.46Å
165	L	93.8	Very high	91.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	114.4	177.5	179.1	59.3	0	0	0	110.4	L141 F156 L162 L167 F180 L185 H187 L188 D189	L141-L165 HydrophobicContact CB-CD1 4.2Å; L141-L165 HydrophobicContact CD2-CD1 3.97Å; L141-L165 HydrophobicContact CG-CD1 4.14Å; L141-L165 WeakPolarHBondContact O-CA 3.44Å; F156-L165 HydrophobicContact CD2-CD2 4.22Å; F156-L165 HydrophobicContact CE2-CD2 3.54Å; F156-L165 HydrophobicContact CZ-CD1 4.14Å; F156-L165 HydrophobicContact CZ-CD2 3.93Å; L162-L165 HydrophobicContact CD2-CB 4.47Å; L165-L167 HydrophobicContact CD1-CD1 3.96Å; L165-L167 HydrophobicContact CD1-CD2 4.13Å; L165-L167 HydrophobicContact CD1-CG 3.82Å; L165-L167 HydrophobicContact CD2-CD1 3.83Å; L165-L167 HydrophobicContact CD2-CG 4.48Å; L165-L167 HydrophobicContact CG-CD1 3.83Å; L165-L167 HydrophobicContact CG-CG 3.92Å; L165-F180 HydrophobicContact CD2-CE1 3.93Å; L165-L185 HydrophobicContact CB-CD1 4.09Å; L165-L185 HydrophobicContact CB-CD2 3.78Å; L165-L185 HydrophobicContact CD2-CD1 4.01Å; L165-H187 PolarHBondContact N-O 2.81Å; L165-H187 VanDerWaalsContact N-O 3.08Å; L165-L188 HydrophobicContact CB-CD1 4.22Å; L165-L188 HydrophobicContact CD2-CD1 4.03Å; L165-L188 HydrophobicContact CG-CD1 4.16Å; L165-L188 WeakPolarHBondContact O-CA 3.49Å; L165-D189 PolarHBondContact O-N 2.98Å; L165-D189 VanDerWaalsContact O-N 3.08Å
166	I	88.6	Confident	91.6	Very high	6 Å²	6	41.2 Å²	41.2	3%	0.031	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	114	179.9	-56.3	-173.7	0	0	0	109.2	Y140 L141 Q142 A143 D144 V164 N168 D189 K893	Y140-I166 HydrophobicContact CE2-CD1 4Å; Y140-I166 VanDerWaalsContact OH-CD1 3.32Å; Y140-I166 WeakPolarHBondContact OH-CD1 3.1Å; L141-I166 PolarHBondContact O-N 3.08Å; Q142-I166 HydrophobicContact CB-CB 4.31Å; Q142-I166 HydrophobicContact CG-CB 4.22Å; Q142-I166 HydrophobicContact CG-CG2 4.31Å; A143-I166 PolarHBondContact N-O 3.23Å; D144-I166 HydrophobicContact CB-CG2 4.09Å; V164-I166 HydrophobicContact CG1-CD1 4.41Å; V164-I166 HydrophobicContact CG1-CG1 4.07Å; I166-N168 WeakPolarHBondContact CG2-OD1 3.31Å; I166-D189 HydrophobicContact CG2-CB 4.38Å; I166-K893 HydrophobicContact CD1-CB 4.16Å
167	L	94.6	Very high	91.4	Very high	1 Å²	1	44 Å²	44	1%	0.005	21%	0.208	C	C	.	.			trans	-133.3	18.1	-175.6	-66.6	175.5	0	0	0	112.8	F127 A143 I148 I151 F156 L165 N170 I172 D189 L190 N193	F127-L167 HydrophobicContact CE2-CD2 3.87Å; F127-L167 HydrophobicContact CZ-CD2 4.44Å; A143-L167 HydrophobicContact CB-CD2 4.15Å; I148-L167 HydrophobicContact CD1-CD2 4.46Å; I151-L167 HydrophobicContact CD1-CD1 4.11Å; F156-L167 HydrophobicContact CZ-CD1 4.4Å; L165-L167 HydrophobicContact CD1-CD1 3.96Å; L165-L167 HydrophobicContact CD1-CD2 4.13Å; L165-L167 HydrophobicContact CD1-CG 3.82Å; L165-L167 HydrophobicContact CD2-CD1 3.83Å; L165-L167 HydrophobicContact CD2-CG 4.48Å; L165-L167 HydrophobicContact CG-CD1 3.83Å; L165-L167 HydrophobicContact CG-CG 3.92Å; L167-N170 PolarHBondContact O-ND2 2.79Å; L167-I172 HydrophobicContact CB-CD1 4.47Å; L167-I172 HydrophobicContact CD1-CD1 4.49Å; L167-D189 CarbonylContact C-O 3.52Å; L167-D189 WeakPolarHBondContact CA-O 3.45Å; L167-D189 PolarHBondContact N-O 3.39Å; L167-L190 HydrophobicContact CB-CD2 4.1Å; L167-L190 HydrophobicContact CD1-CD2 4.23Å; L167-N193 PolarHBondContact O-ND2 3.21Å
168	N	88.4	Confident	91.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.201	C	C	.	.			trans	-62.4	159.9	179.6	59.8	-84.9	0	0	0	112.8	D144 Y145 I166 N170 D189 R191 Q891	D144-N168 VanDerWaalsContact CA-O 3.28Å; D144-N168 WeakPolarHBondContact CA-O 3.34Å; D144-N168 WeakPolarHBondContact CB-ND2 3.01Å; D144-N168 WeakPolarHBondContact CB-O 3.34Å; D144-N168 WeakPolarHBondContact CB-OD1 3.01Å; Y145-N168 PolarHBondContact N-O 3.11Å; I166-N168 WeakPolarHBondContact CG2-OD1 3.31Å; N168-N170 VanDerWaalsContact C-N 3.35Å; N168-N170 PolarHBondContact O-N 3.43Å; N168-N170 PolarHBondContact O-ND2 2.68Å; N168-D189 PolarHBondContact N-O 3.34Å; N168-D189 PolarHBondContact OD1-OD2 2.89Å; N168-R191 CarbonylContact C-O 3.43Å; N168-R191 WeakPolarHBondContact CA-O 3.44Å; N168-R191 HydrophobicContact CB-CB 4.12Å; N168-R191 WeakPolarHBondContact CB-O 3.37Å; N168-Q891 PolarHBondContact ND2-OE1 3.28Å
169	D	88.2	Confident	91.5	Very high	39 Å²	39	39.2 Å²	39.2	21%	0.209	19%	0.189	C	C	.	.	S	Bend	trans	54.6	49.9	174.8	-60.6	-98.8	0	0	0	112.7	Y145 R191 Q891	Y145-D169 HydrophobicContact CD2-CB 3.63Å; Y145-D169 HydrophobicContact CE1-CB 4.32Å; Y145-D169 HydrophobicContact CE2-CB 3.28Å; Y145-D169 WeakPolarHBondContact CE2-OD2 3.31Å; Y145-D169 HydrophobicContact CG-CB 4.22Å; Y145-D169 PolarHBondContact OH-OD1 2.84Å; D169-R191 PolarHBondContact N-O 3.48Å; D169-Q891 VanDerWaalsContact CG-NE2 3.32Å; D169-Q891 PolarHBondContact OD1-NE2 3.25Å; D169-Q891 PolarHBondContact OD2-NE2 2.88Å
170	N	94.1	Very high	91.5	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.011	19%	0.189	C	C	.	.	S	Bend	trans	-122.9	-176.6	175.3	-89.5	-84.5	0	0	0	110.2	A143 N146 I148 L167 N168 I172 N193	A143-N170 PolarHBondContact O-ND2 2.79Å; N146-N170 WeakPolarHBondContact CA-OD1 3.38Å; N146-N170 WeakPolarHBondContact CB-OD1 3.39Å; N146-N170 PolarHBondContact O-OD1 3.37Å; I148-N170 HydrophobicContact CB-CB 4.37Å; I148-N170 VanDerWaalsContact CB-OD1 3.24Å; I148-N170 WeakPolarHBondContact CB-OD1 3.28Å; I148-N170 WeakPolarHBondContact CD1-OD1 3.34Å; I148-N170 WeakPolarHBondContact CG1-OD1 3.34Å; I148-N170 PolarHBondContact N-OD1 3.48Å; L167-N170 PolarHBondContact O-ND2 2.79Å; N168-N170 VanDerWaalsContact C-N 3.35Å; N168-N170 PolarHBondContact O-N 3.43Å; N168-N170 PolarHBondContact O-ND2 2.68Å; N170-I172 HydrophobicContact CB-CD1 4.3Å; N170-I172 HydrophobicContact CB-CG1 4.22Å; N170-N193 VanDerWaalsContact C-OD1 3.25Å; N170-N193 WeakPolarHBondContact CB-OD1 3.42Å; N170-N193 PolarHBondContact O-OD1 3.24Å
171	L	93.9	Very high	91.4	Very high	68 Å²	68	42.3 Å²	42.3	36%	0.356	20%	0.196	S	C	.	.			trans	-108.8	22	-174.5	-61.5	178	0	0	0	113.3	V147 I148 K149 P173	V147-L171 HydrophobicContact CB-CD1 4.22Å; V147-L171 HydrophobicContact CG1-CD1 4.38Å; I148-L171 CarbonylContact O-C 3.58Å; I148-L171 VanDerWaalsContact O-CA 3.29Å; I148-L171 WeakPolarHBondContact O-CA 3.39Å; I148-L171 PolarHBondContact O-N 3.2Å; K149-L171 HydrophobicContact CG-CB 4.18Å; K149-L171 HydrophobicContact CG-CD1 4.39Å; L171-P173 VanDerWaalsContact O-CD 3.29Å; L171-P173 WeakPolarHBondContact O-CD 3.11Å
172	I	96.3	Very high	91.3	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.188	C	C	.	.			trans	-70	117.4	-170.5	-56.6	167.5	0	0	0	110.1	I148 I151 L167 N170 M174 L175 N193 R194 L195	I148-I172 HydrophobicContact CB-CG1 4.34Å; I148-I172 HydrophobicContact CG2-CD1 4.42Å; I148-I172 HydrophobicContact CG2-CG1 4.07Å; I148-I172 WeakPolarHBondContact O-CG1 3.2Å; I148-I172 PolarHBondContact O-N 3.05Å; I148-I172 VanDerWaalsContact O-N 3.12Å; I151-I172 HydrophobicContact CD1-CD1 3.81Å; L167-I172 HydrophobicContact CB-CD1 4.47Å; L167-I172 HydrophobicContact CD1-CD1 4.49Å; N170-I172 HydrophobicContact CB-CD1 4.3Å; N170-I172 HydrophobicContact CB-CG1 4.22Å; I172-M174 WeakPolarHBondContact CG2-O 3.08Å; I172-L175 HydrophobicContact CG2-CD2 3.9Å; I172-N193 VanDerWaalsContact CB-OD1 3.29Å; I172-N193 WeakPolarHBondContact CB-OD1 3.23Å; I172-N193 WeakPolarHBondContact CG1-OD1 3.3Å; I172-N193 PolarHBondContact N-OD1 2.98Å; I172-R194 CarbonylContact O-C 3.39Å; I172-R194 VanDerWaalsContact O-CA 3.28Å; I172-R194 WeakPolarHBondContact O-CA 3.26Å; I172-R194 WeakPolarHBondContact O-CB 3.42Å; I172-R194 PolarHBondContact O-N 3.37Å; I172-L195 HydrophobicContact CG2-CD2 4Å; I172-L195 PolarHBondContact O-N 3.45Å
173	P	90.5	Very high	91.2	Very high	59 Å²	59	40 Å²	40	38%	0.383	19%	0.192	S	C	.	.			trans	-88.1	-25	-177.1	34	-33.7	0	0	0	113.4	K149 L171 R194	K149-P173 WeakPolarHBondContact O-CD 3.28Å; L171-P173 VanDerWaalsContact O-CD 3.29Å; L171-P173 WeakPolarHBondContact O-CD 3.11Å; P173-R194 WeakPolarHBondContact CA-O 3.45Å
174	M	91.1	Very high	91.3	Very high	134 Å²	134	39.1 Å²	39.1	66%	0.66	20%	0.198	S	C	*	.			trans	-161.2	155.7	177.2	59.7	176.7	66.1	0	0	109.5	I172	I172-M174 WeakPolarHBondContact CG2-O 3.08Å
175	L	93.9	Very high	91.5	Very high	14 Å²	14	39.4 Å²	39.4	7%	0.073	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-96.7	136.7	172	-63.1	175.2	0	0	0	110.2	I151 I172 L179 F180 L190 L195 L198 T203	I151-L175 HydrophobicContact CD1-CD2 4.38Å; I172-L175 HydrophobicContact CG2-CD2 3.9Å; L175-L179 HydrophobicContact CD2-CD2 4.14Å; L175-F180 HydrophobicContact CD1-CE2 3.85Å; L175-F180 HydrophobicContact CD1-CZ 3.95Å; L175-L190 HydrophobicContact CD1-CD1 3.99Å; L175-L195 HydrophobicContact CG-CD2 4.2Å; L175-L198 HydrophobicContact CB-CD2 4.43Å; L175-L198 HydrophobicContact CD1-CD2 3.85Å; L175-L198 HydrophobicContact CG-CD2 4.2Å; L175-T203 HydrophobicContact CB-CG2 4.19Å
176	P	92.6	Very high	90.9	Very high	30 Å²	30	40.1 Å²	40.1	20%	0.195	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-72.3	147.7	178.1	31.8	-38.8	0	0	0	112.3	I151 L179	I151-P176 HydrophobicContact CB-CG 4.45Å; I151-P176 HydrophobicContact CG2-CG 4.42Å; I151-P176 WeakPolarHBondContact O-CG 3.41Å; P176-L179 HydrophobicContact CG-CB 4.2Å; P176-L179 HydrophobicContact CG-CD1 4.42Å; P176-L179 HydrophobicContact CG-CD2 4.26Å; P176-L179 WeakPolarHBondContact O-CB 3.11Å; P176-L179 PolarHBondContact O-N 3.3Å
177	N	90.4	Very high	90.4	Very high	59 Å²	59	40.6 Å²	40.6	32%	0.316	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	144.9	176.7	-69.7	-20.3	0	0	0	111.9	S153 L179 Q199 T203	S153-N177 WeakPolarHBondContact CB-O 3.29Å; N177-L179 VanDerWaalsContact C-N 3.27Å; N177-L179 PolarHBondContact O-N 2.81Å; N177-Q199 PolarHBondContact ND2-OE1 3.33Å; N177-T203 PolarHBondContact OD1-OG1 3.18Å
178	Y	89.9	Confident	90.2	Very high	113 Å²	113	40.8 Å²	40.8	44%	0.443	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.8	3.6	-175.7	-47.6	-71.3	0	0	0	116.4	F180 R181 G202 Y206	Y178-F180 VanDerWaalsContact C-N 3.29Å; Y178-F180 PolarHBondContact O-N 3.3Å; Y178-R181 WeakPolarHBondContact O-CB 3.12Å; Y178-R181 PolarHBondContact O-N 3.34Å; Y178-G202 VanDerWaalsContact CA-O 3.23Å; Y178-G202 WeakPolarHBondContact CA-O 3.43Å; Y178-G202 PolarHBondContact N-O 3.38Å; Y178-Y206 AromaticContact CD1-CE2 3.86Å; Y178-Y206 HydrophobicContact CD1-CE2 3.86Å
179	L	92.9	Very high	90	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-44.8	179.9	-177.1	60	0	0	0	113.8	I151 S153 A155 F156 L175 P176 N177	I151-L179 HydrophobicContact CG2-CD1 3.63Å; I151-L179 HydrophobicContact CG2-CD2 4.03Å; S153-L179 WeakPolarHBondContact O-CA 3.27Å; A155-L179 HydrophobicContact CB-CD1 4.38Å; F156-L179 HydrophobicContact CD2-CD1 3.45Å; F156-L179 VanDerWaalsContact CD2-CD1 3.45Å; F156-L179 HydrophobicContact CD2-CD2 4.22Å; F156-L179 HydrophobicContact CD2-CG 3.67Å; F156-L179 HydrophobicContact CE2-CD1 3.75Å; F156-L179 HydrophobicContact CE2-CD2 3.89Å; F156-L179 HydrophobicContact CE2-CG 3.88Å; F156-L179 HydrophobicContact CG-CD1 4.07Å; L175-L179 HydrophobicContact CD2-CD2 4.14Å; P176-L179 HydrophobicContact CG-CB 4.2Å; P176-L179 HydrophobicContact CG-CD1 4.42Å; P176-L179 HydrophobicContact CG-CD2 4.26Å; P176-L179 WeakPolarHBondContact O-CB 3.11Å; P176-L179 PolarHBondContact O-N 3.3Å; N177-L179 VanDerWaalsContact C-N 3.27Å; N177-L179 PolarHBondContact O-N 2.81Å
180	F	92.4	Very high	90.2	Very high	4 Å²	4	39.4 Å²	39.4	2%	0.018	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	6.9	-176	-56.5	-59.6	0	0	0	114	F156 L165 L175 Y178 S182 V183 L185 L188 T203 V207	F156-F180 HydrophobicContact CD2-CE1 4.39Å; F156-F180 HydrophobicContact CE2-CE1 4.3Å; L165-F180 HydrophobicContact CD2-CE1 3.93Å; L175-F180 HydrophobicContact CD1-CE2 3.85Å; L175-F180 HydrophobicContact CD1-CZ 3.95Å; Y178-F180 VanDerWaalsContact C-N 3.29Å; Y178-F180 PolarHBondContact O-N 3.3Å; F180-S182 VanDerWaalsContact C-N 3.25Å; F180-S182 PolarHBondContact O-N 2.97Å; F180-V183 HydrophobicContact CB-CG2 4.15Å; F180-V183 HydrophobicContact CD1-CG2 4.07Å; F180-V183 PolarHBondContact O-N 3.12Å; F180-L185 HydrophobicContact CD1-CD1 3.82Å; F180-L185 HydrophobicContact CE1-CD1 3.82Å; F180-L188 HydrophobicContact CZ-CD2 4.2Å; F180-T203 HydrophobicContact CD2-CG2 4.13Å; F180-T203 HydrophobicContact CE2-CG2 4.05Å; F180-V207 HydrophobicContact CB-CG2 3.79Å; F180-V207 HydrophobicContact CD1-CG2 4.47Å; F180-V207 HydrophobicContact CD2-CG2 3.34Å; F180-V207 HydrophobicContact CE2-CG2 3.99Å; F180-V207 HydrophobicContact CG-CG2 3.62Å
181	R	90.8	Very high	90	Very high	173 Å²	173	40.7 Å²	40.7	65%	0.653	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-26.2	-173.6	-176	177.1	173	-172	-1.8	114.1	Y178 Y206	Y178-R181 WeakPolarHBondContact O-CB 3.12Å; Y178-R181 PolarHBondContact O-N 3.34Å; R181-Y206 HydrophobicContact CB-CD2 3.96Å; R181-Y206 HydrophobicContact CB-CE2 3.88Å; R181-Y206 HydrophobicContact CB-CG 4.36Å; R181-Y206 HydrophobicContact CG-CE1 4.26Å; R181-Y206 HydrophobicContact CG-CE2 4.21Å
182	S	88.8	Confident	89.7	Confident	38 Å²	38	38.2 Å²	38.2	27%	0.266	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-1	-175.3	-69.5	0	0	0	0	115.1	R157 H160 F180	R157-S182 WeakPolarHBondContact O-CB 3.24Å; R157-S182 PolarHBondContact O-OG 3.17Å; H160-S182 PolarHBondContact ND1-O 2.96Å; H160-S182 VanDerWaalsContact ND1-O 3.14Å; F180-S182 VanDerWaalsContact C-N 3.25Å; F180-S182 PolarHBondContact O-N 2.97Å
183	V	91.8	Very high	89.6	Confident	16 Å²	16	38.2 Å²	38.2	10%	0.097	20%	0.196	C	C	.	.			trans	-124.5	161.7	-170	-54.2	0	0	0	0	111.4	F156 L159 L162 F180 L185	F156-V183 HydrophobicContact CB-CG1 3.97Å; L159-V183 HydrophobicContact CB-CG1 4.21Å; L159-V183 WeakPolarHBondContact O-CG1 3.19Å; L162-V183 HydrophobicContact CB-CB 4.4Å; L162-V183 HydrophobicContact CB-CG1 4.3Å; L162-V183 HydrophobicContact CD2-CG1 4.4Å; F180-V183 HydrophobicContact CB-CG2 4.15Å; F180-V183 HydrophobicContact CD1-CG2 4.07Å; F180-V183 PolarHBondContact O-N 3.12Å; V183-L185 HydrophobicContact CG2-CD1 4.43Å; V183-L185 HydrophobicContact CG2-CD2 4.48Å; V183-L185 HydrophobicContact CG2-CG 4.02Å
184	S	88.9	Confident	89.8	Confident	63 Å²	63	41.7 Å²	41.7	44%	0.441	20%	0.201	S	C	.	.			trans	-131	73.2	-178.5	-170	0	0	0	0	110.6	L162 T186 S210	L162-S184 CarbonylContact O-C 3.55Å; L162-S184 PolarHBondContact O-N 3.26Å; S184-T186 PolarHBondContact O-N 2.96Å; S184-S210 PolarHBondContact OG-OG 2.72Å
185	L	88.8	Confident	89.9	Confident	8 Å²	8	35.3 Å²	35.3	4%	0.042	17%	0.17	C	C	.	.			trans	-69.3	127.1	-175.1	-61.5	177.5	0	0	0	111.9	L162 R163 L165 F180 V183 L188 L211	L162-L185 HydrophobicContact CD2-CD2 3.99Å; L162-L185 HydrophobicContact CG-CD2 3.93Å; R163-L185 CarbonylContact O-C 3.39Å; R163-L185 WeakPolarHBondContact O-CA 3.46Å; L165-L185 HydrophobicContact CB-CD1 4.09Å; L165-L185 HydrophobicContact CB-CD2 3.78Å; L165-L185 HydrophobicContact CD2-CD1 4.01Å; F180-L185 HydrophobicContact CD1-CD1 3.82Å; F180-L185 HydrophobicContact CE1-CD1 3.82Å; V183-L185 HydrophobicContact CG2-CD1 4.43Å; V183-L185 HydrophobicContact CG2-CD2 4.48Å; V183-L185 HydrophobicContact CG2-CG 4.02Å; L185-L188 HydrophobicContact CD1-CB 4.4Å; L185-L188 HydrophobicContact CD1-CD1 4.18Å; L185-L188 HydrophobicContact CD1-CD2 4.3Å; L185-L211 HydrophobicContact CB-CD1 4.37Å; L185-L211 WeakPolarHBondContact O-CD1 3.47Å
186	T	81.8	Confident	89.8	Confident	14 Å²	14	40.3 Å²	40.3	9%	0.086	19%	0.191	C	C	.	.	S	Bend	trans	-88.8	-32.8	164.9	61.9	0	0	0	0	111.2	R163 S184 S210 M212 E213 L900	R163-T186 HydrophobicContact CB-CG2 4.3Å; R163-T186 PolarHBondContact O-N 2.85Å; R163-T186 PolarHBondContact O-OG1 3.03Å; S184-T186 PolarHBondContact O-N 2.96Å; T186-S210 WeakPolarHBondContact CA-O 3.48Å; T186-S210 WeakPolarHBondContact CG2-O 3.44Å; T186-M212 PolarHBondContact O-N 3.24Å; T186-E213 PolarHBondContact O-N 3.45Å; T186-L900 WeakPolarHBondContact OG1-CD1 3.27Å
187	H	79.2	Confident	89.7	Confident	16 Å²	16	40.1 Å²	40.1	7%	0.074	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	131.9	-177.5	-62.1	67.1	0	0	0	111	R163 V164 L165 E213 Y896 L900	R163-H187 PolarHBondContact O-N 3.11Å; R163-H187 VanDerWaalsContact O-N 3.13Å; V164-H187 HydrophobicContact CG1-CB 4.27Å; V164-H187 HydrophobicContact CG2-CB 4.31Å; L165-H187 PolarHBondContact N-O 2.81Å; L165-H187 VanDerWaalsContact N-O 3.08Å; H187-E213 WeakPolarHBondContact CA-O 3.44Å; H187-E213 VanDerWaalsContact CD2-CB 3.44Å; H187-E213 WeakPolarHBondContact CD2-CB 3.28Å; H187-E213 IonicContact CD2-OE2 2.85Å; H187-E213 PolarHBondContact CD2-OE2 2.92Å; H187-E213 IonicContact NE2-OE2 2.97Å; H187-Y896 HydrophobicContact CB-CD1 4.48Å; H187-Y896 AromaticContact CD2-CD1 3.29Å; H187-Y896 WeakPolarHBondContact CD2-CD1 3.49Å; H187-Y896 AromaticContact CD2-CE1 3.06Å; H187-Y896 WeakPolarHBondContact CD2-CE1 3.32Å; H187-Y896 AromaticContact CD2-CZ 3.96Å; H187-Y896 AromaticContact CG-CD1 3.67Å; H187-Y896 AromaticContact CG-CE1 3.9Å; H187-Y896 AromaticContact NE2-CD1 3.59Å; H187-Y896 AromaticContact NE2-CE1 3.41Å; H187-Y896 WeakPolarHBondContact NE2-CE1 3.26Å; H187-L900 VanDerWaalsContact CE1-CD2 3.43Å; H187-L900 WeakPolarHBondContact CE1-CD2 3.49Å
188	L	88.6	Confident	89.7	Confident	6 Å²	6	37.5 Å²	37.5	3%	0.031	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	110	-178.6	175.8	56.9	0	0	0	110.8	L165 F180 L185 L190 V207 L211 E213 I214 Q215	L165-L188 HydrophobicContact CB-CD1 4.22Å; L165-L188 HydrophobicContact CD2-CD1 4.03Å; L165-L188 HydrophobicContact CG-CD1 4.16Å; L165-L188 WeakPolarHBondContact O-CA 3.49Å; F180-L188 HydrophobicContact CZ-CD2 4.2Å; L185-L188 HydrophobicContact CD1-CB 4.4Å; L185-L188 HydrophobicContact CD1-CD1 4.18Å; L185-L188 HydrophobicContact CD1-CD2 4.3Å; L188-L190 HydrophobicContact CD1-CD1 4.03Å; L188-L190 HydrophobicContact CD1-CD2 4.29Å; L188-L190 HydrophobicContact CD1-CG 3.87Å; L188-L190 HydrophobicContact CD2-CD1 3.89Å; L188-L190 HydrophobicContact CG-CD1 3.86Å; L188-L190 HydrophobicContact CG-CG 4.04Å; L188-V207 HydrophobicContact CD2-CG1 4.25Å; L188-L211 HydrophobicContact CB-CD1 4.31Å; L188-E213 PolarHBondContact N-O 3.07Å; L188-E213 VanDerWaalsContact N-O 3.14Å; L188-I214 HydrophobicContact CB-CG1 4.21Å; L188-I214 HydrophobicContact CD2-CD1 3.98Å; L188-I214 HydrophobicContact CD2-CG1 4.31Å; L188-I214 HydrophobicContact CG-CD1 4.48Å; L188-I214 HydrophobicContact CG-CG1 4.27Å; L188-I214 WeakPolarHBondContact O-CA 3.46Å; L188-Q215 PolarHBondContact O-N 3.48Å
189	D	85.2	Confident	89.5	Confident	9 Å²	9	36.2 Å²	36.2	5%	0.048	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	117.6	174.7	-168.2	-6.4	0	0	0	110.9	L165 I166 L167 N168 R191 Q215 K893	L165-D189 PolarHBondContact O-N 2.98Å; L165-D189 VanDerWaalsContact O-N 3.08Å; I166-D189 HydrophobicContact CG2-CB 4.38Å; L167-D189 CarbonylContact C-O 3.52Å; L167-D189 WeakPolarHBondContact CA-O 3.45Å; L167-D189 PolarHBondContact N-O 3.39Å; N168-D189 PolarHBondContact N-O 3.34Å; N168-D189 PolarHBondContact OD1-OD2 2.89Å; D189-R191 WeakPolarHBondContact OD1-CB 3.04Å; D189-R191 VanDerWaalsContact OD1-CG 3.3Å; D189-R191 WeakPolarHBondContact OD1-CG 3.47Å; D189-R191 IonicContact OD1-CZ 3.88Å; D189-R191 PolarHBondContact OD1-N 3.42Å; D189-R191 IonicContact OD1-NE 2.86Å; D189-R191 PolarHBondContact OD1-NE 2.84Å; D189-R191 IonicContact OD1-NH2 3.27Å; D189-R191 IonicContact OD2-CZ 3.54Å; D189-R191 IonicContact OD2-NE 3.6Å; D189-R191 PolarHBondContact OD2-NE 2.96Å; D189-R191 IonicContact OD2-NH2 3.43Å; D189-R191 PolarHBondContact OD2-NH2 3.06Å; D189-Q215 PolarHBondContact OD2-OE1 3.05Å; D189-K893 WeakPolarHBondContact OD2-CE 3.34Å; D189-K893 IonicContact OD2-NZ 3.72Å; D189-K893 PolarHBondContact OD2-NZ 2.8Å
190	L	93.3	Very high	89.1	Confident	1 Å²	1	38 Å²	38	1%	0.005	18%	0.18	C	C	.	.			trans	-124.2	15.1	-180	-70.4	166.2	0	0	0	112.1	L167 L175 L188 N193 L195 Q215 L216 N219	L167-L190 HydrophobicContact CB-CD2 4.1Å; L167-L190 HydrophobicContact CD1-CD2 4.23Å; L175-L190 HydrophobicContact CD1-CD1 3.99Å; L188-L190 HydrophobicContact CD1-CD1 4.03Å; L188-L190 HydrophobicContact CD1-CD2 4.29Å; L188-L190 HydrophobicContact CD1-CG 3.87Å; L188-L190 HydrophobicContact CD2-CD1 3.89Å; L188-L190 HydrophobicContact CG-CD1 3.86Å; L188-L190 HydrophobicContact CG-CG 4.04Å; L190-N193 WeakPolarHBondContact O-CB 3.21Å; L190-N193 PolarHBondContact O-ND2 2.6Å; L190-L195 HydrophobicContact CB-CD1 4.16Å; L190-L195 HydrophobicContact CD1-CD1 4.24Å; L190-Q215 PolarHBondContact N-O 3.27Å; L190-L216 HydrophobicContact CB-CD2 4.19Å; L190-L216 HydrophobicContact CD1-CD2 4.07Å; L190-N219 PolarHBondContact O-ND2 2.92Å
191	R	88.4	Confident	88.7	Confident	29 Å²	29	43.4 Å²	43.4	11%	0.109	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	157.9	-177.8	-66.7	174.9	-60.5	110.2	19.4	113.2	N168 D169 D189 N193 Q215 E217 K893	N168-R191 CarbonylContact C-O 3.43Å; N168-R191 WeakPolarHBondContact CA-O 3.44Å; N168-R191 HydrophobicContact CB-CB 4.12Å; N168-R191 WeakPolarHBondContact CB-O 3.37Å; D169-R191 PolarHBondContact N-O 3.48Å; D189-R191 WeakPolarHBondContact OD1-CB 3.04Å; D189-R191 VanDerWaalsContact OD1-CG 3.3Å; D189-R191 WeakPolarHBondContact OD1-CG 3.47Å; D189-R191 IonicContact OD1-CZ 3.88Å; D189-R191 PolarHBondContact OD1-N 3.42Å; D189-R191 IonicContact OD1-NE 2.86Å; D189-R191 PolarHBondContact OD1-NE 2.84Å; D189-R191 IonicContact OD1-NH2 3.27Å; D189-R191 IonicContact OD2-CZ 3.54Å; D189-R191 IonicContact OD2-NE 3.6Å; D189-R191 PolarHBondContact OD2-NE 2.96Å; D189-R191 IonicContact OD2-NH2 3.43Å; D189-R191 PolarHBondContact OD2-NH2 3.06Å; R191-N193 PolarHBondContact O-N 2.05Å; R191-N193 PolarHBondContact O-ND2 3.17Å; R191-N193 VanDerWaalsContact O-ND2 3.08Å; R191-Q215 HydrophobicContact CG-CB 3.71Å; R191-E217 VanDerWaalsContact CA-O 3.3Å; R191-E217 WeakPolarHBondContact CA-O 3.45Å; R191-E217 HydrophobicContact CG-CB 4.02Å; R191-E217 WeakPolarHBondContact CG-OE2 3Å; R191-K893 VanDerWaalsContact NH2-CE 3.26Å
192	G	87.3	Confident	88.2	Confident	16 Å²	16	35.2 Å²	35.2	17%	0.165	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.5	13.3	172.8	0	0	0	0	0	115.2	E217	G192-E217 PolarHBondContact N-O 2.81Å
193	N	94.9	Very high	88.2	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.16	C	C	.	.	S	Bend	trans	-88.6	-170.9	179.4	-88	-87.9	0	0	0	111.7	L167 N170 I172 L190 R191 L195 N219 P220	L167-N193 PolarHBondContact O-ND2 3.21Å; N170-N193 VanDerWaalsContact C-OD1 3.25Å; N170-N193 WeakPolarHBondContact CB-OD1 3.42Å; N170-N193 PolarHBondContact O-OD1 3.24Å; I172-N193 VanDerWaalsContact CB-OD1 3.29Å; I172-N193 WeakPolarHBondContact CB-OD1 3.23Å; I172-N193 WeakPolarHBondContact CG1-OD1 3.3Å; I172-N193 PolarHBondContact N-OD1 2.98Å; L190-N193 WeakPolarHBondContact O-CB 3.21Å; L190-N193 PolarHBondContact O-ND2 2.6Å; R191-N193 PolarHBondContact O-N 2.05Å; R191-N193 PolarHBondContact O-ND2 3.17Å; R191-N193 VanDerWaalsContact O-ND2 3.08Å; N193-L195 HydrophobicContact CB-CG 4.28Å; N193-N219 WeakPolarHBondContact CA-OD1 3.37Å; N193-N219 WeakPolarHBondContact CB-OD1 3.17Å; N193-N219 PolarHBondContact O-OD1 2.74Å; N193-P220 VanDerWaalsContact O-CD 3.28Å; N193-P220 WeakPolarHBondContact O-CD 3.12Å
194	R	94.5	Very high	87.9	Confident	131 Å²	131	33 Å²	33	49%	0.494	16%	0.157	S	C	.	.			trans	-109.6	20.8	-178.6	-56.5	-56.7	-177.1	-178.9	1.3	112.9	I172 P173 K196	I172-R194 CarbonylContact O-C 3.39Å; I172-R194 VanDerWaalsContact O-CA 3.28Å; I172-R194 WeakPolarHBondContact O-CA 3.26Å; I172-R194 WeakPolarHBondContact O-CB 3.42Å; I172-R194 PolarHBondContact O-N 3.37Å; P173-R194 WeakPolarHBondContact CA-O 3.45Å; R194-K196 PolarHBondContact O-N 3.36Å
195	L	94.1	Very high	87.8	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	15%	0.153	C	C	.	.			trans	-64.2	127	-178.4	-57.5	173.5	0	0	0	110.6	I172 L175 L190 N193 L198 N219 P220 W221	I172-L195 HydrophobicContact CG2-CD2 4Å; I172-L195 PolarHBondContact O-N 3.45Å; L175-L195 HydrophobicContact CG-CD2 4.2Å; L190-L195 HydrophobicContact CB-CD1 4.16Å; L190-L195 HydrophobicContact CD1-CD1 4.24Å; N193-L195 HydrophobicContact CB-CG 4.28Å; L195-L198 HydrophobicContact CD1-CD2 4.36Å; L195-L198 HydrophobicContact CD2-CD2 4.46Å; L195-N219 HydrophobicContact CB-CB 4.34Å; L195-N219 WeakPolarHBondContact CB-OD1 3.29Å; L195-N219 WeakPolarHBondContact CG-OD1 3.19Å; L195-N219 PolarHBondContact N-OD1 2.9Å; L195-P220 CarbonylContact O-C 3.54Å; L195-P220 WeakPolarHBondContact O-CD 3.45Å; L195-W221 HydrophobicContact CB-CH2 3.71Å; L195-W221 HydrophobicContact CB-CZ2 4.3Å; L195-W221 HydrophobicContact CB-CZ3 3.97Å; L195-W221 HydrophobicContact CD1-CH2 4.06Å
196	K	91.1	Very high	87.6	Confident	120 Å²	120	36.2 Å²	36.2	52%	0.522	16%	0.163	S	C	.	.			trans	-100.9	-37.1	176.2	-65.2	-172.2	177.5	-176	0	112.5	R194 P220 N222	R194-K196 PolarHBondContact O-N 3.36Å; K196-P220 HydrophobicContact CG-CG 4.46Å; K196-N222 HydrophobicContact CB-CB 3.96Å; K196-N222 PolarHBondContact O-N 3.34Å
197	T	90.3	Very high	87.4	Confident	25 Å²	25	36 Å²	36	15%	0.153	16%	0.162	C	C	.	.			trans	-148	159.7	179	58.2	0	0	0	0	109.1	E226 I227	T197-E226 HydrophobicContact CG2-CB 3.98Å; T197-I227 HydrophobicContact CG2-CB 4.32Å; T197-I227 HydrophobicContact CG2-CG1 4.43Å
198	L	90.3	Very high	86.8	Confident	4 Å²	4	35.9 Å²	35.9	2%	0.021	16%	0.164	C	C	.	.			trans	-128.7	128.7	170	-71.9	173.6	0	0	0	109.2	L175 L195 L204 L216 W221 L230	L175-L198 HydrophobicContact CB-CD2 4.43Å; L175-L198 HydrophobicContact CD1-CD2 3.85Å; L175-L198 HydrophobicContact CG-CD2 4.2Å; L195-L198 HydrophobicContact CD1-CD2 4.36Å; L195-L198 HydrophobicContact CD2-CD2 4.46Å; L198-L204 HydrophobicContact CB-CD1 3.88Å; L198-L204 HydrophobicContact CB-CD2 4.49Å; L198-L204 HydrophobicContact CB-CG 4.28Å; L198-L204 HydrophobicContact CD1-CD2 4.3Å; L198-L216 HydrophobicContact CD1-CD2 3.98Å; L198-W221 HydrophobicContact CD1-CH2 3.72Å; L198-W221 HydrophobicContact CD1-CZ3 4.24Å; L198-W221 HydrophobicContact CG-CH2 3.9Å; L198-W221 HydrophobicContact CG-CZ3 3.98Å; L198-L230 HydrophobicContact CB-CB 4.38Å; L198-L230 HydrophobicContact CB-CD1 4.35Å; L198-L230 HydrophobicContact CB-CD2 4.38Å; L198-L230 HydrophobicContact CD1-CD1 4.26Å; L198-L230 HydrophobicContact CD1-CD2 4.47Å
199	Q	86.4	Confident	86	Confident	86 Å²	86	46.8 Å²	46.8	40%	0.402	21%	0.205	S	C	.	.			trans	-81.4	141.8	179.7	-61.8	-171.5	1.6	0	0	110.5	N177 T203 L204	N177-Q199 PolarHBondContact ND2-OE1 3.33Å; Q199-T203 WeakPolarHBondContact O-CB 3.38Å; Q199-L204 WeakPolarHBondContact O-CG 2.92Å; Q199-L204 PolarHBondContact O-N 3.04Å; Q199-L204 VanDerWaalsContact O-N 3.14Å
200	Y	84.6	Confident	85.5	Confident	38 Å²	38	48.3 Å²	48.3	15%	0.149	22%	0.216	C	C	.	.	I	π-helix	trans	-73.3	-62.3	175.3	177	-94	0	0	0	109.5	G202 T203 L204 E205 W233 P283	Y200-G202 PolarHBondContact O-N 2.84Å; Y200-T203 PolarHBondContact O-N 3.19Å; Y200-L204 HydrophobicContact CD2-CB 4.43Å; Y200-L204 PolarHBondContact O-N 3.3Å; Y200-L204 VanDerWaalsContact O-N 3.12Å; Y200-E205 HydrophobicContact CE1-CB 4.37Å; Y200-E205 HydrophobicContact CE1-CG 4.49Å; Y200-E205 WeakPolarHBondContact O-CB 3.41Å; Y200-E205 PolarHBondContact O-N 2.91Å; Y200-W233 HydrophobicContact CD2-CB 4.1Å; Y200-W233 AromaticContact CD2-CD1 4Å; Y200-W233 HydrophobicContact CD2-CG 4.43Å; Y200-W233 AromaticContact CE2-CD1 3.95Å; Y200-P283 HydrophobicContact CE1-CG 3.75Å
201	K	83.2	Confident	84.7	Confident	119 Å²	119	48.5 Å²	48.5	52%	0.517	22%	0.218	S	C	.	.	I	π-helix	trans	-59.3	125.4	-177.5	-177.1	175.2	179.5	178.5	0	110.4	T203	K201-T203 PolarHBondContact O-N 3.44Å; K201-T203 VanDerWaalsContact O-N 3.14Å
202	G	81.8	Confident	83.9	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	23%	0.225	C	C	.	.	I	π-helix	trans	76.2	-20.9	179.3	0	0	0	0	0	116.5	Y178 Y200 E205 Y206	Y178-G202 VanDerWaalsContact CA-O 3.23Å; Y178-G202 WeakPolarHBondContact CA-O 3.43Å; Y178-G202 PolarHBondContact N-O 3.38Å; Y200-G202 PolarHBondContact O-N 2.84Å; G202-E205 PolarHBondContact N-OE2 2.94Å; G202-Y206 WeakPolarHBondContact O-CD2 3.42Å; G202-Y206 VanDerWaalsContact O-CE2 3.26Å; G202-Y206 WeakPolarHBondContact O-CE2 3.45Å
203	T	87.3	Confident	83.3	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.012	22%	0.224	C	C	.	.	I	π-helix	trans	-112.6	-75	178.3	-61.7	0	0	0	0	111.5	L175 N177 F180 Q199 Y200 K201 E205 Y206	L175-T203 HydrophobicContact CB-CG2 4.19Å; N177-T203 PolarHBondContact OD1-OG1 3.18Å; F180-T203 HydrophobicContact CD2-CG2 4.13Å; F180-T203 HydrophobicContact CE2-CG2 4.05Å; Q199-T203 WeakPolarHBondContact O-CB 3.38Å; Y200-T203 PolarHBondContact O-N 3.19Å; K201-T203 PolarHBondContact O-N 3.44Å; K201-T203 VanDerWaalsContact O-N 3.14Å; T203-E205 PolarHBondContact O-N 3.21Å; T203-Y206 PolarHBondContact O-N 2.84Å
204	L	86.9	Confident	82.8	Confident	6 Å²	6	50.4 Å²	50.4	3%	0.031	22%	0.224	C	C	.	.	I	π-helix	trans	-72.3	-15	-179.3	-58	168.3	0	0	0	113.6	L198 Q199 Y200 Y206 V207 L230 W233	L198-L204 HydrophobicContact CB-CD1 3.88Å; L198-L204 HydrophobicContact CB-CD2 4.49Å; L198-L204 HydrophobicContact CB-CG 4.28Å; L198-L204 HydrophobicContact CD1-CD2 4.3Å; Q199-L204 WeakPolarHBondContact O-CG 2.92Å; Q199-L204 PolarHBondContact O-N 3.04Å; Q199-L204 VanDerWaalsContact O-N 3.14Å; Y200-L204 HydrophobicContact CD2-CB 4.43Å; Y200-L204 PolarHBondContact O-N 3.3Å; Y200-L204 VanDerWaalsContact O-N 3.12Å; L204-Y206 PolarHBondContact O-N 3.41Å; L204-V207 PolarHBondContact O-N 2.92Å; L204-V207 VanDerWaalsContact O-N 3.14Å; L204-L230 HydrophobicContact CD1-CB 4.34Å; L204-L230 HydrophobicContact CD1-CD1 3.78Å; L204-W233 HydrophobicContact CB-CB 4.45Å; L204-W233 HydrophobicContact CB-CD2 4.1Å; L204-W233 HydrophobicContact CB-CG 3.81Å; L204-W233 HydrophobicContact CD1-CB 3.93Å; L204-W233 HydrophobicContact CD1-CD2 4.03Å; L204-W233 HydrophobicContact CD1-CE3 4.25Å; L204-W233 HydrophobicContact CD1-CG 3.9Å; L204-W233 HydrophobicContact CD2-CD2 4.12Å; L204-W233 HydrophobicContact CD2-CE3 4.27Å; L204-W233 HydrophobicContact CD2-CH2 4.39Å; L204-W233 HydrophobicContact CD2-CZ2 4.25Å; L204-W233 HydrophobicContact CD2-CZ3 4.4Å; L204-W233 HydrophobicContact CG-CD2 4.32Å; L204-W233 HydrophobicContact CG-CG 4.35Å; L204-W233 PolarHBondContact O-NE1 3.46Å; L204-W233 VanDerWaalsContact O-NE1 3.15Å
205	E	85.8	Confident	82.3	Confident	77 Å²	77	45.8 Å²	45.8	36%	0.36	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-31.5	173.4	-175.9	-177.5	162.5	0	0	113.5	Y200 G202 T203	Y200-E205 HydrophobicContact CE1-CB 4.37Å; Y200-E205 HydrophobicContact CE1-CG 4.49Å; Y200-E205 WeakPolarHBondContact O-CB 3.41Å; Y200-E205 PolarHBondContact O-N 2.91Å; G202-E205 PolarHBondContact N-OE2 2.94Å; T203-E205 PolarHBondContact O-N 3.21Å
206	Y	84.8	Confident	82.1	Confident	62 Å²	62	45.8 Å²	45.8	24%	0.243	21%	0.208	C	C	.	.	S	Bend	trans	-97.1	-15.3	-179.8	-51.7	-58.2	0	0	0	113.4	Y178 R181 G202 T203 L204	Y178-Y206 AromaticContact CD1-CE2 3.86Å; Y178-Y206 HydrophobicContact CD1-CE2 3.86Å; R181-Y206 HydrophobicContact CB-CD2 3.96Å; R181-Y206 HydrophobicContact CB-CE2 3.88Å; R181-Y206 HydrophobicContact CB-CG 4.36Å; R181-Y206 HydrophobicContact CG-CE1 4.26Å; R181-Y206 HydrophobicContact CG-CE2 4.21Å; G202-Y206 WeakPolarHBondContact O-CD2 3.42Å; G202-Y206 VanDerWaalsContact O-CE2 3.26Å; G202-Y206 WeakPolarHBondContact O-CE2 3.45Å; T203-Y206 PolarHBondContact O-N 2.84Å; L204-Y206 PolarHBondContact O-N 3.41Å
207	V	77.3	Confident	81.9	Confident	10 Å²	10	42.6 Å²	42.6	6%	0.061	20%	0.195	C	C	.	.	S	Bend	trans	-98.5	127.1	-178	-172.6	0	0	0	0	109.2	F180 L188 L204 L211 W233	F180-V207 HydrophobicContact CB-CG2 3.79Å; F180-V207 HydrophobicContact CD1-CG2 4.47Å; F180-V207 HydrophobicContact CD2-CG2 3.34Å; F180-V207 HydrophobicContact CE2-CG2 3.99Å; F180-V207 HydrophobicContact CG-CG2 3.62Å; L188-V207 HydrophobicContact CD2-CG1 4.25Å; L204-V207 PolarHBondContact O-N 2.92Å; L204-V207 VanDerWaalsContact O-N 3.14Å; V207-L211 HydrophobicContact CG1-CD1 4.08Å; V207-L211 HydrophobicContact CG1-CD2 3.77Å; V207-L211 HydrophobicContact CG1-CG 4.47Å; V207-W233 HydrophobicContact CB-CZ2 4.25Å; V207-W233 HydrophobicContact CG1-CZ2 4Å; V207-W233 WeakPolarHBondContact O-CZ2 3.05Å; V207-W233 PolarHBondContact O-NE1 3.3Å
208	G	66.2	Low	81.7	Confident	12 Å²	12	47.6 Å²	47.6	12%	0.124	22%	0.217	C	C	.	.	S	Bend	trans	124.7	-9	174.1	0	0	0	0	0	117
209	R	72.3	Confident	81.7	Confident	235 Å²	235	47.8 Å²	47.8	89%	0.887	22%	0.217	S	C	*	.	S	Bend	trans	-74.3	-32.7	174.7	-65.9	-173.4	-175	-173.2	2.2	113.2
210	S	74.3	Confident	81.9	Confident	41 Å²	41	45 Å²	45	29%	0.287	21%	0.207	S	C	.	.	S	Bend	trans	-121.5	1.9	-176.4	36	0	0	0	0	112.7	S184 T186	S184-S210 PolarHBondContact OG-OG 2.72Å; T186-S210 WeakPolarHBondContact CA-O 3.48Å; T186-S210 WeakPolarHBondContact CG2-O 3.44Å
211	L	77.9	Confident	82.3	Confident	6 Å²	6	43.2 Å²	43.2	3%	0.031	20%	0.2	C	C	.	.			trans	-77.1	125.9	-171	-159.5	73.8	0	0	0	111.4	L185 L188 V207 I214 W233 I237	L185-L211 HydrophobicContact CB-CD1 4.37Å; L185-L211 WeakPolarHBondContact O-CD1 3.47Å; L188-L211 HydrophobicContact CB-CD1 4.31Å; V207-L211 HydrophobicContact CG1-CD1 4.08Å; V207-L211 HydrophobicContact CG1-CD2 3.77Å; V207-L211 HydrophobicContact CG1-CG 4.47Å; L211-I214 HydrophobicContact CD2-CB 3.73Å; L211-I214 HydrophobicContact CD2-CD1 4.25Å; L211-I214 HydrophobicContact CD2-CG1 4.46Å; L211-I214 HydrophobicContact CD2-CG2 3.98Å; L211-I214 HydrophobicContact CG-CB 4.5Å; L211-W233 HydrophobicContact CD2-CH2 3.94Å; L211-W233 HydrophobicContact CD2-CZ2 4.1Å; L211-I237 HydrophobicContact CD2-CD1 4.05Å
212	M	71.5	Confident	82.6	Confident	56 Å²	56	39.5 Å²	39.5	28%	0.276	19%	0.186	S	C	.	.	S	Bend	trans	-102.7	-30.3	173.1	-63.7	-175.3	177.5	0	0	112.2	T186 A241 L242 L900 Y904	T186-M212 PolarHBondContact O-N 3.24Å; M212-A241 CarbonylContact O-C 3.13Å; M212-A241 VanDerWaalsContact O-CA 3.26Å; M212-A241 WeakPolarHBondContact O-CA 3.28Å; M212-L242 PolarHBondContact O-N 3Å; M212-L900 HydrophobicContact CE-CD2 4.19Å; M212-L900 HydrophobicContact SD-CD2 3.47Å; M212-L900 WeakPolarHBondContact SD-CD2 3.35Å; M212-Y904 HydrophobicContact CE-CE1 4.43Å; M212-Y904 HydrophobicContact CE-CE2 3.78Å; M212-Y904 WeakPolarHBondContact CE-OH 3.48Å
213	E	74.8	Confident	83.1	Confident	28 Å²	28	39.5 Å²	39.5	13%	0.131	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	135.4	-177.6	-171.8	168.8	-174.4	0	0	111.4	T186 H187 L188 Q215 L242 Y896	T186-E213 PolarHBondContact O-N 3.45Å; H187-E213 WeakPolarHBondContact CA-O 3.44Å; H187-E213 VanDerWaalsContact CD2-CB 3.44Å; H187-E213 WeakPolarHBondContact CD2-CB 3.28Å; H187-E213 IonicContact CD2-OE2 2.85Å; H187-E213 PolarHBondContact CD2-OE2 2.92Å; H187-E213 IonicContact NE2-OE2 2.97Å; L188-E213 PolarHBondContact N-O 3.07Å; L188-E213 VanDerWaalsContact N-O 3.14Å; E213-Q215 HydrophobicContact CG-CG 4.23Å; E213-Q215 PolarHBondContact OE1-NE2 3.05Å; E213-L242 CarbonylContact C-O 3.4Å; E213-L242 WeakPolarHBondContact CA-O 3.09Å; E213-L242 HydrophobicContact CB-CB 4.36Å; E213-L242 HydrophobicContact CG-CB 4.04Å; E213-Y896 WeakPolarHBondContact OE2-CE1 3.49Å; E213-Y896 PolarHBondContact OE2-OH 2.93Å
214	I	84.3	Confident	83	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	124.7	169.8	-168.3	176	0	0	0	110.8	L188 L211 L216 W233 I237 L242 V243 G244	L188-I214 HydrophobicContact CB-CG1 4.21Å; L188-I214 HydrophobicContact CD2-CD1 3.98Å; L188-I214 HydrophobicContact CD2-CG1 4.31Å; L188-I214 HydrophobicContact CG-CD1 4.48Å; L188-I214 HydrophobicContact CG-CG1 4.27Å; L188-I214 WeakPolarHBondContact O-CA 3.46Å; L211-I214 HydrophobicContact CD2-CB 3.73Å; L211-I214 HydrophobicContact CD2-CD1 4.25Å; L211-I214 HydrophobicContact CD2-CG1 4.46Å; L211-I214 HydrophobicContact CD2-CG2 3.98Å; L211-I214 HydrophobicContact CG-CB 4.5Å; I214-L216 HydrophobicContact CD1-CD1 3.95Å; I214-L216 HydrophobicContact CD1-CD2 4.36Å; I214-L216 HydrophobicContact CD1-CG 4.23Å; I214-L216 HydrophobicContact CG1-CD1 4.16Å; I214-L216 HydrophobicContact CG1-CD2 4.45Å; I214-L216 HydrophobicContact CG1-CG 4.04Å; I214-W233 HydrophobicContact CD1-CH2 3.61Å; I214-W233 HydrophobicContact CD1-CZ3 4.1Å; I214-W233 HydrophobicContact CG2-CH2 4.13Å; I214-W233 HydrophobicContact CG2-CZ3 4.43Å; I214-I237 HydrophobicContact CG2-CD1 4.35Å; I214-L242 PolarHBondContact N-O 2.99Å; I214-V243 HydrophobicContact CG2-CB 4.34Å; I214-V243 HydrophobicContact CG2-CG1 4.07Å; I214-V243 HydrophobicContact CG2-CG2 3.99Å; I214-G244 PolarHBondContact O-N 2.94Å
215	Q	83.8	Confident	83	Confident	34 Å²	34	43 Å²	43	16%	0.159	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	126.3	-178.3	-61.6	-173.1	-16.7	0	0	109.5	L188 D189 L190 R191 E213 E217	L188-Q215 PolarHBondContact O-N 3.48Å; D189-Q215 PolarHBondContact OD2-OE1 3.05Å; L190-Q215 PolarHBondContact N-O 3.27Å; R191-Q215 HydrophobicContact CG-CB 3.71Å; E213-Q215 HydrophobicContact CG-CG 4.23Å; E213-Q215 PolarHBondContact OE1-NE2 3.05Å; Q215-E217 WeakPolarHBondContact CA-OE2 3.47Å; Q215-E217 WeakPolarHBondContact CB-OE2 3.33Å
216	L	89.6	Confident	82.9	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.215	C	C	.	.			trans	-139.6	5.7	-165	-71.8	171.5	0	0	0	112.6	L190 L198 I214 W221 I246	L190-L216 HydrophobicContact CB-CD2 4.19Å; L190-L216 HydrophobicContact CD1-CD2 4.07Å; L198-L216 HydrophobicContact CD1-CD2 3.98Å; I214-L216 HydrophobicContact CD1-CD1 3.95Å; I214-L216 HydrophobicContact CD1-CD2 4.36Å; I214-L216 HydrophobicContact CD1-CG 4.23Å; I214-L216 HydrophobicContact CG1-CD1 4.16Å; I214-L216 HydrophobicContact CG1-CD2 4.45Å; I214-L216 HydrophobicContact CG1-CG 4.04Å; L216-W221 HydrophobicContact CB-CZ2 3.99Å; L216-W221 HydrophobicContact CD2-CH2 4.13Å; L216-W221 HydrophobicContact CD2-CZ2 3.91Å; L216-W221 HydrophobicContact CG-CZ2 4.44Å; L216-W221 PolarHBondContact O-NE1 3.09Å; L216-I246 HydrophobicContact CB-CD1 4.34Å; L216-I246 HydrophobicContact CB-CG1 3.91Å; L216-I246 HydrophobicContact CD1-CD1 3.7Å; L216-I246 HydrophobicContact CD1-CG1 4.21Å
217	E	86	Confident	83.2	Confident	52 Å²	52	41.5 Å²	41.5	24%	0.243	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	166.1	176.7	-59.7	88.2	155.4	0	0	111.8	R191 G192 Q215 N219 G244	R191-E217 VanDerWaalsContact CA-O 3.3Å; R191-E217 WeakPolarHBondContact CA-O 3.45Å; R191-E217 HydrophobicContact CG-CB 4.02Å; R191-E217 WeakPolarHBondContact CG-OE2 3Å; G192-E217 PolarHBondContact N-O 2.81Å; Q215-E217 WeakPolarHBondContact CA-OE2 3.47Å; Q215-E217 WeakPolarHBondContact CB-OE2 3.33Å; E217-N219 PolarHBondContact O-N 2.97Å; E217-N219 PolarHBondContact O-ND2 3.49Å; E217-G244 WeakPolarHBondContact OE1-CA 3.38Å
218	E	86.1	Confident	83.7	Confident	131 Å²	131	41 Å²	41	61%	0.612	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.4	21.1	172.8	-61	179.8	-130.4	0	0	115.1
219	N	91.1	Very high	84.6	Confident	7 Å²	7	41.2 Å²	41.2	4%	0.037	20%	0.198	C	C	.	.	S	Bend	trans	-102.9	143.7	173.5	-83.2	-95.4	0	0	0	110.7	L190 N193 L195 E217 W221	L190-N219 PolarHBondContact O-ND2 2.92Å; N193-N219 WeakPolarHBondContact CA-OD1 3.37Å; N193-N219 WeakPolarHBondContact CB-OD1 3.17Å; N193-N219 PolarHBondContact O-OD1 2.74Å; L195-N219 HydrophobicContact CB-CB 4.34Å; L195-N219 WeakPolarHBondContact CB-OD1 3.29Å; L195-N219 WeakPolarHBondContact CG-OD1 3.19Å; L195-N219 PolarHBondContact N-OD1 2.9Å; E217-N219 PolarHBondContact O-N 2.97Å; E217-N219 PolarHBondContact O-ND2 3.49Å; N219-W221 HydrophobicContact CB-CD2 4.3Å; N219-W221 HydrophobicContact CB-CZ2 3.76Å; N219-W221 PolarHBondContact O-N 3.43Å
220	P	90.5	Very high	85.4	Confident	28 Å²	28	30 Å²	30	18%	0.182	16%	0.156	C	C	.	.			trans	-79.3	64.6	-176.1	34.4	-38	0	0	0	112.2	N193 L195 K196 N222 E249	N193-P220 VanDerWaalsContact O-CD 3.28Å; N193-P220 WeakPolarHBondContact O-CD 3.12Å; L195-P220 CarbonylContact O-C 3.54Å; L195-P220 WeakPolarHBondContact O-CD 3.45Å; K196-P220 HydrophobicContact CG-CG 4.46Å; P220-N222 PolarHBondContact O-N 3.14Å; P220-E249 HydrophobicContact CB-CB 4.28Å; P220-E249 HydrophobicContact CB-CG 4.09Å
221	W	93.3	Very high	86.1	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	124.6	-173.7	-65.1	109.5	0	0	0	112.5	L195 L198 L216 N219 I227 L230 I246 E249 T250	L195-W221 HydrophobicContact CB-CH2 3.71Å; L195-W221 HydrophobicContact CB-CZ2 4.3Å; L195-W221 HydrophobicContact CB-CZ3 3.97Å; L195-W221 HydrophobicContact CD1-CH2 4.06Å; L198-W221 HydrophobicContact CD1-CH2 3.72Å; L198-W221 HydrophobicContact CD1-CZ3 4.24Å; L198-W221 HydrophobicContact CG-CH2 3.9Å; L198-W221 HydrophobicContact CG-CZ3 3.98Å; L216-W221 HydrophobicContact CB-CZ2 3.99Å; L216-W221 HydrophobicContact CD2-CH2 4.13Å; L216-W221 HydrophobicContact CD2-CZ2 3.91Å; L216-W221 HydrophobicContact CG-CZ2 4.44Å; L216-W221 PolarHBondContact O-NE1 3.09Å; N219-W221 HydrophobicContact CB-CD2 4.3Å; N219-W221 HydrophobicContact CB-CZ2 3.76Å; N219-W221 PolarHBondContact O-N 3.43Å; W221-I227 HydrophobicContact CB-CD1 4.18Å; W221-I227 HydrophobicContact CE3-CD1 4Å; W221-L230 HydrophobicContact CE3-CD2 4.05Å; W221-L230 HydrophobicContact CH2-CD2 4.15Å; W221-L230 HydrophobicContact CZ3-CD2 3.76Å; W221-I246 HydrophobicContact CD2-CG2 3.95Å; W221-I246 HydrophobicContact CG-CG2 3.83Å; W221-E249 PolarHBondContact O-N 2.92Å; W221-T250 PolarHBondContact O-N 3.48Å; W221-T250 VanDerWaalsContact O-N 3.07Å
222	N	90.4	Very high	86.4	Confident	41 Å²	41	28.7 Å²	28.7	22%	0.219	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	91.5	178	-177	22.8	0	0	0	109.5	K196 P220 V224 T250	K196-N222 HydrophobicContact CB-CB 3.96Å; K196-N222 PolarHBondContact O-N 3.34Å; P220-N222 PolarHBondContact O-N 3.14Å; N222-V224 WeakPolarHBondContact ND2-CG2 3.5Å; N222-V224 PolarHBondContact O-N 2.84Å; N222-V224 WeakPolarHBondContact OD1-CG1 3.32Å; N222-T250 CarbonylContact C-O 3.55Å; N222-T250 WeakPolarHBondContact CA-OG1 3.11Å; N222-T250 PolarHBondContact OD1-OG1 2.82Å
223	C	90.4	Very high	87.1	Confident	1 Å²	1	26.5 Å²	26.5	1%	0.007	13%	0.134	C	C	.	.			trans	-77.2	52.8	-177.4	-64.7	0	0	0	0	113.2	I227 C248 T250 P251 L254 L267	C223-I227 HydrophobicContact CB-CG2 4.4Å; C223-C248 HydrophobicContact CB-CB 3.72Å; C223-C248 WeakPolarHBondContact CB-SG 3.43Å; C223-C248 WeakPolarHBondContact SG-CB 3.27Å; C223-C248 CovalentContact SG-SG 2.02Å; C223-C248 PolarHBondContact SG-SG 2.99Å; C223-T250 WeakPolarHBondContact CB-O 3.29Å; C223-T250 PolarHBondContact N-O 2.96Å; C223-P251 WeakPolarHBondContact O-CD 3.2Å; C223-L254 HydrophobicContact CB-CB 4.49Å; C223-L254 HydrophobicContact CB-CD1 3.99Å; C223-L254 VanDerWaalsContact O-CD1 3.27Å; C223-L254 WeakPolarHBondContact O-CD1 3.38Å; C223-L267 HydrophobicContact CB-CD2 3.76Å; C223-L267 VanDerWaalsContact O-CD2 3.28Å; C223-L267 WeakPolarHBondContact O-CD2 3.35Å
224	V	87.1	Confident	87.6	Confident	51 Å²	51	26.1 Å²	26.1	31%	0.309	13%	0.133	S	C	.	.	S	Bend	trans	-96.7	176.4	163	-63.7	0	0	0	0	110	N222 E226 I227 L267	N222-V224 WeakPolarHBondContact ND2-CG2 3.5Å; N222-V224 PolarHBondContact O-N 2.84Å; N222-V224 WeakPolarHBondContact OD1-CG1 3.32Å; V224-E226 PolarHBondContact O-N 3.14Å; V224-I227 WeakPolarHBondContact O-CG2 3.5Å; V224-I227 PolarHBondContact O-N 3.44Å; V224-L267 CarbonylContact C-O 3.43Å
225	C	85.7	Confident	87.5	Confident	30 Å²	30	31.1 Å²	31.1	20%	0.203	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-50.6	-30	-170.4	-172.8	0	0	0	0	115.9	I227 V228 L267 C268	C225-I227 VanDerWaalsContact C-N 3.26Å; C225-I227 PolarHBondContact O-N 3.05Å; C225-V228 WeakPolarHBondContact O-CB 3.22Å; C225-V228 WeakPolarHBondContact O-CG2 3.34Å; C225-V228 PolarHBondContact O-N 2.97Å; C225-L267 WeakPolarHBondContact CA-O 3.43Å; C225-L267 WeakPolarHBondContact CB-O 3.24Å; C225-L267 PolarHBondContact N-O 3.12Å; C225-C268 WeakPolarHBondContact CA-SG 3.44Å; C225-C268 HydrophobicContact CB-CB 3.88Å; C225-C268 WeakPolarHBondContact CB-SG 3.47Å; C225-C268 PolarHBondContact O-SG 2.98Å; C225-C268 WeakPolarHBondContact SG-CB 3.43Å; C225-C268 CovalentContact SG-SG 2.03Å; C225-C268 PolarHBondContact SG-SG 3.08Å
226	E	84.9	Confident	87.2	Confident	108 Å²	108	34.7 Å²	34.7	51%	0.505	17%	0.168	S	C	.	.	G	3₁₀ helix	trans	-57.8	-33.9	175.1	-66.8	-178.7	-175.9	0	0	113.9	T197 V224 V228	T197-E226 HydrophobicContact CG2-CB 3.98Å; V224-E226 PolarHBondContact O-N 3.14Å; E226-V228 PolarHBondContact O-N 3.17Å
227	I	89.4	Confident	86.4	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-71.8	-11.4	-176.5	-144.8	168.7	0	0	0	113	T197 W221 C223 V224 C225 Q229 L230 K231 L259 L267	T197-I227 HydrophobicContact CG2-CB 4.32Å; T197-I227 HydrophobicContact CG2-CG1 4.43Å; W221-I227 HydrophobicContact CB-CD1 4.18Å; W221-I227 HydrophobicContact CE3-CD1 4Å; C223-I227 HydrophobicContact CB-CG2 4.4Å; V224-I227 WeakPolarHBondContact O-CG2 3.5Å; V224-I227 PolarHBondContact O-N 3.44Å; C225-I227 VanDerWaalsContact C-N 3.26Å; C225-I227 PolarHBondContact O-N 3.05Å; I227-Q229 PolarHBondContact O-N 3.21Å; I227-Q229 VanDerWaalsContact O-N 3.12Å; I227-L230 HydrophobicContact CD1-CD2 4.42Å; I227-L230 HydrophobicContact CG1-CB 4.2Å; I227-L230 HydrophobicContact CG1-CD2 4.14Å; I227-L230 WeakPolarHBondContact O-CB 3.22Å; I227-L230 PolarHBondContact O-N 3.13Å; I227-K231 PolarHBondContact O-N 2.96Å; I227-L259 HydrophobicContact CD1-CD1 4.43Å; I227-L259 HydrophobicContact CD1-CD2 3.88Å; I227-L259 HydrophobicContact CG1-CD1 4.46Å; I227-L259 HydrophobicContact CG1-CD2 3.84Å; I227-L259 HydrophobicContact CG2-CD1 3.54Å; I227-L259 HydrophobicContact CG2-CD2 4.42Å; I227-L267 HydrophobicContact CG2-CD1 4.05Å; I227-L267 HydrophobicContact CG2-CD2 3.97Å
228	V	87.5	Confident	85.4	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.9	-21.7	178.8	176.8	0	0	0	0	111.9	C225 E226 T232 R264 L267 C268 I276 L280	C225-V228 WeakPolarHBondContact O-CB 3.22Å; C225-V228 WeakPolarHBondContact O-CG2 3.34Å; C225-V228 PolarHBondContact O-N 2.97Å; E226-V228 PolarHBondContact O-N 3.17Å; V228-T232 VanDerWaalsContact O-CB 3.29Å; V228-T232 WeakPolarHBondContact O-CB 3.49Å; V228-T232 PolarHBondContact O-N 3.08Å; V228-T232 PolarHBondContact O-OG1 3.43Å; V228-R264 HydrophobicContact CG1-CG 4.04Å; V228-L267 HydrophobicContact CG2-CB 3.6Å; V228-L267 HydrophobicContact CG2-CD1 3.73Å; V228-L267 HydrophobicContact CG2-CG 4.31Å; V228-C268 VanDerWaalsContact CG2-SG 3.58Å; V228-I276 HydrophobicContact CB-CG2 4.47Å; V228-I276 HydrophobicContact CG1-CG2 3.77Å; V228-L280 HydrophobicContact CB-CD1 4.25Å
229	Q	86.4	Confident	83.9	Confident	16 Å²	16	40.4 Å²	40.4	8%	0.075	19%	0.192	C	C	.	.	H	α-helix	trans	-61	-53.4	167.9	-68.8	-176.3	71.6	0	0	112.1	I227 T232 W233 L280	I227-Q229 PolarHBondContact O-N 3.21Å; I227-Q229 VanDerWaalsContact O-N 3.12Å; Q229-T232 PolarHBondContact O-N 2.81Å; Q229-W233 PolarHBondContact O-N 3.16Å; Q229-L280 HydrophobicContact CG-CB 3.9Å; Q229-L280 HydrophobicContact CG-CD1 4.08Å; Q229-L280 HydrophobicContact CG-CG 4.44Å
230	L	89.3	Confident	82.2	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-60.5	-45.3	174.7	175.2	59.5	0	0	0	110.8	L198 L204 W221 I227 T232 W233 L234 I246 L259	L198-L230 HydrophobicContact CB-CB 4.38Å; L198-L230 HydrophobicContact CB-CD1 4.35Å; L198-L230 HydrophobicContact CB-CD2 4.38Å; L198-L230 HydrophobicContact CD1-CD1 4.26Å; L198-L230 HydrophobicContact CD1-CD2 4.47Å; L204-L230 HydrophobicContact CD1-CB 4.34Å; L204-L230 HydrophobicContact CD1-CD1 3.78Å; W221-L230 HydrophobicContact CE3-CD2 4.05Å; W221-L230 HydrophobicContact CH2-CD2 4.15Å; W221-L230 HydrophobicContact CZ3-CD2 3.76Å; I227-L230 HydrophobicContact CD1-CD2 4.42Å; I227-L230 HydrophobicContact CG1-CB 4.2Å; I227-L230 HydrophobicContact CG1-CD2 4.14Å; I227-L230 WeakPolarHBondContact O-CB 3.22Å; I227-L230 PolarHBondContact O-N 3.13Å; L230-T232 VanDerWaalsContact C-N 3.32Å; L230-T232 PolarHBondContact O-N 2.97Å; L230-W233 HydrophobicContact CD1-CE3 3.96Å; L230-W233 HydrophobicContact CD1-CZ3 4.42Å; L230-W233 WeakPolarHBondContact O-CB 3.23Å; L230-W233 PolarHBondContact O-N 2.85Å; L230-W233 VanDerWaalsContact O-N 3.12Å; L230-L234 HydrophobicContact CD1-CD1 4.27Å; L230-L234 HydrophobicContact CD1-CG 4.2Å; L230-L234 HydrophobicContact CG-CD1 4.09Å; L230-L234 HydrophobicContact CG-CG 4.49Å; L230-L234 VanDerWaalsContact O-CG 3.27Å; L230-L234 WeakPolarHBondContact O-CG 3.46Å; L230-L234 PolarHBondContact O-N 3Å; L230-I246 HydrophobicContact CD2-CD1 4.48Å; L230-I246 HydrophobicContact CD2-CG2 4.41Å; L230-L259 HydrophobicContact CB-CD2 4.31Å; L230-L259 HydrophobicContact CD2-CD2 3.85Å; L230-L259 HydrophobicContact CG-CD2 3.87Å
231	K	87.3	Confident	80.7	Confident	12 Å²	12	44.1 Å²	44.1	5%	0.052	22%	0.216	C	C	.	.	H	α-helix	trans	-56	-45.9	175.4	-165.5	-167.7	171.7	77	0	112.2	I227 W233 L234 E235 L259 R260 I262 R264 L267	I227-K231 PolarHBondContact O-N 2.96Å; K231-W233 VanDerWaalsContact C-N 3.28Å; K231-W233 PolarHBondContact O-N 3.01Å; K231-L234 PolarHBondContact O-N 2.71Å; K231-E235 WeakPolarHBondContact CE-OE1 3.41Å; K231-E235 PolarHBondContact O-N 2.87Å; K231-E235 VanDerWaalsContact O-N 3.11Å; K231-L259 HydrophobicContact CB-CD1 4.16Å; K231-L259 HydrophobicContact CB-CD2 4.39Å; K231-L259 HydrophobicContact CB-CG 4.18Å; K231-L259 HydrophobicContact CG-CD1 4.44Å; K231-L259 HydrophobicContact CG-CG 4.37Å; K231-L259 PolarHBondContact NZ-O 3.3Å; K231-R260 VanDerWaalsContact NZ-C 3.25Å; K231-R260 PolarHBondContact NZ-O 2.77Å; K231-I262 WeakPolarHBondContact CE-O 3.49Å; K231-I262 PolarHBondContact NZ-O 3.08Å; K231-R264 HydrophobicContact CD-CG 4.43Å; K231-L267 HydrophobicContact CD-CD1 4.04Å
232	T	84.4	Confident	79.3	Confident	6 Å²	6	49.4 Å²	49.4	4%	0.037	24%	0.243	C	C	.	.	H	α-helix	trans	-70.5	-24.8	-179.1	-53.6	0	0	0	0	112.7	V228 Q229 L230 R236 R264 I282	V228-T232 VanDerWaalsContact O-CB 3.29Å; V228-T232 WeakPolarHBondContact O-CB 3.49Å; V228-T232 PolarHBondContact O-N 3.08Å; V228-T232 PolarHBondContact O-OG1 3.43Å; Q229-T232 PolarHBondContact O-N 2.81Å; L230-T232 VanDerWaalsContact C-N 3.32Å; L230-T232 PolarHBondContact O-N 2.97Å; T232-R236 VanDerWaalsContact O-CD 3.3Å; T232-R236 WeakPolarHBondContact O-CD 3.45Å; T232-R236 VanDerWaalsContact O-CG 3.24Å; T232-R236 WeakPolarHBondContact O-CG 3.16Å; T232-R264 PolarHBondContact OG1-NH2 3.25Å; T232-I282 HydrophobicContact CG2-CD1 4.17Å; T232-I282 HydrophobicContact CG2-CG2 4.1Å
233	W	87.3	Confident	78.6	Confident	10 Å²	10	49 Å²	49	4%	0.038	24%	0.242	C	C	.	.	H	α-helix	trans	-73	-43.4	170	-179.8	80.7	0	0	0	112.1	Y200 L204 V207 L211 I214 Q229 L230 K231 E235 R236 I237	Y200-W233 HydrophobicContact CD2-CB 4.1Å; Y200-W233 AromaticContact CD2-CD1 4Å; Y200-W233 HydrophobicContact CD2-CG 4.43Å; Y200-W233 AromaticContact CE2-CD1 3.95Å; L204-W233 HydrophobicContact CB-CB 4.45Å; L204-W233 HydrophobicContact CB-CD2 4.1Å; L204-W233 HydrophobicContact CB-CG 3.81Å; L204-W233 HydrophobicContact CD1-CB 3.93Å; L204-W233 HydrophobicContact CD1-CD2 4.03Å; L204-W233 HydrophobicContact CD1-CE3 4.25Å; L204-W233 HydrophobicContact CD1-CG 3.9Å; L204-W233 HydrophobicContact CD2-CD2 4.12Å; L204-W233 HydrophobicContact CD2-CE3 4.27Å; L204-W233 HydrophobicContact CD2-CH2 4.39Å; L204-W233 HydrophobicContact CD2-CZ2 4.25Å; L204-W233 HydrophobicContact CD2-CZ3 4.4Å; L204-W233 HydrophobicContact CG-CD2 4.32Å; L204-W233 HydrophobicContact CG-CG 4.35Å; L204-W233 PolarHBondContact O-NE1 3.46Å; L204-W233 VanDerWaalsContact O-NE1 3.15Å; V207-W233 HydrophobicContact CB-CZ2 4.25Å; V207-W233 HydrophobicContact CG1-CZ2 4Å; V207-W233 WeakPolarHBondContact O-CZ2 3.05Å; V207-W233 PolarHBondContact O-NE1 3.3Å; L211-W233 HydrophobicContact CD2-CH2 3.94Å; L211-W233 HydrophobicContact CD2-CZ2 4.1Å; I214-W233 HydrophobicContact CD1-CH2 3.61Å; I214-W233 HydrophobicContact CD1-CZ3 4.1Å; I214-W233 HydrophobicContact CG2-CH2 4.13Å; I214-W233 HydrophobicContact CG2-CZ3 4.43Å; Q229-W233 PolarHBondContact O-N 3.16Å; L230-W233 HydrophobicContact CD1-CE3 3.96Å; L230-W233 HydrophobicContact CD1-CZ3 4.42Å; L230-W233 WeakPolarHBondContact O-CB 3.23Å; L230-W233 PolarHBondContact O-N 2.85Å; L230-W233 VanDerWaalsContact O-N 3.12Å; K231-W233 VanDerWaalsContact C-N 3.28Å; K231-W233 PolarHBondContact O-N 3.01Å; W233-E235 PolarHBondContact O-N 3.11Å; W233-R236 CarbonylContact O-C 3.55Å; W233-R236 WeakPolarHBondContact O-CA 3.31Å; W233-R236 PolarHBondContact O-N 3.31Å; W233-I237 HydrophobicContact CH2-CD1 3.59Å; W233-I237 HydrophobicContact CZ2-CD1 3.94Å; W233-I237 HydrophobicContact CZ3-CD1 4.03Å; W233-I237 PolarHBondContact O-N 2.88Å; W233-I237 VanDerWaalsContact O-N 3.11Å
234	L	85.1	Confident	77.3	Confident	21 Å²	21	49.2 Å²	49.2	11%	0.11	25%	0.245	C	C	.	.	H	α-helix	trans	-60.7	-32.5	176.2	-65.6	165	0	0	0	112.6	L230 K231 R236 I237 V243 I246 L259 R260	L230-L234 HydrophobicContact CD1-CD1 4.27Å; L230-L234 HydrophobicContact CD1-CG 4.2Å; L230-L234 HydrophobicContact CG-CD1 4.09Å; L230-L234 HydrophobicContact CG-CG 4.49Å; L230-L234 VanDerWaalsContact O-CG 3.27Å; L230-L234 WeakPolarHBondContact O-CG 3.46Å; L230-L234 PolarHBondContact O-N 3Å; K231-L234 PolarHBondContact O-N 2.71Å; L234-R236 PolarHBondContact O-N 3.09Å; L234-I237 WeakPolarHBondContact O-CG2 3.45Å; L234-V243 HydrophobicContact CD2-CG1 3.65Å; L234-I246 HydrophobicContact CD1-CD1 3.52Å; L234-I246 HydrophobicContact CD2-CD1 3.78Å; L234-I246 HydrophobicContact CG-CD1 4.27Å; L234-L259 HydrophobicContact CD1-CD2 4Å; L234-L259 HydrophobicContact CD1-CG 4.47Å; L234-R260 HydrophobicContact CD1-CG 4.36Å
235	E	81	Confident	76.5	Confident	105 Å²	105	49 Å²	49	49%	0.491	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-7	172.9	-70.5	173	-160.2	0	0	113.9	K231 W233 R264	K231-E235 WeakPolarHBondContact CE-OE1 3.41Å; K231-E235 PolarHBondContact O-N 2.87Å; K231-E235 VanDerWaalsContact O-N 3.11Å; W233-E235 PolarHBondContact O-N 3.11Å; E235-R264 VanDerWaalsContact CD-NH1 3.33Å; E235-R264 IonicContact OE1-CZ 2.79Å; E235-R264 IonicContact OE1-NH1 3.39Å; E235-R264 PolarHBondContact OE1-NH1 3.38Å; E235-R264 IonicContact OE1-NH2 3.48Å; E235-R264 IonicContact OE2-CZ 2.96Å; E235-R264 IonicContact OE2-NH1 3.74Å; E235-R264 PolarHBondContact OE2-NH1 2.71Å; E235-R264 IonicContact OE2-NH2 3.38Å; E235-R264 PolarHBondContact OE2-NH2 2.69Å
236	R	77.5	Confident	76.5	Confident	110 Å²	110	47.6 Å²	47.6	42%	0.415	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.6	-6.7	-176	-68.1	174.5	-179.3	-159.1	-2.2	114	T232 W233 L234	T232-R236 VanDerWaalsContact O-CD 3.3Å; T232-R236 WeakPolarHBondContact O-CD 3.45Å; T232-R236 VanDerWaalsContact O-CG 3.24Å; T232-R236 WeakPolarHBondContact O-CG 3.16Å; W233-R236 CarbonylContact O-C 3.55Å; W233-R236 WeakPolarHBondContact O-CA 3.31Å; W233-R236 PolarHBondContact O-N 3.31Å; L234-R236 PolarHBondContact O-N 3.09Å
237	I	73.9	Confident	76.5	Confident	27 Å²	27	44.9 Å²	44.9	14%	0.138	22%	0.222	C	C	.	.	S	Bend	trans	-71.1	149.7	178.8	-158	170.6	0	0	0	110.6	L211 I214 W233 L234 Y239 A241 V243	L211-I237 HydrophobicContact CD2-CD1 4.05Å; I214-I237 HydrophobicContact CG2-CD1 4.35Å; W233-I237 HydrophobicContact CH2-CD1 3.59Å; W233-I237 HydrophobicContact CZ2-CD1 3.94Å; W233-I237 HydrophobicContact CZ3-CD1 4.03Å; W233-I237 PolarHBondContact O-N 2.88Å; W233-I237 VanDerWaalsContact O-N 3.11Å; L234-I237 WeakPolarHBondContact O-CG2 3.45Å; I237-Y239 PolarHBondContact O-N 3.21Å; I237-A241 HydrophobicContact CD1-CB 3.9Å; I237-A241 HydrophobicContact CG1-CB 3.94Å; I237-V243 HydrophobicContact CD1-CG2 3.85Å; I237-V243 HydrophobicContact CG2-CG2 4.29Å
238	P	64.1	Low	76.4	Confident	52 Å²	52	45 Å²	45	34%	0.338	22%	0.223	S	C	.	.			trans	-54.5	134.7	171.6	-28.5	36.5	0	0	0	112.1	T240 A241	P238-T240 PolarHBondContact O-N 3.11Å; P238-T240 VanDerWaalsContact O-N 3.08Å; P238-A241 VanDerWaalsContact O-CB 3.28Å; P238-A241 WeakPolarHBondContact O-CB 3.46Å; P238-A241 PolarHBondContact O-N 3.44Å
239	Y	56.1	Low	76.3	Confident	224 Å²	224	49.8 Å²	49.8	88%	0.878	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	-11.8	179.1	62.2	-93.5	0	0	0	113.9	I237	I237-Y239 PolarHBondContact O-N 3.21Å
240	T	53.7	Low	75.9	Confident	99 Å²	99	51.8 Å²	51.8	61%	0.607	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-12.2	171.9	53.7	0	0	0	0	113.1	P238	P238-T240 PolarHBondContact O-N 3.11Å; P238-T240 VanDerWaalsContact O-N 3.08Å
241	A	60.3	Low	75.5	Confident	13 Å²	13	53.3 Å²	53.3	11%	0.107	27%	0.269	C	S	.	.	S	Bend	trans	-77	127	179.5	0	0	0	0	0	110.5	M212 I237 P238 V243	M212-A241 CarbonylContact O-C 3.13Å; M212-A241 VanDerWaalsContact O-CA 3.26Å; M212-A241 WeakPolarHBondContact O-CA 3.28Å; I237-A241 HydrophobicContact CD1-CB 3.9Å; I237-A241 HydrophobicContact CG1-CB 3.94Å; P238-A241 VanDerWaalsContact O-CB 3.28Å; P238-A241 WeakPolarHBondContact O-CB 3.46Å; P238-A241 PolarHBondContact O-N 3.44Å; A241-V243 HydrophobicContact CB-CG2 4.43Å; A241-V243 PolarHBondContact O-N 3.28Å
242	L	63.9	Low	74.6	Confident	111 Å²	111	61.9 Å²	61.9	58%	0.581	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.7	117.6	171.2	-65.3	177.3	0	0	0	108.7	M212 E213 I214	M212-L242 PolarHBondContact O-N 3Å; E213-L242 CarbonylContact C-O 3.4Å; E213-L242 WeakPolarHBondContact CA-O 3.09Å; E213-L242 HydrophobicContact CB-CB 4.36Å; E213-L242 HydrophobicContact CG-CB 4.04Å; I214-L242 PolarHBondContact N-O 2.99Å
243	V	75.9	Confident	74.2	Confident	32 Å²	32	67.9 Å²	67.9	19%	0.194	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	117.1	-177	-175.7	0	0	0	0	110.4	I214 L234 I237 A241 R260	I214-V243 HydrophobicContact CG2-CB 4.34Å; I214-V243 HydrophobicContact CG2-CG1 4.07Å; I214-V243 HydrophobicContact CG2-CG2 3.99Å; L234-V243 HydrophobicContact CD2-CG1 3.65Å; I237-V243 HydrophobicContact CD1-CG2 3.85Å; I237-V243 HydrophobicContact CG2-CG2 4.29Å; A241-V243 HydrophobicContact CB-CG2 4.43Å; A241-V243 PolarHBondContact O-N 3.28Å; V243-R260 PolarHBondContact O-NH1 2.83Å
244	G	62.5	Low	73.8	Confident	7 Å²	7	67.6 Å²	67.6	7%	0.072	33%	0.333	C	S	.	.			trans	-55.3	161.7	177	0	0	0	0	0	114.7	I214 E217 I246	I214-G244 PolarHBondContact O-N 2.94Å; E217-G244 WeakPolarHBondContact OE1-CA 3.38Å; G244-I246 PolarHBondContact O-N 2.97Å
245	E	69.6	Low	73.4	Confident	47 Å²	47	69.5 Å²	69.5	22%	0.22	34%	0.341	C	S	.	.			trans	-82	118	-175.9	-52.7	-151.6	142.1	0	0	111.9	T247 R260 K399 Y401	E245-T247 PolarHBondContact O-N 3.41Å; E245-R260 IonicContact OE1-NH2 2.77Å; E245-K399 IonicContact OE1-NZ 3.2Å; E245-K399 PolarHBondContact OE1-NZ 2.98Å; E245-Y401 PolarHBondContact OE1-OH 3.31Å; E245-Y401 WeakPolarHBondContact OE2-CE1 3.48Å; E245-Y401 VanDerWaalsContact OE2-CZ 3.27Å; E245-Y401 PolarHBondContact OE2-OH 3.4Å
246	I	86.1	Confident	73	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	32%	0.321	C	S	.	.			trans	-98.3	80.7	-173.3	-61.5	164.4	0	0	0	108.1	L216 W221 L230 L234 G244 D258 L259	L216-I246 HydrophobicContact CB-CD1 4.34Å; L216-I246 HydrophobicContact CB-CG1 3.91Å; L216-I246 HydrophobicContact CD1-CD1 3.7Å; L216-I246 HydrophobicContact CD1-CG1 4.21Å; W221-I246 HydrophobicContact CD2-CG2 3.95Å; W221-I246 HydrophobicContact CG-CG2 3.83Å; L230-I246 HydrophobicContact CD2-CD1 4.48Å; L230-I246 HydrophobicContact CD2-CG2 4.41Å; L234-I246 HydrophobicContact CD1-CD1 3.52Å; L234-I246 HydrophobicContact CD2-CD1 3.78Å; L234-I246 HydrophobicContact CG-CD1 4.27Å; G244-I246 PolarHBondContact O-N 2.97Å; I246-D258 WeakPolarHBondContact O-CA 3.33Å; I246-L259 HydrophobicContact CB-CB 4.18Å; I246-L259 HydrophobicContact CG2-CB 3.75Å; I246-L259 HydrophobicContact CG2-CD2 3.87Å; I246-L259 HydrophobicContact CG2-CG 4.47Å; I246-L259 PolarHBondContact O-N 2.98Å
247	T	84.8	Confident	72.7	Confident	50 Å²	50	61.5 Å²	61.5	31%	0.307	31%	0.309	S	S	.	.	B	Isolated β-bridge	trans	-79.9	127.5	178.1	45.3	0	0	0	0	111.1	E245 E249 K257	E245-T247 PolarHBondContact O-N 3.41Å; T247-E249 PolarHBondContact O-N 3.23Å; T247-K257 WeakPolarHBondContact CA-O 3.4Å
248	C	87	Confident	73	Confident	2 Å²	2	60.8 Å²	60.8	1%	0.014	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	130.2	175.5	-60.5	0	0	0	0	111.3	C223 L254 H255 G256 K257 I262	C223-C248 HydrophobicContact CB-CB 3.72Å; C223-C248 WeakPolarHBondContact CB-SG 3.43Å; C223-C248 WeakPolarHBondContact SG-CB 3.27Å; C223-C248 CovalentContact SG-SG 2.02Å; C223-C248 PolarHBondContact SG-SG 2.99Å; C248-L254 HydrophobicContact CB-CB 4.32Å; C248-L254 WeakPolarHBondContact CB-O 3.45Å; C248-H255 CarbonylContact O-C 3.54Å; C248-H255 VanDerWaalsContact O-CA 3.31Å; C248-H255 WeakPolarHBondContact O-CA 3.48Å; C248-G256 PolarHBondContact O-N 2.88Å; C248-K257 PolarHBondContact N-O 2.72Å; C248-I262 WeakPolarHBondContact SG-CD1 3.38Å
249	E	85.7	Confident	74	Confident	101 Å²	101	58.3 Å²	58.3	47%	0.472	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	-38.8	170.5	-179.2	69.8	-174.9	0	0	110.3	P220 W221 T247 H255	P220-E249 HydrophobicContact CB-CB 4.28Å; P220-E249 HydrophobicContact CB-CG 4.09Å; W221-E249 PolarHBondContact O-N 2.92Å; T247-E249 PolarHBondContact O-N 3.23Å; E249-H255 PolarHBondContact O-CD2 3.34Å; E249-H255 VanDerWaalsContact O-CD2 3.28Å
250	T	79.3	Confident	75.2	Confident	59 Å²	59	52 Å²	52	36%	0.362	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	157.2	179.2	42.1	0	0	0	0	110.3	W221 N222 C223	W221-T250 PolarHBondContact O-N 3.48Å; W221-T250 VanDerWaalsContact O-N 3.07Å; N222-T250 CarbonylContact C-O 3.55Å; N222-T250 WeakPolarHBondContact CA-OG1 3.11Å; N222-T250 PolarHBondContact OD1-OG1 2.82Å; C223-T250 WeakPolarHBondContact CB-O 3.29Å; C223-T250 PolarHBondContact N-O 2.96Å
251	P	79.6	Confident	76.3	Confident	32 Å²	32	49.9 Å²	49.9	21%	0.208	25%	0.248	C	C	.	.	S	Bend	cis	-71.5	163.9	-12.5	33	-37.2	0	0	0	112.5	C223 H253 L254 H255	C223-P251 WeakPolarHBondContact O-CD 3.2Å; P251-H253 VanDerWaalsContact C-N 3.26Å; P251-H253 WeakPolarHBondContact CG-CE1 3.4Å; P251-H253 PolarHBondContact O-N 3.1Å; P251-L254 HydrophobicContact CG-CD1 4.22Å; P251-L254 HydrophobicContact CG-CG 4.33Å; P251-L254 PolarHBondContact O-N 2.94Å; P251-H255 PolarHBondContact O-N 3.3Å; P251-H255 VanDerWaalsContact O-N 3.14Å
252	F	69.3	Low	77.2	Confident	191 Å²	191	49.4 Å²	49.4	84%	0.838	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-50.5	-36.5	-174.5	-178.5	-100.3	0	0	0	115.1	L254 H255	F252-L254 PolarHBondContact O-N 2.93Å; F252-H255 WeakPolarHBondContact O-CB 3.18Å; F252-H255 PolarHBondContact O-N 3.5Å
253	H	76.7	Confident	78	Confident	132 Å²	132	50.4 Å²	50.4	61%	0.611	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-74.2	-6.8	179.3	62.5	-95.6	0	0	0	114.5	P251	P251-H253 VanDerWaalsContact C-N 3.26Å; P251-H253 WeakPolarHBondContact CG-CE1 3.4Å; P251-H253 PolarHBondContact O-N 3.1Å
254	L	79.1	Confident	78.2	Confident	4 Å²	4	51.9 Å²	51.9	2%	0.021	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-115.2	-4.9	170.9	-59.2	179.1	0	0	0	112.7	C223 C248 P251 F252 G256 K257 I262 L267	C223-L254 HydrophobicContact CB-CB 4.49Å; C223-L254 HydrophobicContact CB-CD1 3.99Å; C223-L254 VanDerWaalsContact O-CD1 3.27Å; C223-L254 WeakPolarHBondContact O-CD1 3.38Å; C248-L254 HydrophobicContact CB-CB 4.32Å; C248-L254 WeakPolarHBondContact CB-O 3.45Å; P251-L254 HydrophobicContact CG-CD1 4.22Å; P251-L254 HydrophobicContact CG-CG 4.33Å; P251-L254 PolarHBondContact O-N 2.94Å; F252-L254 PolarHBondContact O-N 2.93Å; L254-G256 PolarHBondContact O-N 2.91Å; L254-K257 HydrophobicContact CD2-CD 3.94Å; L254-K257 WeakPolarHBondContact O-CB 3.5Å; L254-K257 PolarHBondContact O-N 3.32Å; L254-I262 HydrophobicContact CB-CD1 4.22Å; L254-I262 HydrophobicContact CD1-CD1 4.27Å; L254-I262 HydrophobicContact CD1-CG2 4.29Å; L254-I262 HydrophobicContact CD2-CD1 4.23Å; L254-I262 HydrophobicContact CD2-CG1 4.47Å; L254-I262 HydrophobicContact CD2-CG2 4.03Å; L254-I262 HydrophobicContact CG-CD1 4.46Å; L254-L267 HydrophobicContact CD1-CD2 3.85Å
255	H	75.9	Confident	78.9	Confident	61 Å²	61	55 Å²	55	28%	0.282	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	129.9	-177.5	175.1	-71.9	0	0	0	112	C248 E249 P251 F252 K257 D381	C248-H255 CarbonylContact O-C 3.54Å; C248-H255 VanDerWaalsContact O-CA 3.31Å; C248-H255 WeakPolarHBondContact O-CA 3.48Å; E249-H255 PolarHBondContact O-CD2 3.34Å; E249-H255 VanDerWaalsContact O-CD2 3.28Å; P251-H255 PolarHBondContact O-N 3.3Å; P251-H255 VanDerWaalsContact O-N 3.14Å; F252-H255 WeakPolarHBondContact O-CB 3.18Å; F252-H255 PolarHBondContact O-N 3.5Å; H255-K257 VanDerWaalsContact C-N 3.31Å; H255-K257 PolarHBondContact O-N 3.25Å; H255-D381 IonicContact CE1-OD2 3.26Å; H255-D381 PolarHBondContact CE1-OD2 3.44Å
256	G	71.6	Confident	79.4	Confident	7 Å²	7	56.4 Å²	56.4	7%	0.072	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	-6.8	-179.7	0	0	0	0	0	115.7	C248 L254 N378	C248-G256 PolarHBondContact O-N 2.88Å; L254-G256 PolarHBondContact O-N 2.91Å; G256-N378 PolarHBondContact O-ND2 3.49Å
257	K	71.7	Confident	79.3	Confident	40 Å²	40	56.7 Å²	56.7	17%	0.174	27%	0.274	C	S	.	.			trans	-78.4	147	174.2	-63.7	-179	-177.8	175.3	0	111.3	T247 C248 L254 H255 I262 I365	T247-K257 WeakPolarHBondContact CA-O 3.4Å; C248-K257 PolarHBondContact N-O 2.72Å; L254-K257 HydrophobicContact CD2-CD 3.94Å; L254-K257 WeakPolarHBondContact O-CB 3.5Å; L254-K257 PolarHBondContact O-N 3.32Å; H255-K257 VanDerWaalsContact C-N 3.31Å; H255-K257 PolarHBondContact O-N 3.25Å; K257-I262 HydrophobicContact CB-CD1 3.85Å; K257-I262 HydrophobicContact CB-CG1 3.96Å; K257-I262 HydrophobicContact CD-CD1 4.32Å; K257-I262 HydrophobicContact CD-CG1 4.01Å; K257-I365 HydrophobicContact CG-CD1 4.13Å
258	D	79.8	Confident	79.2	Confident	12 Å²	12	54.5 Å²	54.5	6%	0.064	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-76.6	130.5	170.4	-174.9	-37.4	0	0	0	110.3	I246 R260 E261 I262	I246-D258 WeakPolarHBondContact O-CA 3.33Å; D258-R260 PolarHBondContact O-N 3.34Å; D258-R260 VanDerWaalsContact O-N 3.12Å; D258-R260 WeakPolarHBondContact OD1-CB 3.36Å; D258-R260 VanDerWaalsContact OD1-CG 3.31Å; D258-R260 WeakPolarHBondContact OD1-CG 3.1Å; D258-R260 PolarHBondContact OD1-N 2.93Å; D258-R260 IonicContact OD1-NE 2.7Å; D258-R260 PolarHBondContact OD1-NE 3.09Å; D258-R260 VanDerWaalsContact OD1-NE 3.17Å; D258-R260 IonicContact OD2-CZ 3.04Å; D258-R260 VanDerWaalsContact OD2-CZ 3.26Å; D258-R260 IonicContact OD2-NE 3.58Å; D258-R260 PolarHBondContact OD2-NE 3.41Å; D258-R260 IonicContact OD2-NH2 2.87Å; D258-R260 PolarHBondContact OD2-NH2 2.97Å; D258-E261 HydrophobicContact CB-CG 4.17Å; D258-E261 PolarHBondContact O-N 3.06Å; D258-I262 PolarHBondContact O-N 3.08Å
259	L	86	Confident	78.5	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-29.5	177.5	178	60.2	0	0	0	113.7	I227 L230 K231 L234 I246 E261 L267	I227-L259 HydrophobicContact CD1-CD1 4.43Å; I227-L259 HydrophobicContact CD1-CD2 3.88Å; I227-L259 HydrophobicContact CG1-CD1 4.46Å; I227-L259 HydrophobicContact CG1-CD2 3.84Å; I227-L259 HydrophobicContact CG2-CD1 3.54Å; I227-L259 HydrophobicContact CG2-CD2 4.42Å; L230-L259 HydrophobicContact CB-CD2 4.31Å; L230-L259 HydrophobicContact CD2-CD2 3.85Å; L230-L259 HydrophobicContact CG-CD2 3.87Å; K231-L259 HydrophobicContact CB-CD1 4.16Å; K231-L259 HydrophobicContact CB-CD2 4.39Å; K231-L259 HydrophobicContact CB-CG 4.18Å; K231-L259 HydrophobicContact CG-CD1 4.44Å; K231-L259 HydrophobicContact CG-CG 4.37Å; K231-L259 PolarHBondContact NZ-O 3.3Å; L234-L259 HydrophobicContact CD1-CD2 4Å; L234-L259 HydrophobicContact CD1-CG 4.47Å; I246-L259 HydrophobicContact CB-CB 4.18Å; I246-L259 HydrophobicContact CG2-CB 3.75Å; I246-L259 HydrophobicContact CG2-CD2 3.87Å; I246-L259 HydrophobicContact CG2-CG 4.47Å; I246-L259 PolarHBondContact O-N 2.98Å; L259-E261 VanDerWaalsContact C-N 3.26Å; L259-E261 PolarHBondContact O-N 3.3Å; L259-L267 HydrophobicContact CD1-CD1 3.79Å; L259-L267 HydrophobicContact CD1-CD2 4.31Å
260	R	81.6	Confident	77.5	Confident	93 Å²	93	62.5 Å²	62.5	35%	0.351	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-30.3	176.4	-64	175.9	-75.2	-154.3	4.2	111.7	K231 L234 V243 E245 D258	K231-R260 VanDerWaalsContact NZ-C 3.25Å; K231-R260 PolarHBondContact NZ-O 2.77Å; L234-R260 HydrophobicContact CD1-CG 4.36Å; V243-R260 PolarHBondContact O-NH1 2.83Å; E245-R260 IonicContact OE1-NH2 2.77Å; D258-R260 PolarHBondContact O-N 3.34Å; D258-R260 VanDerWaalsContact O-N 3.12Å; D258-R260 WeakPolarHBondContact OD1-CB 3.36Å; D258-R260 VanDerWaalsContact OD1-CG 3.31Å; D258-R260 WeakPolarHBondContact OD1-CG 3.1Å; D258-R260 PolarHBondContact OD1-N 2.93Å; D258-R260 IonicContact OD1-NE 2.7Å; D258-R260 PolarHBondContact OD1-NE 3.09Å; D258-R260 VanDerWaalsContact OD1-NE 3.17Å; D258-R260 IonicContact OD2-CZ 3.04Å; D258-R260 VanDerWaalsContact OD2-CZ 3.26Å; D258-R260 IonicContact OD2-NE 3.58Å; D258-R260 PolarHBondContact OD2-NE 3.41Å; D258-R260 IonicContact OD2-NH2 2.87Å; D258-R260 PolarHBondContact OD2-NH2 2.97Å
261	E	76.4	Confident	76.7	Confident	54 Å²	54	61.8 Å²	61.8	25%	0.252	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-26.4	-175.7	-57.6	-175.5	160.4	0	0	113.6	D258 L259 N367 H369	D258-E261 HydrophobicContact CB-CG 4.17Å; D258-E261 PolarHBondContact O-N 3.06Å; L259-E261 VanDerWaalsContact C-N 3.26Å; L259-E261 PolarHBondContact O-N 3.3Å; E261-N367 PolarHBondContact OE2-ND2 3.13Å; E261-H369 IonicContact OE1-CE1 2.69Å; E261-H369 PolarHBondContact OE1-CE1 3.04Å; E261-H369 IonicContact OE1-NE2 3.9Å; E261-H369 PolarHBondContact OE1-NE2 3.24Å
262	I	78.8	Confident	76	Confident	3 Å²	3	64.2 Å²	64.2	2%	0.015	32%	0.319	C	S	.	.	S	Bend	trans	-76.1	134.7	-177.2	-53.5	164.9	0	0	0	111.2	K231 C248 L254 K257 D258 E266 L267	K231-I262 WeakPolarHBondContact CE-O 3.49Å; K231-I262 PolarHBondContact NZ-O 3.08Å; C248-I262 WeakPolarHBondContact SG-CD1 3.38Å; L254-I262 HydrophobicContact CB-CD1 4.22Å; L254-I262 HydrophobicContact CD1-CD1 4.27Å; L254-I262 HydrophobicContact CD1-CG2 4.29Å; L254-I262 HydrophobicContact CD2-CD1 4.23Å; L254-I262 HydrophobicContact CD2-CG1 4.47Å; L254-I262 HydrophobicContact CD2-CG2 4.03Å; L254-I262 HydrophobicContact CG-CD1 4.46Å; K257-I262 HydrophobicContact CB-CD1 3.85Å; K257-I262 HydrophobicContact CB-CG1 3.96Å; K257-I262 HydrophobicContact CD-CD1 4.32Å; K257-I262 HydrophobicContact CD-CG1 4.01Å; D258-I262 PolarHBondContact O-N 3.08Å; I262-E266 HydrophobicContact CG2-CB 3.72Å; I262-L267 HydrophobicContact CB-CD2 4.42Å; I262-L267 HydrophobicContact CD1-CD2 4.41Å; I262-L267 HydrophobicContact CG2-CD1 4.46Å; I262-L267 HydrophobicContact CG2-CD2 3.82Å; I262-L267 HydrophobicContact CG2-CG 3.83Å
263	K	80.6	Confident	75.7	Confident	131 Å²	131	59.5 Å²	59.5	57%	0.57	30%	0.303	S	S	*	.			trans	-72.7	150.2	179.4	-63.9	174.3	-169.1	150.1	0	112.4	S265 E266 L267	K263-S265 PolarHBondContact O-N 3.06Å; K263-E266 HydrophobicContact CB-CG 4.25Å; K263-E266 WeakPolarHBondContact CD-OE1 3.21Å; K263-E266 WeakPolarHBondContact O-CB 3.41Å; K263-E266 PolarHBondContact O-N 3.2Å; K263-L267 PolarHBondContact O-N 3.01Å
264	R	81.3	Confident	74.9	Confident	64 Å²	64	56 Å²	56	24%	0.242	30%	0.297	C	S	.	.	H	α-helix	trans	-52.3	-41.5	176	-75	-175.1	168.3	79.4	3.4	112.7	V228 K231 T232 E235 E266 L267 C268 D273	V228-R264 HydrophobicContact CG1-CG 4.04Å; K231-R264 HydrophobicContact CD-CG 4.43Å; T232-R264 PolarHBondContact OG1-NH2 3.25Å; E235-R264 VanDerWaalsContact CD-NH1 3.33Å; E235-R264 IonicContact OE1-CZ 2.79Å; E235-R264 IonicContact OE1-NH1 3.39Å; E235-R264 PolarHBondContact OE1-NH1 3.38Å; E235-R264 IonicContact OE1-NH2 3.48Å; E235-R264 IonicContact OE2-CZ 2.96Å; E235-R264 IonicContact OE2-NH1 3.74Å; E235-R264 PolarHBondContact OE2-NH1 2.71Å; E235-R264 IonicContact OE2-NH2 3.38Å; E235-R264 PolarHBondContact OE2-NH2 2.69Å; R264-E266 VanDerWaalsContact C-N 3.34Å; R264-E266 PolarHBondContact O-N 3.2Å; R264-L267 PolarHBondContact O-N 3.03Å; R264-C268 PolarHBondContact O-N 3.04Å; R264-D273 WeakPolarHBondContact CD-OD1 3.24Å
265	S	75.8	Confident	74	Confident	72 Å²	72	60.4 Å²	60.4	50%	0.503	32%	0.317	S	S	.	.	H	α-helix	trans	-70.6	-22	177.9	49.7	0	0	0	0	114.8	K263 C268 P269	K263-S265 PolarHBondContact O-N 3.06Å; S265-C268 CarbonylContact O-C 3.39Å; S265-P269 WeakPolarHBondContact O-CA 3.4Å
266	E	80.9	Confident	73.3	Confident	77 Å²	77	57.6 Å²	57.6	36%	0.36	30%	0.304	S	S	.	.	H	α-helix	trans	-77.8	-27.1	171.7	-69.7	170.7	-131.2	0	0	111.3	I262 K263 R264	I262-E266 HydrophobicContact CG2-CB 3.72Å; K263-E266 HydrophobicContact CB-CG 4.25Å; K263-E266 WeakPolarHBondContact CD-OE1 3.21Å; K263-E266 WeakPolarHBondContact O-CB 3.41Å; K263-E266 PolarHBondContact O-N 3.2Å; R264-E266 VanDerWaalsContact C-N 3.34Å; R264-E266 PolarHBondContact O-N 3.2Å
267	L	83.6	Confident	72.9	Confident	6 Å²	6	60.8 Å²	60.8	3%	0.031	32%	0.317	C	S	.	.	H	α-helix	trans	-84.1	-38.4	174.8	-59.1	167.7	0	0	0	112.1	C223 V224 C225 I227 V228 K231 L254 L259 I262 K263 R264 P269	C223-L267 HydrophobicContact CB-CD2 3.76Å; C223-L267 VanDerWaalsContact O-CD2 3.28Å; C223-L267 WeakPolarHBondContact O-CD2 3.35Å; V224-L267 CarbonylContact C-O 3.43Å; C225-L267 WeakPolarHBondContact CA-O 3.43Å; C225-L267 WeakPolarHBondContact CB-O 3.24Å; C225-L267 PolarHBondContact N-O 3.12Å; I227-L267 HydrophobicContact CG2-CD1 4.05Å; I227-L267 HydrophobicContact CG2-CD2 3.97Å; V228-L267 HydrophobicContact CG2-CB 3.6Å; V228-L267 HydrophobicContact CG2-CD1 3.73Å; V228-L267 HydrophobicContact CG2-CG 4.31Å; K231-L267 HydrophobicContact CD-CD1 4.04Å; L254-L267 HydrophobicContact CD1-CD2 3.85Å; L259-L267 HydrophobicContact CD1-CD1 3.79Å; L259-L267 HydrophobicContact CD1-CD2 4.31Å; I262-L267 HydrophobicContact CB-CD2 4.42Å; I262-L267 HydrophobicContact CD1-CD2 4.41Å; I262-L267 HydrophobicContact CG2-CD1 4.46Å; I262-L267 HydrophobicContact CG2-CD2 3.82Å; I262-L267 HydrophobicContact CG2-CG 3.83Å; K263-L267 PolarHBondContact O-N 3.01Å; R264-L267 PolarHBondContact O-N 3.03Å; L267-P269 VanDerWaalsContact C-CD 3.49Å; L267-P269 WeakPolarHBondContact O-CD 3.37Å
268	C	82.8	Confident	72.3	Confident	3 Å²	3	62.2 Å²	62.2	2%	0.02	34%	0.337	C	S	.	.			trans	-120.9	70.8	-179.7	-67.6	0	0	0	0	112.1	C225 V228 R264 S265 L270 I276	C225-C268 WeakPolarHBondContact CA-SG 3.44Å; C225-C268 HydrophobicContact CB-CB 3.88Å; C225-C268 WeakPolarHBondContact CB-SG 3.47Å; C225-C268 PolarHBondContact O-SG 2.98Å; C225-C268 WeakPolarHBondContact SG-CB 3.43Å; C225-C268 CovalentContact SG-SG 2.03Å; C225-C268 PolarHBondContact SG-SG 3.08Å; V228-C268 VanDerWaalsContact CG2-SG 3.58Å; R264-C268 PolarHBondContact O-N 3.04Å; S265-C268 CarbonylContact O-C 3.39Å; C268-L270 PolarHBondContact O-N 2.98Å; C268-L270 VanDerWaalsContact O-N 3.07Å; C268-I276 HydrophobicContact CB-CD1 3.44Å; C268-I276 VanDerWaalsContact CB-CD1 3.44Å; C268-I276 HydrophobicContact CB-CG1 4.13Å
269	P	71.8	Confident	71.3	Confident	105 Å²	105	69 Å²	69	68%	0.682	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-2.6	179.9	28.6	-36.3	0	0	0	114.9	S265 L267	S265-P269 WeakPolarHBondContact O-CA 3.4Å; L267-P269 VanDerWaalsContact C-CD 3.49Å; L267-P269 WeakPolarHBondContact O-CD 3.37Å
270	L	64.4	Low	70	Confident	167 Å²	167	70.5 Å²	70.5	87%	0.874	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.4	5.7	-173.8	-67.8	173.8	0	0	0	114.4	C268	C268-L270 PolarHBondContact O-N 2.98Å; C268-L270 VanDerWaalsContact O-N 3.07Å
271	L	64	Low	68.8	Low	43 Å²	43	67.7 Å²	67.7	23%	0.225	37%	0.373	C	S	.	.	S	Bend	trans	-141.1	141.3	-180	-67.6	170.5	0	0	0	110	E275 I276 K279	L271-E275 HydrophobicContact CB-CB 4.45Å; L271-E275 HydrophobicContact CD2-CB 4.22Å; L271-I276 HydrophobicContact CB-CD1 4.31Å; L271-I276 HydrophobicContact CB-CG1 3.67Å; L271-I276 HydrophobicContact CD1-CG1 4.44Å; L271-K279 HydrophobicContact CD1-CD 4.05Å; L271-K279 HydrophobicContact CD2-CD 4.26Å
272	T	64.4	Low	68	Low	84 Å²	84	65.6 Å²	65.6	52%	0.515	36%	0.364	S	S	.	.			trans	-76.8	154.7	171.3	63.3	0	0	0	0	111.1	A274 E275 I276	T272-A274 PolarHBondContact O-N 3.19Å; T272-A274 VanDerWaalsContact O-N 3.1Å; T272-E275 WeakPolarHBondContact CB-OE2 3.48Å; T272-E275 WeakPolarHBondContact CG2-OE2 3.3Å; T272-E275 PolarHBondContact N-OE2 3.37Å; T272-E275 CarbonylContact O-C 3.06Å; T272-E275 WeakPolarHBondContact O-CA 3.28Å; T272-E275 WeakPolarHBondContact O-CB 3.16Å; T272-E275 PolarHBondContact O-N 2.75Å; T272-E275 WeakPolarHBondContact OG1-CG 3.41Å; T272-E275 PolarHBondContact OG1-OE2 3.06Å; T272-I276 WeakPolarHBondContact O-CG1 3.3Å; T272-I276 PolarHBondContact O-N 3.27Å
273	D	62.6	Low	66.7	Low	92 Å²	92	68.3 Å²	68.3	49%	0.492	38%	0.381	S	S	.	.	H	α-helix	trans	-54.2	-35.1	-178.3	-68	-62.9	0	0	0	113.2	R264 I276 E277	R264-D273 WeakPolarHBondContact CD-OD1 3.24Å; D273-I276 PolarHBondContact O-N 2.69Å; D273-E277 PolarHBondContact O-N 3.08Å
274	A	58.8	Low	65	Low	59 Å²	59	70.7 Å²	70.7	49%	0.488	39%	0.387	S	S	.	.	H	α-helix	trans	-68.7	-33.1	176.4	0	0	0	0	0	113.5	T272 A278	T272-A274 PolarHBondContact O-N 3.19Å; T272-A274 VanDerWaalsContact O-N 3.1Å; A274-A278 WeakPolarHBondContact O-CB 3.4Å; A274-A278 PolarHBondContact O-N 3.14Å
275	E	61.9	Low	63	Low	96 Å²	96	72.4 Å²	72.4	45%	0.449	40%	0.404	S	S	.	.	H	α-helix	trans	-76.4	-36.3	172.3	-66.6	167.1	116.7	0	0	111.3	L271 T272 A278 K279	L271-E275 HydrophobicContact CB-CB 4.45Å; L271-E275 HydrophobicContact CD2-CB 4.22Å; T272-E275 WeakPolarHBondContact CB-OE2 3.48Å; T272-E275 WeakPolarHBondContact CG2-OE2 3.3Å; T272-E275 PolarHBondContact N-OE2 3.37Å; T272-E275 CarbonylContact O-C 3.06Å; T272-E275 WeakPolarHBondContact O-CA 3.28Å; T272-E275 WeakPolarHBondContact O-CB 3.16Å; T272-E275 PolarHBondContact O-N 2.75Å; T272-E275 WeakPolarHBondContact OG1-CG 3.41Å; T272-E275 PolarHBondContact OG1-OE2 3.06Å; E275-A278 PolarHBondContact O-N 3.29Å; E275-K279 WeakPolarHBondContact O-CB 3.05Å; E275-K279 PolarHBondContact O-N 2.87Å
276	I	60.9	Low	61.1	Low	2 Å²	2	74.6 Å²	74.6	1%	0.01	42%	0.417	C	S	.	.	H	α-helix	trans	-58.8	-49.9	173.9	-67.6	170.6	0	0	0	109.7	V228 C268 L271 T272 D273 A278 K279 L280	V228-I276 HydrophobicContact CB-CG2 4.47Å; V228-I276 HydrophobicContact CG1-CG2 3.77Å; C268-I276 HydrophobicContact CB-CD1 3.44Å; C268-I276 VanDerWaalsContact CB-CD1 3.44Å; C268-I276 HydrophobicContact CB-CG1 4.13Å; L271-I276 HydrophobicContact CB-CD1 4.31Å; L271-I276 HydrophobicContact CB-CG1 3.67Å; L271-I276 HydrophobicContact CD1-CG1 4.44Å; T272-I276 WeakPolarHBondContact O-CG1 3.3Å; T272-I276 PolarHBondContact O-N 3.27Å; D273-I276 PolarHBondContact O-N 2.69Å; I276-A278 PolarHBondContact O-N 3.03Å; I276-K279 PolarHBondContact O-N 3.19Å; I276-L280 HydrophobicContact CG2-CD1 3.72Å; I276-L280 HydrophobicContact CG2-CG 4.44Å; I276-L280 VanDerWaalsContact O-CB 3.24Å; I276-L280 WeakPolarHBondContact O-CB 3.46Å; I276-L280 WeakPolarHBondContact O-CG 3.46Å; I276-L280 PolarHBondContact O-N 3.41Å
277	E	63.3	Low	59	Low	74 Å²	74	78.3 Å²	78.3	35%	0.346	43%	0.432	S	S	.	.	H	α-helix	trans	-60.5	-45.7	176.3	-73.1	-171.8	161.5	0	0	112.7	D273 G281 I282	D273-E277 PolarHBondContact O-N 3.08Å; E277-G281 PolarHBondContact O-N 2.99Å; E277-I282 HydrophobicContact CB-CB 4.5Å; E277-I282 HydrophobicContact CG-CB 4.46Å; E277-I282 HydrophobicContact CG-CD1 4.48Å; E277-I282 PolarHBondContact O-N 2.73Å; E277-I282 VanDerWaalsContact O-N 3.17Å
278	A	59.2	Low	56.5	Low	70 Å²	70	82.9 Å²	82.9	58%	0.579	46%	0.464	S	S	*	.	H	α-helix	trans	-68.6	-36.5	-178.5	0	0	0	0	0	113.3	A274 E275 I276	A274-A278 WeakPolarHBondContact O-CB 3.4Å; A274-A278 PolarHBondContact O-N 3.14Å; E275-A278 PolarHBondContact O-N 3.29Å; I276-A278 PolarHBondContact O-N 3.03Å
279	K	57.3	Low	53.9	Low	153 Å²	153	89.2 Å²	89.2	67%	0.665	50%	0.498	S	S	*	.	H	α-helix	trans	-90.3	-26.5	-173.2	-164.4	173.5	-175.6	176.5	0	113.2	L271 E275 I276	L271-K279 HydrophobicContact CD1-CD 4.05Å; L271-K279 HydrophobicContact CD2-CD 4.26Å; E275-K279 WeakPolarHBondContact O-CB 3.05Å; E275-K279 PolarHBondContact O-N 2.87Å; I276-K279 PolarHBondContact O-N 3.19Å
280	L	60	Low	52.2	Low	32 Å²	32	92.4 Å²	92.4	17%	0.168	50%	0.504	C	S	.	.	H	α-helix	trans	-96.3	1.4	175.6	-56.1	-178.4	0	0	0	113.4	V228 Q229 I276 I282	V228-L280 HydrophobicContact CB-CD1 4.25Å; Q229-L280 HydrophobicContact CG-CB 3.9Å; Q229-L280 HydrophobicContact CG-CD1 4.08Å; Q229-L280 HydrophobicContact CG-CG 4.44Å; I276-L280 HydrophobicContact CG2-CD1 3.72Å; I276-L280 HydrophobicContact CG2-CG 4.44Å; I276-L280 VanDerWaalsContact O-CB 3.24Å; I276-L280 WeakPolarHBondContact O-CB 3.46Å; I276-L280 WeakPolarHBondContact O-CG 3.46Å; I276-L280 PolarHBondContact O-N 3.41Å; L280-I282 HydrophobicContact CB-CD1 4.49Å; L280-I282 HydrophobicContact CB-CG1 4.36Å
281	G	55	Low	50.8	Low	34 Å²	34	92.2 Å²	92.2	35%	0.351	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.3	33.7	172	0	0	0	0	0	114.3	E277	E277-G281 PolarHBondContact O-N 2.99Å
282	I	59.6	Low	49.4	Very low	10 Å²	10	96.6 Å²	96.6	5%	0.051	53%	0.532	C	S	.	.	P	Polyproline II helix	trans	-78.1	129.5	179.4	-58.8	175.1	0	0	0	108.4	T232 E277 L280 R284	T232-I282 HydrophobicContact CG2-CD1 4.17Å; T232-I282 HydrophobicContact CG2-CG2 4.1Å; E277-I282 HydrophobicContact CB-CB 4.5Å; E277-I282 HydrophobicContact CG-CB 4.46Å; E277-I282 HydrophobicContact CG-CD1 4.48Å; E277-I282 PolarHBondContact O-N 2.73Å; E277-I282 VanDerWaalsContact O-N 3.17Å; L280-I282 HydrophobicContact CB-CD1 4.49Å; L280-I282 HydrophobicContact CB-CG1 4.36Å; I282-R284 PolarHBondContact O-N 2.72Å
283	P	52	Low	48	Very low	60 Å²	60	98.5 Å²	98.5	39%	0.39	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-68.3	127.1	-177.2	24.6	-32.1	0	0	0	111.1	Y200	Y200-P283 HydrophobicContact CE1-CG 3.75Å
284	R	45.9	Very low	46.5	Very low	181 Å²	181	100.4 Å²	100.4	68%	0.683	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-77.7	138.5	170.7	-70.5	-177.9	171.9	174.1	-0.1	110.2	I282	I282-R284 PolarHBondContact O-N 2.72Å
285	V	38.5	Very low	45	Very low	100 Å²	100	103.3 Å²	103.3	61%	0.606	56%	0.559	S	S	*	*			trans	-105.5	136.1	172.9	-175.5	0	0	0	0	108.6	F287	V285-F287 PolarHBondContact O-N 3.14Å
286	P	35.9	Very low	43.7	Very low	119 Å²	119	107 Å²	107	77%	0.773	57%	0.574	S	S	*	*			trans	-68.3	121.5	171.8	-14.6	29.2	0	0	0	110.3
287	F	36.5	Very low	41.9	Very low	155 Å²	155	113 Å²	113	68%	0.68	61%	0.613	S	S	*	*			trans	-105.2	115.8	168.3	-80.5	-66.3	0	0	0	109.8	V285 W293	V285-F287 PolarHBondContact O-N 3.14Å; F287-W293 HydrophobicContact CB-CZ2 4.32Å; F287-W293 AromaticContact CD1-CH2 3.33Å; F287-W293 HydrophobicContact CD1-CH2 3.33Å; F287-W293 AromaticContact CD1-CZ2 3.5Å; F287-W293 HydrophobicContact CD1-CZ2 3.5Å; F287-W293 VanDerWaalsContact CD1-CZ2 3.5Å; F287-W293 HydrophobicContact CD1-CZ3 4.48Å; F287-W293 HydrophobicContact CD2-CH2 4.3Å; F287-W293 AromaticContact CE1-CH2 3.38Å; F287-W293 HydrophobicContact CE1-CH2 3.38Å; F287-W293 AromaticContact CE1-CZ2 3.96Å; F287-W293 HydrophobicContact CE1-CZ2 3.96Å; F287-W293 HydrophobicContact CE1-CZ3 4.16Å; F287-W293 HydrophobicContact CE2-CH2 4.34Å; F287-W293 AromaticContact CG-CH2 3.82Å; F287-W293 HydrophobicContact CG-CH2 3.82Å; F287-W293 HydrophobicContact CG-CZ2 4.04Å; F287-W293 AromaticContact CZ-CH2 3.91Å; F287-W293 HydrophobicContact CZ-CH2 3.91Å; F287-W293 HydrophobicContact CZ-CZ3 4.5Å
288	S	32.6	Very low	40.2	Very low	101 Å²	101	114.2 Å²	114.2	71%	0.706	63%	0.63	S	S	*	*			trans	-147.6	75.7	175.3	62.3	0	0	0	0	111.5
289	N	28.3	Very low	38.6	Very low	136 Å²	136	116.5 Å²	116.5	73%	0.727	64%	0.641	S	S	*	*				-177.2	122.5	121.8	-89	-13	0	0	0	110.2	N291 W293	N289-N291 PolarHBondContact O-N 3.26Å; N289-W293 PolarHBondContact O-NE1 2.74Å
290	E	35.8	Very low	37.6	Very low	172 Å²	172	117.6 Å²	117.6	80%	0.804	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	94.7	171.5	-65.9	-173.8	129.8	0	0	109.1
291	N	33.5	Very low	36.2	Very low	163 Å²	163	123.7 Å²	123.7	87%	0.872	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-171.3	1.9	151.4	-96.5	-35	0	0	0	114.7	N289	N289-N291 PolarHBondContact O-N 3.26Å
292	T	36.5	Very low	34.9	Very low	135 Å²	135	127 Å²	127	83%	0.828	70%	0.7	S	S	*	*	S	Bend	trans	-125.9	76.4	167	34.2	0	0	0	0	111
293	W	35	Very low	33.9	Very low	125 Å²	125	131 Å²	131	47%	0.473	73%	0.727	S	S	.	*			trans	-134.6	132.7	179.3	-71.6	77.6	0	0	0	111.1	F287 N289 T295	F287-W293 HydrophobicContact CB-CZ2 4.32Å; F287-W293 AromaticContact CD1-CH2 3.33Å; F287-W293 HydrophobicContact CD1-CH2 3.33Å; F287-W293 AromaticContact CD1-CZ2 3.5Å; F287-W293 HydrophobicContact CD1-CZ2 3.5Å; F287-W293 VanDerWaalsContact CD1-CZ2 3.5Å; F287-W293 HydrophobicContact CD1-CZ3 4.48Å; F287-W293 HydrophobicContact CD2-CH2 4.3Å; F287-W293 AromaticContact CE1-CH2 3.38Å; F287-W293 HydrophobicContact CE1-CH2 3.38Å; F287-W293 AromaticContact CE1-CZ2 3.96Å; F287-W293 HydrophobicContact CE1-CZ2 3.96Å; F287-W293 HydrophobicContact CE1-CZ3 4.16Å; F287-W293 HydrophobicContact CE2-CH2 4.34Å; F287-W293 AromaticContact CG-CH2 3.82Å; F287-W293 HydrophobicContact CG-CH2 3.82Å; F287-W293 HydrophobicContact CG-CZ2 4.04Å; F287-W293 AromaticContact CZ-CH2 3.91Å; F287-W293 HydrophobicContact CZ-CH2 3.91Å; F287-W293 HydrophobicContact CZ-CZ3 4.5Å; N289-W293 PolarHBondContact O-NE1 2.74Å; W293-T295 PolarHBondContact O-N 3.43Å
294	P	29.2	Very low	32.6	Very low	131 Å²	131	136.4 Å²	136.4	85%	0.851	75%	0.745	S	S	*	*			trans	-72.4	71.2	167.9	-17	32.4	0	0	0	112
295	T	28.8	Very low	31.6	Very low	120 Å²	120	135.8 Å²	135.8	74%	0.736	75%	0.749	S	S	*	*			trans	27.8	102.9	161.7	55.2	0	0	0	0	118.3	W293	W293-T295 PolarHBondContact O-N 3.43Å
296	K	34.5	Very low	31.2	Very low	175 Å²	175	138.4 Å²	138.4	76%	0.761	76%	0.76	S	S	*	*			trans	-58.7	153.1	146.4	-65.8	173.6	179.6	169.9	0	109.5
297	P	23.5	Very low	30.6	Very low	128 Å²	128	139.6 Å²	139.6	83%	0.831	77%	0.765	S	S	*	*			trans	-106.8	115.7	135.6	31.3	-28.7	0	0	0	109.9
298	S	26.4	Very low	30.3	Very low	99 Å²	99	136.6 Å²	136.6	69%	0.692	77%	0.769	S	S	*	*			trans	-84.5	126.8	175.3	-55.5	0	0	0	0	110.9
299	S	26.5	Very low	30.1	Very low	117 Å²	117	137.2 Å²	137.2	82%	0.818	77%	0.773	S	S	*	*			trans	-173.8	59.1	154.3	44.6	0	0	0	0	114.9
300	M	36.4	Very low	30.1	Very low	176 Å²	176	136.5 Å²	136.5	87%	0.867	78%	0.779	S	S	*	*			trans	-108.3	147.8	133	-80.7	-168	171.3	0	0	106.3
301	L	29.7	Very low	29.8	Very low	160 Å²	160	135 Å²	135	84%	0.838	78%	0.782	S	S	*	*			cis	-117.5	177.8	4.8	-64.7	82.3	0	0	0	109.1
302	S	28.1	Very low	29.4	Very low	103 Å²	103	136.1 Å²	136.1	72%	0.72	78%	0.781	S	S	*	*				171.7	179	52.4	63.7	0	0	0	0	109.9
303	P	38.2	Very low	29	Very low	95 Å²	95	140 Å²	140	62%	0.617	78%	0.782	S	S	*	*			cis	-133.6	-177.4	-30.1	21.1	2.9	0	0	0	113.8
304	F	25.1	Very low	28.7	Very low	174 Å²	174	142.1 Å²	142.1	76%	0.763	80%	0.795	S	S	*	*			trans	91.3	136.1	149	-71.2	-57.7	0	0	0	123.9
305	H	24.4	Very low	28.5	Very low	167 Å²	167	142.6 Å²	142.6	77%	0.773	79%	0.79	S	S	*	*			trans	68.8	102.3	153.7	-65.8	-52.4	0	0	0	121.9
306	N	30.4	Very low	28.6	Very low	155 Å²	155	148 Å²	148	83%	0.829	80%	0.797	S	S	*	*			trans	-39	143.1	148.3	-44.5	-16.5	0	0	0	113.3
307	T	23.2	Very low	29.1	Very low	144 Å²	144	145.8 Å²	145.8	88%	0.883	80%	0.801	S	S	*	*			trans	-132.1	120.8	134.7	27.4	0	0	0	0	109
308	A	30.8	Very low	29.3	Very low	93 Å²	93	144 Å²	144	77%	0.769	80%	0.797	S	S	*	*			trans	-77.9	149.7	161.1	0	0	0	0	0	108.8
309	S	27.6	Very low	29.4	Very low	113 Å²	113	148.8 Å²	148.8	79%	0.79	81%	0.806	S	S	*	*			trans	-138.3	66.3	168.7	66	0	0	0	0	110.5
310	S	28.1	Very low	30.2	Very low	121 Å²	121	148.6 Å²	148.6	85%	0.846	80%	0.802	S	S	*	*			trans	-63.2	137.8	152	-57.6	0	0	0	0	108.2
311	V	29.2	Very low	30	Very low	141 Å²	141	145.6 Å²	145.6	86%	0.855	79%	0.793	S	S	*	*			trans	-94.6	120.1	175.4	173.4	0	0	0	0	108.9
312	E	25.9	Very low	30.2	Very low	186 Å²	186	147.4 Å²	147.4	87%	0.869	79%	0.794	S	S	*	*			trans	-158.8	171.2	146.5	-123.1	175.4	175.6	0	0	113.6
313	Y	29.1	Very low	30.4	Very low	216 Å²	216	152 Å²	152	85%	0.847	80%	0.801	S	S	*	*			trans	-57.8	160.4	-178.1	-88.6	-128.5	0	0	0	112.3
314	K	27.2	Very low	31	Very low	170 Å²	170	152.6 Å²	152.6	74%	0.739	81%	0.805	S	S	*	*			cis	-171.7	149.3	46.8	-159.3	167.3	178.3	-179.7	0	115
315	D	26	Very low	31.3	Very low	141 Å²	141	150.5 Å²	150.5	75%	0.754	81%	0.807	S	S	*	*			trans	60.9	165.8	154.7	-77.9	-39.6	0	0	0	123.8
316	R	29.7	Very low	31.6	Very low	234 Å²	234	152.2 Å²	152.2	88%	0.883	81%	0.806	S	S	*	*			trans	-104.6	165.6	-169	-76.8	177.2	175.5	175.2	0.7	111.3
317	P	45.6	Very low	31.7	Very low	128 Å²	128	154.7 Å²	154.7	83%	0.831	80%	0.804	S	S	*	*			cis	-132.6	-152.8	32.2	34.7	-9.3	0	0	0	112.8
318	A	27.3	Very low	33.1	Very low	92 Å²	92	153.3 Å²	153.3	76%	0.76	80%	0.798	S	S	*	*			cis	-152.5	-130.9	11.6	0	0	0	0	0	114.6
319	K	28.8	Very low	33.2	Very low	199 Å²	199	156 Å²	156	87%	0.865	81%	0.805	S	S	*	*			trans	-162.7	172.5	-173	-93	178.3	-176.1	170.1	0	108.5
320	P	44.4	Very low	33.4	Very low	113 Å²	113	159.6 Å²	159.6	73%	0.734	81%	0.806	S	S	*	*			cis	-118.3	-164.4	-4.1	34.2	-12.6	0	0	0	111.3
321	T	30.7	Very low	33.4	Very low	112 Å²	112	161 Å²	161	69%	0.687	80%	0.804	S	S	*	*			cis	-162.7	156.9	29.6	-13.6	0	0	0	0	114.1
322	K	33.8	Very low	34	Very low	199 Å²	199	159.9 Å²	159.9	87%	0.865	80%	0.8	S	S	*	*			trans	67.9	100.9	152.5	-71.5	169.3	-177	179.9	0	121.6
323	K	33.3	Very low	35.1	Very low	199 Å²	199	155.8 Å²	155.8	87%	0.865	79%	0.789	S	S	*	*			trans	-70.3	-169.8	155	-79.7	-177.8	173.7	-179.7	0	112.7
324	P	50.8	Low	35.2	Very low	107 Å²	107	151.7 Å²	151.7	70%	0.695	79%	0.787	S	S	*	*			cis	-144.8	177.8	-49.8	41.2	-25.1	0	0	0	115.4
325	T	30.3	Very low	35.9	Very low	130 Å²	130	148.9 Å²	148.9	80%	0.798	79%	0.786	S	S	*	*			trans	-177.1	134.3	134.7	26.6	0	0	0	0	110
326	R	30.6	Very low	36.1	Very low	204 Å²	204	154.4 Å²	154.4	77%	0.77	80%	0.797	S	S	*	*				55.4	136.2	79.4	-70.9	-169	167.6	-174.7	-0.9	114.6
327	R	33.5	Very low	36.1	Very low	206 Å²	206	147.6 Å²	147.6	78%	0.777	79%	0.785	S	S	*	*			cis	-160.3	170.6	1.5	-120.3	-176.5	176.9	177.7	-3.1	110.1
328	P	52.2	Low	35.5	Very low	116 Å²	116	149.9 Å²	149.9	75%	0.753	79%	0.788	S	S	*	*			trans	-108.5	168.1	-173.7	40.8	-33.9	0	0	0	116
329	T	32.1	Very low	35.9	Very low	149 Å²	149	155.1 Å²	155.1	91%	0.914	79%	0.789	S	S	*	*			trans	-143.7	169.6	170	42	0	0	0	0	112.5
330	K	31.8	Very low	36.6	Very low	189 Å²	189	150.6 Å²	150.6	82%	0.822	78%	0.781	S	S	*	*			trans	-130.4	143.9	-176.2	-62.9	177.2	175.8	-179.9	0	111.7
331	N	28.4	Very low	35.9	Very low	149 Å²	149	149 Å²	149	80%	0.797	78%	0.784	S	S	*	*			trans	52.4	163.4	135.5	-62.7	24	0	0	0	121.4
332	P	42.7	Very low	36.3	Very low	119 Å²	119	150.9 Å²	150.9	77%	0.773	79%	0.789	S	S	*	*			cis	-125.7	-121.1	-23.2	28.2	-1.9	0	0	0	113.5
333	P	48.5	Very low	36.6	Very low	100 Å²	100	148.1 Å²	148.1	65%	0.649	78%	0.784	S	S	*	*				-138.3	-176.1	-121.3	45.6	-25.3	0	0	0	119
334	T	32.3	Very low	36.7	Very low	130 Å²	130	147.7 Å²	147.7	80%	0.798	79%	0.785	S	S	*	*			trans	69.5	167.5	161	66.2	0	0	0	0	118.8
335	P	41.4	Very low	36	Very low	111 Å²	111	147.8 Å²	147.8	72%	0.721	79%	0.786	S	S	*	*			cis	-133.5	166.2	-48.8	36.1	-22.1	0	0	0	113.7
336	R	30.9	Very low	36.3	Very low	257 Å²	257	147.7 Å²	147.7	97%	0.97	79%	0.788	S	S	*	*			trans	-165	143.9	146.8	-112.9	165.8	-168.2	-176.5	3.3	112.1
337	S	29.8	Very low	36.7	Very low	91 Å²	91	145.6 Å²	145.6	64%	0.636	79%	0.79	S	S	*	*			trans	-122.6	147.1	177.2	55.4	0	0	0	0	110.9
338	I	31.5	Very low	36.9	Very low	176 Å²	176	139.1 Å²	139.1	90%	0.903	78%	0.781	S	S	*	*			trans	-133.3	131.9	160.4	-62.3	-177.7	0	0	0	107.2
339	Y	36.7	Very low	36	Very low	201 Å²	201	137.1 Å²	137.1	79%	0.788	78%	0.781	S	S	*	*			trans	-99.2	174.9	178.1	-76	-99.9	0	0	0	110
340	P	43.1	Very low	36.1	Very low	105 Å²	105	140.1 Å²	140.1	68%	0.682	78%	0.777	S	S	*	*			cis	-133.3	158.7	-47.7	36.3	-21.7	0	0	0	113.1
341	G	30.3	Very low	36.1	Very low	78 Å²	78	140.3 Å²	140.3	80%	0.804	78%	0.781	S	S	*	*			trans	-89.2	141.8	157	0	0	0	0	0	110.4
342	L	38.1	Very low	36.7	Very low	152 Å²	152	139.3 Å²	139.3	80%	0.796	78%	0.78	S	S	*	*	S	Bend	trans	-79.4	149.2	-172.2	-137.9	73.6	0	0	0	113.2
343	N	39.9	Very low	36.5	Very low	142 Å²	142	144.8 Å²	144.8	76%	0.759	79%	0.785	S	S	*	*			trans	66.5	79.8	164.4	-60.1	-13	0	0	0	118.9
344	Q	35.2	Very low	35.8	Very low	189 Å²	189	145.3 Å²	145.3	88%	0.883	79%	0.789	S	S	*	*			trans	-151	133	141.4	-109.9	167.3	38.5	0	0	110.1
345	P	36.8	Very low	36.7	Very low	110 Å²	110	144.8 Å²	144.8	71%	0.714	79%	0.788	S	S	*	*			trans	-76.6	150.1	176.9	31.9	-34.4	0	0	0	111.3	I347	P345-I347 PolarHBondContact O-N 3.22Å
346	P	37.5	Very low	37.2	Very low	128 Å²	128	144.4 Å²	144.4	83%	0.831	78%	0.778	S	S	*	*			trans	-70.5	115.9	179.9	28.6	-33.7	0	0	0	110.9	A348	P346-A348 PolarHBondContact O-N 3.14Å; P346-A348 VanDerWaalsContact O-N 3.15Å
347	I	37.2	Very low	38.3	Very low	159 Å²	159	136.6 Å²	136.6	82%	0.815	76%	0.761	S	S	*	*			trans	-68.5	111.4	170.6	-61.8	175.5	0	0	0	108	P345 G349	P345-I347 PolarHBondContact O-N 3.22Å; I347-G349 PolarHBondContact O-N 3.31Å
348	A	38.1	Very low	40	Very low	71 Å²	71	136.9 Å²	136.9	59%	0.587	76%	0.755	S	S	*	*			trans	-62.6	118.6	171.2	0	0	0	0	0	109.3	P346 Y350	P346-A348 PolarHBondContact O-N 3.14Å; P346-A348 VanDerWaalsContact O-N 3.15Å; A348-Y350 WeakPolarHBondContact O-CD2 3.34Å; A348-Y350 PolarHBondContact O-N 3.16Å
349	G	33.4	Very low	41.9	Very low	73 Å²	73	130.9 Å²	130.9	75%	0.753	72%	0.724	S	S	*	*			trans	-67.2	97.2	175.6	0	0	0	0	0	110.4	I347 Q351	I347-G349 PolarHBondContact O-N 3.31Å; G349-Q351 PolarHBondContact O-N 2.82Å; G349-Q351 VanDerWaalsContact O-N 3.08Å
350	Y	34.4	Very low	44	Very low	213 Å²	213	123.2 Å²	123.2	84%	0.835	70%	0.699	S	S	*	*			trans	-57.3	114.2	170.1	-68.8	-86	0	0	0	108.9	A348 T352	A348-Y350 WeakPolarHBondContact O-CD2 3.34Å; A348-Y350 PolarHBondContact O-N 3.16Å; Y350-T352 PolarHBondContact O-N 3.4Å
351	Q	32.7	Very low	46	Very low	192 Å²	192	118.4 Å²	118.4	90%	0.897	67%	0.668	S	S	*	*			trans	-62.8	104.4	166.3	-74.9	-177.9	-29.6	0	0	107.7	G349 R353	G349-Q351 PolarHBondContact O-N 2.82Å; G349-Q351 VanDerWaalsContact O-N 3.08Å; Q351-R353 PolarHBondContact O-N 3.07Å
352	T	39.8	Very low	48.2	Very low	129 Å²	129	117.5 Å²	117.5	79%	0.791	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-57.6	125	164.1	40.9	0	0	0	0	107.5	Y350	Y350-T352 PolarHBondContact O-N 3.4Å
353	R	38	Very low	50.1	Low	233 Å²	233	116.3 Å²	116.3	88%	0.879	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-55.3	136.9	167.7	-68.7	-179.7	177	177.8	-1.4	107.1	Q351	Q351-R353 PolarHBondContact O-N 3.07Å
354	P	35.2	Very low	52.1	Low	111 Å²	111	110.3 Å²	110.3	72%	0.721	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-55.6	144.3	179.5	24.1	-33.8	0	0	0	109.6	I356	P354-I356 PolarHBondContact O-N 3.06Å
355	P	49.8	Very low	54.2	Low	120 Å²	120	104.2 Å²	104.2	78%	0.779	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-55.9	134.4	179.4	24.5	-33.8	0	0	0	109.3	P357	P355-P357 VanDerWaalsContact O-N 3.17Å
356	I	52.7	Low	56.3	Low	102 Å²	102	100.1 Å²	100.1	52%	0.523	56%	0.563	S	S	.	*	P	Polyproline II helix	trans	-55.9	123.6	176.9	-59.3	173.8	0	0	0	106.8	P354 I358	P354-I356 PolarHBondContact O-N 3.06Å; I356-I358 PolarHBondContact O-N 3.33Å; I356-I358 VanDerWaalsContact O-N 3.13Å
357	P	54.2	Low	57.8	Low	93 Å²	93	96.6 Å²	96.6	60%	0.604	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-61.4	121.6	-177.2	23.9	-32.9	0	0	0	109	P355 I359	P355-P357 VanDerWaalsContact O-N 3.17Å; P357-I359 PolarHBondContact O-N 3.41Å
358	I	65.6	Low	59.3	Low	98 Å²	98	92.8 Å²	92.8	50%	0.503	52%	0.518	S	S	.	.			trans	-72.3	95.9	177.7	-58.9	174.6	0	0	0	107.4	I356 L368 L375	I356-I358 PolarHBondContact O-N 3.33Å; I356-I358 VanDerWaalsContact O-N 3.13Å; I358-L368 HydrophobicContact CD1-CB 4Å; I358-L368 HydrophobicContact CD1-CD2 3.9Å; I358-L368 HydrophobicContact CG1-CD2 4.23Å; I358-L375 HydrophobicContact CG2-CD1 3.75Å; I358-L375 HydrophobicContact CG2-CD2 4.39Å
359	I	71.9	Confident	60.3	Low	50 Å²	50	92.8 Å²	92.8	26%	0.256	51%	0.505	S	S	.	.			trans	-83.1	117.4	174.6	-54.7	-167.1	0	0	0	107.8	P357 P392 R393 P394 L395	P357-I359 PolarHBondContact O-N 3.41Å; I359-P392 HydrophobicContact CG2-CB 3.51Å; I359-P392 HydrophobicContact CG2-CG 3.52Å; I359-R393 VanDerWaalsContact CG2-O 3.22Å; I359-R393 WeakPolarHBondContact CG2-O 3.32Å; I359-P394 WeakPolarHBondContact O-CA 3.39Å; I359-P394 WeakPolarHBondContact O-CB 3.22Å; I359-L395 HydrophobicContact CD1-CD1 3.66Å; I359-L395 HydrophobicContact CD1-CG 4.03Å; I359-L395 HydrophobicContact CG1-CD1 4.32Å
360	C	80.3	Confident	61.1	Low	39 Å²	39	96.4 Å²	96.4	26%	0.264	51%	0.506	S	S	.	.			trans	-123	135	178.6	-171.1	0	0	0	0	109.8	C366 P392	C360-C366 WeakPolarHBondContact CA-SG 3.24Å; C360-C366 HydrophobicContact CB-CB 3.66Å; C360-C366 WeakPolarHBondContact CB-SG 3.48Å; C360-C366 WeakPolarHBondContact SG-CB 3.03Å; C360-C366 PolarHBondContact SG-N 3.25Å; C360-C366 VanDerWaalsContact SG-N 3.43Å; C360-C366 CovalentContact SG-SG 2.03Å; C360-C366 PolarHBondContact SG-SG 2.91Å; C360-P392 WeakPolarHBondContact O-CD 3.28Å; C360-P392 WeakPolarHBondContact O-CG 3.14Å
361	P	85.6	Confident	61.7	Low	5 Å²	5	93.9 Å²	93.9	3%	0.032	51%	0.507	C	S	.	.			trans	-61.2	149.6	175	-23.8	34.4	0	0	0	112.8	C364 V377 L390 P392 P394	P361-C364 HydrophobicContact CB-CB 4.17Å; P361-C364 PolarHBondContact O-N 3.04Å; P361-V377 HydrophobicContact CG-CG1 4.41Å; P361-L390 HydrophobicContact CB-CB 4.2Å; P361-L390 HydrophobicContact CB-CD2 4.04Å; P361-L390 HydrophobicContact CG-CB 3.99Å; P361-L390 HydrophobicContact CG-CD2 4.13Å; P361-P392 WeakPolarHBondContact CA-O 2.93Å; P361-P394 HydrophobicContact CG-CG 4.35Å
362	A	75.3	Confident	62.9	Low	59 Å²	59	89.4 Å²	89.4	49%	0.488	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	145.4	168.6	0	0	0	0	0	110.9	C364 L391	A362-C364 PolarHBondContact O-N 2.94Å; A362-L391 PolarHBondContact N-O 3.19Å
363	N	78.3	Confident	63.8	Low	126 Å²	126	89.4 Å²	89.4	67%	0.674	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	-3.5	-177.2	-51.4	-26	0	0	0	116.3	K382	N363-K382 HydrophobicContact CB-CD 4.48Å; N363-K382 VanDerWaalsContact O-CD 3.29Å; N363-K382 WeakPolarHBondContact O-CD 3.32Å; N363-K382 WeakPolarHBondContact O-CE 3.33Å
364	C	82.3	Confident	65.3	Low	17 Å²	17	78.6 Å²	78.6	12%	0.115	45%	0.445	C	S	.	.			trans	-97.6	164	174.4	-58.4	0	0	0	0	112.5	P361 A362 N378 C379	P361-C364 HydrophobicContact CB-CB 4.17Å; P361-C364 PolarHBondContact O-N 3.04Å; A362-C364 PolarHBondContact O-N 2.94Å; C364-N378 CarbonylContact C-O 3.28Å; C364-N378 WeakPolarHBondContact CA-O 3.44Å; C364-N378 WeakPolarHBondContact CB-O 3.2Å; C364-C379 HydrophobicContact CB-CB 4.17Å; C364-C379 WeakPolarHBondContact CB-SG 3.43Å; C364-C379 WeakPolarHBondContact SG-CB 3.38Å; C364-C379 CovalentContact SG-SG 2.03Å; C364-C379 PolarHBondContact SG-SG 3.14Å
365	I	78.4	Confident	67.4	Low	60 Å²	60	73.5 Å²	73.5	31%	0.308	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	127	174.5	-60.1	170.8	0	0	0	107.3	K257 N378	K257-I365 HydrophobicContact CG-CD1 4.13Å; I365-N378 PolarHBondContact N-O 3.01Å; I365-N378 PolarHBondContact O-N 2.85Å
366	C	80.6	Confident	69	Low	24 Å²	24	68 Å²	68	16%	0.162	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	128.3	-179.4	-47.5	0	0	0	0	112.5	C360 L375 T376 V377	C360-C366 WeakPolarHBondContact CA-SG 3.24Å; C360-C366 HydrophobicContact CB-CB 3.66Å; C360-C366 WeakPolarHBondContact CB-SG 3.48Å; C360-C366 WeakPolarHBondContact SG-CB 3.03Å; C360-C366 PolarHBondContact SG-N 3.25Å; C360-C366 VanDerWaalsContact SG-N 3.43Å; C360-C366 CovalentContact SG-SG 2.03Å; C360-C366 PolarHBondContact SG-SG 2.91Å; C366-L375 HydrophobicContact CB-CD1 3.87Å; C366-L375 HydrophobicContact CB-CD2 4.46Å; C366-L375 HydrophobicContact CB-CG 4.26Å; C366-T376 CarbonylContact C-O 3.14Å; C366-T376 WeakPolarHBondContact CA-O 3.44Å; C366-V377 HydrophobicContact CB-CG2 4.41Å
367	N	71.1	Confident	70.6	Confident	55 Å²	55	63.1 Å²	63.1	29%	0.294	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	123.9	-174.3	-69.7	-32.6	0	0	0	110.2	E261 T376	E261-N367 PolarHBondContact OE2-ND2 3.13Å; N367-T376 PolarHBondContact N-O 3.36Å; N367-T376 PolarHBondContact O-N 2.99Å
368	L	68.6	Low	71.9	Confident	78 Å²	78	59.6 Å²	59.6	41%	0.408	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	119.6	-179	-176.5	70.1	0	0	0	110.7	I358 I370 L375	I358-L368 HydrophobicContact CD1-CB 4Å; I358-L368 HydrophobicContact CD1-CD2 3.9Å; I358-L368 HydrophobicContact CG1-CD2 4.23Å; L368-I370 PolarHBondContact O-N 2.87Å; L368-L375 HydrophobicContact CB-CD1 4.24Å; L368-L375 HydrophobicContact CD1-CB 4.39Å; L368-L375 HydrophobicContact CD1-CD1 4.43Å
369	H	57.6	Low	72.9	Confident	71 Å²	71	54.9 Å²	54.9	33%	0.329	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	106.4	178.2	-60.7	-88.9	0	0	0	110.4	E261 N371 D372 L373 G374 T376	E261-H369 IonicContact OE1-CE1 2.69Å; E261-H369 PolarHBondContact OE1-CE1 3.04Å; E261-H369 IonicContact OE1-NE2 3.9Å; E261-H369 PolarHBondContact OE1-NE2 3.24Å; H369-N371 VanDerWaalsContact C-N 3.27Å; H369-N371 PolarHBondContact O-N 3.2Å; H369-D372 PolarHBondContact O-N 2.92Å; H369-D372 VanDerWaalsContact O-N 3.15Å; H369-L373 PolarHBondContact O-N 3.02Å; H369-G374 PolarHBondContact N-O 3.5Å; H369-T376 PolarHBondContact CD2-OG1 2.89Å; H369-T376 VanDerWaalsContact CD2-OG1 3.29Å; H369-T376 WeakPolarHBondContact NE2-CB 3.48Å; H369-T376 PolarHBondContact NE2-OG1 2.75Å
370	I	50.3	Low	73.4	Confident	149 Å²	149	55.5 Å²	55.5	76%	0.764	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-34.5	-171.8	-62.9	170.6	0	0	0	112.8	L368 D372	L368-I370 PolarHBondContact O-N 2.87Å; I370-D372 VanDerWaalsContact C-N 3.31Å; I370-D372 PolarHBondContact O-N 3.27Å
371	N	47.9	Very low	73.6	Confident	160 Å²	160	56.6 Å²	56.6	86%	0.856	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-30.9	-178.8	-59.8	-0.2	0	0	0	113.1	H369	H369-N371 VanDerWaalsContact C-N 3.27Å; H369-N371 PolarHBondContact O-N 3.2Å
372	D	56.6	Low	73.6	Confident	98 Å²	98	60.1 Å²	60.1	52%	0.524	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115	-8.7	-168.1	-81.4	36.7	0	0	0	113	H369 I370 G374 K398	H369-D372 PolarHBondContact O-N 2.92Å; H369-D372 VanDerWaalsContact O-N 3.15Å; I370-D372 VanDerWaalsContact C-N 3.31Å; I370-D372 PolarHBondContact O-N 3.27Å; D372-G374 PolarHBondContact O-N 2.91Å; D372-K398 IonicContact OD2-NZ 3.64Å; D372-K398 PolarHBondContact OD2-NZ 3.22Å
373	L	60	Low	74.2	Confident	130 Å²	130	59 Å²	59	68%	0.681	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	8.8	-167.7	-70.4	148.3	0	0	0	114.8	H369	H369-L373 PolarHBondContact O-N 3.02Å
374	G	68.9	Low	74.8	Confident	5 Å²	5	53.7 Å²	53.7	5%	0.052	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	136.9	-177.6	0	0	0	0	0	113.1	H369 D372	H369-G374 PolarHBondContact N-O 3.5Å; D372-G374 PolarHBondContact O-N 2.91Å
375	L	80.4	Confident	75.3	Confident	4 Å²	4	57.5 Å²	57.5	2%	0.021	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	117.6	175.7	-175.3	66.3	0	0	0	110.5	I358 C366 L368 V377 P394 N396 A397 K398 K399	I358-L375 HydrophobicContact CG2-CD1 3.75Å; I358-L375 HydrophobicContact CG2-CD2 4.39Å; C366-L375 HydrophobicContact CB-CD1 3.87Å; C366-L375 HydrophobicContact CB-CD2 4.46Å; C366-L375 HydrophobicContact CB-CG 4.26Å; L368-L375 HydrophobicContact CB-CD1 4.24Å; L368-L375 HydrophobicContact CD1-CB 4.39Å; L368-L375 HydrophobicContact CD1-CD1 4.43Å; L375-V377 HydrophobicContact CD2-CG2 4.1Å; L375-V377 HydrophobicContact CG-CG2 3.98Å; L375-P394 HydrophobicContact CD2-CB 4.05Å; L375-N396 PolarHBondContact N-O 2.98Å; L375-N396 VanDerWaalsContact N-O 3.1Å; L375-A397 CarbonylContact O-C 3.24Å; L375-A397 VanDerWaalsContact O-CA 3.28Å; L375-A397 WeakPolarHBondContact O-CA 3.38Å; L375-K398 PolarHBondContact O-N 2.92Å; L375-K399 PolarHBondContact O-N 3.14Å
376	T	82.2	Confident	75.8	Confident	4 Å²	4	57.6 Å²	57.6	3%	0.025	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	130.8	167	-71.8	0	0	0	0	108.8	C366 N367 H369 K399 Y401	C366-T376 CarbonylContact C-O 3.14Å; C366-T376 WeakPolarHBondContact CA-O 3.44Å; N367-T376 PolarHBondContact N-O 3.36Å; N367-T376 PolarHBondContact O-N 2.99Å; H369-T376 PolarHBondContact CD2-OG1 2.89Å; H369-T376 VanDerWaalsContact CD2-OG1 3.29Å; H369-T376 WeakPolarHBondContact NE2-CB 3.48Å; H369-T376 PolarHBondContact NE2-OG1 2.75Å; T376-K399 HydrophobicContact CG2-CB 4.12Å; T376-K399 HydrophobicContact CG2-CD 4.48Å; T376-Y401 HydrophobicContact CG2-CD2 4.39Å; T376-Y401 HydrophobicContact CG2-CE2 3.98Å
377	V	85.8	Confident	76.3	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	117.1	-177.8	180	0	0	0	0	109	P361 C366 L375 P394 A397 K399 L400 Y401	P361-V377 HydrophobicContact CG-CG1 4.41Å; C366-V377 HydrophobicContact CB-CG2 4.41Å; L375-V377 HydrophobicContact CD2-CG2 4.1Å; L375-V377 HydrophobicContact CG-CG2 3.98Å; V377-P394 HydrophobicContact CG2-CB 3.83Å; V377-P394 HydrophobicContact CG2-CG 4.06Å; V377-A397 HydrophobicContact CG2-CB 4.09Å; V377-K399 PolarHBondContact N-O 3.21Å; V377-L400 HydrophobicContact CB-CD1 3.87Å; V377-L400 HydrophobicContact CG1-CD1 3.68Å; V377-L400 WeakPolarHBondContact O-CA 3.23Å; V377-Y401 PolarHBondContact O-N 3.13Å
378	N	82.1	Confident	77.1	Confident	19 Å²	19	56.1 Å²	56.1	10%	0.102	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	113.1	-177.7	-174.1	-20.9	0	0	0	110.9	G256 C364 I365 K380	G256-N378 PolarHBondContact O-ND2 3.49Å; C364-N378 CarbonylContact C-O 3.28Å; C364-N378 WeakPolarHBondContact CA-O 3.44Å; C364-N378 WeakPolarHBondContact CB-O 3.2Å; I365-N378 PolarHBondContact N-O 3.01Å; I365-N378 PolarHBondContact O-N 2.85Å; N378-K380 WeakPolarHBondContact OD1-CB 3.31Å; N378-K380 PolarHBondContact OD1-N 2.95Å; N378-K380 VanDerWaalsContact OD1-N 3.15Å
379	C	86.2	Confident	78	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.293	C	S	.	.			trans	-124.5	28.3	-177.4	-61.5	0	0	0	0	110.9	C364 K382 F384 L390 Y401 L402 N405	C364-C379 HydrophobicContact CB-CB 4.17Å; C364-C379 WeakPolarHBondContact CB-SG 3.43Å; C364-C379 WeakPolarHBondContact SG-CB 3.38Å; C364-C379 CovalentContact SG-SG 2.03Å; C364-C379 PolarHBondContact SG-SG 3.14Å; C379-K382 WeakPolarHBondContact O-CG 3.36Å; C379-F384 HydrophobicContact CB-CD2 4.29Å; C379-F384 HydrophobicContact CB-CE2 3.86Å; C379-L390 HydrophobicContact CB-CD2 4.38Å; C379-L390 VanDerWaalsContact SG-CD2 3.53Å; C379-Y401 CarbonylContact C-O 3.58Å; C379-Y401 WeakPolarHBondContact CA-O 3.37Å; C379-Y401 VanDerWaalsContact CB-O 3.31Å; C379-Y401 WeakPolarHBondContact CB-O 3.26Å; C379-Y401 PolarHBondContact N-O 3.19Å; C379-L402 HydrophobicContact CB-CD2 3.59Å; C379-L402 HydrophobicContact CB-CG 4.44Å; C379-N405 PolarHBondContact O-ND2 2.77Å
380	K	82.8	Confident	79.3	Confident	62 Å²	62	52.5 Å²	52.5	27%	0.27	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	139.4	-178.1	-162.6	-167	174.2	-71.8	0	111.9	N378 K382 S403	N378-K380 WeakPolarHBondContact OD1-CB 3.31Å; N378-K380 PolarHBondContact OD1-N 2.95Å; N378-K380 VanDerWaalsContact OD1-N 3.15Å; K380-K382 WeakPolarHBondContact O-CE 3.5Å; K380-K382 WeakPolarHBondContact O-CG 3.45Å; K380-K382 PolarHBondContact O-N 3.28Å; K380-K382 PolarHBondContact O-NZ 3.04Å; K380-S403 VanDerWaalsContact CA-O 3.29Å; K380-S403 WeakPolarHBondContact CA-O 3.37Å; K380-S403 WeakPolarHBondContact CG-O 3.46Å
381	D	84.4	Confident	80.9	Confident	62 Å²	62	50.5 Å²	50.5	33%	0.332	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	48.4	175.6	-37.5	-55.7	0	0	0	113.6	H255 S403 G404	H255-D381 IonicContact CE1-OD2 3.26Å; H255-D381 PolarHBondContact CE1-OD2 3.44Å; D381-S403 PolarHBondContact N-O 3.12Å; D381-G404 WeakPolarHBondContact CA-O 3.49Å
382	K	85.6	Confident	82.7	Confident	80 Å²	80	46.2 Å²	46.2	35%	0.348	25%	0.25	S	C	.	.	S	Bend	trans	-111.3	-6.9	-177.9	-58.3	-59.2	171.7	-107.6	0	114.7	N363 C379 K380 F384 N405	N363-K382 HydrophobicContact CB-CD 4.48Å; N363-K382 VanDerWaalsContact O-CD 3.29Å; N363-K382 WeakPolarHBondContact O-CD 3.32Å; N363-K382 WeakPolarHBondContact O-CE 3.33Å; C379-K382 WeakPolarHBondContact O-CG 3.36Å; K380-K382 WeakPolarHBondContact O-CE 3.5Å; K380-K382 WeakPolarHBondContact O-CG 3.45Å; K380-K382 PolarHBondContact O-N 3.28Å; K380-K382 PolarHBondContact O-NZ 3.04Å; K382-F384 HydrophobicContact CB-CD2 3.66Å; K382-F384 HydrophobicContact CB-CE2 3.5Å; K382-F384 VanDerWaalsContact CB-CE2 3.5Å; K382-F384 HydrophobicContact CB-CZ 4.35Å; K382-F384 HydrophobicContact CG-CD2 4.48Å; K382-F384 HydrophobicContact CG-CE2 4Å; K382-N405 WeakPolarHBondContact CA-OD1 3.46Å; K382-N405 PolarHBondContact N-OD1 3.06Å
383	G	88.8	Confident	83.9	Confident	34 Å²	34	45.1 Å²	45.1	35%	0.351	24%	0.238	S	C	.	.			trans	75.6	20.1	179.7	0	0	0	0	0	114.8	N405	G383-N405 PolarHBondContact N-OD1 3.27Å
384	F	91.1	Very high	85	Confident	16 Å²	16	39.1 Å²	39.1	7%	0.07	21%	0.207	C	C	.	.			trans	-61.1	135.6	175.1	-70.1	-67.4	0	0	0	111.2	C379 K382 E389 L390 L402 N405 L406 I407	C379-F384 HydrophobicContact CB-CD2 4.29Å; C379-F384 HydrophobicContact CB-CE2 3.86Å; K382-F384 HydrophobicContact CB-CD2 3.66Å; K382-F384 HydrophobicContact CB-CE2 3.5Å; K382-F384 VanDerWaalsContact CB-CE2 3.5Å; K382-F384 HydrophobicContact CB-CZ 4.35Å; K382-F384 HydrophobicContact CG-CD2 4.48Å; K382-F384 HydrophobicContact CG-CE2 4Å; F384-E389 WeakPolarHBondContact CA-OE2 3.15Å; F384-E389 HydrophobicContact CD1-CB 3.71Å; F384-E389 HydrophobicContact CE1-CB 4.15Å; F384-L390 HydrophobicContact CD2-CD2 4.36Å; F384-L390 HydrophobicContact CE1-CD2 4.25Å; F384-L390 HydrophobicContact CE2-CD2 3.94Å; F384-L390 HydrophobicContact CZ-CD2 3.87Å; F384-L402 HydrophobicContact CD2-CD2 4.45Å; F384-N405 HydrophobicContact CB-CB 4.32Å; F384-N405 PolarHBondContact N-OD1 2.73Å; F384-N405 VanDerWaalsContact N-OD1 3.13Å; F384-L406 CarbonylContact O-C 3.55Å; F384-L406 VanDerWaalsContact O-C 3.26Å; F384-L406 WeakPolarHBondContact O-CA 3.43Å; F384-L406 PolarHBondContact O-N 2.86Å; F384-I407 PolarHBondContact O-N 3.07Å
385	H	91.2	Very high	85.4	Confident	96 Å²	96	42.5 Å²	42.5	44%	0.444	22%	0.223	S	C	.	.	S	Bend	trans	-97.6	-23.9	176.5	-67.8	-73.9	0	0	0	112.9	E389 L406 I407	H385-E389 WeakPolarHBondContact CB-OE1 3.28Å; H385-E389 PolarHBondContact N-OE2 2.88Å; H385-L406 VanDerWaalsContact CE1-CD1 3.49Å; H385-L406 WeakPolarHBondContact CE1-CD1 3.09Å; H385-L406 WeakPolarHBondContact ND1-CB 3.22Å; H385-I407 WeakPolarHBondContact O-CA 3.31Å
386	N	90.7	Very high	85.2	Confident	62 Å²	62	46.2 Å²	46.2	33%	0.332	24%	0.243	S	C	.	.			trans	-143.5	142.7	179.9	-56.1	-92.4	0	0	0	110.2	S388 E389	N386-S388 PolarHBondContact O-N 3.49Å; N386-E389 HydrophobicContact CB-CG 4.39Å; N386-E389 WeakPolarHBondContact CB-OE1 3.21Å; N386-E389 VanDerWaalsContact N-CD 3.34Å; N386-E389 PolarHBondContact N-OE1 3.08Å; N386-E389 PolarHBondContact N-OE2 2.86Å; N386-E389 PolarHBondContact ND2-OE1 2.85Å; N386-E389 VanDerWaalsContact O-CB 3.31Å; N386-E389 WeakPolarHBondContact O-CB 3.2Å; N386-E389 PolarHBondContact O-N 2.9Å
387	I	90.5	Very high	85.3	Confident	2 Å²	2	46 Å²	46	1%	0.01	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-62	-27.6	177.3	-59.5	148.9	0	0	0	111.2	E389 L390 L402 I407 I410 D414 F415 L426	I387-E389 PolarHBondContact O-N 2.68Å; I387-L390 HydrophobicContact CG2-CD1 4.05Å; I387-L390 WeakPolarHBondContact O-CB 3.36Å; I387-L390 VanDerWaalsContact O-CG 3.26Å; I387-L390 WeakPolarHBondContact O-CG 3.16Å; I387-L390 PolarHBondContact O-N 2.86Å; I387-L402 HydrophobicContact CG1-CD1 4.27Å; I387-L402 HydrophobicContact CG2-CD1 4.48Å; I387-I407 HydrophobicContact CD1-CG2 4.48Å; I387-I407 HydrophobicContact CG1-CD1 4.1Å; I387-I407 HydrophobicContact CG1-CG2 4.31Å; I387-I410 HydrophobicContact CD1-CB 4.37Å; I387-I410 HydrophobicContact CD1-CD1 4.44Å; I387-I410 HydrophobicContact CD1-CG1 3.97Å; I387-I410 HydrophobicContact CD1-CG2 4.02Å; I387-D414 HydrophobicContact CB-CB 3.75Å; I387-D414 HydrophobicContact CD1-CB 3.96Å; I387-D414 HydrophobicContact CG1-CB 4.5Å; I387-D414 HydrophobicContact CG2-CB 3.8Å; I387-F415 HydrophobicContact CD1-CE1 4.33Å; I387-F415 HydrophobicContact CD1-CE2 3.92Å; I387-F415 HydrophobicContact CD1-CZ 3.54Å; I387-F415 HydrophobicContact CG1-CZ 4.37Å; I387-F415 HydrophobicContact CG2-CE1 4.06Å; I387-F415 HydrophobicContact CG2-CZ 4.38Å; I387-L426 HydrophobicContact CD1-CD2 4.45Å
388	S	87.8	Confident	85.3	Confident	46 Å²	46	48.4 Å²	48.4	32%	0.322	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-66.2	-9.5	173.5	-76.2	0	0	0	0	115.5	N386 L390 R393 D414	N386-S388 PolarHBondContact O-N 3.49Å; S388-L390 PolarHBondContact O-N 2.82Å; S388-R393 PolarHBondContact OG-NH2 2.87Å; S388-D414 WeakPolarHBondContact CB-OD1 3.35Å; S388-D414 PolarHBondContact N-OD1 3.03Å; S388-D414 PolarHBondContact OG-OD1 3.48Å
389	E	86.6	Confident	85.4	Confident	71 Å²	71	50.1 Å²	50.1	33%	0.332	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-76.1	-8.4	171.4	-69.5	153	-149.2	0	0	113.2	F384 H385 N386 I387 L391	F384-E389 WeakPolarHBondContact CA-OE2 3.15Å; F384-E389 HydrophobicContact CD1-CB 3.71Å; F384-E389 HydrophobicContact CE1-CB 4.15Å; H385-E389 WeakPolarHBondContact CB-OE1 3.28Å; H385-E389 PolarHBondContact N-OE2 2.88Å; N386-E389 HydrophobicContact CB-CG 4.39Å; N386-E389 WeakPolarHBondContact CB-OE1 3.21Å; N386-E389 VanDerWaalsContact N-CD 3.34Å; N386-E389 PolarHBondContact N-OE1 3.08Å; N386-E389 PolarHBondContact N-OE2 2.86Å; N386-E389 PolarHBondContact ND2-OE1 2.85Å; N386-E389 VanDerWaalsContact O-CB 3.31Å; N386-E389 WeakPolarHBondContact O-CB 3.2Å; N386-E389 PolarHBondContact O-N 2.9Å; I387-E389 PolarHBondContact O-N 2.68Å; E389-L391 PolarHBondContact O-N 3.31Å
390	L	86.2	Confident	85.6	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.01	26%	0.259	C	S	.	.			trans	-69.6	78.3	175.5	-64.6	178.2	0	0	0	111.5	P361 C379 F384 I387 S388 P392 R393 L400 L402	P361-L390 HydrophobicContact CB-CB 4.2Å; P361-L390 HydrophobicContact CB-CD2 4.04Å; P361-L390 HydrophobicContact CG-CB 3.99Å; P361-L390 HydrophobicContact CG-CD2 4.13Å; C379-L390 HydrophobicContact CB-CD2 4.38Å; C379-L390 VanDerWaalsContact SG-CD2 3.53Å; F384-L390 HydrophobicContact CD2-CD2 4.36Å; F384-L390 HydrophobicContact CE1-CD2 4.25Å; F384-L390 HydrophobicContact CE2-CD2 3.94Å; F384-L390 HydrophobicContact CZ-CD2 3.87Å; I387-L390 HydrophobicContact CG2-CD1 4.05Å; I387-L390 WeakPolarHBondContact O-CB 3.36Å; I387-L390 VanDerWaalsContact O-CG 3.26Å; I387-L390 WeakPolarHBondContact O-CG 3.16Å; I387-L390 PolarHBondContact O-N 2.86Å; S388-L390 PolarHBondContact O-N 2.82Å; L390-P392 CarbonylContact O-C 3.14Å; L390-R393 VanDerWaalsContact O-CA 3.27Å; L390-R393 WeakPolarHBondContact O-CA 3.18Å; L390-R393 WeakPolarHBondContact O-CG 3.46Å; L390-R393 PolarHBondContact O-N 3Å; L390-L400 HydrophobicContact CD1-CD1 4.31Å; L390-L400 HydrophobicContact CD1-CD2 4.45Å; L390-L402 HydrophobicContact CD1-CD1 4.28Å; L390-L402 HydrophobicContact CD1-CD2 4.14Å; L390-L402 HydrophobicContact CD2-CD2 4.14Å
391	L	84.2	Confident	85.8	Confident	108 Å²	108	48.1 Å²	48.1	57%	0.565	25%	0.25	S	S	*	.	S	Bend	trans	-114.9	130.4	-178.4	-63.6	177.7	0	0	0	111.2	A362 E389	A362-L391 PolarHBondContact N-O 3.19Å; E389-L391 PolarHBondContact O-N 3.31Å
392	P	84	Confident	86.1	Confident	70 Å²	70	45.1 Å²	45.1	46%	0.455	23%	0.234	S	C	.	.	S	Bend	cis	-70.2	143.8	-9.8	32.5	-37.4	0	0	0	112	I359 C360 P361 L390	I359-P392 HydrophobicContact CG2-CB 3.51Å; I359-P392 HydrophobicContact CG2-CG 3.52Å; C360-P392 WeakPolarHBondContact O-CD 3.28Å; C360-P392 WeakPolarHBondContact O-CG 3.14Å; P361-P392 WeakPolarHBondContact CA-O 2.93Å; L390-P392 CarbonylContact O-C 3.14Å
393	R	83.6	Confident	86.2	Confident	74 Å²	74	41.7 Å²	41.7	28%	0.279	22%	0.22	S	C	.	.	P	Polyproline II helix	trans	-63.9	133.6	-178.2	-76.3	-172.2	175.4	-155	3.6	111.1	I359 S388 L390 S413 D414	I359-R393 VanDerWaalsContact CG2-O 3.22Å; I359-R393 WeakPolarHBondContact CG2-O 3.32Å; S388-R393 PolarHBondContact OG-NH2 2.87Å; L390-R393 VanDerWaalsContact O-CA 3.27Å; L390-R393 WeakPolarHBondContact O-CA 3.18Å; L390-R393 WeakPolarHBondContact O-CG 3.46Å; L390-R393 PolarHBondContact O-N 3Å; R393-S413 PolarHBondContact NH1-O 2.88Å; R393-S413 PolarHBondContact NH2-O 3.32Å; R393-S413 VanDerWaalsContact NH2-O 3.11Å; R393-D414 PolarHBondContact NH1-O 2.66Å
394	P	81.5	Confident	85.9	Confident	5 Å²	5	41.5 Å²	41.5	3%	0.032	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-73.7	134.2	-175	31	-33.6	0	0	0	111.1	I359 P361 L375 V377 A397 F418	I359-P394 WeakPolarHBondContact O-CA 3.39Å; I359-P394 WeakPolarHBondContact O-CB 3.22Å; P361-P394 HydrophobicContact CG-CG 4.35Å; L375-P394 HydrophobicContact CD2-CB 4.05Å; V377-P394 HydrophobicContact CG2-CB 3.83Å; V377-P394 HydrophobicContact CG2-CG 4.06Å; P394-A397 HydrophobicContact CB-CB 4.37Å; P394-A397 HydrophobicContact CG-CB 4.19Å; P394-F418 HydrophobicContact CG-CE1 3.64Å; P394-F418 HydrophobicContact CG-CZ 3.8Å
395	L	77.6	Confident	86	Confident	75 Å²	75	41 Å²	41	39%	0.393	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	139.9	171.7	-64.1	176.7	0	0	0	109.7	I359 A397	I359-L395 HydrophobicContact CD1-CD1 3.66Å; I359-L395 HydrophobicContact CD1-CG 4.03Å; I359-L395 HydrophobicContact CG1-CD1 4.32Å; L395-A397 VanDerWaalsContact C-N 3.29Å; L395-A397 PolarHBondContact O-N 2.63Å
396	N	77.5	Confident	86.1	Confident	82 Å²	82	39.6 Å²	39.6	44%	0.439	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	36.7	177.3	-55.6	-9.9	0	0	0	114.4	L375 K398 S420	L375-N396 PolarHBondContact N-O 2.98Å; L375-N396 VanDerWaalsContact N-O 3.1Å; N396-K398 PolarHBondContact O-N 3.28Å; N396-S420 VanDerWaalsContact CA-OG 3.31Å; N396-S420 WeakPolarHBondContact CA-OG 3.46Å
397	A	83.7	Confident	86.4	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.008	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	126.4	171.5	0	0	0	0	0	110.5	L375 V377 P394 L395 F418 S420 L421	L375-A397 CarbonylContact O-C 3.24Å; L375-A397 VanDerWaalsContact O-CA 3.28Å; L375-A397 WeakPolarHBondContact O-CA 3.38Å; V377-A397 HydrophobicContact CG2-CB 4.09Å; P394-A397 HydrophobicContact CB-CB 4.37Å; P394-A397 HydrophobicContact CG-CB 4.19Å; L395-A397 VanDerWaalsContact C-N 3.29Å; L395-A397 PolarHBondContact O-N 2.63Å; A397-F418 HydrophobicContact CB-CD1 3.93Å; A397-F418 HydrophobicContact CB-CE1 3.99Å; A397-S420 PolarHBondContact N-OG 3.01Å; A397-S420 CarbonylContact O-C 3.2Å; A397-S420 WeakPolarHBondContact O-CB 3.4Å; A397-S420 PolarHBondContact O-OG 3.36Å; A397-L421 HydrophobicContact CB-CD2 3.93Å; A397-L421 WeakPolarHBondContact O-CD2 3.36Å; A397-L421 PolarHBondContact O-N 2.94Å
398	K	84.9	Confident	86.6	Confident	50 Å²	50	40.9 Å²	40.9	22%	0.217	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	-28	176.7	-172.2	170.3	-174.7	177.8	0	113	D372 L375 N396 S420 D422 L423	D372-K398 IonicContact OD2-NZ 3.64Å; D372-K398 PolarHBondContact OD2-NZ 3.22Å; L375-K398 PolarHBondContact O-N 2.92Å; N396-K398 PolarHBondContact O-N 3.28Å; K398-S420 WeakPolarHBondContact CA-O 3.49Å; K398-D422 WeakPolarHBondContact CE-OD1 3.5Å; K398-D422 WeakPolarHBondContact CE-OD2 3.39Å; K398-D422 HydrophobicContact CG-CB 4.11Å; K398-D422 IonicContact NZ-OD2 2.65Å; K398-D422 PolarHBondContact O-N 3.08Å; K398-L423 PolarHBondContact O-N 2.92Å
399	K	85.1	Confident	86.9	Confident	54 Å²	54	43 Å²	43	24%	0.235	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	139.9	167.2	-62	-166.4	170.2	-168.7	0	109.7	E245 L375 T376 V377 Y401 L423	E245-K399 IonicContact OE1-NZ 3.2Å; E245-K399 PolarHBondContact OE1-NZ 2.98Å; L375-K399 PolarHBondContact O-N 3.14Å; T376-K399 HydrophobicContact CG2-CB 4.12Å; T376-K399 HydrophobicContact CG2-CD 4.48Å; V377-K399 PolarHBondContact N-O 3.21Å; K399-Y401 HydrophobicContact CB-CD2 4.47Å; K399-Y401 HydrophobicContact CB-CE2 3.84Å; K399-Y401 HydrophobicContact CD-CE2 3.84Å; K399-Y401 WeakPolarHBondContact CD-OH 3.39Å; K399-Y401 PolarHBondContact NZ-OH 3.26Å; K399-L423 WeakPolarHBondContact CA-O 3.41Å; K399-L423 HydrophobicContact CG-CB 4.21Å
400	L	89.6	Confident	87.3	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	116	175.1	178.6	59.3	0	0	0	111	V377 L390 L402 F415 F418 L421 L423 L424 H425	V377-L400 HydrophobicContact CB-CD1 3.87Å; V377-L400 HydrophobicContact CG1-CD1 3.68Å; V377-L400 WeakPolarHBondContact O-CA 3.23Å; L390-L400 HydrophobicContact CD1-CD1 4.31Å; L390-L400 HydrophobicContact CD1-CD2 4.45Å; L400-L402 HydrophobicContact CD1-CD1 4.19Å; L400-L402 HydrophobicContact CD1-CG 4.1Å; L400-L402 HydrophobicContact CD2-CD1 3.78Å; L400-L402 HydrophobicContact CG-CD1 3.81Å; L400-L402 HydrophobicContact CG-CG 4.07Å; L400-F415 HydrophobicContact CD2-CE1 4.19Å; L400-F418 HydrophobicContact CD2-CD1 4.25Å; L400-F418 HydrophobicContact CD2-CE1 3.74Å; L400-F418 HydrophobicContact CD2-CZ 4.26Å; L400-L421 HydrophobicContact CB-CD1 4.28Å; L400-L421 HydrophobicContact CB-CD2 3.77Å; L400-L421 HydrophobicContact CD2-CD1 4.44Å; L400-L423 PolarHBondContact N-O 2.79Å; L400-L424 HydrophobicContact CB-CD1 4.11Å; L400-L424 HydrophobicContact CD2-CD1 3.93Å; L400-L424 HydrophobicContact CG-CD1 4.08Å; L400-H425 PolarHBondContact O-N 3.32Å
401	Y	86.6	Confident	87.7	Confident	20 Å²	20	43.6 Å²	43.6	8%	0.078	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	117.6	178.2	-59.3	-92.5	0	0	0	110.7	E245 T376 V377 C379 K399 L423 H425	E245-Y401 PolarHBondContact OE1-OH 3.31Å; E245-Y401 WeakPolarHBondContact OE2-CE1 3.48Å; E245-Y401 VanDerWaalsContact OE2-CZ 3.27Å; E245-Y401 PolarHBondContact OE2-OH 3.4Å; T376-Y401 HydrophobicContact CG2-CD2 4.39Å; T376-Y401 HydrophobicContact CG2-CE2 3.98Å; V377-Y401 PolarHBondContact O-N 3.13Å; C379-Y401 CarbonylContact C-O 3.58Å; C379-Y401 WeakPolarHBondContact CA-O 3.37Å; C379-Y401 VanDerWaalsContact CB-O 3.31Å; C379-Y401 WeakPolarHBondContact CB-O 3.26Å; C379-Y401 PolarHBondContact N-O 3.19Å; K399-Y401 HydrophobicContact CB-CD2 4.47Å; K399-Y401 HydrophobicContact CB-CE2 3.84Å; K399-Y401 HydrophobicContact CD-CE2 3.84Å; K399-Y401 WeakPolarHBondContact CD-OH 3.39Å; K399-Y401 PolarHBondContact NZ-OH 3.26Å; Y401-L423 HydrophobicContact CD1-CD2 4.29Å; Y401-L423 HydrophobicContact CE1-CD2 3.78Å; Y401-L423 HydrophobicContact CE2-CD2 4.47Å; Y401-H425 HydrophobicContact CD1-CB 3.82Å; Y401-H425 HydrophobicContact CE1-CB 4.46Å
402	L	90.4	Very high	88	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.212	C	C	.	.			trans	-129.3	19.7	-176.9	-74.9	165.2	0	0	0	112	C379 F384 I387 L390 L400 N405 I407 H425 L426 N429	C379-L402 HydrophobicContact CB-CD2 3.59Å; C379-L402 HydrophobicContact CB-CG 4.44Å; F384-L402 HydrophobicContact CD2-CD2 4.45Å; I387-L402 HydrophobicContact CG1-CD1 4.27Å; I387-L402 HydrophobicContact CG2-CD1 4.48Å; L390-L402 HydrophobicContact CD1-CD1 4.28Å; L390-L402 HydrophobicContact CD1-CD2 4.14Å; L390-L402 HydrophobicContact CD2-CD2 4.14Å; L400-L402 HydrophobicContact CD1-CD1 4.19Å; L400-L402 HydrophobicContact CD1-CG 4.1Å; L400-L402 HydrophobicContact CD2-CD1 3.78Å; L400-L402 HydrophobicContact CG-CD1 3.81Å; L400-L402 HydrophobicContact CG-CG 4.07Å; L402-N405 VanDerWaalsContact C-ND2 3.27Å; L402-N405 PolarHBondContact O-ND2 3.26Å; L402-I407 HydrophobicContact CB-CD1 4.1Å; L402-I407 HydrophobicContact CD1-CD1 4.42Å; L402-I407 HydrophobicContact CD2-CD1 4.38Å; L402-H425 CarbonylContact C-O 3.49Å; L402-H425 WeakPolarHBondContact CA-O 3.2Å; L402-H425 PolarHBondContact N-O 3.09Å; L402-L426 HydrophobicContact CB-CD2 3.9Å; L402-L426 HydrophobicContact CD1-CD2 3.84Å; L402-N429 PolarHBondContact O-ND2 2.89Å
403	S	87.8	Confident	88.3	Confident	8 Å²	8	43.7 Å²	43.7	6%	0.056	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	152.3	178.4	25.9	0	0	0	0	113.8	K380 D381 N405 H425 G427	K380-S403 VanDerWaalsContact CA-O 3.29Å; K380-S403 WeakPolarHBondContact CA-O 3.37Å; K380-S403 WeakPolarHBondContact CG-O 3.46Å; D381-S403 PolarHBondContact N-O 3.12Å; S403-N405 VanDerWaalsContact C-N 3.31Å; S403-N405 PolarHBondContact O-N 3.48Å; S403-N405 PolarHBondContact O-ND2 3.31Å; S403-H425 WeakPolarHBondContact CB-ND1 3.29Å; S403-H425 PolarHBondContact N-O 3.14Å; S403-H425 PolarHBondContact OG-ND1 2.85Å; S403-G427 WeakPolarHBondContact CA-O 3.47Å; S403-G427 WeakPolarHBondContact CB-O 3.43Å
404	G	84.1	Confident	88.6	Confident	30 Å²	30	40.2 Å²	40.2	31%	0.309	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	70	25.4	179.3	0	0	0	0	0	114.1	D381 N428	D381-G404 WeakPolarHBondContact CA-O 3.49Å; G404-N428 WeakPolarHBondContact CA-O 3.47Å; G404-N428 PolarHBondContact N-O 3.38Å
405	N	92	Very high	89.1	Confident	5 Å²	5	40 Å²	40	3%	0.027	20%	0.198	C	C	.	.	S	Bend	trans	-105.2	-173.7	176	-71.6	-69.2	0	0	0	110.5	C379 K382 G383 F384 L402 S403 I407 N429	C379-N405 PolarHBondContact O-ND2 2.77Å; K382-N405 WeakPolarHBondContact CA-OD1 3.46Å; K382-N405 PolarHBondContact N-OD1 3.06Å; G383-N405 PolarHBondContact N-OD1 3.27Å; F384-N405 HydrophobicContact CB-CB 4.32Å; F384-N405 PolarHBondContact N-OD1 2.73Å; F384-N405 VanDerWaalsContact N-OD1 3.13Å; L402-N405 VanDerWaalsContact C-ND2 3.27Å; L402-N405 PolarHBondContact O-ND2 3.26Å; S403-N405 VanDerWaalsContact C-N 3.31Å; S403-N405 PolarHBondContact O-N 3.48Å; S403-N405 PolarHBondContact O-ND2 3.31Å; N405-I407 HydrophobicContact CB-CD1 4.28Å; N405-I407 HydrophobicContact CB-CG1 4.13Å; N405-N429 WeakPolarHBondContact CA-OD1 3.49Å; N405-N429 WeakPolarHBondContact CB-OD1 3.39Å; N405-N429 PolarHBondContact O-OD1 3.44Å; N405-N429 VanDerWaalsContact O-OD1 3.12Å
406	L	93.8	Very high	89.4	Confident	67 Å²	67	43.6 Å²	43.6	35%	0.351	21%	0.207	S	C	.	.			trans	-112.6	31.3	-175.8	-58.5	176.4	0	0	0	110.8	F384 H385 Q408	F384-L406 CarbonylContact O-C 3.55Å; F384-L406 VanDerWaalsContact O-C 3.26Å; F384-L406 WeakPolarHBondContact O-CA 3.43Å; F384-L406 PolarHBondContact O-N 2.86Å; H385-L406 VanDerWaalsContact CE1-CD1 3.49Å; H385-L406 WeakPolarHBondContact CE1-CD1 3.09Å; H385-L406 WeakPolarHBondContact ND1-CB 3.22Å; L406-Q408 PolarHBondContact O-N 2.88Å
407	I	96	Very high	89.6	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.212	C	C	.	.			trans	-71.5	122.1	-176.4	-56.8	168.3	0	0	0	108.8	F384 H385 I387 L402 N405 L426 N429 Q430 I431	F384-I407 PolarHBondContact O-N 3.07Å; H385-I407 WeakPolarHBondContact O-CA 3.31Å; I387-I407 HydrophobicContact CD1-CG2 4.48Å; I387-I407 HydrophobicContact CG1-CD1 4.1Å; I387-I407 HydrophobicContact CG1-CG2 4.31Å; L402-I407 HydrophobicContact CB-CD1 4.1Å; L402-I407 HydrophobicContact CD1-CD1 4.42Å; L402-I407 HydrophobicContact CD2-CD1 4.38Å; N405-I407 HydrophobicContact CB-CD1 4.28Å; N405-I407 HydrophobicContact CB-CG1 4.13Å; I407-L426 HydrophobicContact CD1-CD2 4.11Å; I407-N429 HydrophobicContact CB-CB 4.38Å; I407-N429 VanDerWaalsContact CB-OD1 3.32Å; I407-N429 WeakPolarHBondContact CB-OD1 3.4Å; I407-N429 WeakPolarHBondContact CG1-OD1 3.35Å; I407-N429 PolarHBondContact N-OD1 2.86Å; I407-N429 VanDerWaalsContact N-OD1 3.08Å; I407-Q430 CarbonylContact O-C 3.54Å; I407-Q430 WeakPolarHBondContact O-CA 3.49Å; I407-Q430 PolarHBondContact O-N 3.23Å; I407-I431 HydrophobicContact CB-CG1 4.35Å; I407-I431 HydrophobicContact CG2-CG1 4.16Å; I407-I431 VanDerWaalsContact O-CG1 3.27Å; I407-I431 WeakPolarHBondContact O-CG1 3.46Å; I407-I431 PolarHBondContact O-N 3.14Å; I407-I431 VanDerWaalsContact O-N 3.17Å
408	Q	94.8	Very high	89.8	Confident	91 Å²	91	44.7 Å²	44.7	43%	0.425	21%	0.212	S	C	.	.			trans	-104.4	-27.2	-177.5	-72.2	179.1	-1.8	0	0	114.2	L406 Q430 I431 S432	L406-Q408 PolarHBondContact O-N 2.88Å; Q408-Q430 WeakPolarHBondContact CA-O 3.46Å; Q408-Q430 HydrophobicContact CG-CB 3.78Å; Q408-I431 WeakPolarHBondContact O-CA 3.46Å; Q408-S432 PolarHBondContact O-N 2.83Å; Q408-S432 PolarHBondContact O-OG 3.31Å
409	K	94.6	Very high	89.9	Confident	89 Å²	89	45.4 Å²	45.4	39%	0.387	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	144.7	-171.6	-57.8	-174.9	-178.4	172.5	0	110.7	Y411 Y433	K409-Y411 HydrophobicContact CB-CD2 4.49Å; K409-Y411 HydrophobicContact CB-CE2 3.76Å; K409-Y411 WeakPolarHBondContact CD-OH 3.4Å; K409-Y433 WeakPolarHBondContact CA-O 3.49Å
410	I	95.5	Very high	90	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	124.7	173.7	-54.3	-175	0	0	0	109.3	I387 F415 L426 I431 Y433 V434 Q435 A438 F439 L450	I387-I410 HydrophobicContact CD1-CB 4.37Å; I387-I410 HydrophobicContact CD1-CD1 4.44Å; I387-I410 HydrophobicContact CD1-CG1 3.97Å; I387-I410 HydrophobicContact CD1-CG2 4.02Å; I410-F415 HydrophobicContact CG2-CD2 4.19Å; I410-F415 HydrophobicContact CG2-CE2 3.6Å; I410-L426 HydrophobicContact CD1-CD1 3.76Å; I410-I431 HydrophobicContact CD1-CD1 4.18Å; I410-I431 HydrophobicContact CD1-CG2 4.21Å; I410-I431 HydrophobicContact CG1-CG2 4.14Å; I410-Y433 PolarHBondContact N-O 3.17Å; I410-V434 HydrophobicContact CB-CG1 4.25Å; I410-V434 HydrophobicContact CB-CG2 4.38Å; I410-V434 HydrophobicContact CD1-CG2 4.07Å; I410-V434 HydrophobicContact CG1-CG2 4.35Å; I410-Q435 WeakPolarHBondContact O-CB 3.4Å; I410-Q435 PolarHBondContact O-N 3.18Å; I410-A438 HydrophobicContact CG2-CB 3.77Å; I410-F439 HydrophobicContact CD1-CE1 4.43Å; I410-F439 HydrophobicContact CD1-CZ 4.25Å; I410-L450 HydrophobicContact CD1-CD2 4.36Å
411	Y	94.2	Very high	90.1	Very high	86 Å²	86	44.5 Å²	44.5	34%	0.337	22%	0.224	S	C	.	.			trans	-110.4	155.6	178.6	-61.9	-80.8	0	0	0	112.1	K409 S413 D414	K409-Y411 HydrophobicContact CB-CD2 4.49Å; K409-Y411 HydrophobicContact CB-CE2 3.76Å; K409-Y411 WeakPolarHBondContact CD-OH 3.4Å; Y411-S413 PolarHBondContact O-N 3.31Å; Y411-S413 VanDerWaalsContact O-N 3.09Å; Y411-D414 WeakPolarHBondContact CB-OD2 3.39Å; Y411-D414 PolarHBondContact N-OD2 3.05Å; Y411-D414 WeakPolarHBondContact O-CB 3.45Å; Y411-D414 PolarHBondContact O-N 2.94Å
412	R	91.3	Very high	90.1	Very high	114 Å²	114	45.1 Å²	45.1	43%	0.43	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-16.1	178.7	-177.7	162.8	173.3	169.2	-5.2	114.7	G437 I440	R412-G437 WeakPolarHBondContact CG-O 3.47Å; R412-I440 HydrophobicContact CG-CG2 4.32Å
413	S	89.8	Confident	90.1	Very high	66 Å²	66	45.9 Å²	45.9	46%	0.462	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-16.3	172.9	47.7	0	0	0	0	114.3	R393 Y411 W416	R393-S413 PolarHBondContact NH1-O 2.88Å; R393-S413 PolarHBondContact NH2-O 3.32Å; R393-S413 VanDerWaalsContact NH2-O 3.11Å; Y411-S413 PolarHBondContact O-N 3.31Å; Y411-S413 VanDerWaalsContact O-N 3.09Å; S413-W416 WeakPolarHBondContact O-CB 3.34Å
414	D	91	Very high	90.4	Very high	2 Å²	2	45.5 Å²	45.5	1%	0.011	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-49.8	-174	-73	-40.4	0	0	0	111.4	I387 S388 R393 Y411 W416	I387-D414 HydrophobicContact CB-CB 3.75Å; I387-D414 HydrophobicContact CD1-CB 3.96Å; I387-D414 HydrophobicContact CG1-CB 4.5Å; I387-D414 HydrophobicContact CG2-CB 3.8Å; S388-D414 WeakPolarHBondContact CB-OD1 3.35Å; S388-D414 PolarHBondContact N-OD1 3.03Å; S388-D414 PolarHBondContact OG-OD1 3.48Å; R393-D414 PolarHBondContact NH1-O 2.66Å; Y411-D414 WeakPolarHBondContact CB-OD2 3.39Å; Y411-D414 PolarHBondContact N-OD2 3.05Å; Y411-D414 WeakPolarHBondContact O-CB 3.45Å; Y411-D414 PolarHBondContact O-N 2.94Å; D414-W416 VanDerWaalsContact C-N 3.25Å; D414-W416 PolarHBondContact O-N 3.37Å
415	F	91	Very high	90.7	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	22.1	178.4	-60	-60.1	0	0	0	114.5	I387 L400 I410 N417 F418 L424 L426 F439 N441 L442	I387-F415 HydrophobicContact CD1-CE1 4.33Å; I387-F415 HydrophobicContact CD1-CE2 3.92Å; I387-F415 HydrophobicContact CD1-CZ 3.54Å; I387-F415 HydrophobicContact CG1-CZ 4.37Å; I387-F415 HydrophobicContact CG2-CE1 4.06Å; I387-F415 HydrophobicContact CG2-CZ 4.38Å; L400-F415 HydrophobicContact CD2-CE1 4.19Å; I410-F415 HydrophobicContact CG2-CD2 4.19Å; I410-F415 HydrophobicContact CG2-CE2 3.6Å; F415-N417 PolarHBondContact O-N 3.05Å; F415-F418 HydrophobicContact CB-CB 4.42Å; F415-F418 HydrophobicContact CD1-CD2 4.39Å; F415-F418 HydrophobicContact CD1-CG 4.42Å; F415-F418 PolarHBondContact O-N 3.03Å; F415-L424 HydrophobicContact CD1-CD2 4.36Å; F415-L424 HydrophobicContact CE1-CD1 3.85Å; F415-L424 HydrophobicContact CE1-CD2 3.75Å; F415-L424 HydrophobicContact CE1-CG 4.49Å; F415-L424 HydrophobicContact CE2-CD2 4.02Å; F415-L424 HydrophobicContact CZ-CD1 4.07Å; F415-L424 HydrophobicContact CZ-CD2 3.57Å; F415-L424 HydrophobicContact CZ-CG 4.43Å; F415-L426 HydrophobicContact CZ-CD1 4.11Å; F415-F439 AromaticContact CD2-CD1 3.86Å; F415-F439 HydrophobicContact CD2-CD1 3.86Å; F415-F439 HydrophobicContact CD2-CE1 4.09Å; F415-F439 AromaticContact CE2-CD1 3.92Å; F415-F439 HydrophobicContact CE2-CD1 3.92Å; F415-F439 AromaticContact CE2-CE1 3.66Å; F415-F439 HydrophobicContact CE2-CE1 3.66Å; F415-N441 WeakPolarHBondContact O-CB 3.42Å; F415-L442 HydrophobicContact CB-CD1 4.18Å; F415-L442 HydrophobicContact CB-CD2 4.01Å; F415-L442 HydrophobicContact CB-CG 4.12Å; F415-L442 HydrophobicContact CD1-CD1 4.39Å; F415-L442 HydrophobicContact CD2-CD1 4.28Å; F415-L442 HydrophobicContact CG-CD1 4.01Å; F415-L442 HydrophobicContact CG-CG 4.49Å
416	W	84.9	Confident	90.9	Very high	150 Å²	150	45.6 Å²	45.6	57%	0.568	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	131.1	171.7	-168.5	-87.1	0	0	0	111.3	S413 D414 F418	S413-W416 WeakPolarHBondContact O-CB 3.34Å; D414-W416 VanDerWaalsContact C-N 3.25Å; D414-W416 PolarHBondContact O-N 3.37Å; W416-F418 VanDerWaalsContact C-N 3.33Å; W416-F418 WeakPolarHBondContact O-CD2 3.41Å; W416-F418 PolarHBondContact O-N 3.35Å
417	N	80.9	Confident	90.7	Very high	102 Å²	102	42.4 Å²	42.4	55%	0.545	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.2	14.5	-172.6	-66.2	-8.6	0	0	0	117.2	F415 S419	F415-N417 PolarHBondContact O-N 3.05Å; N417-S419 VanDerWaalsContact C-N 3.33Å; N417-S419 PolarHBondContact O-N 3.32Å
418	F	87.6	Confident	90.4	Very high	4 Å²	4	47.6 Å²	47.6	2%	0.018	23%	0.233	C	C	.	.			trans	-91.1	27.1	176.5	-78	-91.8	0	0	0	114.5	P394 A397 L400 F415 W416 S420 L421 L442	P394-F418 HydrophobicContact CG-CE1 3.64Å; P394-F418 HydrophobicContact CG-CZ 3.8Å; A397-F418 HydrophobicContact CB-CD1 3.93Å; A397-F418 HydrophobicContact CB-CE1 3.99Å; L400-F418 HydrophobicContact CD2-CD1 4.25Å; L400-F418 HydrophobicContact CD2-CE1 3.74Å; L400-F418 HydrophobicContact CD2-CZ 4.26Å; F415-F418 HydrophobicContact CB-CB 4.42Å; F415-F418 HydrophobicContact CD1-CD2 4.39Å; F415-F418 HydrophobicContact CD1-CG 4.42Å; F415-F418 PolarHBondContact O-N 3.03Å; W416-F418 VanDerWaalsContact C-N 3.33Å; W416-F418 WeakPolarHBondContact O-CD2 3.41Å; W416-F418 PolarHBondContact O-N 3.35Å; F418-S420 PolarHBondContact O-N 2.87Å; F418-L421 HydrophobicContact CB-CD1 3.88Å; F418-L421 HydrophobicContact CB-CG 4.16Å; F418-L421 HydrophobicContact CD1-CD1 3.81Å; F418-L421 HydrophobicContact CD1-CD2 4.42Å; F418-L421 HydrophobicContact CD1-CG 4.08Å; F418-L421 HydrophobicContact CG-CD1 4.22Å; F418-L421 PolarHBondContact O-N 3.12Å; F418-L421 VanDerWaalsContact O-N 3.1Å; F418-L442 HydrophobicContact CB-CD2 3.59Å; F418-L442 WeakPolarHBondContact O-CD2 3.33Å
419	S	87.6	Confident	90.3	Very high	65 Å²	65	43.9 Å²	43.9	46%	0.455	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-11.9	-170.1	55	0	0	0	0	116.2	N417 N441 N444	N417-S419 VanDerWaalsContact C-N 3.33Å; N417-S419 PolarHBondContact O-N 3.32Å; S419-N441 WeakPolarHBondContact CA-O 3.19Å; S419-N444 PolarHBondContact O-ND2 3.31Å
420	S	87.6	Confident	90.4	Very high	35 Å²	35	43.2 Å²	43.2	25%	0.245	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-0.6	175.9	51.6	0	0	0	0	114.9	N396 A397 K398 F418 D422	N396-S420 VanDerWaalsContact CA-OG 3.31Å; N396-S420 WeakPolarHBondContact CA-OG 3.46Å; A397-S420 PolarHBondContact N-OG 3.01Å; A397-S420 CarbonylContact O-C 3.2Å; A397-S420 WeakPolarHBondContact O-CB 3.4Å; A397-S420 PolarHBondContact O-OG 3.36Å; K398-S420 WeakPolarHBondContact CA-O 3.49Å; F418-S420 PolarHBondContact O-N 2.87Å; S420-D422 PolarHBondContact O-N 3.17Å
421	L	91.1	Very high	90.4	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.215	C	C	.	.			trans	-67	124.2	-179.2	-74.5	179.9	0	0	0	111.9	A397 L400 F418 L442 N444 L445	A397-L421 HydrophobicContact CB-CD2 3.93Å; A397-L421 WeakPolarHBondContact O-CD2 3.36Å; A397-L421 PolarHBondContact O-N 2.94Å; L400-L421 HydrophobicContact CB-CD1 4.28Å; L400-L421 HydrophobicContact CB-CD2 3.77Å; L400-L421 HydrophobicContact CD2-CD1 4.44Å; F418-L421 HydrophobicContact CB-CD1 3.88Å; F418-L421 HydrophobicContact CB-CG 4.16Å; F418-L421 HydrophobicContact CD1-CD1 3.81Å; F418-L421 HydrophobicContact CD1-CD2 4.42Å; F418-L421 HydrophobicContact CD1-CG 4.08Å; F418-L421 HydrophobicContact CG-CD1 4.22Å; F418-L421 PolarHBondContact O-N 3.12Å; F418-L421 VanDerWaalsContact O-N 3.1Å; L421-L442 HydrophobicContact CB-CD2 4.38Å; L421-L442 HydrophobicContact CD1-CD2 3.94Å; L421-L442 HydrophobicContact CG-CD2 4.5Å; L421-N444 CarbonylContact O-C 3.54Å; L421-N444 VanDerWaalsContact O-C 3.24Å; L421-L445 HydrophobicContact CB-CD1 3.76Å; L421-L445 WeakPolarHBondContact O-CA 3.46Å; L421-L445 PolarHBondContact O-N 3.4Å; L421-L445 VanDerWaalsContact O-N 3.14Å
422	D	86.9	Confident	90.5	Very high	34 Å²	34	42.2 Å²	42.2	18%	0.182	22%	0.22	C	C	.	.	S	Bend	trans	-89.8	-33	164.7	-82.2	38.1	0	0	0	111	K398 S420 K446 S447	K398-D422 WeakPolarHBondContact CE-OD1 3.5Å; K398-D422 WeakPolarHBondContact CE-OD2 3.39Å; K398-D422 HydrophobicContact CG-CB 4.11Å; K398-D422 IonicContact NZ-OD2 2.65Å; K398-D422 PolarHBondContact O-N 3.08Å; S420-D422 PolarHBondContact O-N 3.17Å; D422-K446 HydrophobicContact CB-CD 4.43Å; D422-K446 PolarHBondContact O-N 3.34Å; D422-K446 IonicContact OD1-NZ 3.81Å; D422-K446 IonicContact OD2-NZ 2.71Å; D422-K446 PolarHBondContact OD2-NZ 3.04Å; D422-S447 PolarHBondContact O-N 3.05Å
423	L	89.9	Confident	90.6	Very high	16 Å²	16	42.1 Å²	42.1	8%	0.084	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	133.9	-175.4	-177.2	153.6	0	0	0	112.2	K398 K399 L400 Y401 H425 Y449	K398-L423 PolarHBondContact O-N 2.92Å; K399-L423 WeakPolarHBondContact CA-O 3.41Å; K399-L423 HydrophobicContact CG-CB 4.21Å; L400-L423 PolarHBondContact N-O 2.79Å; Y401-L423 HydrophobicContact CD1-CD2 4.29Å; Y401-L423 HydrophobicContact CE1-CD2 3.78Å; Y401-L423 HydrophobicContact CE2-CD2 4.47Å; L423-H425 HydrophobicContact CD2-CB 4.21Å; L423-Y449 HydrophobicContact CD1-CE2 4.1Å; L423-Y449 HydrophobicContact CG-CE2 4.2Å
424	L	94.4	Very high	90.9	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	115.9	176.4	175.1	57.3	0	0	0	109.6	L400 F415 L426 F439 L442 L445 S447 L448 Y449	L400-L424 HydrophobicContact CB-CD1 4.11Å; L400-L424 HydrophobicContact CD2-CD1 3.93Å; L400-L424 HydrophobicContact CG-CD1 4.08Å; F415-L424 HydrophobicContact CD1-CD2 4.36Å; F415-L424 HydrophobicContact CE1-CD1 3.85Å; F415-L424 HydrophobicContact CE1-CD2 3.75Å; F415-L424 HydrophobicContact CE1-CG 4.49Å; F415-L424 HydrophobicContact CE2-CD2 4.02Å; F415-L424 HydrophobicContact CZ-CD1 4.07Å; F415-L424 HydrophobicContact CZ-CD2 3.57Å; F415-L424 HydrophobicContact CZ-CG 4.43Å; L424-L426 HydrophobicContact CD1-CD1 4.1Å; L424-L426 HydrophobicContact CD1-CG 4.03Å; L424-L426 HydrophobicContact CD2-CD1 3.89Å; L424-L426 HydrophobicContact CG-CD1 3.84Å; L424-L426 HydrophobicContact CG-CG 4.14Å; L424-F439 HydrophobicContact CD2-CD1 4.39Å; L424-F439 HydrophobicContact CD2-CE1 4.15Å; L424-L442 HydrophobicContact CD2-CD1 3.88Å; L424-L445 HydrophobicContact CB-CD1 3.75Å; L424-L445 HydrophobicContact CB-CD2 4.13Å; L424-L445 HydrophobicContact CD2-CD2 4.5Å; L424-S447 PolarHBondContact N-O 3.42Å; L424-L448 HydrophobicContact CB-CD1 4.16Å; L424-L448 HydrophobicContact CD2-CD1 3.93Å; L424-L448 HydrophobicContact CG-CD1 3.97Å; L424-L448 WeakPolarHBondContact O-CA 3.06Å; L424-Y449 PolarHBondContact O-N 3.48Å
425	H	90.2	Very high	91.1	Very high	36 Å²	36	42.6 Å²	42.6	17%	0.167	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	108.1	-179.5	-167.9	-45.5	0	0	0	111.3	L400 Y401 L402 S403 L423 G427 Y449	L400-H425 PolarHBondContact O-N 3.32Å; Y401-H425 HydrophobicContact CD1-CB 3.82Å; Y401-H425 HydrophobicContact CE1-CB 4.46Å; L402-H425 CarbonylContact C-O 3.49Å; L402-H425 WeakPolarHBondContact CA-O 3.2Å; L402-H425 PolarHBondContact N-O 3.09Å; S403-H425 WeakPolarHBondContact CB-ND1 3.29Å; S403-H425 PolarHBondContact N-O 3.14Å; S403-H425 PolarHBondContact OG-ND1 2.85Å; L423-H425 HydrophobicContact CD2-CB 4.21Å; H425-G427 PolarHBondContact ND1-N 3.44Å; H425-Y449 HydrophobicContact CB-CD2 4.06Å; H425-Y449 AromaticContact CD2-CD2 3.73Å; H425-Y449 AromaticContact CD2-CG 3.71Å
426	L	95	Very high	91.1	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.241	C	C	.	.			trans	-116.5	4.6	-179.6	-71.6	159.4	0	0	0	112.8	I387 L402 I407 I410 F415 L424 N429 I431 L448 Y449 L450 N453	I387-L426 HydrophobicContact CD1-CD2 4.45Å; L402-L426 HydrophobicContact CB-CD2 3.9Å; L402-L426 HydrophobicContact CD1-CD2 3.84Å; I407-L426 HydrophobicContact CD1-CD2 4.11Å; I410-L426 HydrophobicContact CD1-CD1 3.76Å; F415-L426 HydrophobicContact CZ-CD1 4.11Å; L424-L426 HydrophobicContact CD1-CD1 4.1Å; L424-L426 HydrophobicContact CD1-CG 4.03Å; L424-L426 HydrophobicContact CD2-CD1 3.89Å; L424-L426 HydrophobicContact CG-CD1 3.84Å; L424-L426 HydrophobicContact CG-CG 4.14Å; L426-N429 PolarHBondContact O-ND2 2.86Å; L426-I431 HydrophobicContact CB-CD1 3.87Å; L426-I431 HydrophobicContact CD2-CD1 4.36Å; L426-L448 HydrophobicContact CD1-CD1 4.44Å; L426-Y449 CarbonylContact C-O 3.09Å; L426-Y449 WeakPolarHBondContact CA-O 3.47Å; L426-Y449 WeakPolarHBondContact CB-O 3.28Å; L426-Y449 PolarHBondContact N-O 3.25Å; L426-L450 HydrophobicContact CB-CD2 3.83Å; L426-L450 HydrophobicContact CD1-CD2 3.89Å; L426-N453 PolarHBondContact O-ND2 3.14Å
427	G	90.2	Very high	91.5	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.215	C	C	.	.			trans	-62.5	156.3	-179.5	0	0	0	0	0	115.2	S403 H425 N429 Y449 N451	S403-G427 WeakPolarHBondContact CA-O 3.47Å; S403-G427 WeakPolarHBondContact CB-O 3.43Å; H425-G427 PolarHBondContact ND1-N 3.44Å; G427-N429 PolarHBondContact O-ND2 3.46Å; G427-Y449 PolarHBondContact N-O 3.06Å; G427-Y449 VanDerWaalsContact N-O 3.16Å; G427-N451 CarbonylContact C-O 3.45Å; G427-N451 WeakPolarHBondContact CA-O 3.5Å; G427-N451 VanDerWaalsContact CA-OD1 3.29Å; G427-N451 WeakPolarHBondContact CA-OD1 3.37Å
428	N	89.8	Confident	92.1	Very high	109 Å²	109	36 Å²	36	58%	0.583	19%	0.189	S	C	*	.	S	Bend	trans	54.6	62.7	-171.8	-61.1	-26.8	0	0	0	111.7	G404 N451 G452	G404-N428 WeakPolarHBondContact CA-O 3.47Å; G404-N428 PolarHBondContact N-O 3.38Å; N428-N451 PolarHBondContact N-O 2.95Å; N428-G452 WeakPolarHBondContact CA-O 3.5Å; N428-G452 PolarHBondContact N-O 3.46Å; N428-G452 VanDerWaalsContact N-O 3.13Å
429	N	93.8	Very high	92.4	Very high	13 Å²	13	35.9 Å²	35.9	7%	0.07	19%	0.188	C	C	.	.	S	Bend	trans	-132	-160.5	172.2	-86.9	-90.8	0	0	0	108.7	L402 N405 I407 L426 G427 I431 G452 N453	L402-N429 PolarHBondContact O-ND2 2.89Å; N405-N429 WeakPolarHBondContact CA-OD1 3.49Å; N405-N429 WeakPolarHBondContact CB-OD1 3.39Å; N405-N429 PolarHBondContact O-OD1 3.44Å; N405-N429 VanDerWaalsContact O-OD1 3.12Å; I407-N429 HydrophobicContact CB-CB 4.38Å; I407-N429 VanDerWaalsContact CB-OD1 3.32Å; I407-N429 WeakPolarHBondContact CB-OD1 3.4Å; I407-N429 WeakPolarHBondContact CG1-OD1 3.35Å; I407-N429 PolarHBondContact N-OD1 2.86Å; I407-N429 VanDerWaalsContact N-OD1 3.08Å; L426-N429 PolarHBondContact O-ND2 2.86Å; G427-N429 PolarHBondContact O-ND2 3.46Å; N429-I431 HydrophobicContact CB-CD1 3.97Å; N429-I431 HydrophobicContact CB-CG1 3.93Å; N429-G452 PolarHBondContact N-O 3Å; N429-G452 VanDerWaalsContact N-O 3.14Å; N429-N453 WeakPolarHBondContact CA-OD1 3.43Å; N429-N453 WeakPolarHBondContact CB-OD1 3.35Å; N429-N453 PolarHBondContact N-OD1 2.88Å; N429-N453 PolarHBondContact O-OD1 3.46Å
430	Q	95.3	Very high	92.7	Very high	76 Å²	76	35.1 Å²	35.1	36%	0.355	18%	0.178	S	C	.	.			trans	-119.3	30.3	177.8	-65.5	179	-4.7	0	0	111.3	I407 Q408 S432 N453 D454	I407-Q430 CarbonylContact O-C 3.54Å; I407-Q430 WeakPolarHBondContact O-CA 3.49Å; I407-Q430 PolarHBondContact O-N 3.23Å; Q408-Q430 WeakPolarHBondContact CA-O 3.46Å; Q408-Q430 HydrophobicContact CG-CB 3.78Å; Q430-S432 PolarHBondContact O-N 3.16Å; Q430-N453 PolarHBondContact N-OD1 3.02Å; Q430-D454 VanDerWaalsContact CA-OD2 3.31Å; Q430-D454 WeakPolarHBondContact CA-OD2 3.08Å
431	I	96.8	Very high	92.8	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.177	C	C	.	.			trans	-70.7	107.3	-167.9	-59.9	161.8	0	0	0	108.9	I407 Q408 I410 L426 N429 V434 L450 N453 D454 I455	I407-I431 HydrophobicContact CB-CG1 4.35Å; I407-I431 HydrophobicContact CG2-CG1 4.16Å; I407-I431 VanDerWaalsContact O-CG1 3.27Å; I407-I431 WeakPolarHBondContact O-CG1 3.46Å; I407-I431 PolarHBondContact O-N 3.14Å; I407-I431 VanDerWaalsContact O-N 3.17Å; Q408-I431 WeakPolarHBondContact O-CA 3.46Å; I410-I431 HydrophobicContact CD1-CD1 4.18Å; I410-I431 HydrophobicContact CD1-CG2 4.21Å; I410-I431 HydrophobicContact CG1-CG2 4.14Å; L426-I431 HydrophobicContact CB-CD1 3.87Å; L426-I431 HydrophobicContact CD2-CD1 4.36Å; N429-I431 HydrophobicContact CB-CD1 3.97Å; N429-I431 HydrophobicContact CB-CG1 3.93Å; I431-V434 HydrophobicContact CG2-CG2 3.92Å; I431-L450 HydrophobicContact CD1-CD2 4.07Å; I431-N453 HydrophobicContact CB-CB 4.19Å; I431-N453 VanDerWaalsContact CB-OD1 3.26Å; I431-N453 WeakPolarHBondContact CB-OD1 3.4Å; I431-N453 WeakPolarHBondContact CD1-OD1 3.22Å; I431-N453 VanDerWaalsContact CG1-OD1 3.28Å; I431-N453 WeakPolarHBondContact CG1-OD1 3.45Å; I431-N453 PolarHBondContact N-OD1 3.47Å; I431-D454 CarbonylContact O-C 3.59Å; I431-D454 VanDerWaalsContact O-C 3.25Å; I431-D454 WeakPolarHBondContact O-CA 3.29Å; I431-D454 PolarHBondContact O-N 2.82Å; I431-I455 HydrophobicContact CG2-CD1 4.45Å; I431-I455 HydrophobicContact CG2-CG1 4.36Å; I431-I455 WeakPolarHBondContact O-CG1 3.37Å; I431-I455 PolarHBondContact O-N 3.24Å
432	S	95.3	Very high	92.9	Very high	65 Å²	65	35.4 Å²	35.4	46%	0.455	18%	0.177	S	C	.	.			trans	-107.4	-14.7	177.9	45.5	0	0	0	0	112.9	Q408 Q430 D454	Q408-S432 PolarHBondContact O-N 2.83Å; Q408-S432 PolarHBondContact O-OG 3.31Å; Q430-S432 PolarHBondContact O-N 3.16Å; S432-D454 WeakPolarHBondContact CA-O 3.12Å
433	Y	94.6	Very high	93.1	Very high	111 Å²	111	36.1 Å²	36.1	44%	0.435	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	129.6	-179.2	179	-97.4	0	0	0	112.8	K409 I410 Q435	K409-Y433 WeakPolarHBondContact CA-O 3.49Å; I410-Y433 PolarHBondContact N-O 3.17Å; Y433-Q435 HydrophobicContact CE1-CB 3.97Å
434	V	95.5	Very high	93.1	Very high	10 Å²	10	39.2 Å²	39.2	6%	0.061	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	121.7	172	-177.8	0	0	0	0	108.3	I410 I431 A438 F439 M462	I410-V434 HydrophobicContact CB-CG1 4.25Å; I410-V434 HydrophobicContact CB-CG2 4.38Å; I410-V434 HydrophobicContact CD1-CG2 4.07Å; I410-V434 HydrophobicContact CG1-CG2 4.35Å; I431-V434 HydrophobicContact CG2-CG2 3.92Å; V434-A438 HydrophobicContact CG1-CB 3.65Å; V434-F439 HydrophobicContact CG1-CE2 3.9Å; V434-F439 HydrophobicContact CG1-CZ 4.05Å; V434-M462 HydrophobicContact CB-CE 4.13Å; V434-M462 HydrophobicContact CB-CG 4.32Å; V434-M462 HydrophobicContact CG1-CB 4.49Å; V434-M462 HydrophobicContact CG1-CG 4.4Å; V434-M462 HydrophobicContact CG2-CE 4.39Å
435	Q	94.3	Very high	93.1	Very high	68 Å²	68	39.2 Å²	39.2	32%	0.318	20%	0.201	S	C	.	.			trans	-68.9	146.2	179.3	-168	177.9	22.3	0	0	111.7	I410 Y433 G437 A438	I410-Q435 WeakPolarHBondContact O-CB 3.4Å; I410-Q435 PolarHBondContact O-N 3.18Å; Y433-Q435 HydrophobicContact CE1-CB 3.97Å; Q435-G437 PolarHBondContact O-N 2.87Å; Q435-A438 WeakPolarHBondContact O-CB 3.3Å; Q435-A438 PolarHBondContact O-N 3.45Å
436	E	92.6	Very high	93	Very high	113 Å²	113	41.3 Å²	41.3	53%	0.528	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	129.2	175.8	-58.2	-157.8	142.5	0	0	112.4	A438 S459 G461	E436-A438 VanDerWaalsContact C-N 3.31Å; E436-S459 PolarHBondContact OE1-OG 2.02Å; E436-G461 CarbonylContact C-O 3.19Å; E436-G461 WeakPolarHBondContact CA-O 3.34Å
437	G	91.6	Very high	92.8	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.01	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.3	20.3	-169.8	0	0	0	0	0	114.1	R412 Q435 F439 I440 G461	R412-G437 WeakPolarHBondContact CG-O 3.47Å; Q435-G437 PolarHBondContact O-N 2.87Å; G437-F439 PolarHBondContact O-N 3.26Å; G437-I440 VanDerWaalsContact O-CB 3.28Å; G437-I440 WeakPolarHBondContact O-CB 3.36Å; G437-I440 WeakPolarHBondContact O-CG2 3.32Å; G437-I440 PolarHBondContact O-N 3.3Å; G437-I440 VanDerWaalsContact O-N 3.1Å; G437-G461 PolarHBondContact N-O 2.97Å
438	A	94.1	Very high	93.1	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.4	-42.9	170.7	0	0	0	0	0	112.1	I410 V434 Q435 E436	I410-A438 HydrophobicContact CG2-CB 3.77Å; V434-A438 HydrophobicContact CG1-CB 3.65Å; Q435-A438 WeakPolarHBondContact O-CB 3.3Å; Q435-A438 PolarHBondContact O-N 3.45Å; E436-A438 VanDerWaalsContact C-N 3.31Å
439	F	94.9	Very high	93.3	Very high	1 Å²	1	39.6 Å²	39.6	0%	0.004	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	14.4	-177.1	-48.8	-60.2	0	0	0	113.9	I410 F415 L424 V434 G437 N441 L442 L448 L450 M462 R464 L466	I410-F439 HydrophobicContact CD1-CE1 4.43Å; I410-F439 HydrophobicContact CD1-CZ 4.25Å; F415-F439 AromaticContact CD2-CD1 3.86Å; F415-F439 HydrophobicContact CD2-CD1 3.86Å; F415-F439 HydrophobicContact CD2-CE1 4.09Å; F415-F439 AromaticContact CE2-CD1 3.92Å; F415-F439 HydrophobicContact CE2-CD1 3.92Å; F415-F439 AromaticContact CE2-CE1 3.66Å; F415-F439 HydrophobicContact CE2-CE1 3.66Å; L424-F439 HydrophobicContact CD2-CD1 4.39Å; L424-F439 HydrophobicContact CD2-CE1 4.15Å; V434-F439 HydrophobicContact CG1-CE2 3.9Å; V434-F439 HydrophobicContact CG1-CZ 4.05Å; G437-F439 PolarHBondContact O-N 3.26Å; F439-N441 PolarHBondContact O-N 2.9Å; F439-L442 HydrophobicContact CB-CD1 4.17Å; F439-L442 HydrophobicContact CD1-CD1 3.83Å; F439-L442 HydrophobicContact CG-CD1 4.45Å; F439-L442 WeakPolarHBondContact O-CB 3.13Å; F439-L442 PolarHBondContact O-N 3.5Å; F439-L448 HydrophobicContact CD2-CD2 4.47Å; F439-L448 HydrophobicContact CE2-CD2 4.1Å; F439-L448 HydrophobicContact CZ-CD2 4.13Å; F439-L450 HydrophobicContact CZ-CD1 4.35Å; F439-M462 VanDerWaalsContact CD2-O 3.31Å; F439-M462 WeakPolarHBondContact CD2-O 3.2Å; F439-R464 CarbonylContact C-O 3.48Å; F439-L466 HydrophobicContact CB-CD1 4.02Å; F439-L466 HydrophobicContact CB-CD2 3.73Å; F439-L466 HydrophobicContact CB-CG 3.75Å; F439-L466 HydrophobicContact CD2-CD1 3.77Å; F439-L466 HydrophobicContact CD2-CG 4.44Å; F439-L466 HydrophobicContact CG-CD1 4.07Å; F439-L466 HydrophobicContact CG-CD2 4.31Å; F439-L466 HydrophobicContact CG-CG 4.34Å
440	I	92.6	Very high	93.4	Very high	49 Å²	49	39 Å²	39	25%	0.251	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-24.1	-173.5	-160.1	171.2	0	0	0	114.2	R412 G437 R464	R412-I440 HydrophobicContact CG-CG2 4.32Å; G437-I440 VanDerWaalsContact O-CB 3.28Å; G437-I440 WeakPolarHBondContact O-CB 3.36Å; G437-I440 WeakPolarHBondContact O-CG2 3.32Å; G437-I440 PolarHBondContact O-N 3.3Å; G437-I440 VanDerWaalsContact O-N 3.1Å; I440-R464 WeakPolarHBondContact CA-O 3.39Å; I440-R464 PolarHBondContact N-O 2.93Å
441	N	89.3	Confident	93.2	Very high	41 Å²	41	36.8 Å²	36.8	22%	0.219	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	10.7	179.6	-64.7	-40.3	0	0	0	113.4	F415 S419 F439 P443	F415-N441 WeakPolarHBondContact O-CB 3.42Å; S419-N441 WeakPolarHBondContact CA-O 3.19Å; F439-N441 PolarHBondContact O-N 2.9Å; N441-P443 WeakPolarHBondContact O-CD 3.33Å
442	L	93.6	Very high	92.9	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.194	C	C	.	.			trans	-114.5	56.1	-174.6	-56.4	-173.1	0	0	0	113.7	F415 F418 L421 L424 F439 N444 L445 L466	F415-L442 HydrophobicContact CB-CD1 4.18Å; F415-L442 HydrophobicContact CB-CD2 4.01Å; F415-L442 HydrophobicContact CB-CG 4.12Å; F415-L442 HydrophobicContact CD1-CD1 4.39Å; F415-L442 HydrophobicContact CD2-CD1 4.28Å; F415-L442 HydrophobicContact CG-CD1 4.01Å; F415-L442 HydrophobicContact CG-CG 4.49Å; F418-L442 HydrophobicContact CB-CD2 3.59Å; F418-L442 WeakPolarHBondContact O-CD2 3.33Å; L421-L442 HydrophobicContact CB-CD2 4.38Å; L421-L442 HydrophobicContact CD1-CD2 3.94Å; L421-L442 HydrophobicContact CG-CD2 4.5Å; L424-L442 HydrophobicContact CD2-CD1 3.88Å; F439-L442 HydrophobicContact CB-CD1 4.17Å; F439-L442 HydrophobicContact CD1-CD1 3.83Å; F439-L442 HydrophobicContact CG-CD1 4.45Å; F439-L442 WeakPolarHBondContact O-CB 3.13Å; F439-L442 PolarHBondContact O-N 3.5Å; L442-N444 VanDerWaalsContact C-N 3.29Å; L442-N444 PolarHBondContact O-N 2.97Å; L442-L445 HydrophobicContact CB-CB 4.19Å; L442-L445 HydrophobicContact CD1-CD2 4.17Å; L442-L445 PolarHBondContact O-N 2.76Å; L442-L466 HydrophobicContact CB-CD2 4.15Å
443	P	91.1	Very high	93	Very high	49 Å²	49	34.9 Å²	34.9	32%	0.318	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-28.4	-172.9	28.6	-36.2	0	0	0	114.1	N441 G465 M468	N441-P443 WeakPolarHBondContact O-CD 3.33Å; P443-G465 WeakPolarHBondContact CA-O 3.4Å; P443-M468 VanDerWaalsContact O-CB 3.24Å; P443-M468 WeakPolarHBondContact O-CB 3.31Å; P443-M468 PolarHBondContact O-N 3.12Å
444	N	90.4	Very high	93.1	Very high	82 Å²	82	33.1 Å²	33.1	44%	0.439	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-1.2	-175.5	-65.1	-59.9	0	0	0	114.1	S419 L421 L442 K446	S419-N444 PolarHBondContact O-ND2 3.31Å; L421-N444 CarbonylContact O-C 3.54Å; L421-N444 VanDerWaalsContact O-C 3.24Å; L442-N444 VanDerWaalsContact C-N 3.29Å; L442-N444 PolarHBondContact O-N 2.97Å; N444-K446 PolarHBondContact O-N 3.09Å
445	L	94.6	Very high	93.1	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.171	C	C	.	.			trans	-67.7	126.3	-173.4	-163.5	77	0	0	0	110.6	L421 L424 L442 L448 L466 M468 L469	L421-L445 HydrophobicContact CB-CD1 3.76Å; L421-L445 WeakPolarHBondContact O-CA 3.46Å; L421-L445 PolarHBondContact O-N 3.4Å; L421-L445 VanDerWaalsContact O-N 3.14Å; L424-L445 HydrophobicContact CB-CD1 3.75Å; L424-L445 HydrophobicContact CB-CD2 4.13Å; L424-L445 HydrophobicContact CD2-CD2 4.5Å; L442-L445 HydrophobicContact CB-CB 4.19Å; L442-L445 HydrophobicContact CD1-CD2 4.17Å; L442-L445 PolarHBondContact O-N 2.76Å; L445-L448 HydrophobicContact CD2-CB 4.04Å; L445-L448 HydrophobicContact CD2-CD1 4.37Å; L445-L448 HydrophobicContact CD2-CD2 4.49Å; L445-L466 HydrophobicContact CB-CD2 3.93Å; L445-L466 HydrophobicContact CD2-CD2 3.54Å; L445-L466 HydrophobicContact CG-CD2 4.34Å; L445-M468 CarbonylContact O-C 3.17Å; L445-L469 HydrophobicContact CB-CD1 4.4Å; L445-L469 HydrophobicContact CD2-CD1 4Å; L445-L469 HydrophobicContact CG-CD1 4.05Å; L445-L469 WeakPolarHBondContact O-CA 3.27Å; L445-L469 PolarHBondContact O-N 3.41Å
446	K	88.8	Confident	93.1	Very high	79 Å²	79	33.2 Å²	33.2	34%	0.343	17%	0.172	S	C	.	.			trans	-105	-35	-178.2	-65.6	161.6	-169.4	166.3	0	112.5	D422 N444 M468 S470 Y471	D422-K446 HydrophobicContact CB-CD 4.43Å; D422-K446 PolarHBondContact O-N 3.34Å; D422-K446 IonicContact OD1-NZ 3.81Å; D422-K446 IonicContact OD2-NZ 2.71Å; D422-K446 PolarHBondContact OD2-NZ 3.04Å; N444-K446 PolarHBondContact O-N 3.09Å; K446-M468 HydrophobicContact CG-CG 4.29Å; K446-S470 PolarHBondContact O-N 3.07Å; K446-Y471 PolarHBondContact O-N 3.08Å
447	S	90.4	Very high	93.2	Very high	19 Å²	19	34.8 Å²	34.8	13%	0.133	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	126.2	-177.6	-54.5	0	0	0	0	111.8	D422 L424 Y471	D422-S447 PolarHBondContact O-N 3.05Å; L424-S447 PolarHBondContact N-O 3.42Å; S447-Y471 WeakPolarHBondContact CA-O 3.47Å
448	L	96.4	Very high	93.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	117.6	178.4	177.3	55.4	0	0	0	110.2	L424 L426 F439 L445 L450 L466 L469 Y471 L472 Y473	L424-L448 HydrophobicContact CB-CD1 4.16Å; L424-L448 HydrophobicContact CD2-CD1 3.93Å; L424-L448 HydrophobicContact CG-CD1 3.97Å; L424-L448 WeakPolarHBondContact O-CA 3.06Å; L426-L448 HydrophobicContact CD1-CD1 4.44Å; F439-L448 HydrophobicContact CD2-CD2 4.47Å; F439-L448 HydrophobicContact CE2-CD2 4.1Å; F439-L448 HydrophobicContact CZ-CD2 4.13Å; L445-L448 HydrophobicContact CD2-CB 4.04Å; L445-L448 HydrophobicContact CD2-CD1 4.37Å; L445-L448 HydrophobicContact CD2-CD2 4.49Å; L448-L450 HydrophobicContact CD1-CD1 4.22Å; L448-L450 HydrophobicContact CD1-CG 4.13Å; L448-L450 HydrophobicContact CD2-CD1 3.93Å; L448-L450 HydrophobicContact CG-CD1 3.96Å; L448-L450 HydrophobicContact CG-CG 4.19Å; L448-L466 HydrophobicContact CD2-CD1 3.84Å; L448-L469 HydrophobicContact CB-CD1 3.78Å; L448-L469 HydrophobicContact CB-CD2 4.32Å; L448-Y471 PolarHBondContact N-O 3.26Å; L448-L472 HydrophobicContact CB-CD1 4.09Å; L448-L472 HydrophobicContact CD2-CD1 3.97Å; L448-L472 HydrophobicContact CG-CD1 4.05Å; L448-Y473 PolarHBondContact O-N 3.26Å; L448-Y473 VanDerWaalsContact O-N 3.09Å
449	Y	93	Very high	93.3	Very high	54 Å²	54	35.3 Å²	35.3	21%	0.212	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	115	176.9	-55.6	-98.2	0	0	0	110.6	L423 L424 H425 L426 G427 Y473	L423-Y449 HydrophobicContact CD1-CE2 4.1Å; L423-Y449 HydrophobicContact CG-CE2 4.2Å; L424-Y449 PolarHBondContact O-N 3.48Å; H425-Y449 HydrophobicContact CB-CD2 4.06Å; H425-Y449 AromaticContact CD2-CD2 3.73Å; H425-Y449 AromaticContact CD2-CG 3.71Å; L426-Y449 CarbonylContact C-O 3.09Å; L426-Y449 WeakPolarHBondContact CA-O 3.47Å; L426-Y449 WeakPolarHBondContact CB-O 3.28Å; L426-Y449 PolarHBondContact N-O 3.25Å; G427-Y449 PolarHBondContact N-O 3.06Å; G427-Y449 VanDerWaalsContact N-O 3.16Å; Y449-Y473 AromaticContact CD1-CD2 3.3Å; Y449-Y473 HydrophobicContact CD1-CD2 3.3Å; Y449-Y473 AromaticContact CD1-CE2 3.85Å; Y449-Y473 HydrophobicContact CD1-CE2 3.85Å; Y449-Y473 AromaticContact CD1-CG 3.71Å; Y449-Y473 HydrophobicContact CD1-CG 3.71Å; Y449-Y473 AromaticContact CE1-CD2 3.29Å; Y449-Y473 HydrophobicContact CE1-CD2 3.29Å; Y449-Y473 AromaticContact CE1-CE2 3.29Å; Y449-Y473 HydrophobicContact CE1-CE2 3.29Å; Y449-Y473 AromaticContact CE1-CG 3.94Å; Y449-Y473 HydrophobicContact CE1-CG 3.94Å; Y449-Y473 AromaticContact CE1-CZ 3.96Å; Y449-Y473 AromaticContact CG-CD2 3.98Å; Y449-Y473 HydrophobicContact CG-CD2 3.98Å; Y449-Y473 AromaticContact CZ-CD2 3.97Å; Y449-Y473 AromaticContact CZ-CE2 3.69Å
450	L	95.8	Very high	93.1	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	19%	0.187	C	C	.	.			trans	-124.7	14.2	175.5	-71.7	164.6	0	0	0	111.4	I410 L426 I431 F439 L448 N453 I455 Y473 F474 N477	I410-L450 HydrophobicContact CD1-CD2 4.36Å; L426-L450 HydrophobicContact CB-CD2 3.83Å; L426-L450 HydrophobicContact CD1-CD2 3.89Å; I431-L450 HydrophobicContact CD1-CD2 4.07Å; F439-L450 HydrophobicContact CZ-CD1 4.35Å; L448-L450 HydrophobicContact CD1-CD1 4.22Å; L448-L450 HydrophobicContact CD1-CG 4.13Å; L448-L450 HydrophobicContact CD2-CD1 3.93Å; L448-L450 HydrophobicContact CG-CD1 3.96Å; L448-L450 HydrophobicContact CG-CG 4.19Å; L450-N453 WeakPolarHBondContact O-CB 3.41Å; L450-N453 PolarHBondContact O-ND2 2.8Å; L450-I455 HydrophobicContact CB-CD1 4.12Å; L450-I455 HydrophobicContact CD1-CD1 4.48Å; L450-I455 HydrophobicContact CD2-CD1 4.42Å; L450-Y473 CarbonylContact C-O 3.59Å; L450-Y473 WeakPolarHBondContact CA-O 3.26Å; L450-Y473 PolarHBondContact N-O 3.48Å; L450-F474 HydrophobicContact CB-CD1 3.77Å; L450-F474 HydrophobicContact CB-CE1 3.65Å; L450-F474 HydrophobicContact CD1-CD1 4.47Å; L450-F474 HydrophobicContact CD1-CE1 3.54Å; L450-F474 HydrophobicContact CD1-CZ 3.81Å; L450-F474 HydrophobicContact CG-CE1 4.23Å; L450-N477 PolarHBondContact O-ND2 2.85Å
451	N	92.3	Very high	93	Very high	29 Å²	29	35.2 Å²	35.2	16%	0.155	18%	0.182	C	C	.	.			trans	-62.7	148.7	176.7	57.9	-19.2	0	0	0	113.2	G427 N428 N453 Y473 E475	G427-N451 CarbonylContact C-O 3.45Å; G427-N451 WeakPolarHBondContact CA-O 3.5Å; G427-N451 VanDerWaalsContact CA-OD1 3.29Å; G427-N451 WeakPolarHBondContact CA-OD1 3.37Å; N428-N451 PolarHBondContact N-O 2.95Å; N451-N453 PolarHBondContact O-ND2 3.26Å; N451-Y473 PolarHBondContact N-O 2.71Å; N451-E475 CarbonylContact C-O 3.51Å; N451-E475 WeakPolarHBondContact CA-O 3.24Å; N451-E475 HydrophobicContact CB-CG 3.84Å; N451-E475 VanDerWaalsContact CB-O 3.28Å; N451-E475 WeakPolarHBondContact CB-O 3.34Å; N451-E475 WeakPolarHBondContact CB-OE1 3.36Å; N451-E475 PolarHBondContact ND2-OE1 3.23Å
452	G	90.1	Very high	93.2	Very high	18 Å²	18	34 Å²	34	19%	0.186	18%	0.175	C	C	.	.	S	Bend	trans	61.9	60	-176.8	0	0	0	0	0	112.6	N428 N429 E475 Y476	N428-G452 WeakPolarHBondContact CA-O 3.5Å; N428-G452 PolarHBondContact N-O 3.46Å; N428-G452 VanDerWaalsContact N-O 3.13Å; N429-G452 PolarHBondContact N-O 3Å; N429-G452 VanDerWaalsContact N-O 3.14Å; G452-E475 PolarHBondContact N-O 3.43Å; G452-Y476 WeakPolarHBondContact CA-O 3.14Å; G452-Y476 PolarHBondContact N-O 3.07Å
453	N	96.4	Very high	93.2	Very high	7 Å²	7	34 Å²	34	4%	0.037	18%	0.175	C	C	.	.	S	Bend	trans	-146.5	175.9	-179.9	-83.3	-74	0	0	0	110.8	L426 N429 Q430 I431 L450 N451 I455 Y476 N477	L426-N453 PolarHBondContact O-ND2 3.14Å; N429-N453 WeakPolarHBondContact CA-OD1 3.43Å; N429-N453 WeakPolarHBondContact CB-OD1 3.35Å; N429-N453 PolarHBondContact N-OD1 2.88Å; N429-N453 PolarHBondContact O-OD1 3.46Å; Q430-N453 PolarHBondContact N-OD1 3.02Å; I431-N453 HydrophobicContact CB-CB 4.19Å; I431-N453 VanDerWaalsContact CB-OD1 3.26Å; I431-N453 WeakPolarHBondContact CB-OD1 3.4Å; I431-N453 WeakPolarHBondContact CD1-OD1 3.22Å; I431-N453 VanDerWaalsContact CG1-OD1 3.28Å; I431-N453 WeakPolarHBondContact CG1-OD1 3.45Å; I431-N453 PolarHBondContact N-OD1 3.47Å; L450-N453 WeakPolarHBondContact O-CB 3.41Å; L450-N453 PolarHBondContact O-ND2 2.8Å; N451-N453 PolarHBondContact O-ND2 3.26Å; N453-I455 HydrophobicContact CB-CD1 4.49Å; N453-I455 HydrophobicContact CB-CG1 4.24Å; N453-Y476 PolarHBondContact N-O 3.35Å; N453-N477 WeakPolarHBondContact CB-OD1 3.43Å; N453-N477 WeakPolarHBondContact O-CA 3.25Å; N453-N477 PolarHBondContact O-OD1 2.79Å; N453-N477 VanDerWaalsContact O-OD1 3.06Å
454	D	96.6	Very high	93.2	Very high	75 Å²	75	38.6 Å²	38.6	40%	0.401	19%	0.186	S	C	.	.			trans	-100.2	29	-174.1	-62.2	-61.6	0	0	0	113.2	Q430 I431 S432 E456 V478	Q430-D454 VanDerWaalsContact CA-OD2 3.31Å; Q430-D454 WeakPolarHBondContact CA-OD2 3.08Å; I431-D454 CarbonylContact O-C 3.59Å; I431-D454 VanDerWaalsContact O-C 3.25Å; I431-D454 WeakPolarHBondContact O-CA 3.29Å; I431-D454 PolarHBondContact O-N 2.82Å; S432-D454 WeakPolarHBondContact CA-O 3.12Å; D454-E456 PolarHBondContact O-N 3.3Å; D454-V478 WeakPolarHBondContact O-CG2 3.28Å
455	I	96.5	Very high	93.1	Very high	4 Å²	4	35.4 Å²	35.4	2%	0.021	17%	0.173	C	C	.	.			trans	-73.7	118.3	-174	-56.5	176.4	0	0	0	110.1	I431 L450 N453 L458 F474 N477 V478 I479	I431-I455 HydrophobicContact CG2-CD1 4.45Å; I431-I455 HydrophobicContact CG2-CG1 4.36Å; I431-I455 WeakPolarHBondContact O-CG1 3.37Å; I431-I455 PolarHBondContact O-N 3.24Å; L450-I455 HydrophobicContact CB-CD1 4.12Å; L450-I455 HydrophobicContact CD1-CD1 4.48Å; L450-I455 HydrophobicContact CD2-CD1 4.42Å; N453-I455 HydrophobicContact CB-CD1 4.49Å; N453-I455 HydrophobicContact CB-CG1 4.24Å; I455-L458 HydrophobicContact CG2-CD2 4.04Å; I455-F474 HydrophobicContact CD1-CD1 4.14Å; I455-F474 HydrophobicContact CD1-CE1 3.72Å; I455-N477 VanDerWaalsContact CB-OD1 3.31Å; I455-N477 WeakPolarHBondContact CB-OD1 2.99Å; I455-N477 WeakPolarHBondContact CG1-OD1 3.27Å; I455-N477 PolarHBondContact N-OD1 3.49Å; I455-V478 CarbonylContact O-C 3.1Å; I455-V478 VanDerWaalsContact O-C 3.22Å; I455-V478 PolarHBondContact O-N 2.81Å; I455-I479 HydrophobicContact CB-CG1 4.37Å; I455-I479 HydrophobicContact CG2-CG1 4.26Å; I455-I479 WeakPolarHBondContact O-CA 3.42Å; I455-I479 WeakPolarHBondContact O-CG1 3.4Å; I455-I479 PolarHBondContact O-N 3.49Å
456	E	94.8	Very high	93.1	Very high	75 Å²	75	35.4 Å²	35.4	35%	0.35	17%	0.173	S	C	.	.			trans	-89.7	-26.9	-179.2	-65.1	-156.4	152.2	0	0	115.2	D454 V478 I479 R480	D454-E456 PolarHBondContact O-N 3.3Å; E456-V478 HydrophobicContact CG-CG2 3.98Å; E456-I479 CarbonylContact O-C 3.58Å; E456-I479 WeakPolarHBondContact O-CA 3.35Å; E456-R480 PolarHBondContact O-N 3.49Å; E456-R480 IonicContact OE1-CZ 2.79Å; E456-R480 IonicContact OE1-NH1 2.62Å; E456-R480 PolarHBondContact OE1-NH1 3.24Å; E456-R480 IonicContact OE1-NH2 3.23Å; E456-R480 PolarHBondContact OE1-NH2 2.86Å; E456-R480 IonicContact OE2-CZ 2.79Å; E456-R480 IonicContact OE2-NH1 3.71Å; E456-R480 PolarHBondContact OE2-NH1 3.35Å
457	R	93.7	Very high	93.2	Very high	146 Å²	146	37.7 Å²	37.7	55%	0.551	19%	0.185	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-148.4	150.9	-172.5	-53.6	-171.9	-166.7	-152.6	10.5	112.3	E481	R457-E481 VanDerWaalsContact CA-O 3.3Å; R457-E481 WeakPolarHBondContact CA-O 3.29Å; R457-E481 WeakPolarHBondContact CD-OE2 3.34Å; R457-E481 HydrophobicContact CG-CB 4.21Å; R457-E481 IonicContact CZ-OE2 3.96Å; R457-E481 IonicContact NE-OE2 3.12Å; R457-E481 IonicContact NH1-OE2 3.84Å; R457-E481 PolarHBondContact NH1-OE2 3.17Å
458	L	95	Very high	93.2	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	131.1	172.1	-55.8	-173.5	0	0	0	111.4	I455 M462 F463 F474 I479 E481 I482 Q483 S486 F487 L498	I455-L458 HydrophobicContact CG2-CD2 4.04Å; L458-M462 HydrophobicContact CD2-CE 3.72Å; L458-F463 HydrophobicContact CB-CE2 4.21Å; L458-F463 HydrophobicContact CD1-CZ 4.19Å; L458-F463 HydrophobicContact CD2-CZ 4.1Å; L458-F474 HydrophobicContact CD1-CD2 4.17Å; L458-F474 HydrophobicContact CD1-CE2 3.88Å; L458-F474 HydrophobicContact CD1-CZ 4.35Å; L458-F474 HydrophobicContact CD2-CE1 3.94Å; L458-F474 HydrophobicContact CD2-CE2 4.06Å; L458-F474 HydrophobicContact CD2-CZ 3.66Å; L458-I479 HydrophobicContact CD1-CD1 4.24Å; L458-I479 HydrophobicContact CD2-CD1 4.08Å; L458-I479 HydrophobicContact CG-CD1 4.18Å; L458-I479 HydrophobicContact CG-CG2 4.13Å; L458-E481 PolarHBondContact N-O 3.3Å; L458-I482 HydrophobicContact CB-CG1 4.21Å; L458-I482 HydrophobicContact CB-CG2 4.35Å; L458-I482 HydrophobicContact CD1-CD1 4.03Å; L458-I482 HydrophobicContact CD1-CG1 4.02Å; L458-I482 HydrophobicContact CG-CG1 4.22Å; L458-Q483 PolarHBondContact O-N 3.26Å; L458-S486 PolarHBondContact O-OG 2.87Å; L458-F487 HydrophobicContact CD1-CE1 4.18Å; L458-F487 HydrophobicContact CD1-CZ 3.91Å; L458-L498 HydrophobicContact CD1-CD2 4.27Å
459	S	93.1	Very high	93.2	Very high	12 Å²	12	40.9 Å²	40.9	8%	0.084	20%	0.199	C	C	.	.			trans	-117.9	155.3	171.3	86	0	0	0	0	111.9	E436 G461 M462 F463	E436-S459 PolarHBondContact OE1-OG 2.02Å; S459-G461 PolarHBondContact O-N 2.9Å; S459-G461 PolarHBondContact OG-N 2.88Å; S459-M462 PolarHBondContact N-SD 3.49Å; S459-M462 PolarHBondContact O-N 3.01Å; S459-M462 PolarHBondContact OG-N 3.34Å; S459-F463 WeakPolarHBondContact O-CD2 3.45Å
460	P	90.5	Very high	93	Very high	34 Å²	34	39.1 Å²	39.1	22%	0.221	19%	0.194	C	C	.	.	H	α-helix	trans	-59.3	-32.4	171.1	-17.6	27.7	0	0	0	112.3	M462 F463 S484 L489	P460-M462 VanDerWaalsContact C-N 3.29Å; P460-M462 PolarHBondContact O-N 2.88Å; P460-F463 PolarHBondContact O-N 3.07Å; P460-S484 WeakPolarHBondContact CG-O 3.27Å; P460-L489 WeakPolarHBondContact O-CD1 3.45Å
461	G	90.8	Very high	92.7	Very high	14 Å²	14	42.9 Å²	42.9	14%	0.144	21%	0.209	C	C	.	.	H	α-helix	trans	-61.3	-34.9	-179.8	0	0	0	0	0	113.2	E436 G437 S459 F463	E436-G461 CarbonylContact C-O 3.19Å; E436-G461 WeakPolarHBondContact CA-O 3.34Å; G437-G461 PolarHBondContact N-O 2.97Å; S459-G461 PolarHBondContact O-N 2.9Å; S459-G461 PolarHBondContact OG-N 2.88Å; G461-F463 PolarHBondContact O-N 3.46Å
462	M	93.1	Very high	92.8	Very high	15 Å²	15	41.5 Å²	41.5	7%	0.074	20%	0.202	C	C	.	.	H	α-helix	trans	-58.6	-47.1	178.2	-70.4	162	56.7	0	0	112.2	V434 F439 L458 S459 P460 R464	V434-M462 HydrophobicContact CB-CE 4.13Å; V434-M462 HydrophobicContact CB-CG 4.32Å; V434-M462 HydrophobicContact CG1-CB 4.49Å; V434-M462 HydrophobicContact CG1-CG 4.4Å; V434-M462 HydrophobicContact CG2-CE 4.39Å; F439-M462 VanDerWaalsContact CD2-O 3.31Å; F439-M462 WeakPolarHBondContact CD2-O 3.2Å; L458-M462 HydrophobicContact CD2-CE 3.72Å; S459-M462 PolarHBondContact N-SD 3.49Å; S459-M462 PolarHBondContact O-N 3.01Å; S459-M462 PolarHBondContact OG-N 3.34Å; P460-M462 VanDerWaalsContact C-N 3.29Å; P460-M462 PolarHBondContact O-N 2.88Å; M462-R464 VanDerWaalsContact C-N 3.33Å; M462-R464 PolarHBondContact O-N 2.86Å
463	F	93.4	Very high	93	Very high	1 Å²	1	42.5 Å²	42.5	0%	0.004	20%	0.2	C	C	.	.	H	α-helix	trans	-84.1	-2.5	-171.4	-56.6	-73.5	0	0	0	114.9	L458 S459 P460 G461 G465 L466 L472 F474 S486 F487 M490	L458-F463 HydrophobicContact CB-CE2 4.21Å; L458-F463 HydrophobicContact CD1-CZ 4.19Å; L458-F463 HydrophobicContact CD2-CZ 4.1Å; S459-F463 WeakPolarHBondContact O-CD2 3.45Å; P460-F463 PolarHBondContact O-N 3.07Å; G461-F463 PolarHBondContact O-N 3.46Å; F463-G465 PolarHBondContact O-N 3.47Å; F463-L466 HydrophobicContact CB-CD1 4.32Å; F463-L466 HydrophobicContact CD1-CD1 4.04Å; F463-L466 WeakPolarHBondContact O-CB 3.43Å; F463-L466 PolarHBondContact O-N 2.03Å; F463-L466 VanDerWaalsContact O-N 3.16Å; F463-L472 HydrophobicContact CD1-CD2 4.43Å; F463-L472 HydrophobicContact CE1-CD1 4.34Å; F463-L472 HydrophobicContact CE1-CD2 3.91Å; F463-L472 HydrophobicContact CZ-CD2 4.45Å; F463-F474 AromaticContact CE1-CE2 3.8Å; F463-F474 HydrophobicContact CE1-CE2 3.8Å; F463-F474 AromaticContact CE1-CZ 3.68Å; F463-F474 HydrophobicContact CE1-CZ 3.68Å; F463-F474 AromaticContact CZ-CE2 3.65Å; F463-F474 HydrophobicContact CZ-CE2 3.65Å; F463-F474 AromaticContact CZ-CZ 3.62Å; F463-F474 HydrophobicContact CZ-CZ 3.62Å; F463-S486 VanDerWaalsContact CD2-O 3.27Å; F463-S486 WeakPolarHBondContact CD2-O 3.45Å; F463-F487 HydrophobicContact CZ-CE1 4.43Å; F463-M490 HydrophobicContact CB-CE 3.65Å; F463-M490 HydrophobicContact CB-CG 4.31Å; F463-M490 HydrophobicContact CB-SD 3.83Å; F463-M490 HydrophobicContact CD1-CE 3.53Å; F463-M490 HydrophobicContact CD1-SD 3.8Å; F463-M490 HydrophobicContact CD2-CE 3.96Å; F463-M490 HydrophobicContact CE1-CE 4.14Å; F463-M490 HydrophobicContact CG-CE 3.42Å; F463-M490 VanDerWaalsContact CG-CE 3.42Å; F463-M490 HydrophobicContact CG-SD 4Å
464	R	92.4	Very high	93	Very high	144 Å²	144	42.1 Å²	42.1	54%	0.543	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	109.4	-177.4	-176.8	179.3	-176.7	170.3	4.1	111.5	F439 I440 M462 L489	F439-R464 CarbonylContact C-O 3.48Å; I440-R464 WeakPolarHBondContact CA-O 3.39Å; I440-R464 PolarHBondContact N-O 2.93Å; M462-R464 VanDerWaalsContact C-N 3.33Å; M462-R464 PolarHBondContact O-N 2.86Å; R464-L489 HydrophobicContact CB-CD1 3.77Å; R464-L489 HydrophobicContact CG-CD1 4.17Å
465	G	88.4	Confident	92.6	Very high	16 Å²	16	39.6 Å²	39.6	17%	0.165	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	131.5	-24.8	179.9	0	0	0	0	0	114	P443 F463 Q467	P443-G465 WeakPolarHBondContact CA-O 3.4Å; F463-G465 PolarHBondContact O-N 3.47Å; G465-Q467 PolarHBondContact O-N 3.26Å
466	L	93.9	Very high	92.3	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	20%	0.203	C	C	.	.			trans	-80.7	49.1	-167.9	-65.9	177.2	0	0	0	114.4	F439 L442 L445 L448 F463 M468 L469 M490	F439-L466 HydrophobicContact CB-CD1 4.02Å; F439-L466 HydrophobicContact CB-CD2 3.73Å; F439-L466 HydrophobicContact CB-CG 3.75Å; F439-L466 HydrophobicContact CD2-CD1 3.77Å; F439-L466 HydrophobicContact CD2-CG 4.44Å; F439-L466 HydrophobicContact CG-CD1 4.07Å; F439-L466 HydrophobicContact CG-CD2 4.31Å; F439-L466 HydrophobicContact CG-CG 4.34Å; L442-L466 HydrophobicContact CB-CD2 4.15Å; L445-L466 HydrophobicContact CB-CD2 3.93Å; L445-L466 HydrophobicContact CD2-CD2 3.54Å; L445-L466 HydrophobicContact CG-CD2 4.34Å; L448-L466 HydrophobicContact CD2-CD1 3.84Å; F463-L466 HydrophobicContact CB-CD1 4.32Å; F463-L466 HydrophobicContact CD1-CD1 4.04Å; F463-L466 WeakPolarHBondContact O-CB 3.43Å; F463-L466 PolarHBondContact O-N 2.03Å; F463-L466 VanDerWaalsContact O-N 3.16Å; L466-M468 VanDerWaalsContact C-N 3.31Å; L466-M468 PolarHBondContact O-N 2.95Å; L466-L469 HydrophobicContact CB-CB 4.09Å; L466-L469 HydrophobicContact CD1-CD2 4.33Å; L466-L469 WeakPolarHBondContact O-CB 3.42Å; L466-L469 PolarHBondContact O-N 2.97Å; L466-M490 HydrophobicContact CB-CG 3.79Å; L466-M490 HydrophobicContact CB-SD 3.88Å; L466-M490 HydrophobicContact CD1-SD 3.98Å; L466-M490 WeakPolarHBondContact O-CG 3.45Å
467	Q	90.5	Very high	92.3	Very high	127 Å²	127	41.5 Å²	41.5	59%	0.593	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-32.9	-170.7	-66.7	-178.8	-16.9	0	0	114.1	G465 N492	G465-Q467 PolarHBondContact O-N 3.26Å; Q467-N492 PolarHBondContact O-ND2 2.96Å
468	M	91.4	Very high	92.4	Very high	86 Å²	86	36.7 Å²	36.7	42%	0.424	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	8	-179	-157.2	63.4	-168.9	0	0	113.9	P443 L445 K446 L466 S470	P443-M468 VanDerWaalsContact O-CB 3.24Å; P443-M468 WeakPolarHBondContact O-CB 3.31Å; P443-M468 PolarHBondContact O-N 3.12Å; L445-M468 CarbonylContact O-C 3.17Å; K446-M468 HydrophobicContact CG-CG 4.29Å; L466-M468 VanDerWaalsContact C-N 3.31Å; L466-M468 PolarHBondContact O-N 2.95Å; M468-S470 PolarHBondContact O-N 3.34Å
469	L	94.8	Very high	92.5	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.176	C	C	.	.			trans	-71.5	128.8	-173.9	-163	83.2	0	0	0	111.3	L445 L448 L466 L472 M490 N492 L493	L445-L469 HydrophobicContact CB-CD1 4.4Å; L445-L469 HydrophobicContact CD2-CD1 4Å; L445-L469 HydrophobicContact CG-CD1 4.05Å; L445-L469 WeakPolarHBondContact O-CA 3.27Å; L445-L469 PolarHBondContact O-N 3.41Å; L448-L469 HydrophobicContact CB-CD1 3.78Å; L448-L469 HydrophobicContact CB-CD2 4.32Å; L466-L469 HydrophobicContact CB-CB 4.09Å; L466-L469 HydrophobicContact CD1-CD2 4.33Å; L466-L469 WeakPolarHBondContact O-CB 3.42Å; L466-L469 PolarHBondContact O-N 2.97Å; L469-L472 HydrophobicContact CD2-CB 3.99Å; L469-L472 HydrophobicContact CD2-CD1 4.11Å; L469-L472 HydrophobicContact CD2-CD2 4.19Å; L469-L472 HydrophobicContact CD2-CG 4.33Å; L469-M490 HydrophobicContact CB-SD 4.32Å; L469-M490 HydrophobicContact CD2-SD 3.52Å; L469-M490 VanDerWaalsContact CD2-SD 3.52Å; L469-N492 CarbonylContact O-C 3.53Å; L469-N492 VanDerWaalsContact O-O 3.14Å; L469-L493 HydrophobicContact CD2-CD1 4.27Å; L469-L493 VanDerWaalsContact O-CA 3.24Å; L469-L493 WeakPolarHBondContact O-CA 3.47Å; L469-L493 PolarHBondContact O-N 2.99Å; L469-L493 VanDerWaalsContact O-N 3.11Å
470	S	89.3	Confident	92.6	Very high	17 Å²	17	42 Å²	42	12%	0.119	19%	0.194	C	C	.	.			trans	-114.6	-28.2	177.5	-61.1	0	0	0	0	113.4	K446 M468 N492 Q494 L495	K446-S470 PolarHBondContact O-N 3.07Å; M468-S470 PolarHBondContact O-N 3.34Å; S470-N492 WeakPolarHBondContact CA-O 3.41Å; S470-N492 PolarHBondContact OG-O 2.86Å; S470-Q494 PolarHBondContact O-N 3.12Å; S470-L495 PolarHBondContact O-N 2.95Å
471	Y	89.6	Confident	92.7	Very high	80 Å²	80	43.9 Å²	43.9	31%	0.314	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	123.6	-175.7	-52	-87	0	0	0	111.5	K446 S447 L448 L495	K446-Y471 PolarHBondContact O-N 3.08Å; S447-Y471 WeakPolarHBondContact CA-O 3.47Å; L448-Y471 PolarHBondContact N-O 3.26Å; Y471-L495 HydrophobicContact CD1-CB 3.88Å; Y471-L495 HydrophobicContact CD1-CD1 4.23Å; Y471-L495 HydrophobicContact CE1-CB 4.5Å
472	L	95.4	Very high	92.9	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	117.6	-176.4	-176.3	53.6	0	0	0	110.9	L448 F463 L469 F474 F487 M490 L493 L495 V496 F497	L448-L472 HydrophobicContact CB-CD1 4.09Å; L448-L472 HydrophobicContact CD2-CD1 3.97Å; L448-L472 HydrophobicContact CG-CD1 4.05Å; F463-L472 HydrophobicContact CD1-CD2 4.43Å; F463-L472 HydrophobicContact CE1-CD1 4.34Å; F463-L472 HydrophobicContact CE1-CD2 3.91Å; F463-L472 HydrophobicContact CZ-CD2 4.45Å; L469-L472 HydrophobicContact CD2-CB 3.99Å; L469-L472 HydrophobicContact CD2-CD1 4.11Å; L469-L472 HydrophobicContact CD2-CD2 4.19Å; L469-L472 HydrophobicContact CD2-CG 4.33Å; L472-F474 HydrophobicContact CD1-CD2 4.17Å; L472-F474 HydrophobicContact CD1-CE2 3.66Å; L472-F474 HydrophobicContact CD1-CZ 4.13Å; L472-F474 HydrophobicContact CD2-CD2 4.39Å; L472-F474 HydrophobicContact CD2-CE2 3.83Å; L472-F474 HydrophobicContact CG-CD2 3.93Å; L472-F474 HydrophobicContact CG-CE2 3.68Å; L472-F487 HydrophobicContact CD2-CD1 4.23Å; L472-F487 HydrophobicContact CD2-CE1 4.06Å; L472-M490 HydrophobicContact CD2-CE 3.86Å; L472-M490 HydrophobicContact CD2-SD 4.27Å; L472-L493 HydrophobicContact CB-CD1 3.87Å; L472-L493 HydrophobicContact CD2-CD1 4.45Å; L472-L493 HydrophobicContact CD2-CD2 4.5Å; L472-L495 PolarHBondContact N-O 3.16Å; L472-V496 HydrophobicContact CB-CG2 4.43Å; L472-V496 WeakPolarHBondContact O-CA 3.26Å; L472-F497 PolarHBondContact O-N 3.13Å; L472-F497 VanDerWaalsContact O-N 3.07Å
473	Y	93.4	Very high	92.9	Very high	38 Å²	38	46.6 Å²	46.6	15%	0.149	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	117.8	-173.4	-60.6	-86.1	0	0	0	110.9	L448 Y449 L450 N451 E475 L495 F497	L448-Y473 PolarHBondContact O-N 3.26Å; L448-Y473 VanDerWaalsContact O-N 3.09Å; Y449-Y473 AromaticContact CD1-CD2 3.3Å; Y449-Y473 HydrophobicContact CD1-CD2 3.3Å; Y449-Y473 AromaticContact CD1-CE2 3.85Å; Y449-Y473 HydrophobicContact CD1-CE2 3.85Å; Y449-Y473 AromaticContact CD1-CG 3.71Å; Y449-Y473 HydrophobicContact CD1-CG 3.71Å; Y449-Y473 AromaticContact CE1-CD2 3.29Å; Y449-Y473 HydrophobicContact CE1-CD2 3.29Å; Y449-Y473 AromaticContact CE1-CE2 3.29Å; Y449-Y473 HydrophobicContact CE1-CE2 3.29Å; Y449-Y473 AromaticContact CE1-CG 3.94Å; Y449-Y473 HydrophobicContact CE1-CG 3.94Å; Y449-Y473 AromaticContact CE1-CZ 3.96Å; Y449-Y473 AromaticContact CG-CD2 3.98Å; Y449-Y473 HydrophobicContact CG-CD2 3.98Å; Y449-Y473 AromaticContact CZ-CD2 3.97Å; Y449-Y473 AromaticContact CZ-CE2 3.69Å; L450-Y473 CarbonylContact C-O 3.59Å; L450-Y473 WeakPolarHBondContact CA-O 3.26Å; L450-Y473 PolarHBondContact N-O 3.48Å; N451-Y473 PolarHBondContact N-O 2.71Å; Y473-E475 WeakPolarHBondContact CA-OE2 3.32Å; Y473-E475 WeakPolarHBondContact CB-OE2 3.3Å; Y473-L495 HydrophobicContact CD1-CD2 4.2Å; Y473-L495 HydrophobicContact CE1-CD2 3.65Å; Y473-F497 HydrophobicContact CD1-CB 4.23Å; Y473-F497 AromaticContact CD1-CD2 3.72Å; Y473-F497 HydrophobicContact CD1-CD2 3.72Å; Y473-F497 HydrophobicContact CD1-CE2 4.42Å; Y473-F497 HydrophobicContact CD1-CG 4.2Å; Y473-F497 AromaticContact CE1-CD2 3.77Å; Y473-F497 HydrophobicContact CE1-CD2 3.77Å; Y473-F497 HydrophobicContact CE1-CE2 4.01Å; Y473-F497 HydrophobicContact CE1-CG 4.38Å
474	F	95.9	Very high	92.8	Very high	0 Å²	0	49 Å²	49	0%	0	23%	0.226	C	C	.	.			trans	-128.1	11.3	179.7	-80.3	-62.7	0	0	0	112.6	L450 I455 L458 F463 L472 N477 I479 F497 L498 N501	L450-F474 HydrophobicContact CB-CD1 3.77Å; L450-F474 HydrophobicContact CB-CE1 3.65Å; L450-F474 HydrophobicContact CD1-CD1 4.47Å; L450-F474 HydrophobicContact CD1-CE1 3.54Å; L450-F474 HydrophobicContact CD1-CZ 3.81Å; L450-F474 HydrophobicContact CG-CE1 4.23Å; I455-F474 HydrophobicContact CD1-CD1 4.14Å; I455-F474 HydrophobicContact CD1-CE1 3.72Å; L458-F474 HydrophobicContact CD1-CD2 4.17Å; L458-F474 HydrophobicContact CD1-CE2 3.88Å; L458-F474 HydrophobicContact CD1-CZ 4.35Å; L458-F474 HydrophobicContact CD2-CE1 3.94Å; L458-F474 HydrophobicContact CD2-CE2 4.06Å; L458-F474 HydrophobicContact CD2-CZ 3.66Å; F463-F474 AromaticContact CE1-CE2 3.8Å; F463-F474 HydrophobicContact CE1-CE2 3.8Å; F463-F474 AromaticContact CE1-CZ 3.68Å; F463-F474 HydrophobicContact CE1-CZ 3.68Å; F463-F474 AromaticContact CZ-CE2 3.65Å; F463-F474 HydrophobicContact CZ-CE2 3.65Å; F463-F474 AromaticContact CZ-CZ 3.62Å; F463-F474 HydrophobicContact CZ-CZ 3.62Å; L472-F474 HydrophobicContact CD1-CD2 4.17Å; L472-F474 HydrophobicContact CD1-CE2 3.66Å; L472-F474 HydrophobicContact CD1-CZ 4.13Å; L472-F474 HydrophobicContact CD2-CD2 4.39Å; L472-F474 HydrophobicContact CD2-CE2 3.83Å; L472-F474 HydrophobicContact CG-CD2 3.93Å; L472-F474 HydrophobicContact CG-CE2 3.68Å; F474-N477 PolarHBondContact O-ND2 2.94Å; F474-I479 HydrophobicContact CB-CD1 3.91Å; F474-I479 HydrophobicContact CD1-CD1 4.04Å; F474-I479 HydrophobicContact CG-CD1 4Å; F474-F497 CarbonylContact C-O 3.59Å; F474-F497 WeakPolarHBondContact CA-O 3.47Å; F474-F497 WeakPolarHBondContact CB-O 3.43Å; F474-F497 PolarHBondContact N-O 3.16Å; F474-L498 HydrophobicContact CB-CD2 3.77Å; F474-L498 HydrophobicContact CD2-CD2 4.16Å; F474-L498 HydrophobicContact CG-CD2 4.3Å; F474-N501 PolarHBondContact O-ND2 2.9Å
475	E	88.1	Confident	92.7	Very high	22 Å²	22	46.3 Å²	46.3	10%	0.103	22%	0.219	C	C	.	.			trans	-60.5	147.4	-179.8	64.8	-76.6	176.5	0	0	113	N451 G452 Y473 F497 N499	N451-E475 CarbonylContact C-O 3.51Å; N451-E475 WeakPolarHBondContact CA-O 3.24Å; N451-E475 HydrophobicContact CB-CG 3.84Å; N451-E475 VanDerWaalsContact CB-O 3.28Å; N451-E475 WeakPolarHBondContact CB-O 3.34Å; N451-E475 WeakPolarHBondContact CB-OE1 3.36Å; N451-E475 PolarHBondContact ND2-OE1 3.23Å; G452-E475 PolarHBondContact N-O 3.43Å; Y473-E475 WeakPolarHBondContact CA-OE2 3.32Å; Y473-E475 WeakPolarHBondContact CB-OE2 3.3Å; E475-F497 PolarHBondContact N-O 3Å; E475-F497 WeakPolarHBondContact OE2-CB 3Å; E475-N499 WeakPolarHBondContact CA-O 3.43Å; E475-N499 WeakPolarHBondContact CB-ND2 3.46Å; E475-N499 WeakPolarHBondContact CB-O 3.08Å
476	Y	91.2	Very high	92.8	Very high	108 Å²	108	45.6 Å²	45.6	42%	0.424	21%	0.212	S	C	.	.	S	Bend	trans	55.8	55	-173.5	-50.3	-86	0	0	0	112.6	G452 N453 N499 N500 L890	G452-Y476 WeakPolarHBondContact CA-O 3.14Å; G452-Y476 PolarHBondContact N-O 3.07Å; N453-Y476 PolarHBondContact N-O 3.35Å; Y476-N499 PolarHBondContact N-O 3.28Å; Y476-N499 VanDerWaalsContact N-O 3.11Å; Y476-N500 WeakPolarHBondContact CA-O 3.01Å; Y476-N500 HydrophobicContact CD1-CB 3.8Å; Y476-N500 HydrophobicContact CE1-CB 4.15Å; Y476-N500 WeakPolarHBondContact CE1-ND2 3.24Å; Y476-N500 HydrophobicContact CG-CB 4.28Å; Y476-N500 PolarHBondContact N-O 3.21Å; Y476-L890 HydrophobicContact CE1-CD1 3.73Å
477	N	95	Very high	92.7	Very high	10 Å²	10	45.6 Å²	45.6	5%	0.053	21%	0.212	C	C	.	.	S	Bend	trans	-119.1	-176.1	166.4	-84.4	-103.4	0	0	0	109.5	L450 N453 I455 F474 I479 N500 N501	L450-N477 PolarHBondContact O-ND2 2.85Å; N453-N477 WeakPolarHBondContact CB-OD1 3.43Å; N453-N477 WeakPolarHBondContact O-CA 3.25Å; N453-N477 PolarHBondContact O-OD1 2.79Å; N453-N477 VanDerWaalsContact O-OD1 3.06Å; I455-N477 VanDerWaalsContact CB-OD1 3.31Å; I455-N477 WeakPolarHBondContact CB-OD1 2.99Å; I455-N477 WeakPolarHBondContact CG1-OD1 3.27Å; I455-N477 PolarHBondContact N-OD1 3.49Å; F474-N477 PolarHBondContact O-ND2 2.94Å; N477-I479 HydrophobicContact CB-CD1 4.18Å; N477-I479 HydrophobicContact CB-CG1 3.93Å; N477-N500 PolarHBondContact N-O 3.11Å; N477-N500 VanDerWaalsContact O-O 3.1Å; N477-N501 WeakPolarHBondContact CA-OD1 3.01Å; N477-N501 WeakPolarHBondContact CB-OD1 3.42Å; N477-N501 PolarHBondContact O-OD1 3.15Å
478	V	96.1	Very high	92.7	Very high	46 Å²	46	41.2 Å²	41.2	28%	0.279	20%	0.195	S	C	.	.			trans	-110.2	29.5	177.7	-67.9	0	0	0	0	112.2	D454 I455 E456 R480 L502	D454-V478 WeakPolarHBondContact O-CG2 3.28Å; I455-V478 CarbonylContact O-C 3.1Å; I455-V478 VanDerWaalsContact O-C 3.22Å; I455-V478 PolarHBondContact O-N 2.81Å; E456-V478 HydrophobicContact CG-CG2 3.98Å; V478-R480 WeakPolarHBondContact O-CG 3.36Å; V478-R480 PolarHBondContact O-N 3.36Å; V478-R480 VanDerWaalsContact O-N 3.16Å; V478-L502 HydrophobicContact CB-CD1 4.01Å; V478-L502 HydrophobicContact CG1-CD1 4.37Å
479	I	96.9	Very high	92.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.192	C	C	.	.			trans	-66	117.7	-172.2	-53.9	166.1	0	0	0	109.4	I455 E456 L458 F474 N477 I482 L498 N501 L502 L503	I455-I479 HydrophobicContact CB-CG1 4.37Å; I455-I479 HydrophobicContact CG2-CG1 4.26Å; I455-I479 WeakPolarHBondContact O-CA 3.42Å; I455-I479 WeakPolarHBondContact O-CG1 3.4Å; I455-I479 PolarHBondContact O-N 3.49Å; E456-I479 CarbonylContact O-C 3.58Å; E456-I479 WeakPolarHBondContact O-CA 3.35Å; L458-I479 HydrophobicContact CD1-CD1 4.24Å; L458-I479 HydrophobicContact CD2-CD1 4.08Å; L458-I479 HydrophobicContact CG-CD1 4.18Å; L458-I479 HydrophobicContact CG-CG2 4.13Å; F474-I479 HydrophobicContact CB-CD1 3.91Å; F474-I479 HydrophobicContact CD1-CD1 4.04Å; F474-I479 HydrophobicContact CG-CD1 4Å; N477-I479 HydrophobicContact CB-CD1 4.18Å; N477-I479 HydrophobicContact CB-CG1 3.93Å; I479-I482 HydrophobicContact CG2-CG1 4.29Å; I479-L498 HydrophobicContact CD1-CD2 3.79Å; I479-N501 HydrophobicContact CB-CB 4.29Å; I479-N501 VanDerWaalsContact CB-OD1 3.28Å; I479-N501 WeakPolarHBondContact CB-OD1 3.36Å; I479-N501 WeakPolarHBondContact CG1-OD1 3.33Å; I479-N501 PolarHBondContact N-OD1 3.36Å; I479-L502 CarbonylContact O-C 3.59Å; I479-L502 VanDerWaalsContact O-CA 3.31Å; I479-L502 WeakPolarHBondContact O-CA 3.24Å; I479-L502 PolarHBondContact O-N 2.84Å; I479-L503 HydrophobicContact CB-CD2 4.28Å; I479-L503 HydrophobicContact CG2-CD2 3.68Å; I479-L503 PolarHBondContact O-N 3.07Å; I479-L503 VanDerWaalsContact O-N 3.11Å
480	R	94.4	Very high	92.5	Very high	123 Å²	123	40.4 Å²	40.4	46%	0.464	19%	0.192	S	C	.	.			trans	-98.6	-28.6	178.6	-53.8	-171.4	-170.7	110.4	15.8	112.8	E456 V478 L502	E456-R480 PolarHBondContact O-N 3.49Å; E456-R480 IonicContact OE1-CZ 2.79Å; E456-R480 IonicContact OE1-NH1 2.62Å; E456-R480 PolarHBondContact OE1-NH1 3.24Å; E456-R480 IonicContact OE1-NH2 3.23Å; E456-R480 PolarHBondContact OE1-NH2 2.86Å; E456-R480 IonicContact OE2-CZ 2.79Å; E456-R480 IonicContact OE2-NH1 3.71Å; E456-R480 PolarHBondContact OE2-NH1 3.35Å; V478-R480 WeakPolarHBondContact O-CG 3.36Å; V478-R480 PolarHBondContact O-N 3.36Å; V478-R480 VanDerWaalsContact O-N 3.16Å; R480-L502 HydrophobicContact CG-CB 3.94Å; R480-L502 HydrophobicContact CG-CD1 4.15Å
481	E	92.8	Very high	92.5	Very high	75 Å²	75	42.6 Å²	42.6	35%	0.35	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	136.9	-169.6	-173.2	-173.5	178.3	0	0	111.1	R457 L458	R457-E481 VanDerWaalsContact CA-O 3.3Å; R457-E481 WeakPolarHBondContact CA-O 3.29Å; R457-E481 WeakPolarHBondContact CD-OE2 3.34Å; R457-E481 HydrophobicContact CG-CB 4.21Å; R457-E481 IonicContact CZ-OE2 3.96Å; R457-E481 IonicContact NE-OE2 3.12Å; R457-E481 IonicContact NH1-OE2 3.84Å; R457-E481 PolarHBondContact NH1-OE2 3.17Å; L458-E481 PolarHBondContact N-O 3.3Å
482	I	95	Very high	92.5	Very high	6 Å²	6	42.4 Å²	42.4	3%	0.031	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	137.9	165.9	-60.8	-180	0	0	0	106	L458 I479 F487 L498 L503 L506 P507	L458-I482 HydrophobicContact CB-CG1 4.21Å; L458-I482 HydrophobicContact CB-CG2 4.35Å; L458-I482 HydrophobicContact CD1-CD1 4.03Å; L458-I482 HydrophobicContact CD1-CG1 4.02Å; L458-I482 HydrophobicContact CG-CG1 4.22Å; I479-I482 HydrophobicContact CG2-CG1 4.29Å; I482-F487 HydrophobicContact CD1-CE2 4.23Å; I482-F487 HydrophobicContact CD1-CZ 4.15Å; I482-F487 HydrophobicContact CG2-CE2 4.12Å; I482-F487 HydrophobicContact CG2-CZ 4.5Å; I482-L498 HydrophobicContact CD1-CD1 3.84Å; I482-L498 HydrophobicContact CD1-CD2 4.37Å; I482-L503 HydrophobicContact CD1-CD1 4.02Å; I482-L503 HydrophobicContact CD1-CD2 4.02Å; I482-L503 HydrophobicContact CG1-CD2 3.81Å; I482-L506 HydrophobicContact CD1-CD2 3.92Å; I482-P507 WeakPolarHBondContact O-CD 3.45Å; I482-P507 WeakPolarHBondContact O-CG 3.44Å
483	Q	92.9	Very high	92.4	Very high	80 Å²	80	42.4 Å²	42.4	37%	0.374	21%	0.211	S	C	.	.			trans	-89	153.1	176.8	-66.9	179.8	-14.3	0	0	111.8	L458 S486 P507	L458-Q483 PolarHBondContact O-N 3.26Å; Q483-S486 PolarHBondContact N-OG 3.33Å; Q483-S486 VanDerWaalsContact O-CB 3.3Å; Q483-S486 WeakPolarHBondContact O-CB 3.08Å; Q483-S486 PolarHBondContact O-N 3.36Å; Q483-S486 PolarHBondContact O-OG 3.3Å; Q483-P507 VanDerWaalsContact C-CG 3.49Å
484	S	90.5	Very high	92.1	Very high	52 Å²	52	44.9 Å²	44.9	36%	0.364	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.6	144.6	175.2	-70.3	0	0	0	0	111.6	P460 S486 N508	P460-S484 WeakPolarHBondContact CG-O 3.27Å; S484-S486 PolarHBondContact O-N 3.42Å; S484-S486 VanDerWaalsContact O-N 3.16Å; S484-N508 VanDerWaalsContact CB-O 3.24Å; S484-N508 WeakPolarHBondContact CB-O 3.01Å; S484-N508 PolarHBondContact OG-O 3.38Å
485	H	90.5	Very high	91.8	Very high	87 Å²	87	45.5 Å²	45.5	40%	0.403	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	12.3	-178.9	-55	87	0	0	0	115.8	F487 S488 D509	H485-F487 VanDerWaalsContact C-N 3.27Å; H485-F487 PolarHBondContact O-N 3.38Å; H485-F487 VanDerWaalsContact O-N 3.16Å; H485-S488 VanDerWaalsContact O-CB 3.29Å; H485-S488 WeakPolarHBondContact O-CB 3.21Å; H485-S488 PolarHBondContact O-N 3.26Å; H485-S488 PolarHBondContact O-OG 3.48Å; H485-D509 VanDerWaalsContact CA-O 3.28Å; H485-D509 WeakPolarHBondContact CA-O 3.27Å; H485-D509 IonicContact CE1-OD2 3.17Å; H485-D509 PolarHBondContact N-O 2.82Å; H485-D509 VanDerWaalsContact N-O 3.11Å; H485-D509 WeakPolarHBondContact NE2-CB 3.34Å
486	S	90.9	Very high	92.1	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-37.4	-175.7	-73.1	0	0	0	0	114.2	L458 F463 Q483 S484	L458-S486 PolarHBondContact O-OG 2.87Å; F463-S486 VanDerWaalsContact CD2-O 3.27Å; F463-S486 WeakPolarHBondContact CD2-O 3.45Å; Q483-S486 PolarHBondContact N-OG 3.33Å; Q483-S486 VanDerWaalsContact O-CB 3.3Å; Q483-S486 WeakPolarHBondContact O-CB 3.08Å; Q483-S486 PolarHBondContact O-N 3.36Å; Q483-S486 PolarHBondContact O-OG 3.3Å; S484-S486 PolarHBondContact O-N 3.42Å; S484-S486 VanDerWaalsContact O-N 3.16Å
487	F	92.4	Very high	92.1	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-7.6	-179.6	-55.1	-67.3	0	0	0	113.8	L458 F463 L472 I482 H485 L489 M490 L493 V496 L498 A510 F511 T514	L458-F487 HydrophobicContact CD1-CE1 4.18Å; L458-F487 HydrophobicContact CD1-CZ 3.91Å; F463-F487 HydrophobicContact CZ-CE1 4.43Å; L472-F487 HydrophobicContact CD2-CD1 4.23Å; L472-F487 HydrophobicContact CD2-CE1 4.06Å; I482-F487 HydrophobicContact CD1-CE2 4.23Å; I482-F487 HydrophobicContact CD1-CZ 4.15Å; I482-F487 HydrophobicContact CG2-CE2 4.12Å; I482-F487 HydrophobicContact CG2-CZ 4.5Å; H485-F487 VanDerWaalsContact C-N 3.27Å; H485-F487 PolarHBondContact O-N 3.38Å; H485-F487 VanDerWaalsContact O-N 3.16Å; F487-L489 PolarHBondContact O-N 2.95Å; F487-L489 VanDerWaalsContact O-N 3.08Å; F487-M490 HydrophobicContact CB-CE 4.35Å; F487-M490 HydrophobicContact CD1-CE 3.75Å; F487-M490 PolarHBondContact O-N 2.77Å; F487-L493 HydrophobicContact CB-CD2 4.04Å; F487-L493 HydrophobicContact CD1-CD2 4.03Å; F487-L493 HydrophobicContact CG-CD2 4.29Å; F487-V496 HydrophobicContact CE1-CG1 4.49Å; F487-V496 HydrophobicContact CZ-CG1 4.37Å; F487-L498 HydrophobicContact CZ-CD1 4.28Å; F487-A510 WeakPolarHBondContact CD2-O 3.42Å; F487-A510 PolarHBondContact N-O 3.41Å; F487-F511 AromaticContact CD2-CD1 3.57Å; F487-F511 HydrophobicContact CD2-CD1 3.57Å; F487-F511 AromaticContact CD2-CE1 3.61Å; F487-F511 HydrophobicContact CD2-CE1 3.61Å; F487-F511 HydrophobicContact CE2-CD1 4.12Å; F487-F511 AromaticContact CE2-CE1 3.65Å; F487-F511 HydrophobicContact CE2-CE1 3.65Å; F487-F511 HydrophobicContact CE2-CZ 4.48Å; F487-F511 HydrophobicContact CG-CD1 4.37Å; F487-T514 HydrophobicContact CB-CG2 3.82Å; F487-T514 VanDerWaalsContact O-CG2 3.23Å; F487-T514 WeakPolarHBondContact O-CG2 3.5Å
488	S	90.1	Very high	92.1	Very high	36 Å²	36	41 Å²	41	25%	0.252	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-23.4	-172.9	67.1	0	0	0	0	115.6	H485 M490 A512	H485-S488 VanDerWaalsContact O-CB 3.29Å; H485-S488 WeakPolarHBondContact O-CB 3.21Å; H485-S488 PolarHBondContact O-N 3.26Å; H485-S488 PolarHBondContact O-OG 3.48Å; S488-M490 PolarHBondContact O-N 2.95Å; S488-A512 WeakPolarHBondContact CA-O 3.47Å; S488-A512 VanDerWaalsContact CB-O 3.28Å; S488-A512 WeakPolarHBondContact CB-O 3.45Å
489	L	89.4	Confident	91.8	Very high	69 Å²	69	39.5 Å²	39.5	36%	0.361	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	2.2	178.4	-56.5	-172.6	0	0	0	113.6	P460 R464 F487	P460-L489 WeakPolarHBondContact O-CD1 3.45Å; R464-L489 HydrophobicContact CB-CD1 3.77Å; R464-L489 HydrophobicContact CG-CD1 4.17Å; F487-L489 PolarHBondContact O-N 2.95Å; F487-L489 VanDerWaalsContact O-N 3.08Å
490	M	93.1	Very high	91.5	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.204	C	C	.	.			trans	-126.2	71.6	-177.1	-60.3	-179.9	-73.6	0	0	110.3	F463 L466 L469 L472 F487 S488 N492 L493	F463-M490 HydrophobicContact CB-CE 3.65Å; F463-M490 HydrophobicContact CB-CG 4.31Å; F463-M490 HydrophobicContact CB-SD 3.83Å; F463-M490 HydrophobicContact CD1-CE 3.53Å; F463-M490 HydrophobicContact CD1-SD 3.8Å; F463-M490 HydrophobicContact CD2-CE 3.96Å; F463-M490 HydrophobicContact CE1-CE 4.14Å; F463-M490 HydrophobicContact CG-CE 3.42Å; F463-M490 VanDerWaalsContact CG-CE 3.42Å; F463-M490 HydrophobicContact CG-SD 4Å; L466-M490 HydrophobicContact CB-CG 3.79Å; L466-M490 HydrophobicContact CB-SD 3.88Å; L466-M490 HydrophobicContact CD1-SD 3.98Å; L466-M490 WeakPolarHBondContact O-CG 3.45Å; L469-M490 HydrophobicContact CB-SD 4.32Å; L469-M490 HydrophobicContact CD2-SD 3.52Å; L469-M490 VanDerWaalsContact CD2-SD 3.52Å; L472-M490 HydrophobicContact CD2-CE 3.86Å; L472-M490 HydrophobicContact CD2-SD 4.27Å; F487-M490 HydrophobicContact CB-CE 4.35Å; F487-M490 HydrophobicContact CD1-CE 3.75Å; F487-M490 PolarHBondContact O-N 2.77Å; S488-M490 PolarHBondContact O-N 2.95Å; M490-N492 VanDerWaalsContact C-N 3.25Å; M490-N492 PolarHBondContact O-N 3.45Å; M490-L493 HydrophobicContact CB-CB 4.14Å; M490-L493 HydrophobicContact CB-CD2 4.36Å; M490-L493 HydrophobicContact CE-CD2 4.14Å; M490-L493 WeakPolarHBondContact O-CB 3.43Å; M490-L493 PolarHBondContact O-N 3.34Å
491	P	89.9	Confident	91.6	Very high	62 Å²	62	34.8 Å²	34.8	40%	0.403	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-25.6	-172	26.3	-35.4	0	0	0	113.7	L493	P491-L493 VanDerWaalsContact C-N 3.27Å; P491-L493 PolarHBondContact O-N 3.34Å
492	N	89.6	Confident	91.7	Very high	77 Å²	77	33.9 Å²	33.9	41%	0.412	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	9.8	179.2	-67.6	-68.2	0	0	0	114	Q467 L469 S470 M490 Q494	Q467-N492 PolarHBondContact O-ND2 2.96Å; L469-N492 CarbonylContact O-C 3.53Å; L469-N492 VanDerWaalsContact O-O 3.14Å; S470-N492 WeakPolarHBondContact CA-O 3.41Å; S470-N492 PolarHBondContact OG-O 2.86Å; M490-N492 VanDerWaalsContact C-N 3.25Å; M490-N492 PolarHBondContact O-N 3.45Å; N492-Q494 PolarHBondContact O-N 3.26Å
493	L	93.1	Very high	91.7	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.178	C	C	.	.			trans	-72	118.1	-174.3	-173.2	61.9	0	0	0	111.6	L469 L472 F487 M490 P491 V496 T514 N515 L516	L469-L493 HydrophobicContact CD2-CD1 4.27Å; L469-L493 VanDerWaalsContact O-CA 3.24Å; L469-L493 WeakPolarHBondContact O-CA 3.47Å; L469-L493 PolarHBondContact O-N 2.99Å; L469-L493 VanDerWaalsContact O-N 3.11Å; L472-L493 HydrophobicContact CB-CD1 3.87Å; L472-L493 HydrophobicContact CD2-CD1 4.45Å; L472-L493 HydrophobicContact CD2-CD2 4.5Å; F487-L493 HydrophobicContact CB-CD2 4.04Å; F487-L493 HydrophobicContact CD1-CD2 4.03Å; F487-L493 HydrophobicContact CG-CD2 4.29Å; M490-L493 HydrophobicContact CB-CB 4.14Å; M490-L493 HydrophobicContact CB-CD2 4.36Å; M490-L493 HydrophobicContact CE-CD2 4.14Å; M490-L493 WeakPolarHBondContact O-CB 3.43Å; M490-L493 PolarHBondContact O-N 3.34Å; P491-L493 VanDerWaalsContact C-N 3.27Å; P491-L493 PolarHBondContact O-N 3.34Å; L493-V496 HydrophobicContact CD1-CG2 4.04Å; L493-V496 HydrophobicContact CD2-CG2 3.53Å; L493-V496 HydrophobicContact CG-CG2 3.83Å; L493-T514 HydrophobicContact CD2-CG2 4.5Å; L493-N515 CarbonylContact O-C 3.51Å; L493-L516 HydrophobicContact CG-CD1 4.22Å; L493-L516 WeakPolarHBondContact O-CA 3.27Å; L493-L516 PolarHBondContact O-N 2.91Å
494	Q	87.5	Confident	91.7	Very high	90 Å²	90	38.2 Å²	38.2	42%	0.421	19%	0.193	S	C	.	.			trans	-109.3	-30.2	-175.5	-66.4	179.6	-0.6	0	0	113	S470 N492 A517 R518	S470-Q494 PolarHBondContact O-N 3.12Å; N492-Q494 PolarHBondContact O-N 3.26Å; Q494-A517 CarbonylContact O-C 3.11Å; Q494-A517 WeakPolarHBondContact O-CA 3.39Å; Q494-A517 PolarHBondContact O-N 2.79Å; Q494-R518 PolarHBondContact O-N 2.75Å
495	L	88.1	Confident	91.7	Very high	12 Å²	12	39.2 Å²	39.2	6%	0.063	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	127.9	-176.9	-177	153.8	0	0	0	111.3	S470 Y471 L472 Y473 F497 R518	S470-L495 PolarHBondContact O-N 2.95Å; Y471-L495 HydrophobicContact CD1-CB 3.88Å; Y471-L495 HydrophobicContact CD1-CD1 4.23Å; Y471-L495 HydrophobicContact CE1-CB 4.5Å; L472-L495 PolarHBondContact N-O 3.16Å; Y473-L495 HydrophobicContact CD1-CD2 4.2Å; Y473-L495 HydrophobicContact CE1-CD2 3.65Å; L495-F497 HydrophobicContact CD1-CD1 4.5Å; L495-F497 HydrophobicContact CD1-CE1 3.87Å; L495-F497 HydrophobicContact CD1-CZ 4.01Å; L495-F497 HydrophobicContact CD2-CD1 3.66Å; L495-F497 HydrophobicContact CD2-CD2 4.37Å; L495-F497 HydrophobicContact CD2-CE1 3.87Å; L495-F497 HydrophobicContact CD2-CG 3.93Å; L495-F497 HydrophobicContact CD2-CZ 4.31Å; L495-F497 HydrophobicContact CG-CD1 4.03Å; L495-F497 HydrophobicContact CG-CE1 3.84Å; L495-F497 HydrophobicContact CG-CZ 4.42Å; L495-R518 WeakPolarHBondContact CA-O 3.29Å; L495-R518 HydrophobicContact CB-CB 4.47Å; L495-R518 HydrophobicContact CD1-CB 4.41Å; L495-R518 HydrophobicContact CG-CB 4.24Å
496	V	94.6	Very high	91.9	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	116.5	171.3	173.2	0	0	0	0	109.4	L472 F487 L493 L498 L516 R518 L519 N520	L472-V496 HydrophobicContact CB-CG2 4.43Å; L472-V496 WeakPolarHBondContact O-CA 3.26Å; F487-V496 HydrophobicContact CE1-CG1 4.49Å; F487-V496 HydrophobicContact CZ-CG1 4.37Å; L493-V496 HydrophobicContact CD1-CG2 4.04Å; L493-V496 HydrophobicContact CD2-CG2 3.53Å; L493-V496 HydrophobicContact CG-CG2 3.83Å; V496-L498 HydrophobicContact CG1-CD1 3.61Å; V496-L498 HydrophobicContact CG1-CG 3.77Å; V496-L516 HydrophobicContact CB-CD1 4.09Å; V496-L516 HydrophobicContact CG2-CD1 3.69Å; V496-R518 PolarHBondContact N-O 2.81Å; V496-L519 HydrophobicContact CB-CD1 4.32Å; V496-L519 HydrophobicContact CG1-CD1 4.29Å; V496-N520 PolarHBondContact O-N 2.94Å
497	F	91.2	Very high	91.9	Very high	47 Å²	47	36.8 Å²	36.8	21%	0.206	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	119.8	171.4	-75.9	3.1	0	0	0	110.3	L472 Y473 F474 E475 L495 N520	L472-F497 PolarHBondContact O-N 3.13Å; L472-F497 VanDerWaalsContact O-N 3.07Å; Y473-F497 HydrophobicContact CD1-CB 4.23Å; Y473-F497 AromaticContact CD1-CD2 3.72Å; Y473-F497 HydrophobicContact CD1-CD2 3.72Å; Y473-F497 HydrophobicContact CD1-CE2 4.42Å; Y473-F497 HydrophobicContact CD1-CG 4.2Å; Y473-F497 AromaticContact CE1-CD2 3.77Å; Y473-F497 HydrophobicContact CE1-CD2 3.77Å; Y473-F497 HydrophobicContact CE1-CE2 4.01Å; Y473-F497 HydrophobicContact CE1-CG 4.38Å; F474-F497 CarbonylContact C-O 3.59Å; F474-F497 WeakPolarHBondContact CA-O 3.47Å; F474-F497 WeakPolarHBondContact CB-O 3.43Å; F474-F497 PolarHBondContact N-O 3.16Å; E475-F497 PolarHBondContact N-O 3Å; E475-F497 WeakPolarHBondContact OE2-CB 3Å; L495-F497 HydrophobicContact CD1-CD1 4.5Å; L495-F497 HydrophobicContact CD1-CE1 3.87Å; L495-F497 HydrophobicContact CD1-CZ 4.01Å; L495-F497 HydrophobicContact CD2-CD1 3.66Å; L495-F497 HydrophobicContact CD2-CD2 4.37Å; L495-F497 HydrophobicContact CD2-CE1 3.87Å; L495-F497 HydrophobicContact CD2-CG 3.93Å; L495-F497 HydrophobicContact CD2-CZ 4.31Å; L495-F497 HydrophobicContact CG-CD1 4.03Å; L495-F497 HydrophobicContact CG-CE1 3.84Å; L495-F497 HydrophobicContact CG-CZ 4.42Å; F497-N520 HydrophobicContact CD1-CB 3.58Å; F497-N520 HydrophobicContact CE1-CB 4.05Å; F497-N520 HydrophobicContact CG-CB 4.17Å
498	L	95.1	Very high	91.7	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.214	C	C	.	.			trans	-127.6	15.5	-178.8	-77	163.4	0	0	0	111.4	L458 F474 I479 I482 F487 V496 N501 L503 N520 L521 N524	L458-L498 HydrophobicContact CD1-CD2 4.27Å; F474-L498 HydrophobicContact CB-CD2 3.77Å; F474-L498 HydrophobicContact CD2-CD2 4.16Å; F474-L498 HydrophobicContact CG-CD2 4.3Å; I479-L498 HydrophobicContact CD1-CD2 3.79Å; I482-L498 HydrophobicContact CD1-CD1 3.84Å; I482-L498 HydrophobicContact CD1-CD2 4.37Å; F487-L498 HydrophobicContact CZ-CD1 4.28Å; V496-L498 HydrophobicContact CG1-CD1 3.61Å; V496-L498 HydrophobicContact CG1-CG 3.77Å; L498-N501 WeakPolarHBondContact O-CB 3.47Å; L498-N501 PolarHBondContact O-ND2 3.19Å; L498-L503 HydrophobicContact CB-CD1 4.29Å; L498-L503 HydrophobicContact CD1-CD1 4.31Å; L498-L503 HydrophobicContact CD2-CD1 4.48Å; L498-N520 CarbonylContact C-O 3.53Å; L498-N520 WeakPolarHBondContact CA-O 3.35Å; L498-N520 WeakPolarHBondContact CB-O 3.36Å; L498-N520 PolarHBondContact N-O 3.29Å; L498-L521 HydrophobicContact CB-CD2 3.98Å; L498-L521 HydrophobicContact CD1-CD2 4.02Å; L498-N524 PolarHBondContact O-ND2 2.85Å
499	N	91.1	Very high	91.6	Very high	14 Å²	14	41.9 Å²	41.9	8%	0.075	22%	0.215	C	C	.	.			trans	-68.8	149	-178.8	56.1	-84.7	0	0	0	113	E475 Y476 N520 R522	E475-N499 WeakPolarHBondContact CA-O 3.43Å; E475-N499 WeakPolarHBondContact CB-ND2 3.46Å; E475-N499 WeakPolarHBondContact CB-O 3.08Å; Y476-N499 PolarHBondContact N-O 3.28Å; Y476-N499 VanDerWaalsContact N-O 3.11Å; N499-N520 WeakPolarHBondContact CB-OD1 3.29Å; N499-N520 PolarHBondContact N-O 2.64Å; N499-N520 PolarHBondContact OD1-ND2 2.91Å; N499-R522 CarbonylContact C-O 3.46Å; N499-R522 WeakPolarHBondContact CA-O 3.43Å; N499-R522 HydrophobicContact CB-CB 3.86Å; N499-R522 WeakPolarHBondContact CB-O 3.35Å
500	N	89.3	Confident	91.6	Very high	19 Å²	19	38.6 Å²	38.6	10%	0.102	20%	0.198	C	C	.	.	S	Bend	trans	57	60.8	-171.2	-44.7	-55.6	0	0	0	111.5	Y476 N477 R522 R523 L890	Y476-N500 WeakPolarHBondContact CA-O 3.01Å; Y476-N500 HydrophobicContact CD1-CB 3.8Å; Y476-N500 HydrophobicContact CE1-CB 4.15Å; Y476-N500 WeakPolarHBondContact CE1-ND2 3.24Å; Y476-N500 HydrophobicContact CG-CB 4.28Å; Y476-N500 PolarHBondContact N-O 3.21Å; N477-N500 PolarHBondContact N-O 3.11Å; N477-N500 VanDerWaalsContact O-O 3.1Å; N500-R522 PolarHBondContact N-O 3.39Å; N500-R523 VanDerWaalsContact CA-O 3.29Å; N500-R523 WeakPolarHBondContact CA-O 3.12Å; N500-R523 PolarHBondContact N-O 3.47Å; N500-R523 WeakPolarHBondContact OD1-CD 3.37Å; N500-R523 PolarHBondContact OD1-NH1 3.23Å; N500-L890 WeakPolarHBondContact ND2-CD2 3.33Å; N500-L890 WeakPolarHBondContact OD1-CD2 3.35Å
501	N	95.9	Very high	91.4	Very high	4 Å²	4	38.6 Å²	38.6	2%	0.021	20%	0.198	C	C	.	.	S	Bend	trans	-130.4	-172.8	169.9	-84.3	-81.8	0	0	0	108.7	F474 N477 I479 L498 L503 R523 N524	F474-N501 PolarHBondContact O-ND2 2.9Å; N477-N501 WeakPolarHBondContact CA-OD1 3.01Å; N477-N501 WeakPolarHBondContact CB-OD1 3.42Å; N477-N501 PolarHBondContact O-OD1 3.15Å; I479-N501 HydrophobicContact CB-CB 4.29Å; I479-N501 VanDerWaalsContact CB-OD1 3.28Å; I479-N501 WeakPolarHBondContact CB-OD1 3.36Å; I479-N501 WeakPolarHBondContact CG1-OD1 3.33Å; I479-N501 PolarHBondContact N-OD1 3.36Å; L498-N501 WeakPolarHBondContact O-CB 3.47Å; L498-N501 PolarHBondContact O-ND2 3.19Å; N501-L503 HydrophobicContact CB-CG 4.37Å; N501-R523 PolarHBondContact N-O 2.7Å; N501-N524 WeakPolarHBondContact CA-OD1 3.36Å; N501-N524 WeakPolarHBondContact CB-OD1 3.39Å; N501-N524 PolarHBondContact O-OD1 3.26Å
502	L	95.9	Very high	91.3	Very high	56 Å²	56	36.4 Å²	36.4	29%	0.293	19%	0.185	S	C	.	.			trans	-113.9	20.3	-173.6	-58.1	178.4	0	0	0	112.3	V478 I479 R480 N524	V478-L502 HydrophobicContact CB-CD1 4.01Å; V478-L502 HydrophobicContact CG1-CD1 4.37Å; I479-L502 CarbonylContact O-C 3.59Å; I479-L502 VanDerWaalsContact O-CA 3.31Å; I479-L502 WeakPolarHBondContact O-CA 3.24Å; I479-L502 PolarHBondContact O-N 2.84Å; R480-L502 HydrophobicContact CG-CB 3.94Å; R480-L502 HydrophobicContact CG-CD1 4.15Å; L502-N524 PolarHBondContact N-OD1 2.85Å
503	L	95.7	Very high	91	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.195	C	C	.	.			trans	-64.7	134.7	-174.9	-61	172.1	0	0	0	111.1	I479 I482 L498 N501 L506 L521 N524 H525 F526	I479-L503 HydrophobicContact CB-CD2 4.28Å; I479-L503 HydrophobicContact CG2-CD2 3.68Å; I479-L503 PolarHBondContact O-N 3.07Å; I479-L503 VanDerWaalsContact O-N 3.11Å; I482-L503 HydrophobicContact CD1-CD1 4.02Å; I482-L503 HydrophobicContact CD1-CD2 4.02Å; I482-L503 HydrophobicContact CG1-CD2 3.81Å; L498-L503 HydrophobicContact CB-CD1 4.29Å; L498-L503 HydrophobicContact CD1-CD1 4.31Å; L498-L503 HydrophobicContact CD2-CD1 4.48Å; N501-L503 HydrophobicContact CB-CG 4.37Å; L503-L506 HydrophobicContact CD1-CD2 4.45Å; L503-L521 HydrophobicContact CD1-CD2 4.26Å; L503-N524 HydrophobicContact CB-CB 4.17Å; L503-N524 VanDerWaalsContact CB-OD1 3.27Å; L503-N524 WeakPolarHBondContact CB-OD1 3.35Å; L503-N524 WeakPolarHBondContact CG-OD1 3.33Å; L503-N524 PolarHBondContact N-OD1 3.11Å; L503-N524 VanDerWaalsContact N-OD1 3.09Å; L503-H525 CarbonylContact O-C 3.19Å; L503-H525 VanDerWaalsContact O-CA 3.24Å; L503-H525 WeakPolarHBondContact O-CA 3.49Å; L503-H525 PolarHBondContact O-N 3.33Å; L503-F526 HydrophobicContact CB-CE1 4.13Å; L503-F526 HydrophobicContact CB-CE2 3.84Å; L503-F526 HydrophobicContact CB-CZ 3.5Å; L503-F526 VanDerWaalsContact CB-CZ 3.5Å; L503-F526 HydrophobicContact CD1-CE2 4.27Å; L503-F526 HydrophobicContact CD1-CZ 3.91Å; L503-F526 HydrophobicContact CG-CZ 4.34Å; L503-F526 PolarHBondContact O-N 3.03Å
504	R	92.5	Very high	90.8	Very high	178 Å²	178	36.2 Å²	36.2	67%	0.672	20%	0.199	S	C	*	.			trans	-107.7	-28.3	178.1	-65.7	-177.3	177.9	-161.9	-3.1	114.2	H525	R504-H525 WeakPolarHBondContact CA-O 3.47Å; R504-H525 HydrophobicContact CG-CB 4.03Å
505	S	90.8	Very high	90.7	Very high	73 Å²	73	36 Å²	36	51%	0.51	20%	0.201	S	C	.	.			trans	-154.9	161.7	179.1	56.5	0	0	0	0	109
506	L	92.9	Very high	90.8	Very high	6 Å²	6	35.5 Å²	35.5	3%	0.031	20%	0.198	C	C	.	.			trans	-108.3	141.1	166.3	-65.8	-172.7	0	0	0	108.5	I482 L503 F511 L521 F526 L529 V534	I482-L506 HydrophobicContact CD1-CD2 3.92Å; L503-L506 HydrophobicContact CD1-CD2 4.45Å; L506-F511 HydrophobicContact CD1-CE2 3.51Å; L506-F511 HydrophobicContact CD1-CZ 3.72Å; L506-L521 HydrophobicContact CD1-CD1 4.25Å; L506-F526 HydrophobicContact CD2-CE1 4.1Å; L506-F526 HydrophobicContact CD2-CZ 3.92Å; L506-F526 HydrophobicContact CG-CE1 3.82Å; L506-F526 HydrophobicContact CG-CZ 3.97Å; L506-L529 HydrophobicContact CB-CD1 4.12Å; L506-L529 HydrophobicContact CD1-CD1 4.05Å; L506-L529 HydrophobicContact CG-CD1 3.93Å; L506-V534 HydrophobicContact CB-CG1 3.96Å; L506-V534 HydrophobicContact CD1-CG1 3.95Å
507	P	91.6	Very high	90.2	Very high	30 Å²	30	36.6 Å²	36.6	20%	0.195	21%	0.207	C	C	.	.			trans	-76.7	157	177.5	37.2	-40.4	0	0	0	110.4	I482 Q483 D509 A510 V534	I482-P507 WeakPolarHBondContact O-CD 3.45Å; I482-P507 WeakPolarHBondContact O-CG 3.44Å; Q483-P507 VanDerWaalsContact C-CG 3.49Å; P507-D509 PolarHBondContact O-N 2.75Å; P507-A510 HydrophobicContact CG-CB 4.05Å; P507-A510 WeakPolarHBondContact O-CB 3.28Å; P507-A510 PolarHBondContact O-N 3.33Å; P507-V534 VanDerWaalsContact O-CG2 3.25Å; P507-V534 WeakPolarHBondContact O-CG2 3.33Å
508	N	88.8	Confident	89.7	Confident	90 Å²	90	37.8 Å²	37.8	48%	0.481	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	142.7	169.1	-64.7	9	0	0	0	110.4	S484 A510	S484-N508 VanDerWaalsContact CB-O 3.24Å; S484-N508 WeakPolarHBondContact CB-O 3.01Å; S484-N508 PolarHBondContact OG-O 3.38Å; N508-A510 PolarHBondContact O-N 2.89Å
509	D	87.9	Confident	89.5	Confident	52 Å²	52	37.8 Å²	37.8	28%	0.278	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.6	18.3	176.5	-45.2	-50.7	0	0	0	114.6	H485 P507 F511 A512 G533 H537	H485-D509 VanDerWaalsContact CA-O 3.28Å; H485-D509 WeakPolarHBondContact CA-O 3.27Å; H485-D509 IonicContact CE1-OD2 3.17Å; H485-D509 PolarHBondContact N-O 2.82Å; H485-D509 VanDerWaalsContact N-O 3.11Å; H485-D509 WeakPolarHBondContact NE2-CB 3.34Å; P507-D509 PolarHBondContact O-N 2.75Å; D509-F511 VanDerWaalsContact C-N 3.27Å; D509-F511 PolarHBondContact O-N 3.15Å; D509-A512 HydrophobicContact CB-CB 3.85Å; D509-A512 WeakPolarHBondContact O-CB 3.3Å; D509-A512 PolarHBondContact O-N 2.8Å; D509-G533 WeakPolarHBondContact CA-O 3.42Å; D509-G533 PolarHBondContact N-O 2.87Å; D509-H537 IonicContact OD1-CE1 3.52Å; D509-H537 PolarHBondContact OD1-CE1 2.9Å
510	A	89.1	Confident	89.3	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-46	175.8	0	0	0	0	0	113	F487 P507 N508	F487-A510 WeakPolarHBondContact CD2-O 3.42Å; F487-A510 PolarHBondContact N-O 3.41Å; P507-A510 HydrophobicContact CG-CB 4.05Å; P507-A510 WeakPolarHBondContact O-CB 3.28Å; P507-A510 PolarHBondContact O-N 3.33Å; N508-A510 PolarHBondContact O-N 2.89Å
511	F	89.9	Confident	89.5	Confident	1 Å²	1	37 Å²	37	0%	0.004	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	6	-177.2	-56	-61.8	0	0	0	113.8	F487 L506 D509 G513 T514 L516 L519 V534 L538	F487-F511 AromaticContact CD2-CD1 3.57Å; F487-F511 HydrophobicContact CD2-CD1 3.57Å; F487-F511 AromaticContact CD2-CE1 3.61Å; F487-F511 HydrophobicContact CD2-CE1 3.61Å; F487-F511 HydrophobicContact CE2-CD1 4.12Å; F487-F511 AromaticContact CE2-CE1 3.65Å; F487-F511 HydrophobicContact CE2-CE1 3.65Å; F487-F511 HydrophobicContact CE2-CZ 4.48Å; F487-F511 HydrophobicContact CG-CD1 4.37Å; L506-F511 HydrophobicContact CD1-CE2 3.51Å; L506-F511 HydrophobicContact CD1-CZ 3.72Å; D509-F511 VanDerWaalsContact C-N 3.27Å; D509-F511 PolarHBondContact O-N 3.15Å; F511-G513 PolarHBondContact O-N 3.04Å; F511-T514 PolarHBondContact O-N 3.01Å; F511-T514 VanDerWaalsContact O-N 3.07Å; F511-T514 PolarHBondContact O-OG1 3Å; F511-L516 HydrophobicContact CD1-CD2 4.05Å; F511-L516 HydrophobicContact CE1-CD2 4.01Å; F511-L519 HydrophobicContact CE1-CD1 4.24Å; F511-L519 HydrophobicContact CE2-CD2 3.84Å; F511-L519 HydrophobicContact CZ-CD1 3.88Å; F511-L519 HydrophobicContact CZ-CD2 3.67Å; F511-L519 HydrophobicContact CZ-CG 4.46Å; F511-V534 HydrophobicContact CD2-CG1 3.95Å; F511-V534 HydrophobicContact CE2-CG1 3.95Å; F511-L538 HydrophobicContact CB-CD2 4.02Å; F511-L538 HydrophobicContact CD2-CD1 4.46Å; F511-L538 HydrophobicContact CD2-CD2 3.87Å; F511-L538 HydrophobicContact CD2-CG 4.36Å; F511-L538 HydrophobicContact CG-CD2 3.94Å
512	A	87.4	Confident	89.2	Confident	15 Å²	15	37 Å²	37	12%	0.124	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	130.2	-177.1	0	0	0	0	0	111.1	S488 D509	S488-A512 WeakPolarHBondContact CA-O 3.47Å; S488-A512 VanDerWaalsContact CB-O 3.28Å; S488-A512 WeakPolarHBondContact CB-O 3.45Å; D509-A512 HydrophobicContact CB-CB 3.85Å; D509-A512 WeakPolarHBondContact O-CB 3.3Å; D509-A512 PolarHBondContact O-N 2.8Å
513	G	83.5	Confident	88.8	Confident	60 Å²	60	37.9 Å²	37.9	62%	0.619	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	81	5	-176.8	0	0	0	0	0	115.9	F511	F511-G513 PolarHBondContact O-N 3.04Å
514	T	88.6	Confident	88.7	Confident	14 Å²	14	38 Å²	38	9%	0.086	21%	0.206	C	C	.	.			trans	-104.3	148.8	174.9	70.3	0	0	0	0	112	F487 L493 F511	F487-T514 HydrophobicContact CB-CG2 3.82Å; F487-T514 VanDerWaalsContact O-CG2 3.23Å; F487-T514 WeakPolarHBondContact O-CG2 3.5Å; L493-T514 HydrophobicContact CD2-CG2 4.5Å; F511-T514 PolarHBondContact O-N 3.01Å; F511-T514 VanDerWaalsContact O-N 3.07Å; F511-T514 PolarHBondContact O-OG1 3Å
515	N	85.7	Confident	88.9	Confident	85 Å²	85	33.5 Å²	33.5	46%	0.455	19%	0.192	S	C	.	.			trans	-106.4	57.6	176.5	-166.3	69.9	0	0	0	111.5	L493 A517 S540	L493-N515 CarbonylContact O-C 3.51Å; N515-A517 PolarHBondContact O-N 2.92Å; N515-S540 PolarHBondContact ND2-OG 3.47Å; N515-S540 WeakPolarHBondContact OD1-CB 3.33Å; N515-S540 PolarHBondContact OD1-OG 2.96Å
516	L	88.9	Confident	89	Confident	2 Å²	2	30 Å²	30	1%	0.01	17%	0.168	C	C	.	.			trans	-69.6	121.8	-169.3	-167	69.8	0	0	0	112.3	L493 V496 F511 L519 L538 S540 I541	L493-L516 HydrophobicContact CG-CD1 4.22Å; L493-L516 WeakPolarHBondContact O-CA 3.27Å; L493-L516 PolarHBondContact O-N 2.91Å; V496-L516 HydrophobicContact CB-CD1 4.09Å; V496-L516 HydrophobicContact CG2-CD1 3.69Å; F511-L516 HydrophobicContact CD1-CD2 4.05Å; F511-L516 HydrophobicContact CE1-CD2 4.01Å; L516-L519 HydrophobicContact CD2-CB 3.82Å; L516-L519 HydrophobicContact CD2-CD1 4.11Å; L516-L519 HydrophobicContact CD2-CD2 4.28Å; L516-L519 HydrophobicContact CD2-CG 4.29Å; L516-L538 HydrophobicContact CB-CD2 4.08Å; L516-L538 HydrophobicContact CD2-CD2 3.98Å; L516-S540 CarbonylContact O-C 3.58Å; L516-I541 PolarHBondContact O-N 3.5Å
517	A	82.9	Confident	88.9	Confident	22 Å²	22	33 Å²	33	18%	0.182	19%	0.186	C	C	.	.	S	Bend	trans	-98.9	-27.3	-179.4	0	0	0	0	0	113.3	Q494 N515 V542 Q543	Q494-A517 CarbonylContact O-C 3.11Å; Q494-A517 WeakPolarHBondContact O-CA 3.39Å; Q494-A517 PolarHBondContact O-N 2.79Å; N515-A517 PolarHBondContact O-N 2.92Å; A517-V542 HydrophobicContact CB-CG2 4.43Å; A517-V542 PolarHBondContact O-N 2.72Å; A517-Q543 PolarHBondContact O-N 3Å
518	R	81.2	Confident	88.8	Confident	72 Å²	72	34.1 Å²	34.1	27%	0.272	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	127.8	175.9	-59.8	-167.2	175	92.8	-9.2	111.7	Q494 L495 V496 Q543	Q494-R518 PolarHBondContact O-N 2.75Å; L495-R518 WeakPolarHBondContact CA-O 3.29Å; L495-R518 HydrophobicContact CB-CB 4.47Å; L495-R518 HydrophobicContact CD1-CB 4.41Å; L495-R518 HydrophobicContact CG-CB 4.24Å; V496-R518 PolarHBondContact N-O 2.81Å; R518-Q543 WeakPolarHBondContact CA-O 3.16Å; R518-Q543 HydrophobicContact CG-CB 4.1Å
519	L	89.8	Confident	88.8	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	127.1	176.1	177.6	56.1	0	0	0	109.7	V496 F511 L516 L521 L538 I541 Q543 I544 D545	V496-L519 HydrophobicContact CB-CD1 4.32Å; V496-L519 HydrophobicContact CG1-CD1 4.29Å; F511-L519 HydrophobicContact CE1-CD1 4.24Å; F511-L519 HydrophobicContact CE2-CD2 3.84Å; F511-L519 HydrophobicContact CZ-CD1 3.88Å; F511-L519 HydrophobicContact CZ-CD2 3.67Å; F511-L519 HydrophobicContact CZ-CG 4.46Å; L516-L519 HydrophobicContact CD2-CB 3.82Å; L516-L519 HydrophobicContact CD2-CD1 4.11Å; L516-L519 HydrophobicContact CD2-CD2 4.28Å; L516-L519 HydrophobicContact CD2-CG 4.29Å; L519-L521 HydrophobicContact CD1-CD2 4.17Å; L519-L521 HydrophobicContact CD1-CG 4.1Å; L519-L521 HydrophobicContact CD2-CD1 4.07Å; L519-L521 HydrophobicContact CD2-CG 4.44Å; L519-L521 HydrophobicContact CG-CD1 4.25Å; L519-L521 HydrophobicContact CG-CG 4.08Å; L519-L538 HydrophobicContact CD2-CD1 3.86Å; L519-I541 HydrophobicContact CB-CD1 4.02Å; L519-Q543 PolarHBondContact N-O 3.4Å; L519-I544 HydrophobicContact CB-CG1 4.25Å; L519-I544 HydrophobicContact CD2-CD1 4.03Å; L519-I544 HydrophobicContact CD2-CG1 4.3Å; L519-I544 HydrophobicContact CG-CG1 4.38Å; L519-I544 WeakPolarHBondContact O-CA 3.46Å; L519-D545 PolarHBondContact O-N 2.97Å
520	N	87.1	Confident	88.7	Confident	17 Å²	17	30 Å²	30	9%	0.091	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	116	173.8	-165.4	-20.2	0	0	0	111.6	V496 F497 L498 N499 R522 D545	V496-N520 PolarHBondContact O-N 2.94Å; F497-N520 HydrophobicContact CD1-CB 3.58Å; F497-N520 HydrophobicContact CE1-CB 4.05Å; F497-N520 HydrophobicContact CG-CB 4.17Å; L498-N520 CarbonylContact C-O 3.53Å; L498-N520 WeakPolarHBondContact CA-O 3.35Å; L498-N520 WeakPolarHBondContact CB-O 3.36Å; L498-N520 PolarHBondContact N-O 3.29Å; N499-N520 WeakPolarHBondContact CB-OD1 3.29Å; N499-N520 PolarHBondContact N-O 2.64Å; N499-N520 PolarHBondContact OD1-ND2 2.91Å; N520-R522 WeakPolarHBondContact OD1-CB 3.05Å; N520-R522 PolarHBondContact OD1-N 3.38Å; N520-D545 HydrophobicContact CB-CB 4.37Å; N520-D545 WeakPolarHBondContact OD1-CB 3.39Å; N520-D545 PolarHBondContact OD1-OD2 2.87Å
521	L	92.6	Very high	88.6	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.181	C	C	.	.			trans	-117.5	12.4	177.6	-62.6	173.2	0	0	0	112.3	L498 L503 L506 L519 R523 N524 F526 L529 D545 L546 N549	L498-L521 HydrophobicContact CB-CD2 3.98Å; L498-L521 HydrophobicContact CD1-CD2 4.02Å; L503-L521 HydrophobicContact CD1-CD2 4.26Å; L506-L521 HydrophobicContact CD1-CD1 4.25Å; L519-L521 HydrophobicContact CD1-CD2 4.17Å; L519-L521 HydrophobicContact CD1-CG 4.1Å; L519-L521 HydrophobicContact CD2-CD1 4.07Å; L519-L521 HydrophobicContact CD2-CG 4.44Å; L519-L521 HydrophobicContact CG-CD1 4.25Å; L519-L521 HydrophobicContact CG-CG 4.08Å; L521-R523 PolarHBondContact O-N 2.94Å; L521-N524 PolarHBondContact O-ND2 2.87Å; L521-F526 HydrophobicContact CB-CD2 4.41Å; L521-F526 HydrophobicContact CB-CE2 3.9Å; L521-F526 HydrophobicContact CD1-CE2 4.09Å; L521-F526 HydrophobicContact CD1-CZ 4.24Å; L521-F526 HydrophobicContact CD2-CE2 3.88Å; L521-F526 HydrophobicContact CD2-CZ 4.04Å; L521-F526 HydrophobicContact CG-CE2 4.17Å; L521-L529 HydrophobicContact CD1-CD2 4.46Å; L521-D545 WeakPolarHBondContact CA-O 3.31Å; L521-D545 WeakPolarHBondContact CB-O 3.31Å; L521-D545 PolarHBondContact N-O 3.11Å; L521-L546 HydrophobicContact CB-CD2 4.41Å; L521-L546 HydrophobicContact CD1-CD2 3.93Å; L521-N549 PolarHBondContact O-ND2 3.32Å
522	R	90	Very high	88.3	Confident	5 Å²	5	37.1 Å²	37.1	2%	0.019	21%	0.209	C	C	.	.			trans	-49.8	134.1	179.9	175.6	-177.1	178.9	150.9	0.6	112.4	E121 N499 N500 N520 H547 Q548 K889 T892	E121-R522 IonicContact OE1-NH2 3.19Å; E121-R522 PolarHBondContact OE1-NH2 2.58Å; N499-R522 CarbonylContact C-O 3.46Å; N499-R522 WeakPolarHBondContact CA-O 3.43Å; N499-R522 HydrophobicContact CB-CB 3.86Å; N499-R522 WeakPolarHBondContact CB-O 3.35Å; N500-R522 PolarHBondContact N-O 3.39Å; N520-R522 WeakPolarHBondContact OD1-CB 3.05Å; N520-R522 PolarHBondContact OD1-N 3.38Å; R522-H547 VanDerWaalsContact CA-O 3.3Å; R522-H547 WeakPolarHBondContact CA-O 3.37Å; R522-H547 PolarHBondContact NE-CE1 2.68Å; R522-H547 PolarHBondContact NH1-CE1 3.38Å; R522-H547 PolarHBondContact NH1-NE2 3.46Å; R522-H547 PolarHBondContact NH2-CE1 3.08Å; R522-Q548 HydrophobicContact CG-CB 4.46Å; R522-K889 PolarHBondContact NH2-O 2.92Å; R522-T892 PolarHBondContact NH1-OG1 2.87Å
523	R	87.6	Confident	88	Confident	74 Å²	74	37.1 Å²	37.1	28%	0.279	21%	0.211	S	C	.	.	S	Bend	trans	48.2	70.6	-179.6	-168.7	-165.3	-74.2	83.8	3.3	111.9	N500 N501 L521 H547 Q548 K889 L890	N500-R523 VanDerWaalsContact CA-O 3.29Å; N500-R523 WeakPolarHBondContact CA-O 3.12Å; N500-R523 PolarHBondContact N-O 3.47Å; N500-R523 WeakPolarHBondContact OD1-CD 3.37Å; N500-R523 PolarHBondContact OD1-NH1 3.23Å; N501-R523 PolarHBondContact N-O 2.7Å; L521-R523 PolarHBondContact O-N 2.94Å; R523-H547 PolarHBondContact N-O 3.12Å; R523-Q548 WeakPolarHBondContact CA-O 3.23Å; R523-Q548 HydrophobicContact CB-CB 4.14Å; R523-Q548 VanDerWaalsContact NH2-OE1 3.09Å; R523-K889 PolarHBondContact NH2-O 3.46Å; R523-L890 VanDerWaalsContact NH1-CG 3.28Å
524	N	94.9	Very high	88.1	Confident	2 Å²	2	34.2 Å²	34.2	1%	0.011	18%	0.181	C	C	.	.	S	Bend	trans	-114.9	-155.2	158.9	-85.2	-86.8	0	0	0	107.6	L498 N501 L502 L503 L521 F526 N549	L498-N524 PolarHBondContact O-ND2 2.85Å; N501-N524 WeakPolarHBondContact CA-OD1 3.36Å; N501-N524 WeakPolarHBondContact CB-OD1 3.39Å; N501-N524 PolarHBondContact O-OD1 3.26Å; L502-N524 PolarHBondContact N-OD1 2.85Å; L503-N524 HydrophobicContact CB-CB 4.17Å; L503-N524 VanDerWaalsContact CB-OD1 3.27Å; L503-N524 WeakPolarHBondContact CB-OD1 3.35Å; L503-N524 WeakPolarHBondContact CG-OD1 3.33Å; L503-N524 PolarHBondContact N-OD1 3.11Å; L503-N524 VanDerWaalsContact N-OD1 3.09Å; L521-N524 PolarHBondContact O-ND2 2.87Å; N524-F526 HydrophobicContact CB-CD2 3.55Å; N524-F526 HydrophobicContact CB-CE2 3.55Å; N524-N549 WeakPolarHBondContact CA-OD1 3.45Å; N524-N549 WeakPolarHBondContact CB-OD1 3.13Å; N524-N549 PolarHBondContact N-OD1 2.7Å; N524-N549 PolarHBondContact O-OD1 2.97Å
525	H	95.1	Very high	88	Confident	84 Å²	84	33.7 Å²	33.7	39%	0.389	18%	0.178	S	C	.	.			trans	-121.9	33.6	176.6	-62.6	-37.9	0	0	0	111.6	L503 R504 V527 N549	L503-H525 CarbonylContact O-C 3.19Å; L503-H525 VanDerWaalsContact O-CA 3.24Å; L503-H525 WeakPolarHBondContact O-CA 3.49Å; L503-H525 PolarHBondContact O-N 3.33Å; R504-H525 WeakPolarHBondContact CA-O 3.47Å; R504-H525 HydrophobicContact CG-CB 4.03Å; H525-V527 PolarHBondContact O-N 3.21Å; H525-N549 PolarHBondContact N-OD1 3Å
526	F	93.2	Very high	87.8	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.181	C	C	.	.			trans	-64.4	122.4	177	-70	-73.4	0	0	0	111.2	L503 L506 L521 N524 L529 N549 P550 W551	L503-F526 HydrophobicContact CB-CE1 4.13Å; L503-F526 HydrophobicContact CB-CE2 3.84Å; L503-F526 HydrophobicContact CB-CZ 3.5Å; L503-F526 VanDerWaalsContact CB-CZ 3.5Å; L503-F526 HydrophobicContact CD1-CE2 4.27Å; L503-F526 HydrophobicContact CD1-CZ 3.91Å; L503-F526 HydrophobicContact CG-CZ 4.34Å; L503-F526 PolarHBondContact O-N 3.03Å; L506-F526 HydrophobicContact CD2-CE1 4.1Å; L506-F526 HydrophobicContact CD2-CZ 3.92Å; L506-F526 HydrophobicContact CG-CE1 3.82Å; L506-F526 HydrophobicContact CG-CZ 3.97Å; L521-F526 HydrophobicContact CB-CD2 4.41Å; L521-F526 HydrophobicContact CB-CE2 3.9Å; L521-F526 HydrophobicContact CD1-CE2 4.09Å; L521-F526 HydrophobicContact CD1-CZ 4.24Å; L521-F526 HydrophobicContact CD2-CE2 3.88Å; L521-F526 HydrophobicContact CD2-CZ 4.04Å; L521-F526 HydrophobicContact CG-CE2 4.17Å; N524-F526 HydrophobicContact CB-CD2 3.55Å; N524-F526 HydrophobicContact CB-CE2 3.55Å; F526-L529 HydrophobicContact CD1-CD1 4.13Å; F526-L529 HydrophobicContact CE1-CD1 4.07Å; F526-N549 HydrophobicContact CB-CB 4.19Å; F526-N549 WeakPolarHBondContact CD2-OD1 3.4Å; F526-N549 PolarHBondContact N-OD1 3.29Å; F526-P550 CarbonylContact O-C 3.26Å; F526-P550 VanDerWaalsContact O-C 3.28Å; F526-P550 VanDerWaalsContact O-CD 3.27Å; F526-P550 WeakPolarHBondContact O-CD 3.28Å; F526-W551 HydrophobicContact CB-CE3 4.34Å; F526-W551 HydrophobicContact CB-CH2 3.49Å; F526-W551 VanDerWaalsContact CB-CH2 3.49Å; F526-W551 HydrophobicContact CB-CZ2 4.06Å; F526-W551 HydrophobicContact CB-CZ3 3.66Å; F526-W551 HydrophobicContact CG-CH2 4.12Å
527	V	91.4	Very high	87.5	Confident	69 Å²	69	38 Å²	38	42%	0.418	20%	0.195	S	C	.	.	S	Bend	trans	-94.7	-46.7	174.6	-178.3	0	0	0	0	109.5	H525 W551 D552	H525-V527 PolarHBondContact O-N 3.21Å; V527-W551 CarbonylContact O-C 3.1Å; V527-W551 WeakPolarHBondContact O-CA 3.48Å; V527-D552 HydrophobicContact CG1-CB 3.53Å; V527-D552 PolarHBondContact O-N 2.97Å
528	S	89.1	Confident	87.5	Confident	53 Å²	53	37.4 Å²	37.4	37%	0.371	19%	0.189	S	C	.	.			trans	-140.2	162.4	169.1	63.7	0	0	0	0	110
529	L	89.3	Confident	87.4	Confident	6 Å²	6	39.7 Å²	39.7	3%	0.031	21%	0.211	C	C	.	.			trans	-136.4	112.4	-179.5	-168.8	65.2	0	0	0	109	L506 L521 F526 L535 L546 W551 L560	L506-L529 HydrophobicContact CB-CD1 4.12Å; L506-L529 HydrophobicContact CD1-CD1 4.05Å; L506-L529 HydrophobicContact CG-CD1 3.93Å; L521-L529 HydrophobicContact CD1-CD2 4.46Å; F526-L529 HydrophobicContact CD1-CD1 4.13Å; F526-L529 HydrophobicContact CE1-CD1 4.07Å; L529-L535 HydrophobicContact CD2-CD1 3.98Å; L529-L535 HydrophobicContact CD2-CD2 3.95Å; L529-L535 HydrophobicContact CD2-CG 4.27Å; L529-L535 HydrophobicContact CG-CD1 4.13Å; L529-L535 HydrophobicContact CG-CG 4.39Å; L529-L546 HydrophobicContact CD2-CD2 3.94Å; L529-W551 HydrophobicContact CB-CH2 3.93Å; L529-W551 HydrophobicContact CB-CZ3 3.76Å; L529-W551 HydrophobicContact CD2-CH2 4.22Å; L529-L560 HydrophobicContact CB-CD1 4.49Å; L529-L560 HydrophobicContact CB-CD2 4.31Å
530	P	86.4	Confident	87	Confident	50 Å²	50	41.9 Å²	41.9	33%	0.325	23%	0.226	S	C	.	.			trans	-67.5	138.5	-177	27.2	-34.2	0	0	0	110.8	V534	P530-V534 HydrophobicContact CG-CG2 3.9Å; P530-V534 WeakPolarHBondContact O-CB 3.14Å
531	V	85.7	Confident	86.8	Confident	18 Å²	18	41.5 Å²	41.5	11%	0.109	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-53.6	176	173.8	0	0	0	0	110.9	G533 V534 L535 E536 P559 L560 W563	V531-G533 PolarHBondContact O-N 3.22Å; V531-V534 PolarHBondContact O-N 2.77Å; V531-L535 HydrophobicContact CG1-CB 4.39Å; V531-L535 HydrophobicContact CG2-CD1 3.92Å; V531-L535 PolarHBondContact O-N 3.17Å; V531-E536 PolarHBondContact O-N 2.98Å; V531-P559 HydrophobicContact CB-CB 4.28Å; V531-P559 VanDerWaalsContact CG2-C 3.49Å; V531-P559 HydrophobicContact CG2-CB 4.05Å; V531-P559 WeakPolarHBondContact CG2-O 3.24Å; V531-L560 HydrophobicContact CG2-CB 4.47Å; V531-W563 HydrophobicContact CG1-CB 4.02Å; V531-W563 HydrophobicContact CG1-CG 4.01Å; V531-W563 HydrophobicContact CG2-CB 3.66Å; V531-W563 HydrophobicContact CG2-CG 4.1Å
532	H	84.4	Confident	85.9	Confident	131 Å²	131	44 Å²	44	61%	0.606	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	135.7	175.9	-64.6	-55.2	0	0	0	111	V534 E536	H532-V534 PolarHBondContact O-N 3.46Å; H532-V534 VanDerWaalsContact O-N 3.09Å; H532-E536 IonicContact CE1-OE2 3.36Å; H532-E536 IonicContact CG-OE2 3.95Å; H532-E536 IonicContact ND1-OE2 2.7Å; H532-E536 PolarHBondContact ND1-OE2 2.78Å
533	G	80.4	Confident	85.2	Confident	15 Å²	15	45.1 Å²	45.1	16%	0.155	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.9	-18.9	-177.3	0	0	0	0	0	115.8	D509 V531 H537	D509-G533 WeakPolarHBondContact CA-O 3.42Å; D509-G533 PolarHBondContact N-O 2.87Å; V531-G533 PolarHBondContact O-N 3.22Å; G533-H537 PolarHBondContact O-CE1 3.42Å; G533-H537 VanDerWaalsContact O-CE1 3.3Å; G533-H537 PolarHBondContact O-ND1 2.71Å
534	V	86.4	Confident	85.1	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.1	-71.4	-178.7	-172.8	0	0	0	0	112.3	L506 P507 F511 P530 V531 H532 E536 H537	L506-V534 HydrophobicContact CB-CG1 3.96Å; L506-V534 HydrophobicContact CD1-CG1 3.95Å; P507-V534 VanDerWaalsContact O-CG2 3.25Å; P507-V534 WeakPolarHBondContact O-CG2 3.33Å; F511-V534 HydrophobicContact CD2-CG1 3.95Å; F511-V534 HydrophobicContact CE2-CG1 3.95Å; P530-V534 HydrophobicContact CG-CG2 3.9Å; P530-V534 WeakPolarHBondContact O-CB 3.14Å; V531-V534 PolarHBondContact O-N 2.77Å; H532-V534 PolarHBondContact O-N 3.46Å; H532-V534 VanDerWaalsContact O-N 3.09Å; V534-E536 VanDerWaalsContact C-N 3.35Å; V534-H537 PolarHBondContact O-N 2.74Å
535	L	85	Confident	84.5	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.01	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-76.1	-23.6	-176	-61.3	172.9	0	0	0	113.2	L529 V531 H537 L538 I544 L560 W563	L529-L535 HydrophobicContact CD2-CD1 3.98Å; L529-L535 HydrophobicContact CD2-CD2 3.95Å; L529-L535 HydrophobicContact CD2-CG 4.27Å; L529-L535 HydrophobicContact CG-CD1 4.13Å; L529-L535 HydrophobicContact CG-CG 4.39Å; V531-L535 HydrophobicContact CG1-CB 4.39Å; V531-L535 HydrophobicContact CG2-CD1 3.92Å; V531-L535 PolarHBondContact O-N 3.17Å; L535-H537 PolarHBondContact O-N 2.97Å; L535-L538 HydrophobicContact CD2-CD1 3.65Å; L535-L538 WeakPolarHBondContact O-CB 3.08Å; L535-L538 PolarHBondContact O-N 2.82Å; L535-I544 HydrophobicContact CD2-CD1 4.05Å; L535-L560 HydrophobicContact CD1-CD1 3.44Å; L535-L560 VanDerWaalsContact CD1-CD1 3.44Å; L535-W563 HydrophobicContact CB-CD2 4.07Å; L535-W563 HydrophobicContact CB-CG 4.48Å; L535-W563 HydrophobicContact CB-CH2 4.38Å; L535-W563 HydrophobicContact CB-CZ2 3.83Å; L535-W563 HydrophobicContact CD1-CD2 4Å; L535-W563 HydrophobicContact CD1-CE3 3.82Å; L535-W563 HydrophobicContact CD1-CH2 4.37Å; L535-W563 HydrophobicContact CD1-CZ3 4Å; L535-W563 HydrophobicContact CD2-CH2 3.91Å; L535-W563 HydrophobicContact CD2-CZ2 4.11Å; L535-W563 HydrophobicContact CD2-CZ3 4.26Å; L535-W563 HydrophobicContact CG-CH2 4.46Å; L535-W563 HydrophobicContact CG-CZ2 4.38Å; L535-W563 PolarHBondContact O-NE1 3.19Å
536	E	83.1	Confident	84.2	Confident	114 Å²	114	38.1 Å²	38.1	53%	0.533	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-59.8	-27.4	174.1	-172.2	164.1	-172.5	0	0	112.7	V531 H532 V534 L538	V531-E536 PolarHBondContact O-N 2.98Å; H532-E536 IonicContact CE1-OE2 3.36Å; H532-E536 IonicContact CG-OE2 3.95Å; H532-E536 IonicContact ND1-OE2 2.7Å; H532-E536 PolarHBondContact ND1-OE2 2.78Å; V534-E536 VanDerWaalsContact C-N 3.35Å; E536-L538 VanDerWaalsContact C-N 3.35Å
537	H	82	Confident	83.8	Confident	65 Å²	65	39.3 Å²	39.3	30%	0.301	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-75.5	-17.8	175.2	-68.7	116.4	0	0	0	114.1	D509 G533 V534 L535 T539	D509-H537 IonicContact OD1-CE1 3.52Å; D509-H537 PolarHBondContact OD1-CE1 2.9Å; G533-H537 PolarHBondContact O-CE1 3.42Å; G533-H537 VanDerWaalsContact O-CE1 3.3Å; G533-H537 PolarHBondContact O-ND1 2.71Å; V534-H537 PolarHBondContact O-N 2.74Å; L535-H537 PolarHBondContact O-N 2.97Å; H537-T539 PolarHBondContact O-N 3.38Å
538	L	82.5	Confident	83.5	Confident	8 Å²	8	39 Å²	39	4%	0.042	22%	0.215	C	C	.	.			trans	-82.8	48.9	-172.2	-60.7	-176.6	0	0	0	113	F511 L516 L519 L535 E536 S540 I541 I544	F511-L538 HydrophobicContact CB-CD2 4.02Å; F511-L538 HydrophobicContact CD2-CD1 4.46Å; F511-L538 HydrophobicContact CD2-CD2 3.87Å; F511-L538 HydrophobicContact CD2-CG 4.36Å; F511-L538 HydrophobicContact CG-CD2 3.94Å; L516-L538 HydrophobicContact CB-CD2 4.08Å; L516-L538 HydrophobicContact CD2-CD2 3.98Å; L519-L538 HydrophobicContact CD2-CD1 3.86Å; L535-L538 HydrophobicContact CD2-CD1 3.65Å; L535-L538 WeakPolarHBondContact O-CB 3.08Å; L535-L538 PolarHBondContact O-N 2.82Å; E536-L538 VanDerWaalsContact C-N 3.35Å; L538-S540 VanDerWaalsContact C-N 3.3Å; L538-S540 PolarHBondContact O-N 2.9Å; L538-I541 HydrophobicContact CB-CB 4.16Å; L538-I541 HydrophobicContact CB-CG2 4.4Å; L538-I541 WeakPolarHBondContact O-CB 3.34Å; L538-I541 VanDerWaalsContact O-CG2 3.24Å; L538-I541 WeakPolarHBondContact O-CG2 3.43Å; L538-I541 PolarHBondContact O-N 3.04Å; L538-I544 HydrophobicContact CD1-CD1 4.29Å
539	T	79.4	Confident	83.7	Confident	121 Å²	121	36.9 Å²	36.9	74%	0.742	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-23.4	-172.3	54.7	0	0	0	0	114.8	H537	H537-T539 PolarHBondContact O-N 3.38Å
540	S	82.1	Confident	83.8	Confident	46 Å²	46	38.3 Å²	38.3	32%	0.322	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	14.4	178.9	-66.1	0	0	0	0	113.9	N515 L516 L538 V542	N515-S540 PolarHBondContact ND2-OG 3.47Å; N515-S540 WeakPolarHBondContact OD1-CB 3.33Å; N515-S540 PolarHBondContact OD1-OG 2.96Å; L516-S540 CarbonylContact O-C 3.58Å; L538-S540 VanDerWaalsContact C-N 3.3Å; L538-S540 PolarHBondContact O-N 2.9Å; S540-V542 PolarHBondContact O-N 3.4Å
541	I	81.2	Confident	84.1	Confident	9 Å²	9	36 Å²	36	5%	0.046	19%	0.194	C	C	.	.			trans	-67.8	130.9	-175.4	-159.1	72.5	0	0	0	111.6	L516 L519 L538 Q543 I544 L567 I571	L516-I541 PolarHBondContact O-N 3.5Å; L519-I541 HydrophobicContact CB-CD1 4.02Å; L538-I541 HydrophobicContact CB-CB 4.16Å; L538-I541 HydrophobicContact CB-CG2 4.4Å; L538-I541 WeakPolarHBondContact O-CB 3.34Å; L538-I541 VanDerWaalsContact O-CG2 3.24Å; L538-I541 WeakPolarHBondContact O-CG2 3.43Å; L538-I541 PolarHBondContact O-N 3.04Å; I541-Q543 WeakPolarHBondContact CD1-O 3.2Å; I541-I544 HydrophobicContact CG1-CB 4.17Å; I541-L567 HydrophobicContact CG2-CD2 4.37Å; I541-I571 HydrophobicContact CG2-CD1 4.15Å; I541-I571 HydrophobicContact CG2-CG2 4.09Å; I541-I571 WeakPolarHBondContact O-CD1 3.28Å; I541-I571 WeakPolarHBondContact O-CG1 3.29Å
542	V	75.6	Confident	84.4	Confident	53 Å²	53	36.9 Å²	36.9	32%	0.321	20%	0.198	S	C	.	.	S	Bend	trans	-109.9	-27.8	177.5	-176.8	0	0	0	0	110.8	A517 S540 I571 V572 V899	A517-V542 HydrophobicContact CB-CG2 4.43Å; A517-V542 PolarHBondContact O-N 2.72Å; S540-V542 PolarHBondContact O-N 3.4Å; V542-I571 WeakPolarHBondContact O-CA 3.47Å; V542-V572 PolarHBondContact O-N 3.38Å; V542-V572 VanDerWaalsContact O-N 3.08Å; V542-V899 HydrophobicContact CG1-CG2 4.23Å
543	Q	75.3	Confident	84.7	Confident	28 Å²	28	30.6 Å²	30.6	13%	0.131	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	128.4	-179.8	180	-169.4	-22.8	0	0	109.6	A517 R518 L519 I541 P894	A517-Q543 PolarHBondContact O-N 3Å; R518-Q543 WeakPolarHBondContact CA-O 3.16Å; R518-Q543 HydrophobicContact CG-CB 4.1Å; L519-Q543 PolarHBondContact N-O 3.4Å; I541-Q543 WeakPolarHBondContact CD1-O 3.2Å; Q543-P894 HydrophobicContact CG-CG 3.79Å; Q543-P894 VanDerWaalsContact NE2-CG 3.31Å
544	I	84.8	Confident	85.1	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	116.6	170.3	-170.6	173.8	0	0	0	110.3	L519 L535 L538 I541 L546 W563 L567 V572 V573 G574	L519-I544 HydrophobicContact CB-CG1 4.25Å; L519-I544 HydrophobicContact CD2-CD1 4.03Å; L519-I544 HydrophobicContact CD2-CG1 4.3Å; L519-I544 HydrophobicContact CG-CG1 4.38Å; L519-I544 WeakPolarHBondContact O-CA 3.46Å; L535-I544 HydrophobicContact CD2-CD1 4.05Å; L538-I544 HydrophobicContact CD1-CD1 4.29Å; I541-I544 HydrophobicContact CG1-CB 4.17Å; I544-L546 HydrophobicContact CD1-CD1 4.42Å; I544-L546 HydrophobicContact CD1-CD2 3.91Å; I544-L546 HydrophobicContact CD1-CG 4.19Å; I544-L546 HydrophobicContact CG1-CD2 3.97Å; I544-L546 HydrophobicContact CG1-CG 4.04Å; I544-W563 HydrophobicContact CD1-CH2 3.72Å; I544-W563 HydrophobicContact CD1-CZ3 4.16Å; I544-W563 HydrophobicContact CG2-CH2 4.2Å; I544-W563 HydrophobicContact CG2-CZ3 4.44Å; I544-L567 HydrophobicContact CG2-CD1 4.47Å; I544-V572 PolarHBondContact N-O 3.02Å; I544-V573 HydrophobicContact CG2-CB 4.46Å; I544-V573 HydrophobicContact CG2-CG1 4.24Å; I544-V573 HydrophobicContact CG2-CG2 3.93Å; I544-V573 WeakPolarHBondContact O-CA 3.05Å; I544-G574 PolarHBondContact O-N 3.03Å
545	D	81.6	Confident	85.1	Confident	12 Å²	12	34 Å²	34	6%	0.064	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	113.1	176.1	-171.3	-9.6	0	0	0	109.7	L519 N520 L521 H547	L519-D545 PolarHBondContact O-N 2.97Å; N520-D545 HydrophobicContact CB-CB 4.37Å; N520-D545 WeakPolarHBondContact OD1-CB 3.39Å; N520-D545 PolarHBondContact OD1-OD2 2.87Å; L521-D545 WeakPolarHBondContact CA-O 3.31Å; L521-D545 WeakPolarHBondContact CB-O 3.31Å; L521-D545 PolarHBondContact N-O 3.11Å; D545-H547 IonicContact OD1-CD2 3.39Å; D545-H547 PolarHBondContact OD1-CD2 3.26Å; D545-H547 IonicContact OD1-CG 2.71Å; D545-H547 PolarHBondContact OD1-N 3.31Å; D545-H547 IonicContact OD2-CD2 3.02Å; D545-H547 IonicContact OD2-NE2 2.94Å
546	L	88.9	Confident	85.2	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.224	C	C	.	.			trans	-111.8	2.3	-179.4	-67.2	-175.4	0	0	0	112.6	L521 L529 I544 N549 W551 L564 V576	L521-L546 HydrophobicContact CB-CD2 4.41Å; L521-L546 HydrophobicContact CD1-CD2 3.93Å; L529-L546 HydrophobicContact CD2-CD2 3.94Å; I544-L546 HydrophobicContact CD1-CD1 4.42Å; I544-L546 HydrophobicContact CD1-CD2 3.91Å; I544-L546 HydrophobicContact CD1-CG 4.19Å; I544-L546 HydrophobicContact CG1-CD2 3.97Å; I544-L546 HydrophobicContact CG1-CG 4.04Å; L546-N549 PolarHBondContact O-ND2 2.86Å; L546-W551 HydrophobicContact CB-CZ2 3.92Å; L546-W551 HydrophobicContact CD2-CH2 4.5Å; L546-W551 HydrophobicContact CD2-CZ2 4.27Å; L546-W551 HydrophobicContact CG-CZ2 4.48Å; L546-W551 WeakPolarHBondContact O-CZ2 3.36Å; L546-W551 PolarHBondContact O-NE1 2.65Å; L546-W551 VanDerWaalsContact O-NE1 3.11Å; L546-L564 HydrophobicContact CD1-CD2 4.37Å; L546-V576 HydrophobicContact CB-CG2 4Å; L546-V576 HydrophobicContact CD1-CG2 4.07Å
547	H	85.5	Confident	85.5	Confident	25 Å²	25	35 Å²	35	12%	0.116	20%	0.199	C	C	.	.			trans	-80.8	167.4	-162.9	90	76.9	0	0	0	113.6	R522 R523 D545 N549 E575 T892	R522-H547 VanDerWaalsContact CA-O 3.3Å; R522-H547 WeakPolarHBondContact CA-O 3.37Å; R522-H547 PolarHBondContact NE-CE1 2.68Å; R522-H547 PolarHBondContact NH1-CE1 3.38Å; R522-H547 PolarHBondContact NH1-NE2 3.46Å; R522-H547 PolarHBondContact NH2-CE1 3.08Å; R523-H547 PolarHBondContact N-O 3.12Å; D545-H547 IonicContact OD1-CD2 3.39Å; D545-H547 PolarHBondContact OD1-CD2 3.26Å; D545-H547 IonicContact OD1-CG 2.71Å; D545-H547 PolarHBondContact OD1-N 3.31Å; D545-H547 IonicContact OD2-CD2 3.02Å; D545-H547 IonicContact OD2-NE2 2.94Å; H547-N549 PolarHBondContact O-N 2.91Å; H547-N549 PolarHBondContact O-ND2 2.85Å; H547-E575 WeakPolarHBondContact CA-O 3.25Å; H547-E575 VanDerWaalsContact CB-O 3.26Å; H547-E575 WeakPolarHBondContact CB-O 3.27Å; H547-T892 WeakPolarHBondContact NE2-CB 3.38Å; H547-T892 PolarHBondContact NE2-OG1 2.89Å
548	Q	84.8	Confident	85.8	Confident	64 Å²	64	32.8 Å²	32.8	30%	0.299	19%	0.189	S	C	.	.	S	Bend	trans	57.3	30.9	-175.7	-76.6	166.1	-1.1	0	0	113.8	R522 R523	R522-Q548 HydrophobicContact CG-CB 4.46Å; R523-Q548 WeakPolarHBondContact CA-O 3.23Å; R523-Q548 HydrophobicContact CB-CB 4.14Å; R523-Q548 VanDerWaalsContact NH2-OE1 3.09Å
549	N	92.4	Very high	86.1	Confident	8 Å²	8	34.9 Å²	34.9	4%	0.043	20%	0.203	C	C	.	.			trans	-107.6	149.2	172.7	-79.5	-71.7	0	0	0	111.4	L521 N524 H525 F526 L546 H547 W551	L521-N549 PolarHBondContact O-ND2 3.32Å; N524-N549 WeakPolarHBondContact CA-OD1 3.45Å; N524-N549 WeakPolarHBondContact CB-OD1 3.13Å; N524-N549 PolarHBondContact N-OD1 2.7Å; N524-N549 PolarHBondContact O-OD1 2.97Å; H525-N549 PolarHBondContact N-OD1 3Å; F526-N549 HydrophobicContact CB-CB 4.19Å; F526-N549 WeakPolarHBondContact CD2-OD1 3.4Å; F526-N549 PolarHBondContact N-OD1 3.29Å; L546-N549 PolarHBondContact O-ND2 2.86Å; H547-N549 PolarHBondContact O-N 2.91Å; H547-N549 PolarHBondContact O-ND2 2.85Å; N549-W551 HydrophobicContact CB-CD2 4.27Å; N549-W551 HydrophobicContact CB-CZ2 3.83Å; N549-W551 PolarHBondContact O-N 3.11Å
550	P	92.8	Very high	86.6	Confident	35 Å²	35	29.2 Å²	29.2	23%	0.227	17%	0.168	C	C	.	.			trans	-81.8	61.3	-177.6	36.1	-38.1	0	0	0	112.5	F526 D552 N579	F526-P550 CarbonylContact O-C 3.26Å; F526-P550 VanDerWaalsContact O-C 3.28Å; F526-P550 VanDerWaalsContact O-CD 3.27Å; F526-P550 WeakPolarHBondContact O-CD 3.28Å; P550-D552 PolarHBondContact O-N 2.89Å; P550-N579 HydrophobicContact CB-CB 4.18Å
551	W	93.3	Very high	86.9	Confident	1 Å²	1	27.6 Å²	27.6	0%	0.004	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	130.4	-176.6	-62.4	111.7	0	0	0	112.9	F526 V527 L529 L546 N549 I557 L560 V576 N579 T580	F526-W551 HydrophobicContact CB-CE3 4.34Å; F526-W551 HydrophobicContact CB-CH2 3.49Å; F526-W551 VanDerWaalsContact CB-CH2 3.49Å; F526-W551 HydrophobicContact CB-CZ2 4.06Å; F526-W551 HydrophobicContact CB-CZ3 3.66Å; F526-W551 HydrophobicContact CG-CH2 4.12Å; V527-W551 CarbonylContact O-C 3.1Å; V527-W551 WeakPolarHBondContact O-CA 3.48Å; L529-W551 HydrophobicContact CB-CH2 3.93Å; L529-W551 HydrophobicContact CB-CZ3 3.76Å; L529-W551 HydrophobicContact CD2-CH2 4.22Å; L546-W551 HydrophobicContact CB-CZ2 3.92Å; L546-W551 HydrophobicContact CD2-CH2 4.5Å; L546-W551 HydrophobicContact CD2-CZ2 4.27Å; L546-W551 HydrophobicContact CG-CZ2 4.48Å; L546-W551 WeakPolarHBondContact O-CZ2 3.36Å; L546-W551 PolarHBondContact O-NE1 2.65Å; L546-W551 VanDerWaalsContact O-NE1 3.11Å; N549-W551 HydrophobicContact CB-CD2 4.27Å; N549-W551 HydrophobicContact CB-CZ2 3.83Å; N549-W551 PolarHBondContact O-N 3.11Å; W551-I557 HydrophobicContact CE3-CD1 4.38Å; W551-L560 HydrophobicContact CE3-CD2 4.26Å; W551-L560 HydrophobicContact CZ3-CD2 4.07Å; W551-V576 HydrophobicContact CD2-CG1 4.03Å; W551-V576 HydrophobicContact CG-CG1 3.87Å; W551-N579 PolarHBondContact O-N 3.05Å; W551-T580 PolarHBondContact O-N 3.37Å; W551-T580 VanDerWaalsContact O-N 3.15Å
552	D	91.8	Very high	87.2	Confident	37 Å²	37	32.4 Å²	32.4	20%	0.198	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	117.1	168	-174	55.8	0	0	0	110.2	V527 P550 S554 I557 T580	V527-D552 HydrophobicContact CG1-CB 3.53Å; V527-D552 PolarHBondContact O-N 2.97Å; P550-D552 PolarHBondContact O-N 2.89Å; D552-S554 VanDerWaalsContact C-N 3.33Å; D552-S554 PolarHBondContact O-N 3.1Å; D552-S554 PolarHBondContact OD1-OG 2.91Å; D552-S554 WeakPolarHBondContact OD2-CB 3.3Å; D552-S554 PolarHBondContact OD2-OG 3.39Å; D552-I557 WeakPolarHBondContact O-CD1 3.41Å; D552-T580 WeakPolarHBondContact CA-O 3.37Å; D552-T580 WeakPolarHBondContact CA-OG1 3.41Å; D552-T580 WeakPolarHBondContact CB-OG1 3.34Å; D552-T580 VanDerWaalsContact OD1-C 3.24Å; D552-T580 WeakPolarHBondContact OD1-CB 3.2Å; D552-T580 PolarHBondContact OD1-OG1 3.03Å
553	C	90.3	Very high	87.9	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.168	C	C	.	.			trans	-100.3	41.5	-175.7	-64.1	0	0	0	0	112.2	I557 C578 T580 A584 L592	C553-I557 HydrophobicContact CB-CG2 4.3Å; C553-C578 HydrophobicContact CB-CB 3.74Å; C553-C578 WeakPolarHBondContact CB-SG 3.44Å; C553-C578 WeakPolarHBondContact SG-CB 3.43Å; C553-C578 CovalentContact SG-SG 2.02Å; C553-C578 PolarHBondContact SG-SG 2.86Å; C553-T580 PolarHBondContact N-O 2.81Å; C553-A584 HydrophobicContact CB-CB 4.05Å; C553-L592 HydrophobicContact CB-CD1 4.21Å
554	S	89.1	Confident	88.4	Confident	37 Å²	37	30.5 Å²	30.5	26%	0.259	16%	0.164	S	C	.	.	S	Bend	trans	-77.9	177.1	165.2	-56	0	0	0	0	111.1	D552 D556 I557 I597	D552-S554 VanDerWaalsContact C-N 3.33Å; D552-S554 PolarHBondContact O-N 3.1Å; D552-S554 PolarHBondContact OD1-OG 2.91Å; D552-S554 WeakPolarHBondContact OD2-CB 3.3Å; D552-S554 PolarHBondContact OD2-OG 3.39Å; S554-D556 PolarHBondContact O-N 3.37Å; S554-I557 WeakPolarHBondContact O-CB 3.24Å; S554-I557 VanDerWaalsContact O-CG2 3.27Å; S554-I557 WeakPolarHBondContact O-CG2 3.44Å; S554-I557 PolarHBondContact O-N 2.81Å; S554-I597 WeakPolarHBondContact O-CG2 3.47Å
555	C	86.8	Confident	88.4	Confident	48 Å²	48	35.6 Å²	35.6	32%	0.324	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-41.8	-40.1	-179.8	-69	0	0	0	0	115.5	I557 I558 I597 C598	C555-I557 PolarHBondContact O-N 2.6Å; C555-I557 VanDerWaalsContact O-N 3.12Å; C555-I558 WeakPolarHBondContact O-CB 3.36Å; C555-I558 WeakPolarHBondContact O-CG1 3.47Å; C555-I558 PolarHBondContact O-N 3.5Å; C555-I597 PolarHBondContact N-O 3Å; C555-C598 HydrophobicContact CB-CB 3.8Å; C555-C598 WeakPolarHBondContact CB-SG 3.37Å; C555-C598 VanDerWaalsContact SG-CA 3.5Å; C555-C598 WeakPolarHBondContact SG-CB 3.45Å; C555-C598 CovalentContact SG-SG 2.04Å; C555-C598 PolarHBondContact SG-SG 2.96Å
556	D	85.5	Confident	88.4	Confident	137 Å²	137	43.7 Å²	43.7	73%	0.733	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-64	-15.1	-177.1	-64.4	-27.9	0	0	0	114.4	S554 I558 P559	S554-D556 PolarHBondContact O-N 3.37Å; D556-I558 VanDerWaalsContact C-N 3.33Å; D556-P559 WeakPolarHBondContact O-CD 3.37Å
557	I	89.3	Confident	87.7	Confident	2 Å²	2	45 Å²	45	1%	0.01	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-79.5	-15	178.2	-148	63.6	0	0	0	113	W551 D552 C553 S554 C555 L560 K561 L589 I597	W551-I557 HydrophobicContact CE3-CD1 4.38Å; D552-I557 WeakPolarHBondContact O-CD1 3.41Å; C553-I557 HydrophobicContact CB-CG2 4.3Å; S554-I557 WeakPolarHBondContact O-CB 3.24Å; S554-I557 VanDerWaalsContact O-CG2 3.27Å; S554-I557 WeakPolarHBondContact O-CG2 3.44Å; S554-I557 PolarHBondContact O-N 2.81Å; C555-I557 PolarHBondContact O-N 2.6Å; C555-I557 VanDerWaalsContact O-N 3.12Å; I557-L560 HydrophobicContact CD1-CB 4.32Å; I557-L560 HydrophobicContact CD1-CD2 3.72Å; I557-L560 HydrophobicContact CG1-CB 4.45Å; I557-L560 HydrophobicContact CG1-CD2 4.32Å; I557-L560 WeakPolarHBondContact O-CA 3.35Å; I557-L560 WeakPolarHBondContact O-CB 3.36Å; I557-L560 PolarHBondContact O-N 2.92Å; I557-K561 PolarHBondContact O-N 3.2Å; I557-L589 HydrophobicContact CB-CD1 4.34Å; I557-L589 HydrophobicContact CD1-CD2 4.48Å; I557-L589 HydrophobicContact CG1-CD1 3.84Å; I557-L589 HydrophobicContact CG1-CD2 3.65Å; I557-L589 HydrophobicContact CG1-CG 4.42Å; I557-L589 HydrophobicContact CG2-CD1 3.53Å; I557-I597 HydrophobicContact CG2-CD1 4.38Å; I557-I597 HydrophobicContact CG2-CG2 3.74Å
558	I	88.6	Confident	86.5	Confident	18 Å²	18	46.6 Å²	46.6	9%	0.092	24%	0.244	C	C	.	.	H	α-helix	trans	-55.6	-42.4	-172.6	-72	172.3	0	0	0	113.3	C555 D556 L560 K561 Q562 V594 I597 C598 L601	C555-I558 WeakPolarHBondContact O-CB 3.36Å; C555-I558 WeakPolarHBondContact O-CG1 3.47Å; C555-I558 PolarHBondContact O-N 3.5Å; D556-I558 VanDerWaalsContact C-N 3.33Å; I558-L560 VanDerWaalsContact C-N 3.33Å; I558-L560 PolarHBondContact O-N 3.35Å; I558-K561 PolarHBondContact O-N 3.09Å; I558-Q562 HydrophobicContact CG2-CG 4.3Å; I558-Q562 WeakPolarHBondContact O-CG 3.45Å; I558-Q562 PolarHBondContact O-N 2.97Å; I558-V594 HydrophobicContact CD1-CG1 3.7Å; I558-V594 HydrophobicContact CG1-CG1 4.17Å; I558-V594 HydrophobicContact CG2-CG1 4.3Å; I558-I597 HydrophobicContact CD1-CG2 4.05Å; I558-I597 HydrophobicContact CG1-CB 4.46Å; I558-I597 HydrophobicContact CG1-CG2 3.68Å; I558-C598 HydrophobicContact CD1-CB 3.41Å; I558-C598 VanDerWaalsContact CD1-CB 3.41Å; I558-L601 HydrophobicContact CD1-CD1 3.8Å
559	P	89.2	Confident	85.1	Confident	51 Å²	51	47.4 Å²	47.4	33%	0.331	26%	0.256	S	S	.	.	H	α-helix	trans	-58.6	-43.2	174.3	-25.2	35.7	0	0	0	112.3	V531 D556 K561 Q562 W563	V531-P559 HydrophobicContact CB-CB 4.28Å; V531-P559 VanDerWaalsContact CG2-C 3.49Å; V531-P559 HydrophobicContact CG2-CB 4.05Å; V531-P559 WeakPolarHBondContact CG2-O 3.24Å; D556-P559 WeakPolarHBondContact O-CD 3.37Å; P559-K561 VanDerWaalsContact C-N 3.35Å; P559-K561 PolarHBondContact O-N 2.78Å; P559-Q562 PolarHBondContact O-N 2.89Å; P559-W563 WeakPolarHBondContact O-CB 3.5Å; P559-W563 PolarHBondContact O-N 3.47Å
560	L	89.8	Confident	83	Confident	2 Å²	2	48 Å²	48	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-62.4	-43.1	177.3	-179.1	64.8	0	0	0	110.8	L529 V531 L535 W551 I557 I558 W563 L564 L589	L529-L560 HydrophobicContact CB-CD1 4.49Å; L529-L560 HydrophobicContact CB-CD2 4.31Å; V531-L560 HydrophobicContact CG2-CB 4.47Å; L535-L560 HydrophobicContact CD1-CD1 3.44Å; L535-L560 VanDerWaalsContact CD1-CD1 3.44Å; W551-L560 HydrophobicContact CE3-CD2 4.26Å; W551-L560 HydrophobicContact CZ3-CD2 4.07Å; I557-L560 HydrophobicContact CD1-CB 4.32Å; I557-L560 HydrophobicContact CD1-CD2 3.72Å; I557-L560 HydrophobicContact CG1-CB 4.45Å; I557-L560 HydrophobicContact CG1-CD2 4.32Å; I557-L560 WeakPolarHBondContact O-CA 3.35Å; I557-L560 WeakPolarHBondContact O-CB 3.36Å; I557-L560 PolarHBondContact O-N 2.92Å; I558-L560 VanDerWaalsContact C-N 3.33Å; I558-L560 PolarHBondContact O-N 3.35Å; L560-W563 HydrophobicContact CD1-CE3 4.17Å; L560-W563 PolarHBondContact O-N 3.28Å; L560-L564 HydrophobicContact CD1-CG 4.44Å; L560-L564 HydrophobicContact CG-CD1 4.18Å; L560-L564 WeakPolarHBondContact O-CB 3.44Å; L560-L564 VanDerWaalsContact O-CG 3.24Å; L560-L564 WeakPolarHBondContact O-CG 3.31Å; L560-L564 PolarHBondContact O-N 3.45Å; L560-L589 HydrophobicContact CB-CD2 4.48Å; L560-L589 HydrophobicContact CD2-CD2 4.05Å; L560-L589 HydrophobicContact CG-CD2 4.11Å
561	K	88.4	Confident	81.4	Confident	12 Å²	12	47.7 Å²	47.7	5%	0.052	26%	0.256	C	S	.	.	H	α-helix	trans	-57.5	-53.3	174	-171.8	-171.1	162.2	-177.4	0	111.2	I557 I558 P559 W563 L564 E565 L589 L592 V594 I597	I557-K561 PolarHBondContact O-N 3.2Å; I558-K561 PolarHBondContact O-N 3.09Å; P559-K561 VanDerWaalsContact C-N 3.35Å; P559-K561 PolarHBondContact O-N 2.78Å; K561-W563 VanDerWaalsContact C-N 3.27Å; K561-W563 PolarHBondContact O-N 2.79Å; K561-L564 WeakPolarHBondContact O-CB 3.14Å; K561-L564 PolarHBondContact O-N 3.21Å; K561-L564 VanDerWaalsContact O-N 3.1Å; K561-E565 WeakPolarHBondContact CE-OE1 3.26Å; K561-E565 HydrophobicContact CG-CG 4.49Å; K561-E565 IonicContact NZ-OE1 3.63Å; K561-E565 PolarHBondContact NZ-OE1 3.36Å; K561-E565 WeakPolarHBondContact O-CG 3.31Å; K561-E565 PolarHBondContact O-N 3.28Å; K561-L589 HydrophobicContact CB-CD1 4.11Å; K561-L589 HydrophobicContact CB-CD2 4.27Å; K561-L589 HydrophobicContact CB-CG 4.02Å; K561-L589 WeakPolarHBondContact CD-O 3.49Å; K561-L589 HydrophobicContact CG-CD1 4.44Å; K561-L589 HydrophobicContact CG-CG 4.23Å; K561-L592 PolarHBondContact NZ-O 3.48Å; K561-V594 HydrophobicContact CD-CG2 4.41Å; K561-I597 HydrophobicContact CD-CD1 3.96Å
562	Q	88.6	Confident	79.8	Confident	111 Å²	111	49.5 Å²	49.5	52%	0.519	27%	0.267	S	S	.	.	H	α-helix	trans	-60.9	-34.8	-179.8	-70.6	176.5	-4	0	0	112.7	I558 P559 K566	I558-Q562 HydrophobicContact CG2-CG 4.3Å; I558-Q562 WeakPolarHBondContact O-CG 3.45Å; I558-Q562 PolarHBondContact O-N 2.97Å; P559-Q562 PolarHBondContact O-N 2.89Å; Q562-K566 VanDerWaalsContact O-CB 3.24Å; Q562-K566 WeakPolarHBondContact O-CB 3.35Å; Q562-K566 PolarHBondContact O-N 3.18Å; Q562-K566 VanDerWaalsContact O-N 3.09Å
563	W	88.4	Confident	78.9	Confident	31 Å²	31	48.8 Å²	48.8	12%	0.117	26%	0.264	C	S	.	.	H	α-helix	trans	-66.3	-46.6	173.6	-179.1	85.9	0	0	0	111.2	V531 L535 I544 P559 L560 K561 E565 K566 L567	V531-W563 HydrophobicContact CG1-CB 4.02Å; V531-W563 HydrophobicContact CG1-CG 4.01Å; V531-W563 HydrophobicContact CG2-CB 3.66Å; V531-W563 HydrophobicContact CG2-CG 4.1Å; L535-W563 HydrophobicContact CB-CD2 4.07Å; L535-W563 HydrophobicContact CB-CG 4.48Å; L535-W563 HydrophobicContact CB-CH2 4.38Å; L535-W563 HydrophobicContact CB-CZ2 3.83Å; L535-W563 HydrophobicContact CD1-CD2 4Å; L535-W563 HydrophobicContact CD1-CE3 3.82Å; L535-W563 HydrophobicContact CD1-CH2 4.37Å; L535-W563 HydrophobicContact CD1-CZ3 4Å; L535-W563 HydrophobicContact CD2-CH2 3.91Å; L535-W563 HydrophobicContact CD2-CZ2 4.11Å; L535-W563 HydrophobicContact CD2-CZ3 4.26Å; L535-W563 HydrophobicContact CG-CH2 4.46Å; L535-W563 HydrophobicContact CG-CZ2 4.38Å; L535-W563 PolarHBondContact O-NE1 3.19Å; I544-W563 HydrophobicContact CD1-CH2 3.72Å; I544-W563 HydrophobicContact CD1-CZ3 4.16Å; I544-W563 HydrophobicContact CG2-CH2 4.2Å; I544-W563 HydrophobicContact CG2-CZ3 4.44Å; P559-W563 WeakPolarHBondContact O-CB 3.5Å; P559-W563 PolarHBondContact O-N 3.47Å; L560-W563 HydrophobicContact CD1-CE3 4.17Å; L560-W563 PolarHBondContact O-N 3.28Å; K561-W563 VanDerWaalsContact C-N 3.27Å; K561-W563 PolarHBondContact O-N 2.79Å; W563-E565 VanDerWaalsContact C-N 3.32Å; W563-E565 PolarHBondContact O-N 2.99Å; W563-K566 CarbonylContact O-C 3.59Å; W563-K566 PolarHBondContact O-N 3.24Å; W563-K566 VanDerWaalsContact O-N 3.08Å; W563-L567 HydrophobicContact CD2-CD2 4.38Å; W563-L567 HydrophobicContact CD2-CG 4.45Å; W563-L567 HydrophobicContact CE3-CD1 4.09Å; W563-L567 HydrophobicContact CE3-CG 4.4Å; W563-L567 HydrophobicContact CH2-CD1 3.9Å; W563-L567 HydrophobicContact CH2-CD2 4.12Å; W563-L567 HydrophobicContact CH2-CG 4.46Å; W563-L567 HydrophobicContact CZ2-CD1 4.41Å; W563-L567 HydrophobicContact CZ2-CD2 3.81Å; W563-L567 HydrophobicContact CZ3-CD1 3.73Å; W563-L567 HydrophobicContact CZ3-CG 4.42Å; W563-L567 WeakPolarHBondContact O-CG 3.45Å; W563-L567 PolarHBondContact O-N 3.41Å
564	L	87.1	Confident	77.5	Confident	10 Å²	10	49.7 Å²	49.7	5%	0.052	27%	0.274	C	S	.	.	H	α-helix	trans	-61.3	-36.2	176.2	-71.2	174.1	0	0	0	113.4	L546 L560 K561 K566 L567 V573 V576 L589 R590	L546-L564 HydrophobicContact CD1-CD2 4.37Å; L560-L564 HydrophobicContact CD1-CG 4.44Å; L560-L564 HydrophobicContact CG-CD1 4.18Å; L560-L564 WeakPolarHBondContact O-CB 3.44Å; L560-L564 VanDerWaalsContact O-CG 3.24Å; L560-L564 WeakPolarHBondContact O-CG 3.31Å; L560-L564 PolarHBondContact O-N 3.45Å; K561-L564 WeakPolarHBondContact O-CB 3.14Å; K561-L564 PolarHBondContact O-N 3.21Å; K561-L564 VanDerWaalsContact O-N 3.1Å; L564-K566 VanDerWaalsContact C-N 3.34Å; L564-L567 HydrophobicContact CD2-CD1 4Å; L564-V573 HydrophobicContact CD2-CG1 3.74Å; L564-V573 HydrophobicContact CD2-CG2 4.21Å; L564-V576 HydrophobicContact CD1-CB 4.34Å; L564-V576 HydrophobicContact CD1-CG1 4.46Å; L564-V576 HydrophobicContact CD1-CG2 3.88Å; L564-L589 HydrophobicContact CD1-CD2 3.97Å; L564-R590 HydrophobicContact CB-CG 4.4Å
565	E	83.6	Confident	76.6	Confident	106 Å²	106	49.7 Å²	49.7	50%	0.495	27%	0.27	S	S	.	.	H	α-helix	trans	-71.6	-27.7	173.9	-70.3	173.5	135.6	0	0	112.7	K561 W563	K561-E565 WeakPolarHBondContact CE-OE1 3.26Å; K561-E565 HydrophobicContact CG-CG 4.49Å; K561-E565 IonicContact NZ-OE1 3.63Å; K561-E565 PolarHBondContact NZ-OE1 3.36Å; K561-E565 WeakPolarHBondContact O-CG 3.31Å; K561-E565 PolarHBondContact O-N 3.28Å; W563-E565 VanDerWaalsContact C-N 3.32Å; W563-E565 PolarHBondContact O-N 2.99Å
566	K	82	Confident	76.6	Confident	182 Å²	182	47.4 Å²	47.4	79%	0.791	25%	0.254	S	S	*	.	H	α-helix	trans	-85.2	-16.5	178.8	-173.5	177.9	177.1	-174.9	0	113.4	Q562 W563 L564	Q562-K566 VanDerWaalsContact O-CB 3.24Å; Q562-K566 WeakPolarHBondContact O-CB 3.35Å; Q562-K566 PolarHBondContact O-N 3.18Å; Q562-K566 VanDerWaalsContact O-N 3.09Å; W563-K566 CarbonylContact O-C 3.59Å; W563-K566 PolarHBondContact O-N 3.24Å; W563-K566 VanDerWaalsContact O-N 3.08Å; L564-K566 VanDerWaalsContact C-N 3.34Å
567	L	75.4	Confident	76.6	Confident	29 Å²	29	41.9 Å²	41.9	15%	0.152	23%	0.225	C	C	.	.	S	Bend	trans	-62.4	134.5	171.3	-67	179.7	0	0	0	110	I541 I544 W563 L564 I571 V573	I541-L567 HydrophobicContact CG2-CD2 4.37Å; I544-L567 HydrophobicContact CG2-CD1 4.47Å; W563-L567 HydrophobicContact CD2-CD2 4.38Å; W563-L567 HydrophobicContact CD2-CG 4.45Å; W563-L567 HydrophobicContact CE3-CD1 4.09Å; W563-L567 HydrophobicContact CE3-CG 4.4Å; W563-L567 HydrophobicContact CH2-CD1 3.9Å; W563-L567 HydrophobicContact CH2-CD2 4.12Å; W563-L567 HydrophobicContact CH2-CG 4.46Å; W563-L567 HydrophobicContact CZ2-CD1 4.41Å; W563-L567 HydrophobicContact CZ2-CD2 3.81Å; W563-L567 HydrophobicContact CZ3-CD1 3.73Å; W563-L567 HydrophobicContact CZ3-CG 4.42Å; W563-L567 WeakPolarHBondContact O-CG 3.45Å; W563-L567 PolarHBondContact O-N 3.41Å; L564-L567 HydrophobicContact CD2-CD1 4Å; L567-I571 HydrophobicContact CB-CB 4.4Å; L567-I571 HydrophobicContact CB-CD1 4.18Å; L567-I571 HydrophobicContact CD1-CG2 4.13Å; L567-I571 HydrophobicContact CD2-CD1 3.79Å; L567-I571 HydrophobicContact CD2-CG2 4.49Å; L567-V573 HydrophobicContact CD1-CG2 3.52Å
568	S	60.3	Low	76.7	Confident	58 Å²	58	42 Å²	42	41%	0.406	23%	0.226	S	C	.	.			trans	-63.1	143.9	174	73.4	0	0	0	0	110.3	V570 I571	S568-V570 PolarHBondContact O-N 2.98Å; S568-I571 WeakPolarHBondContact O-CB 3.34Å; S568-I571 PolarHBondContact O-N 3.16Å
569	S	53.7	Low	76.7	Confident	80 Å²	80	44.6 Å²	44.6	56%	0.559	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.6	-23.8	-178.6	40.7	0	0	0	0	115.9
570	V	49.4	Very low	76.6	Confident	21 Å²	21	44.7 Å²	44.7	13%	0.127	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-15.5	178.6	-173.4	0	0	0	0	113.8	S568 V572 E898 K902	S568-V570 PolarHBondContact O-N 2.98Å; V570-V572 PolarHBondContact O-N 2.66Å; V570-E898 HydrophobicContact CB-CG 4.45Å; V570-E898 HydrophobicContact CG1-CB 4.27Å; V570-E898 HydrophobicContact CG1-CG 4.04Å; V570-E898 HydrophobicContact CG2-CG 4.11Å; V570-K902 HydrophobicContact CG1-CD 4Å; V570-K902 VanDerWaalsContact CG2-NZ 3.27Å
571	I	59.1	Low	76.4	Confident	29 Å²	29	46 Å²	46	15%	0.149	25%	0.248	C	C	.	.	S	Bend	trans	-79.6	108.9	176.6	-61	174.8	0	0	0	107.2	I541 V542 L567 S568 V573	I541-I571 HydrophobicContact CG2-CD1 4.15Å; I541-I571 HydrophobicContact CG2-CG2 4.09Å; I541-I571 WeakPolarHBondContact O-CD1 3.28Å; I541-I571 WeakPolarHBondContact O-CG1 3.29Å; V542-I571 WeakPolarHBondContact O-CA 3.47Å; L567-I571 HydrophobicContact CB-CB 4.4Å; L567-I571 HydrophobicContact CB-CD1 4.18Å; L567-I571 HydrophobicContact CD1-CG2 4.13Å; L567-I571 HydrophobicContact CD2-CD1 3.79Å; L567-I571 HydrophobicContact CD2-CG2 4.49Å; S568-I571 WeakPolarHBondContact O-CB 3.34Å; S568-I571 PolarHBondContact O-N 3.16Å; I571-V573 HydrophobicContact CG2-CG2 4.46Å; I571-V573 PolarHBondContact O-N 2.03Å; I571-V573 VanDerWaalsContact O-N 3.12Å
572	V	59.6	Low	76.2	Confident	38 Å²	38	54.1 Å²	54.1	23%	0.23	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	110.3	-173.8	-161.8	0	0	0	0	110	V542 I544 V570 P894	V542-V572 PolarHBondContact O-N 3.38Å; V542-V572 VanDerWaalsContact O-N 3.08Å; I544-V572 PolarHBondContact N-O 3.02Å; V570-V572 PolarHBondContact O-N 2.66Å; V572-P894 HydrophobicContact CB-CB 3.83Å; V572-P894 HydrophobicContact CG1-CB 3.41Å; V572-P894 VanDerWaalsContact CG1-CB 3.41Å; V572-P894 HydrophobicContact CG2-CB 4.34Å
573	V	71.8	Confident	75.9	Confident	23 Å²	23	54.2 Å²	54.2	14%	0.139	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	125.6	175.4	-169.6	0	0	0	0	109.9	I544 L564 L567 I571 V576	I544-V573 HydrophobicContact CG2-CB 4.46Å; I544-V573 HydrophobicContact CG2-CG1 4.24Å; I544-V573 HydrophobicContact CG2-CG2 3.93Å; I544-V573 WeakPolarHBondContact O-CA 3.05Å; L564-V573 HydrophobicContact CD2-CG1 3.74Å; L564-V573 HydrophobicContact CD2-CG2 4.21Å; L567-V573 HydrophobicContact CD1-CG2 3.52Å; I571-V573 HydrophobicContact CG2-CG2 4.46Å; I571-V573 PolarHBondContact O-N 2.03Å; I571-V573 VanDerWaalsContact O-N 3.12Å; V573-V576 HydrophobicContact CG1-CG2 4.45Å
574	G	62.2	Low	75.7	Confident	19 Å²	19	52.8 Å²	52.8	20%	0.196	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-69	145	166.6	0	0	0	0	0	111.3	I544	I544-G574 PolarHBondContact O-N 3.03Å
575	E	69.3	Low	75.7	Confident	37 Å²	37	58.7 Å²	58.7	17%	0.173	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-55.6	140.7	-174.6	-64.5	171.4	164.8	0	0	113.6	N70 Q72 R73 H547 T577	N70-E575 PolarHBondContact ND2-OE1 2.88Å; Q72-E575 PolarHBondContact NE2-OE1 3.28Å; Q72-E575 PolarHBondContact NE2-OE2 3.03Å; Q72-E575 PolarHBondContact OE1-OE2 3.13Å; R73-E575 IonicContact NH2-OE2 3.19Å; R73-E575 PolarHBondContact NH2-OE2 3.35Å; H547-E575 WeakPolarHBondContact CA-O 3.25Å; H547-E575 VanDerWaalsContact CB-O 3.26Å; H547-E575 WeakPolarHBondContact CB-O 3.27Å; E575-T577 HydrophobicContact CB-CG2 4.33Å
576	V	86.6	Confident	75.5	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.295	C	S	.	.			trans	-110.3	69.1	-173.8	-176.2	0	0	0	0	107.1	L546 W551 L564 V573 C578 D588 L589	L546-V576 HydrophobicContact CB-CG2 4Å; L546-V576 HydrophobicContact CD1-CG2 4.07Å; W551-V576 HydrophobicContact CD2-CG1 4.03Å; W551-V576 HydrophobicContact CG-CG1 3.87Å; L564-V576 HydrophobicContact CD1-CB 4.34Å; L564-V576 HydrophobicContact CD1-CG1 4.46Å; L564-V576 HydrophobicContact CD1-CG2 3.88Å; V573-V576 HydrophobicContact CG1-CG2 4.45Å; V576-C578 PolarHBondContact O-N 2.8Å; V576-D588 PolarHBondContact N-OD1 3.08Å; V576-L589 HydrophobicContact CB-CB 4.03Å; V576-L589 HydrophobicContact CG1-CB 3.84Å; V576-L589 HydrophobicContact CG1-CD2 3.77Å; V576-L589 HydrophobicContact CG1-CG 4.47Å; V576-L589 WeakPolarHBondContact O-CB 3.49Å; V576-L589 PolarHBondContact O-N 2.72Å
577	T	86.8	Confident	75.5	Confident	21 Å²	21	51.3 Å²	51.3	13%	0.129	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-76.1	124.1	-176.4	55.9	0	0	0	0	111.6	E575 K587	E575-T577 HydrophobicContact CB-CG2 4.33Å; T577-K587 CarbonylContact C-O 3.6Å; T577-K587 VanDerWaalsContact CA-O 3.31Å; T577-K587 WeakPolarHBondContact CA-O 3.35Å
578	C	89.9	Confident	76	Confident	3 Å²	3	50.9 Å²	50.9	2%	0.02	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	137.3	179.1	-58.8	0	0	0	0	112.1	C553 V576 A584 G586 K587 L592	C553-C578 HydrophobicContact CB-CB 3.74Å; C553-C578 WeakPolarHBondContact CB-SG 3.44Å; C553-C578 WeakPolarHBondContact SG-CB 3.43Å; C553-C578 CovalentContact SG-SG 2.02Å; C553-C578 PolarHBondContact SG-SG 2.86Å; V576-C578 PolarHBondContact O-N 2.8Å; C578-A584 HydrophobicContact CB-CB 4Å; C578-A584 WeakPolarHBondContact CB-O 3.37Å; C578-G586 PolarHBondContact O-N 2.99Å; C578-K587 PolarHBondContact N-O 2.77Å; C578-L592 WeakPolarHBondContact SG-CD1 3.11Å
579	N	90.7	Very high	77.3	Confident	73 Å²	73	48.1 Å²	48.1	39%	0.39	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	-24.1	178.1	178.8	89.6	0	0	0	112.2	P550 W551 F585	P550-N579 HydrophobicContact CB-CB 4.18Å; W551-N579 PolarHBondContact O-N 3.05Å; N579-F585 VanDerWaalsContact O-CD2 3.26Å; N579-F585 WeakPolarHBondContact O-CD2 3.42Å
580	T	85.6	Confident	78.8	Confident	54 Å²	54	47.8 Å²	47.8	33%	0.331	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	165.9	164.7	47.4	0	0	0	0	108.9	W551 D552 C553	W551-T580 PolarHBondContact O-N 3.37Å; W551-T580 VanDerWaalsContact O-N 3.15Å; D552-T580 WeakPolarHBondContact CA-O 3.37Å; D552-T580 WeakPolarHBondContact CA-OG1 3.41Å; D552-T580 WeakPolarHBondContact CB-OG1 3.34Å; D552-T580 VanDerWaalsContact OD1-C 3.24Å; D552-T580 WeakPolarHBondContact OD1-CB 3.2Å; D552-T580 PolarHBondContact OD1-OG1 3.03Å; C553-T580 PolarHBondContact N-O 2.81Å
581	P	86.1	Confident	80.4	Confident	29 Å²	29	49.4 Å²	49.4	19%	0.188	26%	0.255	C	S	.	.	S	Bend	cis	-69.7	172.9	-19.2	31.3	-36.5	0	0	0	112.3	Y583 A584 F585	P581-Y583 VanDerWaalsContact C-N 3.28Å; P581-Y583 HydrophobicContact CB-CD1 4.11Å; P581-Y583 HydrophobicContact CB-CE1 3.87Å; P581-Y583 HydrophobicContact CG-CD1 3.76Å; P581-Y583 HydrophobicContact CG-CD2 4.42Å; P581-Y583 HydrophobicContact CG-CE1 3.2Å; P581-Y583 HydrophobicContact CG-CE2 3.93Å; P581-Y583 HydrophobicContact CG-CG 4.33Å; P581-Y583 PolarHBondContact O-N 3.11Å; P581-Y583 VanDerWaalsContact O-N 3.15Å; P581-A584 PolarHBondContact O-N 3.19Å; P581-F585 PolarHBondContact O-N 3.26Å
582	E	83.9	Confident	81.5	Confident	183 Å²	183	48.6 Å²	48.6	86%	0.855	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-56.4	-34.8	-171.7	-65	-173.6	161.9	0	0	114.3	A584 F585	E582-A584 PolarHBondContact O-N 3.2Å; E582-F585 WeakPolarHBondContact O-CB 3.36Å; E582-F585 PolarHBondContact O-N 3.41Å
583	Y	83.1	Confident	82.5	Confident	113 Å²	113	52.7 Å²	52.7	44%	0.443	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-67.1	-20.8	178.1	66.5	-106.7	0	0	0	113.9	P581 K587 V596	P581-Y583 VanDerWaalsContact C-N 3.28Å; P581-Y583 HydrophobicContact CB-CD1 4.11Å; P581-Y583 HydrophobicContact CB-CE1 3.87Å; P581-Y583 HydrophobicContact CG-CD1 3.76Å; P581-Y583 HydrophobicContact CG-CD2 4.42Å; P581-Y583 HydrophobicContact CG-CE1 3.2Å; P581-Y583 HydrophobicContact CG-CE2 3.93Å; P581-Y583 HydrophobicContact CG-CG 4.33Å; P581-Y583 PolarHBondContact O-N 3.11Å; P581-Y583 VanDerWaalsContact O-N 3.15Å; Y583-K587 PolarHBondContact O-NZ 3.23Å; Y583-V596 HydrophobicContact CD2-CG1 4.42Å; Y583-V596 HydrophobicContact CE2-CG1 4.41Å; Y583-V596 WeakPolarHBondContact CE2-O 3.48Å
584	A	84.4	Confident	83.1	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-99.3	-11.6	178.4	0	0	0	0	0	112.8	C553 C578 P581 E582 G586 K587 L592	C553-A584 HydrophobicContact CB-CB 4.05Å; C578-A584 HydrophobicContact CB-CB 4Å; C578-A584 WeakPolarHBondContact CB-O 3.37Å; P581-A584 PolarHBondContact O-N 3.19Å; E582-A584 PolarHBondContact O-N 3.2Å; A584-G586 PolarHBondContact O-N 2.86Å; A584-K587 WeakPolarHBondContact O-CB 3.39Å; A584-K587 PolarHBondContact O-N 3.23Å; A584-K587 VanDerWaalsContact O-N 3.15Å; A584-L592 HydrophobicContact CB-CD1 3.96Å
585	F	86.3	Confident	83.8	Confident	135 Å²	135	57.7 Å²	57.7	59%	0.592	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	128.4	-170.3	-173.1	-86.9	0	0	0	113.2	N579 P581 E582 K587	N579-F585 VanDerWaalsContact O-CD2 3.26Å; N579-F585 WeakPolarHBondContact O-CD2 3.42Å; P581-F585 PolarHBondContact O-N 3.26Å; E582-F585 WeakPolarHBondContact O-CB 3.36Å; E582-F585 PolarHBondContact O-N 3.41Å; F585-K587 VanDerWaalsContact C-N 3.28Å; F585-K587 PolarHBondContact O-N 3.29Å
586	G	80.3	Confident	84.2	Confident	31 Å²	31	59.1 Å²	59.1	32%	0.32	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.3	-14.8	176.9	0	0	0	0	0	115.9	C578 A584	C578-G586 PolarHBondContact O-N 2.99Å; A584-G586 PolarHBondContact O-N 2.86Å
587	K	82	Confident	83.9	Confident	102 Å²	102	59.1 Å²	59.1	44%	0.443	30%	0.299	S	S	.	.			trans	-79.2	149.2	-178.1	-60.7	169	-178.6	167.7	0	111.5	T577 C578 Y583 A584 F585 L592	T577-K587 CarbonylContact C-O 3.6Å; T577-K587 VanDerWaalsContact CA-O 3.31Å; T577-K587 WeakPolarHBondContact CA-O 3.35Å; C578-K587 PolarHBondContact N-O 2.77Å; Y583-K587 PolarHBondContact O-NZ 3.23Å; A584-K587 WeakPolarHBondContact O-CB 3.39Å; A584-K587 PolarHBondContact O-N 3.23Å; A584-K587 VanDerWaalsContact O-N 3.15Å; F585-K587 VanDerWaalsContact C-N 3.28Å; F585-K587 PolarHBondContact O-N 3.29Å; K587-L592 HydrophobicContact CB-CD1 4.42Å; K587-L592 HydrophobicContact CB-CD2 4.24Å; K587-L592 HydrophobicContact CB-CG 4.2Å; K587-L592 HydrophobicContact CD-CD2 3.62Å; K587-L592 HydrophobicContact CD-CG 4.49Å
588	D	85.9	Confident	83.7	Confident	19 Å²	19	58.6 Å²	58.6	10%	0.102	30%	0.296	C	S	.	.	B	Isolated β-bridge	trans	-74.8	137.3	172.2	-171.7	51.8	0	0	0	110.6	V576 R590 S591	V576-D588 PolarHBondContact N-OD1 3.08Å; D588-R590 PolarHBondContact O-N 3.33Å; D588-R590 IonicContact OD1-NH2 2.69Å; D588-R590 IonicContact OD2-CZ 2.75Å; D588-R590 VanDerWaalsContact OD2-CZ 3.23Å; D588-R590 IonicContact OD2-NE 3.44Å; D588-R590 PolarHBondContact OD2-NE 3.19Å; D588-R590 IonicContact OD2-NH2 3.27Å; D588-R590 PolarHBondContact OD2-NH2 3.42Å; D588-S591 PolarHBondContact O-N 3.23Å; D588-S591 VanDerWaalsContact O-N 3.16Å; D588-S591 PolarHBondContact O-OG 2.88Å
589	L	87.4	Confident	82.8	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-27.1	-176.5	176	59.7	0	0	0	113.7	I557 L560 K561 L564 V576 I597	I557-L589 HydrophobicContact CB-CD1 4.34Å; I557-L589 HydrophobicContact CD1-CD2 4.48Å; I557-L589 HydrophobicContact CG1-CD1 3.84Å; I557-L589 HydrophobicContact CG1-CD2 3.65Å; I557-L589 HydrophobicContact CG1-CG 4.42Å; I557-L589 HydrophobicContact CG2-CD1 3.53Å; L560-L589 HydrophobicContact CB-CD2 4.48Å; L560-L589 HydrophobicContact CD2-CD2 4.05Å; L560-L589 HydrophobicContact CG-CD2 4.11Å; K561-L589 HydrophobicContact CB-CD1 4.11Å; K561-L589 HydrophobicContact CB-CD2 4.27Å; K561-L589 HydrophobicContact CB-CG 4.02Å; K561-L589 WeakPolarHBondContact CD-O 3.49Å; K561-L589 HydrophobicContact CG-CD1 4.44Å; K561-L589 HydrophobicContact CG-CG 4.23Å; L564-L589 HydrophobicContact CD1-CD2 3.97Å; V576-L589 HydrophobicContact CB-CB 4.03Å; V576-L589 HydrophobicContact CG1-CB 3.84Å; V576-L589 HydrophobicContact CG1-CD2 3.77Å; V576-L589 HydrophobicContact CG1-CG 4.47Å; V576-L589 WeakPolarHBondContact O-CB 3.49Å; V576-L589 PolarHBondContact O-N 2.72Å; L589-I597 HydrophobicContact CD1-CD1 4.11Å
590	R	84.1	Confident	81.5	Confident	74 Å²	74	65.8 Å²	65.8	28%	0.279	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-31.7	-178.4	-65.2	170	-63.1	-169	-1.5	113.2	L564 D588	L564-R590 HydrophobicContact CB-CG 4.4Å; D588-R590 PolarHBondContact O-N 3.33Å; D588-R590 IonicContact OD1-NH2 2.69Å; D588-R590 IonicContact OD2-CZ 2.75Å; D588-R590 VanDerWaalsContact OD2-CZ 3.23Å; D588-R590 IonicContact OD2-NE 3.44Å; D588-R590 PolarHBondContact OD2-NE 3.19Å; D588-R590 IonicContact OD2-NH2 3.27Å; D588-R590 PolarHBondContact OD2-NH2 3.42Å
591	S	82.8	Confident	80.2	Confident	55 Å²	55	67.7 Å²	67.7	39%	0.385	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-6.9	-179.5	65.8	0	0	0	0	113.5	D588	D588-S591 PolarHBondContact O-N 3.23Å; D588-S591 VanDerWaalsContact O-N 3.16Å; D588-S591 PolarHBondContact O-OG 2.88Å
592	L	83.2	Confident	78.4	Confident	11 Å²	11	71.8 Å²	71.8	6%	0.058	36%	0.356	C	S	.	.	S	Bend	trans	-79	123.7	170.4	-75.5	173.6	0	0	0	111.1	C553 K561 C578 A584 K587 I597	C553-L592 HydrophobicContact CB-CD1 4.21Å; K561-L592 PolarHBondContact NZ-O 3.48Å; C578-L592 WeakPolarHBondContact SG-CD1 3.11Å; A584-L592 HydrophobicContact CB-CD1 3.96Å; K587-L592 HydrophobicContact CB-CD1 4.42Å; K587-L592 HydrophobicContact CB-CD2 4.24Å; K587-L592 HydrophobicContact CB-CG 4.2Å; K587-L592 HydrophobicContact CD-CD2 3.62Å; K587-L592 HydrophobicContact CD-CG 4.49Å; L592-I597 HydrophobicContact CB-CD1 3.8Å; L592-I597 HydrophobicContact CB-CG1 3.95Å; L592-I597 HydrophobicContact CD1-CG1 4.43Å
593	E	81.4	Confident	76.7	Confident	124 Å²	124	72.5 Å²	72.5	58%	0.579	35%	0.352	S	S	*	.			trans	-64.1	144.8	173.1	-66	-174.1	159.5	0	0	112.2	E595 V596 I597	E593-E595 PolarHBondContact O-N 3.39Å; E593-V596 HydrophobicContact CB-CB 4.49Å; E593-V596 HydrophobicContact CB-CG2 4.11Å; E593-V596 PolarHBondContact O-N 2.96Å; E593-I597 WeakPolarHBondContact O-CG1 3.46Å; E593-I597 PolarHBondContact O-N 3.1Å; E593-I597 VanDerWaalsContact O-N 3.12Å
594	V	82.9	Confident	74.8	Confident	44 Å²	44	72.1 Å²	72.1	27%	0.267	37%	0.366	S	S	.	.	H	α-helix	trans	-61.2	-33.3	-179.9	-174.6	0	0	0	0	111.3	I558 K561 V596 I597 C598 L601	I558-V594 HydrophobicContact CD1-CG1 3.7Å; I558-V594 HydrophobicContact CG1-CG1 4.17Å; I558-V594 HydrophobicContact CG2-CG1 4.3Å; K561-V594 HydrophobicContact CD-CG2 4.41Å; V594-V596 VanDerWaalsContact C-N 3.3Å; V594-V596 PolarHBondContact O-N 3.48Å; V594-I597 PolarHBondContact O-N 2.73Å; V594-C598 PolarHBondContact O-N 3.39Å; V594-L601 HydrophobicContact CG1-CD1 3.98Å
595	E	77.3	Confident	72.8	Confident	103 Å²	103	76.9 Å²	76.9	48%	0.481	40%	0.399	S	S	.	.	H	α-helix	trans	-68.3	-27.1	178.2	-50.5	-161.1	134.5	0	0	113.5	E593 K602	E593-E595 PolarHBondContact O-N 3.39Å; E595-K602 VanDerWaalsContact CD-NZ 3.28Å; E595-K602 WeakPolarHBondContact OE1-CE 3.26Å; E595-K602 IonicContact OE1-NZ 3.28Å; E595-K602 WeakPolarHBondContact OE2-CE 3.5Å; E595-K602 IonicContact OE2-NZ 2.79Å; E595-K602 PolarHBondContact OE2-NZ 3.45Å
596	V	77.4	Confident	70.5	Confident	67 Å²	67	72.8 Å²	72.8	41%	0.406	40%	0.395	S	S	.	.	H	α-helix	trans	-84.1	-34.2	177.1	177.1	0	0	0	0	110.8	Y583 E593 V594	Y583-V596 HydrophobicContact CD2-CG1 4.42Å; Y583-V596 HydrophobicContact CE2-CG1 4.41Å; Y583-V596 WeakPolarHBondContact CE2-O 3.48Å; E593-V596 HydrophobicContact CB-CB 4.49Å; E593-V596 HydrophobicContact CB-CG2 4.11Å; E593-V596 PolarHBondContact O-N 2.96Å; V594-V596 VanDerWaalsContact C-N 3.3Å; V594-V596 PolarHBondContact O-N 3.48Å
597	I	81.1	Confident	68.8	Low	1 Å²	1	77.3 Å²	77.3	1%	0.005	42%	0.419	C	S	.	.	H	α-helix	trans	-69.9	-39	174.8	-66.4	168	0	0	0	111.6	S554 C555 I557 I558 K561 L589 L592 E593 V594	S554-I597 WeakPolarHBondContact O-CG2 3.47Å; C555-I597 PolarHBondContact N-O 3Å; I557-I597 HydrophobicContact CG2-CD1 4.38Å; I557-I597 HydrophobicContact CG2-CG2 3.74Å; I558-I597 HydrophobicContact CD1-CG2 4.05Å; I558-I597 HydrophobicContact CG1-CB 4.46Å; I558-I597 HydrophobicContact CG1-CG2 3.68Å; K561-I597 HydrophobicContact CD-CD1 3.96Å; L589-I597 HydrophobicContact CD1-CD1 4.11Å; L592-I597 HydrophobicContact CB-CD1 3.8Å; L592-I597 HydrophobicContact CB-CG1 3.95Å; L592-I597 HydrophobicContact CD1-CG1 4.43Å; E593-I597 WeakPolarHBondContact O-CG1 3.46Å; E593-I597 PolarHBondContact O-N 3.1Å; E593-I597 VanDerWaalsContact O-N 3.12Å; V594-I597 PolarHBondContact O-N 2.73Å
598	C	82.7	Confident	66.5	Low	10 Å²	10	77.9 Å²	77.9	7%	0.068	44%	0.436	C	S	.	.			trans	-144.1	86.5	-176.7	-160.5	0	0	0	0	113	C555 I558 V594 E600 L601	C555-C598 HydrophobicContact CB-CB 3.8Å; C555-C598 WeakPolarHBondContact CB-SG 3.37Å; C555-C598 VanDerWaalsContact SG-CA 3.5Å; C555-C598 WeakPolarHBondContact SG-CB 3.45Å; C555-C598 CovalentContact SG-SG 2.04Å; C555-C598 PolarHBondContact SG-SG 2.96Å; I558-C598 HydrophobicContact CD1-CB 3.41Å; I558-C598 VanDerWaalsContact CD1-CB 3.41Å; V594-C598 PolarHBondContact O-N 3.39Å; C598-E600 PolarHBondContact O-N 3.32Å; C598-L601 HydrophobicContact CB-CD1 4.13Å; C598-L601 HydrophobicContact CB-CG 4.38Å; C598-L601 PolarHBondContact O-N 2.95Å
599	P	69.6	Low	64.4	Low	75 Å²	75	83.1 Å²	83.1	49%	0.487	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-65.2	-20.3	-179.1	25.1	-34.4	0	0	0	113.8	L601 K602	P599-L601 PolarHBondContact O-N 3.4Å; P599-K602 PolarHBondContact O-N 2.87Å
600	E	64.4	Low	62.1	Low	152 Å²	152	87.8 Å²	87.8	71%	0.71	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-65.2	-23.4	178.4	-63	-160.4	166.5	0	0	113.4	C598 K602 Y603	C598-E600 PolarHBondContact O-N 3.32Å; E600-K602 PolarHBondContact O-N 2.97Å; E600-K602 VanDerWaalsContact O-N 3.17Å; E600-Y603 PolarHBondContact O-N 3Å
601	L	58	Low	59.8	Low	94 Å²	94	92.4 Å²	92.4	49%	0.492	54%	0.539	S	S	.	.	G	3₁₀ helix	trans	-61	-24.8	174.9	-73.1	172.3	0	0	0	112.9	I558 V594 C598 P599 Y603	I558-L601 HydrophobicContact CD1-CD1 3.8Å; V594-L601 HydrophobicContact CG1-CD1 3.98Å; C598-L601 HydrophobicContact CB-CD1 4.13Å; C598-L601 HydrophobicContact CB-CG 4.38Å; C598-L601 PolarHBondContact O-N 2.95Å; P599-L601 PolarHBondContact O-N 3.4Å; L601-Y603 PolarHBondContact O-N 2.79Å
602	K	48.3	Very low	58	Low	114 Å²	114	95.5 Å²	95.5	50%	0.496	56%	0.558	S	S	.	*	G	3₁₀ helix	trans	-70.6	-16.1	173.8	-72	-174.2	170.7	174.3	0	114.1	E595 P599 E600	E595-K602 VanDerWaalsContact CD-NZ 3.28Å; E595-K602 WeakPolarHBondContact OE1-CE 3.26Å; E595-K602 IonicContact OE1-NZ 3.28Å; E595-K602 WeakPolarHBondContact OE2-CE 3.5Å; E595-K602 IonicContact OE2-NZ 2.79Å; E595-K602 PolarHBondContact OE2-NZ 3.45Å; P599-K602 PolarHBondContact O-N 2.87Å; E600-K602 PolarHBondContact O-N 2.97Å; E600-K602 VanDerWaalsContact O-N 3.17Å
603	Y	47.5	Very low	55.6	Low	198 Å²	198	99.1 Å²	99.1	78%	0.776	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	-13.4	-179.3	-67.2	-81.7	0	0	0	113.5	E600 L601 S605	E600-Y603 PolarHBondContact O-N 3Å; L601-Y603 PolarHBondContact O-N 2.79Å; Y603-S605 VanDerWaalsContact C-N 3.27Å; Y603-S605 PolarHBondContact O-N 3.35Å
604	S	44.4	Very low	53.2	Low	105 Å²	105	96.2 Å²	96.2	73%	0.734	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	-17.8	176.2	-165.1	0	0	0	0	113.7
605	S	41.9	Very low	50.8	Low	100 Å²	100	101.7 Å²	101.7	70%	0.699	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	13.7	178.7	52.4	0	0	0	0	114.6	Y603	Y603-S605 VanDerWaalsContact C-N 3.27Å; Y603-S605 PolarHBondContact O-N 3.35Å
606	G	37.7	Very low	48.5	Very low	49 Å²	49	103.5 Å²	103.5	51%	0.505	64%	0.641	S	S	.	*	S	Bend	trans	-82	136.7	170.5	0	0	0	0	0	111.9	S608	G606-S608 PolarHBondContact O-N 2.95Å
607	P	44.3	Very low	46.3	Very low	127 Å²	127	106.3 Å²	106.3	83%	0.825	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-69.5	128.6	176.8	28.5	-33.8	0	0	0	111.1
608	S	34.3	Very low	44	Very low	114 Å²	114	111.8 Å²	111.8	80%	0.797	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-56.6	128.9	179.2	-53	0	0	0	0	111.9	G606 A610	G606-S608 PolarHBondContact O-N 2.95Å; S608-A610 PolarHBondContact O-N 2.99Å
609	P	42	Very low	41.5	Very low	128 Å²	128	118 Å²	118	83%	0.831	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-70.3	116.6	177.4	28	-33.4	0	0	0	110.5
610	A	39.8	Very low	39.5	Very low	99 Å²	99	117.2 Å²	117.2	82%	0.818	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-79.5	124.8	177.2	0	0	0	0	0	111.5	S608	S608-A610 PolarHBondContact O-N 2.99Å
611	L	35.4	Very low	38.1	Very low	170 Å²	170	115.4 Å²	115.4	89%	0.89	74%	0.735	S	S	*	*			trans	-134.5	155.5	162	-79.1	175.7	0	0	0	110
612	P	45	Very low	36.8	Very low	121 Å²	121	116 Å²	116	79%	0.786	75%	0.747	S	S	*	*			trans	-124	164.8	-147	40.7	-27.8	0	0	0	116.1
613	G	32.4	Very low	35.9	Very low	86 Å²	86	119.4 Å²	119.4	89%	0.887	77%	0.765	S	S	*	*			trans	88.4	143.7	170.6	0	0	0	0	0	113.7
614	G	31.5	Very low	35.3	Very low	64 Å²	64	117.9 Å²	117.9	66%	0.66	77%	0.769	S	S	*	*			cis	-174.4	171.5	-4.7	0	0	0	0	0	110.6
615	D	31.5	Very low	34.6	Very low	159 Å²	159	116.2 Å²	116.2	85%	0.85	77%	0.769	S	S	*	*			trans	21.4	136.4	153.5	-38.3	-29.6	0	0	0	118.8
616	D	28.4	Very low	34	Very low	140 Å²	140	120.6 Å²	120.6	75%	0.749	78%	0.778	S	S	*	*			cis	-170.6	173.4	29.7	-151	-6.8	0	0	0	114.2
617	L	32.5	Very low	33.6	Very low	126 Å²	126	123.5 Å²	123.5	66%	0.66	79%	0.791	S	S	*	*			trans	56.1	103.4	148.6	-113.4	74	0	0	0	123.2
618	T	31.4	Very low	33	Very low	117 Å²	117	122 Å²	122	72%	0.718	78%	0.783	S	S	*	*				62.8	158.7	124.7	62.1	0	0	0	0	121.6
619	T	30.3	Very low	33.4	Very low	139 Å²	139	128.6 Å²	128.6	85%	0.853	79%	0.791	S	S	*	*			cis	-155.9	161.3	10.6	-16	0	0	0	0	111.8
620	G	28	Very low	33.2	Very low	59 Å²	59	133.3 Å²	133.3	61%	0.608	79%	0.792	S	S	*	*			trans	98.2	103.1	158.2	0	0	0	0	0	115
621	S	34.4	Very low	33.3	Very low	114 Å²	114	132 Å²	132	80%	0.797	79%	0.787	S	S	*	*				76.5	132.2	68.1	71.9	0	0	0	0	114.1
622	S	32.2	Very low	34	Very low	108 Å²	108	129 Å²	129	76%	0.755	79%	0.787	S	S	*	*			cis	-169.6	149.2	-9.9	-86.1	0	0	0	0	107.9
623	E	29.6	Very low	34.7	Very low	185 Å²	185	127.4 Å²	127.4	86%	0.864	78%	0.775	S	S	*	*				177.5	173.4	127.1	-99.5	-176.8	169	0	0	112.9
624	L	35.2	Very low	36.1	Very low	166 Å²	166	127.2 Å²	127.2	87%	0.869	76%	0.758	S	S	*	*			trans	-42.8	152.5	-173.2	-72.3	53.5	0	0	0	115.3
625	G	29	Very low	37.6	Very low	70 Å²	70	130.4 Å²	130.4	72%	0.722	76%	0.759	S	S	*	*			cis	149	125.5	0.6	0	0	0	0	0	112.3
626	E	29.3	Very low	39.4	Very low	191 Å²	191	126.2 Å²	126.2	89%	0.893	74%	0.743	S	S	*	*			trans	50	108.9	147.6	-157.5	144.2	-133.1	0	0	117.9
627	S	29.8	Very low	41.7	Very low	111 Å²	111	123.2 Å²	123.2	78%	0.776	73%	0.729	S	S	*	*				176.8	-176.7	68.4	54.9	0	0	0	0	113.3
628	S	31.8	Very low	43.7	Very low	95 Å²	95	121.4 Å²	121.4	66%	0.664	72%	0.72	S	S	*	*			trans	83.2	84	160.2	-146.9	0	0	0	0	117.7	R630	S628-R630 PolarHBondContact O-N 3.11Å
629	R	42.2	Very low	46	Very low	252 Å²	252	120.5 Å²	120.5	95%	0.951	71%	0.709	S	S	*	*			trans	-57.2	122.6	153.2	-71.3	176.4	173.2	173.5	-3.1	109.5
630	R	37.2	Very low	48.1	Very low	228 Å²	228	118.9 Å²	118.9	86%	0.86	70%	0.695	S	S	*	*			trans	-125.5	126	152.8	-74.6	-172.5	172.3	-176.2	-2.2	108.4	S628	S628-R630 PolarHBondContact O-N 3.11Å
631	G	43.3	Very low	50.3	Low	70 Å²	70	118.6 Å²	118.6	72%	0.722	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-65.1	147.2	178.1	0	0	0	0	0	111.1	V633	G631-V633 PolarHBondContact O-N 2.85Å
632	A	48.4	Very low	52.5	Low	107 Å²	107	118.2 Å²	118.2	88%	0.884	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-61.4	120.9	174.8	0	0	0	0	0	110
633	V	60.2	Low	55	Low	89 Å²	89	117.5 Å²	117.5	54%	0.539	66%	0.66	S	S	.	*	P	Polyproline II helix	trans	-82.4	127.4	173.8	176.8	0	0	0	0	107.9	G631 V637	G631-V633 PolarHBondContact O-N 2.85Å; V633-V637 HydrophobicContact CG1-CB 3.84Å; V633-V637 HydrophobicContact CG1-CG1 3.97Å
634	P	61.9	Low	57.6	Low	81 Å²	81	114.2 Å²	114.2	53%	0.526	65%	0.646	S	S	.	*	P	Polyproline II helix	trans	-63.2	143	-177.9	24.9	-33.8	0	0	0	111.7	S636 V637	P634-S636 PolarHBondContact O-N 2.91Å; P634-V637 HydrophobicContact CG-CG2 4.16Å; P634-V637 PolarHBondContact O-N 3.18Å
635	L	63.8	Low	60.1	Low	131 Å²	131	111.5 Å²	111.5	69%	0.686	63%	0.633	S	S	*	*	H	α-helix	trans	-53.4	-32.7	-172.1	-119.2	80	0	0	0	113.7	V637 L638 I639	L635-V637 VanDerWaalsContact C-N 3.3Å; L635-V637 PolarHBondContact O-N 3Å; L635-L638 WeakPolarHBondContact O-CB 3.31Å; L635-L638 PolarHBondContact O-N 3.3Å; L635-L638 VanDerWaalsContact O-N 3.11Å; L635-I639 WeakPolarHBondContact O-CG1 3.16Å; L635-I639 PolarHBondContact O-N 3.22Å
636	S	69.6	Low	62.9	Low	71 Å²	71	115.1 Å²	115.1	50%	0.497	63%	0.628	S	S	.	*	H	α-helix	trans	-56.4	-39.1	177.5	50.8	0	0	0	0	113.3	P634 L640	P634-S636 PolarHBondContact O-N 2.91Å; S636-L640 WeakPolarHBondContact O-CB 3.27Å; S636-L640 VanDerWaalsContact O-CG 3.27Å; S636-L640 WeakPolarHBondContact O-CG 3.28Å; S636-L640 PolarHBondContact O-N 3.28Å
637	V	74.9	Confident	65.6	Low	77 Å²	77	109.8 Å²	109.8	47%	0.467	61%	0.605	S	S	.	*	H	α-helix	trans	-73.3	-33.4	178.1	179.2	0	0	0	0	111.2	V633 P634 L635 S641	V633-V637 HydrophobicContact CG1-CB 3.84Å; V633-V637 HydrophobicContact CG1-CG1 3.97Å; P634-V637 HydrophobicContact CG-CG2 4.16Å; P634-V637 PolarHBondContact O-N 3.18Å; L635-V637 VanDerWaalsContact C-N 3.3Å; L635-V637 PolarHBondContact O-N 3Å; V637-S641 WeakPolarHBondContact O-CB 3.49Å; V637-S641 PolarHBondContact O-N 3.26Å; V637-S641 PolarHBondContact O-OG 3.32Å
638	L	74.8	Confident	68.1	Low	88 Å²	88	107.2 Å²	107.2	46%	0.461	59%	0.587	S	S	.	*	H	α-helix	trans	-68.2	-43.6	173.9	-111.5	167	0	0	0	111.7	L635 S641 L642	L635-L638 WeakPolarHBondContact O-CB 3.31Å; L635-L638 PolarHBondContact O-N 3.3Å; L635-L638 VanDerWaalsContact O-N 3.11Å; L638-S641 WeakPolarHBondContact CA-OG 3.39Å; L638-S641 PolarHBondContact O-N 3.44Å; L638-S641 PolarHBondContact O-OG 3.06Å; L638-S641 VanDerWaalsContact O-OG 3.1Å; L638-L642 HydrophobicContact CD2-CD1 4.41Å; L638-L642 WeakPolarHBondContact O-CB 3.5Å; L638-L642 WeakPolarHBondContact O-CG 3.36Å; L638-L642 PolarHBondContact O-N 3.1Å
639	I	80.9	Confident	70.8	Confident	98 Å²	98	105.1 Å²	105.1	50%	0.503	58%	0.576	S	S	.	*	H	α-helix	trans	-63.8	-46.9	175.6	-66.9	163.5	0	0	0	110.6	L635 S641 L642 L643	L635-I639 WeakPolarHBondContact O-CG1 3.16Å; L635-I639 PolarHBondContact O-N 3.22Å; I639-S641 PolarHBondContact O-N 3.02Å; I639-L642 PolarHBondContact O-N 3.1Å; I639-L643 VanDerWaalsContact O-CB 3.25Å; I639-L643 WeakPolarHBondContact O-CB 3.44Å; I639-L643 PolarHBondContact O-N 3.37Å
640	L	73.3	Confident	73.1	Confident	106 Å²	106	96.4 Å²	96.4	56%	0.555	55%	0.551	S	S	*	*	H	α-helix	trans	-62.2	-42.2	178.1	-76.3	166.7	0	0	0	112.5	S636 L643 I644	S636-L640 WeakPolarHBondContact O-CB 3.27Å; S636-L640 VanDerWaalsContact O-CG 3.27Å; S636-L640 WeakPolarHBondContact O-CG 3.28Å; S636-L640 PolarHBondContact O-N 3.28Å; L640-L643 PolarHBondContact O-N 2.65Å; L640-I644 WeakPolarHBondContact O-CB 3.4Å; L640-I644 VanDerWaalsContact O-CG1 3.26Å; L640-I644 WeakPolarHBondContact O-CG1 3.21Å; L640-I644 PolarHBondContact O-N 2.98Å
641	S	75.2	Confident	75.4	Confident	53 Å²	53	92.8 Å²	92.8	37%	0.371	54%	0.541	S	S	.	.	H	α-helix	trans	-70.2	-37	178.2	51.8	0	0	0	0	113	V637 L638 I639 L645	V637-S641 WeakPolarHBondContact O-CB 3.49Å; V637-S641 PolarHBondContact O-N 3.26Å; V637-S641 PolarHBondContact O-OG 3.32Å; L638-S641 WeakPolarHBondContact CA-OG 3.39Å; L638-S641 PolarHBondContact O-N 3.44Å; L638-S641 PolarHBondContact O-OG 3.06Å; L638-S641 VanDerWaalsContact O-OG 3.1Å; I639-S641 PolarHBondContact O-N 3.02Å; S641-L645 WeakPolarHBondContact O-CB 3.12Å; S641-L645 PolarHBondContact O-N 2.88Å
642	L	81.2	Confident	77.5	Confident	105 Å²	105	93.8 Å²	93.8	55%	0.55	53%	0.533	S	S	.	.	H	α-helix	trans	-64.2	-39.8	170.6	-77.9	167.2	0	0	0	112.4	L638 I639 L645 F646	L638-L642 HydrophobicContact CD2-CD1 4.41Å; L638-L642 WeakPolarHBondContact O-CB 3.5Å; L638-L642 WeakPolarHBondContact O-CG 3.36Å; L638-L642 PolarHBondContact O-N 3.1Å; I639-L642 PolarHBondContact O-N 3.1Å; L642-L645 WeakPolarHBondContact O-CB 3.41Å; L642-L645 PolarHBondContact O-N 2.03Å; L642-F646 WeakPolarHBondContact O-CB 3.47Å; L642-F646 PolarHBondContact O-N 3.43Å
643	L	84	Confident	79.2	Confident	94 Å²	94	92.9 Å²	92.9	49%	0.492	52%	0.517	S	S	.	.	H	α-helix	trans	-69.9	-38.3	179.6	-168.2	142.4	0	0	0	111.7	I639 L640 F646 I647	I639-L643 VanDerWaalsContact O-CB 3.25Å; I639-L643 WeakPolarHBondContact O-CB 3.44Å; I639-L643 PolarHBondContact O-N 3.37Å; L640-L643 PolarHBondContact O-N 2.65Å; L643-F646 PolarHBondContact O-N 3.21Å; L643-I647 HydrophobicContact CD2-CD1 3.61Å; L643-I647 HydrophobicContact CG-CD1 4.49Å; L643-I647 WeakPolarHBondContact O-CB 3.22Å; L643-I647 VanDerWaalsContact O-CG1 3.31Å; L643-I647 WeakPolarHBondContact O-CG1 3.44Å; L643-I647 PolarHBondContact O-N 3.14Å
644	I	84.6	Confident	80.2	Confident	115 Å²	115	91.1 Å²	91.1	59%	0.59	51%	0.512	S	S	*	.	H	α-helix	trans	-63.3	-44	170	-69.9	165.2	0	0	0	111	L640 I647 S648	L640-I644 WeakPolarHBondContact O-CB 3.4Å; L640-I644 VanDerWaalsContact O-CG1 3.26Å; L640-I644 WeakPolarHBondContact O-CG1 3.21Å; L640-I644 PolarHBondContact O-N 2.98Å; I644-I647 PolarHBondContact O-N 2.83Å; I644-S648 WeakPolarHBondContact O-CB 3Å; I644-S648 PolarHBondContact O-N 2.82Å
645	L	86.7	Confident	81.4	Confident	110 Å²	110	89.2 Å²	89.2	58%	0.576	51%	0.507	S	S	*	.	H	α-helix	trans	-59.4	-47.4	175.2	-87.2	166.4	0	0	0	111.6	S641 L642 S648 A649	S641-L645 WeakPolarHBondContact O-CB 3.12Å; S641-L645 PolarHBondContact O-N 2.88Å; L642-L645 WeakPolarHBondContact O-CB 3.41Å; L642-L645 PolarHBondContact O-N 2.03Å; L645-S648 PolarHBondContact O-N 3.45Å; L645-S648 PolarHBondContact O-OG 2.77Å; L645-A649 PolarHBondContact O-N 3.35Å
646	F	88.6	Confident	82.3	Confident	145 Å²	145	88 Å²	88	64%	0.636	50%	0.5	S	S	*	.	H	α-helix	trans	-59.5	-48.8	177.9	-175.8	-98.8	0	0	0	112	L642 L643 S648 A649 V650	L642-F646 WeakPolarHBondContact O-CB 3.47Å; L642-F646 PolarHBondContact O-N 3.43Å; L643-F646 PolarHBondContact O-N 3.21Å; F646-S648 VanDerWaalsContact C-N 3.31Å; F646-S648 PolarHBondContact O-N 3.39Å; F646-A649 PolarHBondContact O-N 3.1Å; F646-V650 HydrophobicContact CD1-CG2 4.34Å; F646-V650 HydrophobicContact CE1-CG2 3.98Å; F646-V650 HydrophobicContact CZ-CG2 4.19Å; F646-V650 WeakPolarHBondContact O-CG2 3.47Å; F646-V650 PolarHBondContact O-N 3.42Å
647	I	86.4	Confident	82.8	Confident	80 Å²	80	91.4 Å²	91.4	41%	0.41	51%	0.507	S	S	.	.	H	α-helix	trans	-59.2	-42.7	176.1	-70.5	171.9	0	0	0	110.8	L643 I644 A649 V650 F651	L643-I647 HydrophobicContact CD2-CD1 3.61Å; L643-I647 HydrophobicContact CG-CD1 4.49Å; L643-I647 WeakPolarHBondContact O-CB 3.22Å; L643-I647 VanDerWaalsContact O-CG1 3.31Å; L643-I647 WeakPolarHBondContact O-CG1 3.44Å; L643-I647 PolarHBondContact O-N 3.14Å; I644-I647 PolarHBondContact O-N 2.83Å; I647-A649 PolarHBondContact O-N 2.93Å; I647-V650 PolarHBondContact O-N 2.65Å; I647-F651 HydrophobicContact CG2-CD2 3.73Å; I647-F651 HydrophobicContact CG2-CE2 3.63Å; I647-F651 VanDerWaalsContact O-CD2 3.3Å; I647-F651 WeakPolarHBondContact O-CD2 3.41Å; I647-F651 PolarHBondContact O-N 3.01Å
648	S	81.5	Confident	82.9	Confident	56 Å²	56	90.5 Å²	90.5	39%	0.392	51%	0.507	S	S	.	.	H	α-helix	trans	-63.8	-38.9	177.7	77.7	0	0	0	0	112.6	I644 L645 F646 F651 V652	I644-S648 WeakPolarHBondContact O-CB 3Å; I644-S648 PolarHBondContact O-N 2.82Å; L645-S648 PolarHBondContact O-N 3.45Å; L645-S648 PolarHBondContact O-OG 2.77Å; F646-S648 VanDerWaalsContact C-N 3.31Å; F646-S648 PolarHBondContact O-N 3.39Å; S648-F651 PolarHBondContact O-N 3.3Å; S648-V652 WeakPolarHBondContact O-CG2 3.48Å; S648-V652 PolarHBondContact O-N 3.45Å
649	A	89.1	Confident	83	Confident	52 Å²	52	91.8 Å²	91.8	43%	0.43	51%	0.509	S	S	.	.	H	α-helix	trans	-65.9	-38.9	175.8	0	0	0	0	0	112.4	L645 F646 I647 V652 T653	L645-A649 PolarHBondContact O-N 3.35Å; F646-A649 PolarHBondContact O-N 3.1Å; I647-A649 PolarHBondContact O-N 2.93Å; A649-V652 PolarHBondContact O-N 3.36Å; A649-T653 WeakPolarHBondContact O-CB 3.43Å; A649-T653 WeakPolarHBondContact O-CG2 3.21Å; A649-T653 PolarHBondContact O-N 2.82Å; A649-T653 PolarHBondContact O-OG1 2.69Å
650	V	89.5	Confident	82.7	Confident	69 Å²	69	90.4 Å²	90.4	42%	0.418	51%	0.505	S	S	.	.	H	α-helix	trans	-62.8	-43.6	173.8	173.2	0	0	0	0	111	F646 I647 T653 A654	F646-V650 HydrophobicContact CD1-CG2 4.34Å; F646-V650 HydrophobicContact CE1-CG2 3.98Å; F646-V650 HydrophobicContact CZ-CG2 4.19Å; F646-V650 WeakPolarHBondContact O-CG2 3.47Å; F646-V650 PolarHBondContact O-N 3.42Å; I647-V650 PolarHBondContact O-N 2.65Å; V650-T653 WeakPolarHBondContact CA-OG1 3.02Å; V650-T653 PolarHBondContact O-OG1 3.22Å; V650-A654 VanDerWaalsContact O-CB 3.26Å; V650-A654 WeakPolarHBondContact O-CB 3.5Å; V650-A654 PolarHBondContact O-N 2.92Å
651	F	85.6	Confident	82.4	Confident	151 Å²	151	89.6 Å²	89.6	66%	0.662	50%	0.501	S	S	*	.	H	α-helix	trans	-68.8	-36	175.9	-78.7	-63.4	0	0	0	113.7	I647 S648 G655	I647-F651 HydrophobicContact CG2-CD2 3.73Å; I647-F651 HydrophobicContact CG2-CE2 3.63Å; I647-F651 VanDerWaalsContact O-CD2 3.3Å; I647-F651 WeakPolarHBondContact O-CD2 3.41Å; I647-F651 PolarHBondContact O-N 3.01Å; S648-F651 PolarHBondContact O-N 3.3Å; F651-G655 PolarHBondContact O-N 3.19Å
652	V	87	Confident	81.7	Confident	91 Å²	91	97 Å²	97	55%	0.552	52%	0.52	S	S	*	.	H	α-helix	trans	-66.3	-44.4	174.8	167.9	0	0	0	0	111.4	S648 A649 G655 L656	S648-V652 WeakPolarHBondContact O-CG2 3.48Å; S648-V652 PolarHBondContact O-N 3.45Å; A649-V652 PolarHBondContact O-N 3.36Å; V652-G655 PolarHBondContact O-N 2.94Å; V652-L656 HydrophobicContact CG1-CD1 4.08Å; V652-L656 WeakPolarHBondContact O-CB 3.2Å; V652-L656 WeakPolarHBondContact O-CG 3.44Å; V652-L656 PolarHBondContact O-N 3.48Å
653	T	83.9	Confident	80.6	Confident	88 Å²	88	100.6 Å²	100.6	54%	0.54	53%	0.527	S	S	.	.	H	α-helix	trans	-67.3	-42.4	177.5	48.7	0	0	0	0	112.2	A649 V650 G655 L656 F657	A649-T653 WeakPolarHBondContact O-CB 3.43Å; A649-T653 WeakPolarHBondContact O-CG2 3.21Å; A649-T653 PolarHBondContact O-N 2.82Å; A649-T653 PolarHBondContact O-OG1 2.69Å; V650-T653 WeakPolarHBondContact CA-OG1 3.02Å; V650-T653 PolarHBondContact O-OG1 3.22Å; T653-G655 VanDerWaalsContact C-N 3.35Å; T653-G655 PolarHBondContact O-N 3.44Å; T653-L656 PolarHBondContact O-N 3.38Å; T653-F657 WeakPolarHBondContact O-CB 3.28Å; T653-F657 PolarHBondContact O-N 2.73Å
654	A	82.9	Confident	79.3	Confident	53 Å²	53	105.6 Å²	105.6	44%	0.438	54%	0.539	S	S	.	.	H	α-helix	trans	-61.1	-41.3	171.5	0	0	0	0	0	112.3	V650 F657 A658	V650-A654 VanDerWaalsContact O-CB 3.26Å; V650-A654 WeakPolarHBondContact O-CB 3.5Å; V650-A654 PolarHBondContact O-N 2.92Å; A654-F657 PolarHBondContact O-N 3.34Å; A654-A658 WeakPolarHBondContact O-CB 3.24Å; A654-A658 PolarHBondContact O-N 3.04Å
655	G	85.2	Confident	77.6	Confident	41 Å²	41	109 Å²	109	42%	0.423	55%	0.55	S	S	.	.	H	α-helix	trans	-62.7	-43.1	175.4	0	0	0	0	0	113	F651 V652 T653 A658 F659	F651-G655 PolarHBondContact O-N 3.19Å; V652-G655 PolarHBondContact O-N 2.94Å; T653-G655 VanDerWaalsContact C-N 3.35Å; T653-G655 PolarHBondContact O-N 3.44Å; G655-A658 PolarHBondContact O-N 3.13Å; G655-F659 VanDerWaalsContact O-CB 3.32Å; G655-F659 WeakPolarHBondContact O-CB 3.4Å; G655-F659 PolarHBondContact O-N 3.15Å
656	L	82.9	Confident	75.9	Confident	104 Å²	104	112.6 Å²	112.6	55%	0.545	56%	0.56	S	S	.	*	H	α-helix	trans	-63.5	-42.1	173	-75.7	167.7	0	0	0	111.8	V652 T653 F659 V660	V652-L656 HydrophobicContact CG1-CD1 4.08Å; V652-L656 WeakPolarHBondContact O-CB 3.2Å; V652-L656 WeakPolarHBondContact O-CG 3.44Å; V652-L656 PolarHBondContact O-N 3.48Å; T653-L656 PolarHBondContact O-N 3.38Å; L656-F659 WeakPolarHBondContact O-CB 3.17Å; L656-F659 PolarHBondContact O-N 3.4Å; L656-V660 WeakPolarHBondContact O-CG2 3.45Å; L656-V660 PolarHBondContact O-N 2.94Å
657	F	81.3	Confident	73.6	Confident	144 Å²	144	113.1 Å²	113.1	63%	0.632	57%	0.569	S	S	*	*	H	α-helix	trans	-64.3	-45.1	177.6	-154.8	-99.3	0	0	0	111.4	T653 A654 F659 V660 L661	T653-F657 WeakPolarHBondContact O-CB 3.28Å; T653-F657 PolarHBondContact O-N 2.73Å; A654-F657 PolarHBondContact O-N 3.34Å; F657-F659 VanDerWaalsContact C-N 3.34Å; F657-F659 PolarHBondContact O-N 3.31Å; F657-V660 PolarHBondContact O-N 3.42Å; F657-L661 HydrophobicContact CD1-CD1 3.7Å; F657-L661 HydrophobicContact CD1-CG 4.24Å; F657-L661 HydrophobicContact CE1-CD1 3.82Å; F657-L661 HydrophobicContact CE1-CG 4.31Å; F657-L661 WeakPolarHBondContact O-CG 3.44Å; F657-L661 PolarHBondContact O-N 2.82Å
658	A	75.7	Confident	71.6	Confident	57 Å²	57	115 Å²	115	47%	0.471	59%	0.587	S	S	.	*	H	α-helix	trans	-61.3	-40.2	173.2	0	0	0	0	0	112.2	A654 G655 L661 R662	A654-A658 WeakPolarHBondContact O-CB 3.24Å; A654-A658 PolarHBondContact O-N 3.04Å; G655-A658 PolarHBondContact O-N 3.13Å; A658-L661 PolarHBondContact O-N 3Å; A658-R662 VanDerWaalsContact O-CB 3.26Å; A658-R662 WeakPolarHBondContact O-CB 3.3Å; A658-R662 PolarHBondContact O-N 2.97Å
659	F	76.8	Confident	69.3	Low	116 Å²	116	122.5 Å²	122.5	51%	0.509	61%	0.613	S	S	.	*	H	α-helix	trans	-62.8	-45.1	174.6	179.3	-99.1	0	0	0	112	G655 L656 F657 R662 R663	G655-F659 VanDerWaalsContact O-CB 3.32Å; G655-F659 WeakPolarHBondContact O-CB 3.4Å; G655-F659 PolarHBondContact O-N 3.15Å; L656-F659 WeakPolarHBondContact O-CB 3.17Å; L656-F659 PolarHBondContact O-N 3.4Å; F657-F659 VanDerWaalsContact C-N 3.34Å; F657-F659 PolarHBondContact O-N 3.31Å; F659-R662 PolarHBondContact O-N 3.43Å; F659-R663 WeakPolarHBondContact O-CB 3.4Å; F659-R663 PolarHBondContact O-N 3.22Å
660	V	74.7	Confident	66.5	Low	68 Å²	68	130.6 Å²	130.6	41%	0.412	63%	0.632	S	S	.	*	H	α-helix	trans	-62.4	-46	176.1	168.8	0	0	0	0	111.4	L656 F657 R662 R663 R664	L656-V660 WeakPolarHBondContact O-CG2 3.45Å; L656-V660 PolarHBondContact O-N 2.94Å; F657-V660 PolarHBondContact O-N 3.42Å; V660-R662 VanDerWaalsContact C-N 3.32Å; V660-R662 PolarHBondContact O-N 2.92Å; V660-R663 WeakPolarHBondContact O-CB 3.22Å; V660-R663 PolarHBondContact O-N 3.39Å; V660-R664 WeakPolarHBondContact O-CG 3.2Å; V660-R664 PolarHBondContact O-N 3.02Å
661	L	66.8	Low	63.9	Low	89 Å²	89	137 Å²	137	47%	0.466	65%	0.654	S	S	.	*	H	α-helix	trans	-61.7	-39.1	175.4	-70.8	173.3	0	0	0	112.1	F657 A658 R664 K665	F657-L661 HydrophobicContact CD1-CD1 3.7Å; F657-L661 HydrophobicContact CD1-CG 4.24Å; F657-L661 HydrophobicContact CE1-CD1 3.82Å; F657-L661 HydrophobicContact CE1-CG 4.31Å; F657-L661 WeakPolarHBondContact O-CG 3.44Å; F657-L661 PolarHBondContact O-N 2.82Å; A658-L661 PolarHBondContact O-N 3Å; L661-R664 PolarHBondContact O-N 2.91Å; L661-K665 PolarHBondContact O-N 3.35Å
662	R	62.5	Low	61.1	Low	208 Å²	208	140.6 Å²	140.6	79%	0.785	66%	0.663	S	S	*	*	H	α-helix	trans	-69.5	-32.2	175.9	-159	173.3	-168.9	-179.8	3.2	112.2	A658 F659 V660	A658-R662 VanDerWaalsContact O-CB 3.26Å; A658-R662 WeakPolarHBondContact O-CB 3.3Å; A658-R662 PolarHBondContact O-N 2.97Å; F659-R662 PolarHBondContact O-N 3.43Å; V660-R662 VanDerWaalsContact C-N 3.32Å; V660-R662 PolarHBondContact O-N 2.92Å
663	R	56.9	Low	58.3	Low	182 Å²	182	140.9 Å²	140.9	69%	0.687	67%	0.67	S	S	*	*	H	α-helix	trans	-68.5	-41.3	171.8	-125.2	178.7	-179.8	-171	0.3	111.9	F659 V660 K665 K666	F659-R663 WeakPolarHBondContact O-CB 3.4Å; F659-R663 PolarHBondContact O-N 3.22Å; V660-R663 WeakPolarHBondContact O-CB 3.22Å; V660-R663 PolarHBondContact O-N 3.39Å; R663-K665 PolarHBondContact O-N 3.48Å; R663-K666 PolarHBondContact O-N 2.79Å; R663-K666 VanDerWaalsContact O-N 3.14Å
664	R	56.6	Low	55.6	Low	198 Å²	198	146.1 Å²	146.1	75%	0.747	69%	0.688	S	S	*	*	H	α-helix	trans	-63.2	-18.8	177.3	-73.8	-176	-179.9	-163.6	0.7	113.9	V660 L661 K666	V660-R664 WeakPolarHBondContact O-CG 3.2Å; V660-R664 PolarHBondContact O-N 3.02Å; L661-R664 PolarHBondContact O-N 2.91Å; R664-K666 VanDerWaalsContact C-N 3.35Å
665	K	49	Very low	53.2	Low	187 Å²	187	149.5 Å²	149.5	81%	0.813	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	11	173.9	-68.7	-171.6	176.4	-174.6	0	115	L661 R663	L661-K665 PolarHBondContact O-N 3.35Å; R663-K665 PolarHBondContact O-N 3.48Å
666	K	50.8	Low	50.4	Low	185 Å²	185	154.2 Å²	154.2	80%	0.804	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.8	26	-177.4	-82.9	-160.3	170.6	-167.6	0	116	R663 R664	R663-K666 PolarHBondContact O-N 2.79Å; R663-K666 VanDerWaalsContact O-N 3.14Å; R664-K666 VanDerWaalsContact C-N 3.35Å
667	L	41.2	Very low	48.1	Very low	156 Å²	156	155.9 Å²	155.9	82%	0.817	73%	0.727	S	S	*	*			trans	-131	116	169	-81.9	165.6	0	0	0	110.4
668	P	44.5	Very low	45.7	Very low	120 Å²	120	155.8 Å²	155.8	78%	0.779	74%	0.738	S	S	*	*			trans	-82.5	138	170.4	33	-31.3	0	0	0	110.1
669	F	31.8	Very low	43.4	Very low	214 Å²	214	156.4 Å²	156.4	94%	0.939	75%	0.751	S	S	*	*			trans	-131.9	156.2	165.1	-132.2	-95.3	0	0	0	112.2
670	R	31.6	Very low	41.2	Very low	221 Å²	221	158.6 Å²	158.6	83%	0.834	77%	0.766	S	S	*	*			trans	-118.1	140	-150.1	177	-179.8	177.2	178.9	0.4	111.3	R672	R670-R672 PolarHBondContact O-N 2.93Å
671	K	33.4	Very low	38.8	Very low	204 Å²	204	162.4 Å²	162.4	89%	0.887	78%	0.78	S	S	*	*			trans	-63.5	126.7	172.6	-73.5	-174.9	176	-176.9	0	111.9
672	R	28	Very low	36.9	Very low	226 Å²	226	165.7 Å²	165.7	85%	0.853	79%	0.794	S	S	*	*			trans	-160.6	122.6	136.6	-91.8	-154.9	161.3	145.3	-4.8	105.5	R670	R670-R672 PolarHBondContact O-N 2.93Å
673	S	27.8	Very low	35.2	Very low	98 Å²	98	163.5 Å²	163.5	69%	0.685	79%	0.793	S	S	*	*				76.7	111.8	58	78.4	0	0	0	0	112.6
674	E	27.3	Very low	33.6	Very low	197 Å²	197	161.1 Å²	161.1	92%	0.921	80%	0.803	S	S	*	*			trans	-142.5	157.8	165.8	-164.1	144	-122.2	0	0	108.8
675	V	32.8	Very low	32.1	Very low	125 Å²	125	162.3 Å²	162.3	76%	0.758	81%	0.807	S	S	*	*			trans	-140.8	131.1	-162.1	168.5	0	0	0	0	110.1
676	D	26.8	Very low	31.1	Very low	140 Å²	140	160 Å²	160	75%	0.749	80%	0.802	S	S	*	*			trans	38.9	132.9	158.5	-84.9	-35.3	0	0	0	124.1
677	L	34.6	Very low	30	Very low	138 Å²	138	159.2 Å²	159.2	72%	0.723	80%	0.799	S	S	*	*			trans	81.4	123.7	133.3	-73.9	166.4	0	0	0	123.4
678	T	30.9	Very low	29.4	Very low	142 Å²	142	160.6 Å²	160.6	87%	0.871	80%	0.802	S	S	*	*			trans	75.9	135.4	149	62.1	0	0	0	0	121.4
679	G	27.4	Very low	28.5	Very low	71 Å²	71	162.2 Å²	162.2	73%	0.732	80%	0.804	S	S	*	*			trans	155.2	94.5	163.5	0	0	0	0	0	117.7
680	I	29.9	Very low	29.3	Very low	162 Å²	162	157.6 Å²	157.6	83%	0.831	80%	0.795	S	S	*	*				15.5	143.7	125.7	-64.2	164.4	0	0	0	117.4
681	Q	24.5	Very low	29.7	Very low	148 Å²	148	152.9 Å²	152.9	69%	0.692	79%	0.793	S	S	*	*			cis	177.8	-179.3	-10.1	-176.9	179.8	-7.9	0	0	106.6
682	M	27.7	Very low	29.4	Very low	158 Å²	158	154 Å²	154	78%	0.778	79%	0.792	S	S	*	*			trans	83.8	133.6	166.4	-56.1	-170.5	-178.4	0	0	115.2
683	Q	24.8	Very low	29.5	Very low	161 Å²	161	151.9 Å²	151.9	75%	0.752	79%	0.792	S	S	*	*			cis	103.4	121.8	26.2	-175	168.6	4.3	0	0	112
684	C	25.1	Very low	29.4	Very low	133 Å²	133	151.6 Å²	151.6	90%	0.899	79%	0.79	S	S	*	*			trans	-138.9	152.6	-175.5	-90.4	0	0	0	0	114.1
685	R	24.3	Very low	29.4	Very low	223 Å²	223	148 Å²	148	84%	0.842	79%	0.785	S	S	*	*			trans	-159.1	151.5	-174.2	-98.2	-170.5	170.7	-168.4	-3	108.5
686	I	27.6	Very low	29.2	Very low	137 Å²	137	147.2 Å²	147.2	70%	0.703	79%	0.791	S	S	*	*			cis	-144.6	-129.4	-10.5	-165.1	164.2	0	0	0	108.3
687	F	28.7	Very low	29.2	Very low	169 Å²	169	144.4 Å²	144.4	74%	0.741	80%	0.796	S	S	*	*			trans	-75.5	155.3	156.3	-79.8	-115.2	0	0	0	109.8
688	E	27.3	Very low	28.9	Very low	186 Å²	186	145.5 Å²	145.5	87%	0.869	80%	0.802	S	S	*	*				175.2	149.8	111	-93.8	172	-176.2	0	0	111
689	D	27.1	Very low	29.7	Very low	154 Å²	154	144.4 Å²	144.4	82%	0.824	80%	0.797	S	S	*	*			trans	-91.2	-155.6	175.9	-57.7	-75.1	0	0	0	111
690	P	48.1	Very low	29.8	Very low	117 Å²	117	144.5 Å²	144.5	76%	0.76	80%	0.799	S	S	*	*				-111	178	-128.5	29.6	-7.4	0	0	0	114.1
691	P	39.9	Very low	29.8	Very low	122 Å²	122	143.3 Å²	143.3	79%	0.792	80%	0.799	S	S	*	*				-146	145.2	116.6	35.2	-19.8	0	0	0	117.4
692	R	27.6	Very low	31.2	Very low	227 Å²	227	141.5 Å²	141.5	86%	0.857	80%	0.8	S	S	*	*			trans	18.1	152.2	139	-63.4	-179.5	173.1	177.4	-2.2	122.8
693	Q	29.8	Very low	31.3	Very low	181 Å²	181	142.8 Å²	142.8	85%	0.846	80%	0.804	S	S	*	*			trans	75.1	153	158.2	-74.6	168.8	-27.9	0	0	117.9
694	S	26.1	Very low	31.8	Very low	93 Å²	93	144.3 Å²	144.3	65%	0.65	81%	0.809	S	S	*	*			cis	-172.8	154	-37.9	50.2	0	0	0	0	110.8
695	C	25.7	Very low	32.8	Very low	120 Å²	120	143.7 Å²	143.7	81%	0.811	80%	0.803	S	S	*	*			trans	74.1	114.3	158.9	-60.8	0	0	0	0	120.8
696	A	28.8	Very low	33.3	Very low	109 Å²	109	139 Å²	139	90%	0.901	80%	0.799	S	S	*	*			trans	61.1	139.6	131.2	0	0	0	0	0	122.2
697	G	27.5	Very low	34.3	Very low	81 Å²	81	137.8 Å²	137.8	84%	0.835	80%	0.8	S	S	*	*			trans	158.4	64.7	168.3	0	0	0	0	0	117
698	N	29.1	Very low	34.5	Very low	162 Å²	162	134.8 Å²	134.8	87%	0.866	80%	0.8	S	S	*	*			trans	-98.3	168.8	161.7	-136	8.8	0	0	0	107.9
699	P	47.6	Very low	34.7	Very low	118 Å²	118	132.4 Å²	132.4	77%	0.766	79%	0.793	S	S	*	*			cis	-132.1	-168.2	-6.3	42.6	-25.4	0	0	0	113.3
700	G	27.7	Very low	34.9	Very low	74 Å²	74	132.6 Å²	132.6	76%	0.763	79%	0.788	S	S	*	*			trans	156.8	117.3	157.7	0	0	0	0	0	118
701	T	31.1	Very low	34.1	Very low	136 Å²	136	132.6 Å²	132.6	83%	0.834	79%	0.786	S	S	*	*			trans	-128.6	-177.7	160.8	62.2	0	0	0	0	107.3
702	P	54.2	Low	33.7	Very low	110 Å²	110	135.4 Å²	135.4	71%	0.714	79%	0.788	S	S	*	*			cis	-134.4	-159.9	-3.3	30.5	-5.7	0	0	0	114.2
703	E	30.1	Very low	33.7	Very low	185 Å²	185	129.2 Å²	129.2	86%	0.864	78%	0.78	S	S	*	*			trans	130.5	168.9	141.7	-60.1	-131.1	116.7	0	0	119.1
704	K	34.5	Very low	33.8	Very low	194 Å²	194	128.3 Å²	128.3	84%	0.843	78%	0.775	S	S	*	*			trans	-135.4	176.2	-167.1	-108.3	179.7	-178.2	177.5	0	108.2
705	P	46.2	Very low	33.9	Very low	119 Å²	119	129.3 Å²	129.3	77%	0.773	78%	0.777	S	S	*	*			cis	-152.2	-158.8	39.1	42.8	-18.1	0	0	0	117.7
706	T	33.8	Very low	34.1	Very low	126 Å²	126	129 Å²	129	77%	0.773	77%	0.772	S	S	*	*			trans	-76.9	175.7	178.6	46.6	0	0	0	0	114.6
707	P	49.8	Very low	34.1	Very low	111 Å²	111	131.7 Å²	131.7	72%	0.721	77%	0.766	S	S	*	*				-163.9	-174.9	52.2	46.2	-22.1	0	0	0	122.9
708	S	32.7	Very low	34.1	Very low	105 Å²	105	133.5 Å²	133.5	73%	0.734	76%	0.761	S	S	*	*			trans	83.1	156.5	147.7	86	0	0	0	0	120.3
709	L	31.3	Very low	34	Very low	137 Å²	137	134.5 Å²	134.5	72%	0.717	76%	0.76	S	S	*	*			cis	-164.9	154.1	-9.6	-146.1	64	0	0	0	114.5
710	H	32	Very low	33	Very low	157 Å²	157	131.7 Å²	131.7	73%	0.727	75%	0.752	S	S	*	*			trans	56.2	162.1	152.6	-72.2	-25	0	0	0	122.7
711	T	29.8	Very low	33.1	Very low	118 Å²	118	136.7 Å²	136.7	72%	0.724	76%	0.755	S	S	*	*			cis	-153.7	-173.9	1.5	-1.1	0	0	0	0	114.6
712	H	31.9	Very low	33	Very low	180 Å²	180	133 Å²	133	83%	0.833	74%	0.744	S	S	*	*			trans	-59.5	-176.5	-174.8	-52.4	-80.4	0	0	0	118.9
713	S	29.1	Very low	31.9	Very low	97 Å²	97	135.8 Å²	135.8	68%	0.678	75%	0.747	S	S	*	*			cis	-166.7	178.8	23.7	68	0	0	0	0	116.5
714	H	31.2	Very low	31.8	Very low	163 Å²	163	132.6 Å²	132.6	76%	0.755	74%	0.74	S	S	*	*			trans	47.5	125.4	156.9	-68.2	-65.7	0	0	0	122.1
715	T	28.9	Very low	31.5	Very low	113 Å²	113	133.4 Å²	133.4	69%	0.693	74%	0.739	S	S	*	*				74.7	151	65.3	68.8	0	0	0	0	115.5
716	T	28.6	Very low	30.6	Very low	115 Å²	115	134.5 Å²	134.5	71%	0.706	74%	0.739	S	S	*	*			cis	-166.4	150.3	23.7	-20.8	0	0	0	0	115.7
717	H	28.7	Very low	30.2	Very low	165 Å²	165	138.5 Å²	138.5	76%	0.764	74%	0.741	S	S	*	*			trans	50.2	146	148.3	-91.8	-72	0	0	0	128.1
718	T	27.3	Very low	29.1	Very low	119 Å²	119	139.8 Å²	139.8	73%	0.73	74%	0.74	S	S	*	*			trans	65.4	168.5	147	48	0	0	0	0	121.9
719	H	28.3	Very low	29.1	Very low	183 Å²	183	140.2 Å²	140.2	85%	0.847	74%	0.741	S	S	*	*			cis	177.5	148.3	-49.2	-123.1	-75.9	0	0	0	108.6
720	G	26.2	Very low	29.2	Very low	58 Å²	58	141.9 Å²	141.9	60%	0.598	74%	0.744	S	S	*	*			trans	140.5	118	173.2	0	0	0	0	0	112.8
721	H	29.6	Very low	29	Very low	180 Å²	180	140 Å²	140	83%	0.833	75%	0.747	S	S	*	*				61.9	131.4	67.4	-65.4	-75.2	0	0	0	113.6
722	G	28.1	Very low	28.7	Very low	58 Å²	58	139.9 Å²	139.9	60%	0.598	75%	0.745	S	S	*	*			cis	157	-174.2	-0.6	0	0	0	0	0	111.3
723	H	32	Very low	28.6	Very low	169 Å²	169	137.4 Å²	137.4	78%	0.782	74%	0.743	S	S	*	*			trans	75.6	154.8	165.6	-49.5	-74.7	0	0	0	116.7
724	V	28.8	Very low	28.6	Very low	117 Å²	117	140.3 Å²	140.3	71%	0.709	75%	0.746	S	S	*	*			cis	-156.2	137.6	1.2	106.4	0	0	0	0	112.3
725	Y	27.4	Very low	28.4	Very low	211 Å²	211	139.6 Å²	139.6	83%	0.827	74%	0.744	S	S	*	*			trans	41.6	160.5	148.4	-75.2	-99.3	0	0	0	126.7
726	D	28.1	Very low	28.2	Very low	143 Å²	143	139.3 Å²	139.3	77%	0.765	75%	0.746	S	S	*	*			trans	-86	-169.9	-175.6	-52.9	-93.4	0	0	0	117.3
727	Y	25.3	Very low	28.2	Very low	209 Å²	209	139.8 Å²	139.8	82%	0.82	74%	0.744	S	S	*	*			trans	102.1	100.2	159.1	-92.3	-110.3	0	0	0	121.5
728	I	26.1	Very low	28.2	Very low	138 Å²	138	138.8 Å²	138.8	71%	0.708	75%	0.745	S	S	*	*				55.7	147.2	121.7	-62.5	-174.2	0	0	0	120
729	P	33.4	Very low	28.9	Very low	114 Å²	114	137.9 Å²	137.9	74%	0.74	74%	0.741	S	S	*	*			cis	-131.4	-162.9	-3.4	36.1	-13.6	0	0	0	116.4
730	H	31.8	Very low	28.9	Very low	172 Å²	172	136.2 Å²	136.2	80%	0.796	74%	0.736	S	S	*	*			trans	-65.3	156.5	176.9	-55.4	91.8	0	0	0	117.6
731	P	29.3	Very low	28.9	Very low	119 Å²	119	143.8 Å²	143.8	77%	0.773	75%	0.748	S	S	*	*				-128.6	165.6	102.8	37.9	-31.9	0	0	0	112.4
732	V	23.1	Very low	29	Very low	115 Å²	115	143.9 Å²	143.9	70%	0.697	75%	0.746	S	S	*	*			cis	94.9	92.6	23.1	-176.4	0	0	0	0	115.7
733	T	28.8	Very low	29.6	Very low	128 Å²	128	147 Å²	147	79%	0.785	76%	0.756	S	S	*	*			trans	67.9	161.1	160.4	63.4	0	0	0	0	118
734	Q	30.1	Very low	29.6	Very low	158 Å²	158	149.4 Å²	149.4	74%	0.738	76%	0.758	S	S	*	*			cis	-156.7	128.4	20	-158.7	169.3	20.7	0	0	115.2
735	M	26.4	Very low	29.5	Very low	147 Å²	147	152.6 Å²	152.6	72%	0.724	77%	0.765	S	S	*	*			trans	56.3	151.8	146.7	-60.2	178.9	80.4	0	0	120.8
736	C	25.4	Very low	29.6	Very low	108 Å²	108	146.1 Å²	146.1	73%	0.73	76%	0.763	S	S	*	*			cis	-138.7	141.4	30.2	-63.2	0	0	0	0	117.4
737	N	28.6	Very low	29.6	Very low	124 Å²	124	148.3 Å²	148.3	66%	0.663	77%	0.769	S	S	*	*			trans	69.3	107.3	136.7	-59.6	-2.2	0	0	0	124.6
738	N	28.9	Very low	29.7	Very low	145 Å²	145	146 Å²	146	78%	0.775	77%	0.769	S	S	*	*				69.9	152.8	129.8	-79.9	1	0	0	0	123.1
739	P	40.9	Very low	29.8	Very low	99 Å²	99	143.4 Å²	143.4	64%	0.643	77%	0.768	S	S	*	*			cis	-140.3	146.9	-28.1	36.8	-18.6	0	0	0	117
740	I	29	Very low	29.5	Very low	148 Å²	148	146.8 Å²	146.8	76%	0.759	77%	0.774	S	S	*	*			trans	54.3	125.2	130.2	-55.8	175.8	0	0	0	119.4
741	Y	26.6	Very low	29.3	Very low	217 Å²	217	147.6 Å²	147.6	85%	0.851	78%	0.778	S	S	*	*			cis	-153.6	171.6	-6	-135.8	-106	0	0	0	111.4
742	K	32	Very low	29.2	Very low	182 Å²	182	150.5 Å²	150.5	79%	0.791	78%	0.781	S	S	*	*			trans	-108.3	-174.4	179.7	-118.8	-173.8	-178.6	-174.4	0	110.3
743	P	39.4	Very low	29.3	Very low	123 Å²	123	153.4 Å²	153.4	80%	0.799	79%	0.789	S	S	*	*			cis	-142.1	-154	29.7	44.1	-21.9	0	0	0	116.4
744	R	31.7	Very low	29.2	Very low	220 Å²	220	151.7 Å²	151.7	83%	0.83	79%	0.788	S	S	*	*			trans	-143.6	-174.1	-179.3	-165.8	-175.6	-179.6	-171.6	0.2	106.9
745	E	27.9	Very low	29	Very low	184 Å²	184	151.8 Å²	151.8	86%	0.86	79%	0.789	S	S	*	*			trans	80.2	156.8	175.5	-59.8	144.2	-141.3	0	0	114.2
746	G	28.1	Very low	29	Very low	75 Å²	75	153.2 Å²	153.2	77%	0.773	79%	0.791	S	S	*	*			cis	-165.5	173.4	2.4	0	0	0	0	0	113.5
747	E	28.3	Very low	29	Very low	189 Å²	189	152.1 Å²	152.1	88%	0.883	79%	0.785	S	S	*	*			trans	-92.3	-169.2	-167.7	-59.3	161.1	121.9	0	0	114.7
748	I	28.6	Very low	29	Very low	162 Å²	162	154 Å²	154	83%	0.831	79%	0.79	S	S	*	*			trans	105.3	145.2	154.2	-56.3	174.6	0	0	0	118
749	A	27.2	Very low	29	Very low	83 Å²	83	156.8 Å²	156.8	69%	0.686	80%	0.795	S	S	*	*			trans	71.4	130.5	177.5	0	0	0	0	0	116.4
750	E	27.6	Very low	28.3	Very low	185 Å²	185	160.1 Å²	160.1	86%	0.864	80%	0.799	S	S	*	*			cis	95	162.6	32.2	-67.5	-172.4	139.1	0	0	114.6
751	E	27.9	Very low	28.2	Very low	189 Å²	189	158.5 Å²	158.5	88%	0.883	79%	0.792	S	S	*	*			trans	77.3	96.9	178.4	-58	-169.6	159.9	0	0	119.5
752	E	26.1	Very low	28.1	Very low	180 Å²	180	155.5 Å²	155.5	84%	0.841	79%	0.791	S	S	*	*				38.3	121.8	121.6	-64.3	-158.3	139.8	0	0	123.6
753	M	26.2	Very low	27.8	Very low	175 Å²	175	150.6 Å²	150.6	86%	0.862	79%	0.792	S	S	*	*				59.4	79.6	116	-163.2	167.6	157.2	0	0	121.2
754	A	26.3	Very low	27.1	Very low	93 Å²	93	149.8 Å²	149.8	77%	0.769	79%	0.789	S	S	*	*			trans	-155.7	127.7	134.3	0	0	0	0	0	108.9
755	Q	25.4	Very low	26.9	Very low	159 Å²	159	144.8 Å²	144.8	74%	0.743	79%	0.788	S	S	*	*			cis	88.8	136.9	46.6	-158.3	-171.4	56.4	0	0	112.9
756	F	27.5	Very low	26.8	Very low	178 Å²	178	140.4 Å²	140.4	78%	0.781	78%	0.777	S	S	*	*			trans	65.9	119.6	-171.6	-65	-84	0	0	0	115.3
757	S	25.4	Very low	26.8	Very low	85 Å²	85	143.8 Å²	143.8	59%	0.594	78%	0.778	S	S	*	*			cis	100.4	130.4	28	-157.7	0	0	0	0	114.4
758	E	27.3	Very low	26.8	Very low	163 Å²	163	139.6 Å²	139.6	76%	0.762	77%	0.769	S	S	*	*			trans	44.1	102.1	152.4	-66.8	166.6	128.1	0	0	120.6
759	K	29.1	Very low	26.9	Very low	203 Å²	203	138 Å²	138	88%	0.883	76%	0.763	S	S	*	*				-156.1	136.7	95.4	-91.5	138.4	-172.5	171.4	0	108.9
760	K	26.5	Very low	26.9	Very low	170 Å²	170	143 Å²	143	74%	0.739	77%	0.765	S	S	*	*			cis	84.3	121.4	35	-154.9	-159.3	180	-171.3	0	113
761	D	27	Very low	27	Very low	113 Å²	113	144.8 Å²	144.8	60%	0.604	76%	0.764	S	S	*	*			trans	63.8	119.4	173.1	-58.7	-43.4	0	0	0	116.3
762	N	24.7	Very low	27.3	Very low	154 Å²	154	141.2 Å²	141.2	82%	0.824	76%	0.755	S	S	*	*				87.9	121.4	52.9	-82.8	-42.8	0	0	0	113.7
763	G	25.2	Very low	27.4	Very low	79 Å²	79	139.5 Å²	139.5	81%	0.814	75%	0.751	S	S	*	*			trans	82.2	165.4	176.3	0	0	0	0	0	114.6
764	S	25.6	Very low	27.9	Very low	106 Å²	106	138 Å²	138	74%	0.741	75%	0.746	S	S	*	*			cis	-168.5	138.5	-15.3	-177.9	0	0	0	0	109.6
765	S	26	Very low	28.3	Very low	116 Å²	116	139.9 Å²	139.9	81%	0.811	74%	0.739	S	S	*	*			trans	63.1	172.6	172.7	84.5	0	0	0	0	115
766	S	27.6	Very low	28.6	Very low	91 Å²	91	139.2 Å²	139.2	64%	0.636	73%	0.733	S	S	*	*			cis	-151.7	175.2	2.8	65.5	0	0	0	0	111.4
767	N	26.5	Very low	29.2	Very low	146 Å²	146	136 Å²	136	78%	0.781	72%	0.721	S	S	*	*			trans	31.6	120.1	147.6	-60.4	-23.5	0	0	0	118.8
768	S	28.7	Very low	30	Very low	101 Å²	101	140.5 Å²	140.5	71%	0.706	73%	0.725	S	S	*	*				175.6	147.6	82.9	43.8	0	0	0	0	108.3
769	N	31.1	Very low	30.5	Very low	130 Å²	130	138.4 Å²	138.4	70%	0.695	72%	0.715	S	S	*	*				45.5	121.4	74	-66.8	-22.5	0	0	0	112.2
770	Y	27.4	Very low	30.6	Very low	188 Å²	188	138.4 Å²	138.4	74%	0.737	71%	0.709	S	S	*	*			cis	-154.3	164.5	42.3	-71.5	-87.4	0	0	0	113.9
771	R	28.9	Very low	31.1	Very low	221 Å²	221	134.8 Å²	134.8	83%	0.834	70%	0.702	S	S	*	*			trans	27.8	147.4	136.7	-58.8	174.3	162.1	149.8	-7	120.1
772	T	34.2	Very low	31.5	Very low	115 Å²	115	137.3 Å²	137.3	71%	0.706	71%	0.714	S	S	*	*			cis	-157.3	146.5	41.1	45.1	0	0	0	0	115.7
773	L	29.8	Very low	32	Very low	143 Å²	143	133.8 Å²	133.8	75%	0.749	71%	0.707	S	S	*	*			trans	58.8	132.2	134.4	-65.8	168.6	0	0	0	124
774	L	34.8	Very low	32.3	Very low	143 Å²	143	136.5 Å²	136.5	75%	0.749	71%	0.708	S	S	*	*			trans	63.7	131.6	142.7	-63.8	167.2	0	0	0	118.3
775	E	35.3	Very low	32.6	Very low	133 Å²	133	135.9 Å²	135.9	62%	0.621	70%	0.703	S	S	*	*			cis	-156.8	-163.4	-7.7	-143.6	-176.9	178.8	0	0	106.3
776	K	32.2	Very low	32.8	Very low	145 Å²	145	137.7 Å²	137.7	63%	0.63	70%	0.704	S	S	*	*			cis	-167.6	153.2	6.1	-146.7	161.4	-177	53.2	0	104.7
777	E	40.9	Very low	32.9	Very low	112 Å²	112	137.6 Å²	137.6	52%	0.523	70%	0.703	S	S	.	*			cis	-172.6	174.7	-18.3	-102.7	-171.6	108.6	0	0	103.9
778	R	41.6	Very low	33.1	Very low	178 Å²	178	138.7 Å²	138.7	67%	0.672	70%	0.703	S	S	*	*			cis	-167.1	160.6	-6.8	-98.7	176.9	114.5	82.1	16.4	103.1
779	E	36.4	Very low	33.1	Very low	120 Å²	120	140.4 Å²	140.4	56%	0.561	70%	0.704	S	S	*	*			cis	-164.5	170.9	-12.9	-95.4	-179.3	138	0	0	104.9
780	W	32	Very low	32.9	Very low	202 Å²	202	140.7 Å²	140.7	77%	0.765	71%	0.705	S	S	*	*			cis	-159.1	-175	11	-133.4	28.9	0	0	0	112
781	T	36.6	Very low	32.8	Very low	94 Å²	94	136.9 Å²	136.9	58%	0.577	70%	0.702	S	S	*	*			trans	6	145.2	152.6	60.1	0	0	0	0	122
782	L	36.6	Very low	32.6	Very low	166 Å²	166	133.9 Å²	133.9	87%	0.869	70%	0.701	S	S	*	*			cis	-174.1	170.1	2.3	-105.1	168.1	0	0	0	106.3
783	A	35.1	Very low	32.2	Very low	81 Å²	81	134.8 Å²	134.8	67%	0.669	71%	0.706	S	S	*	*			cis	-159.6	-160.6	-5	0	0	0	0	0	107.1
784	V	30.9	Very low	32	Very low	136 Å²	136	133.6 Å²	133.6	82%	0.824	71%	0.705	S	S	*	*			cis	-156.8	-168.8	0.7	84.2	0	0	0	0	110.6
785	S	32.7	Very low	31.6	Very low	93 Å²	93	133.1 Å²	133.1	65%	0.65	71%	0.707	S	S	*	*			trans	-63	171.8	-178.9	-25.8	0	0	0	0	117.7
786	N	28.8	Very low	31.1	Very low	153 Å²	153	133.5 Å²	133.5	82%	0.818	71%	0.714	S	S	*	*			cis	-156.5	-179.8	7.7	-138.2	4.8	0	0	0	116.3
787	S	31.4	Very low	30.9	Very low	90 Å²	90	134.7 Å²	134.7	63%	0.629	72%	0.721	S	S	*	*			trans	-81.3	179.4	-177	56.5	0	0	0	0	116.3
788	Q	29.8	Very low	30.2	Very low	168 Å²	168	134.3 Å²	134.3	79%	0.785	73%	0.727	S	S	*	*			cis	-164.8	169.2	-15.7	-115.7	178.7	-4.3	0	0	112.2
789	L	27.7	Very low	29.4	Very low	137 Å²	137	132 Å²	132	72%	0.717	73%	0.733	S	S	*	*			trans	0.9	151	148.5	-63.9	156.9	0	0	0	119.7
790	N	27.2	Very low	28.9	Very low	136 Å²	136	130.2 Å²	130.2	73%	0.727	74%	0.739	S	S	*	*				-170.7	176.9	50.9	-138.3	-7.3	0	0	0	116.7
791	T	25.4	Very low	28.6	Very low	109 Å²	109	127.8 Å²	127.8	67%	0.669	74%	0.74	S	S	*	*			trans	-48.5	157.5	176.9	53	0	0	0	0	120.6
792	I	25.8	Very low	28.1	Very low	157 Å²	157	130.6 Å²	130.6	81%	0.805	75%	0.75	S	S	*	*				-178.5	133.3	123.9	-100.4	166.2	0	0	0	117.5
793	V	25.7	Very low	27.5	Very low	134 Å²	134	128.2 Å²	128.2	81%	0.812	75%	0.747	S	S	*	*			trans	66.6	159.8	147.8	174.3	0	0	0	0	123.1
794	T	24.4	Very low	27.1	Very low	119 Å²	119	127.5 Å²	127.5	73%	0.73	75%	0.748	S	S	*	*			trans	-93.4	165	-168.4	53.4	0	0	0	0	116.1
795	V	26.9	Very low	26.9	Very low	132 Å²	132	130.6 Å²	130.6	80%	0.8	75%	0.751	S	S	*	*				178.3	158.4	119.8	147.7	0	0	0	0	111.3
796	N	25.1	Very low	26.6	Very low	142 Å²	142	133.3 Å²	133.3	76%	0.759	75%	0.753	S	S	*	*			trans	-67.9	154.1	176.6	-62.7	-36	0	0	0	113.7
797	H	28.5	Very low	26.7	Very low	169 Å²	169	133.1 Å²	133.1	78%	0.782	75%	0.747	S	S	*	*			trans	173.9	116	134.9	-90.1	-60.6	0	0	0	107.1
798	T	25.2	Very low	26.7	Very low	104 Å²	104	135.3 Å²	135.3	64%	0.638	75%	0.752	S	S	*	*				55.4	116.7	80	67.6	0	0	0	0	116
799	T	25.2	Very low	26.6	Very low	131 Å²	131	130.7 Å²	130.7	80%	0.804	75%	0.749	S	S	*	*			trans	62.9	114.8	145.7	55.5	0	0	0	0	121.6
800	A	26.2	Very low	26.7	Very low	82 Å²	82	127.3 Å²	127.3	68%	0.678	75%	0.748	S	S	*	*				72.8	112.4	125.6	0	0	0	0	0	121.9
801	D	25.2	Very low	26.6	Very low	150 Å²	150	128.7 Å²	128.7	80%	0.802	75%	0.754	S	S	*	*				67.3	168	127.8	-56.9	-32	0	0	0	122.5
802	I	25.7	Very low	26.5	Very low	154 Å²	154	129.1 Å²	129.1	79%	0.79	76%	0.761	S	S	*	*			trans	69.8	101.3	174.3	-48.5	175	0	0	0	113.4
803	S	24.8	Very low	27	Very low	115 Å²	115	127.3 Å²	127.3	80%	0.804	76%	0.759	S	S	*	*			cis	83.7	138.8	30.1	100.6	0	0	0	0	116.2
804	G	26.9	Very low	27.1	Very low	67 Å²	67	126.5 Å²	126.5	69%	0.691	75%	0.754	S	S	*	*			trans	105.6	111.8	169.6	0	0	0	0	0	116.4
805	F	26.1	Very low	27.3	Very low	200 Å²	200	126.8 Å²	126.8	88%	0.877	76%	0.755	S	S	*	*				-177.3	123.4	115.5	-97.5	-70.4	0	0	0	110.8
806	H	27.5	Very low	27.4	Very low	151 Å²	151	128 Å²	128	70%	0.699	76%	0.756	S	S	*	*			trans	13.4	142.8	130.4	-62.9	-104	0	0	0	118.3
807	E	30.3	Very low	27.6	Very low	148 Å²	148	127.9 Å²	127.9	69%	0.692	76%	0.755	S	S	*	*			cis	-169.1	175.8	3.9	-126.4	179.2	-113.6	0	0	108.7
808	N	31	Very low	27.6	Very low	136 Å²	136	124.1 Å²	124.1	73%	0.727	75%	0.748	S	S	*	*			cis	-151.4	-171.9	-5.4	-161.9	-42.8	0	0	0	106.1
809	G	27.2	Very low	27.7	Very low	71 Å²	71	128.2 Å²	128.2	73%	0.732	76%	0.76	S	S	*	*			trans	159.1	16.1	162.7	0	0	0	0	0	123.1
810	G	29.6	Very low	27.9	Very low	66 Å²	66	133 Å²	133	68%	0.68	76%	0.763	S	S	*	*			trans	79.5	142.9	158.5	0	0	0	0	0	120.9
811	L	25.9	Very low	28.1	Very low	165 Å²	165	135.3 Å²	135.3	86%	0.864	77%	0.771	S	S	*	*			trans	62.3	91.6	162.6	-57	168.9	0	0	0	116.3
812	C	24	Very low	28.4	Very low	119 Å²	119	134 Å²	134	80%	0.804	77%	0.769	S	S	*	*				65.3	143.7	64.6	-53.8	0	0	0	0	114.7
813	P	36.3	Very low	28.7	Very low	118 Å²	118	132.3 Å²	132.3	77%	0.766	77%	0.768	S	S	*	*			cis	-111.6	-178.1	-9.8	41.1	-29.2	0	0	0	111.7
814	T	27	Very low	28.6	Very low	117 Å²	117	132.7 Å²	132.7	72%	0.718	77%	0.765	S	S	*	*			cis	-160.9	137.2	-15.3	22.5	0	0	0	0	105.5
815	V	28.4	Very low	28.5	Very low	125 Å²	125	136.8 Å²	136.8	76%	0.758	78%	0.776	S	S	*	*				63.9	124.7	73.3	177.1	0	0	0	0	113.4
816	I	28.6	Very low	28.5	Very low	158 Å²	158	130.5 Å²	130.5	81%	0.81	77%	0.768	S	S	*	*			cis	-164.9	173.6	-21.9	-126.4	162.1	0	0	0	109
817	D	29.4	Very low	28.4	Very low	140 Å²	140	132.9 Å²	132.9	75%	0.749	78%	0.777	S	S	*	*			trans	-94.8	159.8	179.4	-170.7	19.9	0	0	0	114.3
818	S	29.1	Very low	28.2	Very low	89 Å²	89	132.2 Å²	132.2	62%	0.622	78%	0.783	S	S	*	*			trans	91	145.4	147.4	83.2	0	0	0	0	123.4
819	Q	26.9	Very low	27.9	Very low	190 Å²	190	132.1 Å²	132.1	89%	0.888	78%	0.782	S	S	*	*			trans	85.5	161.8	155.4	-50.3	-149.8	23.3	0	0	121.8
820	R	30.1	Very low	27.8	Very low	233 Å²	233	134.2 Å²	134.2	88%	0.879	78%	0.784	S	S	*	*			trans	-107.8	168.2	-161.1	-52.3	172.4	177	163.4	-3.3	111.7
821	P	30.5	Very low	27.6	Very low	129 Å²	129	137.6 Å²	137.6	84%	0.838	79%	0.786	S	S	*	*				-143.4	177.2	90.1	37	-20.7	0	0	0	115.3
822	T	31.6	Very low	27.7	Very low	124 Å²	124	140 Å²	140	76%	0.761	79%	0.785	S	S	*	*			trans	-87.1	163.3	173.8	49.6	0	0	0	0	112.1
823	P	31.2	Very low	27.7	Very low	117 Å²	117	137.4 Å²	137.4	76%	0.76	78%	0.778	S	S	*	*				-149.8	135	101.3	36.5	-18.5	0	0	0	117.6
824	T	24	Very low	27.3	Very low	124 Å²	124	138.6 Å²	138.6	76%	0.761	78%	0.784	S	S	*	*			trans	24.6	150.5	135.8	64	0	0	0	0	125
825	V	24.1	Very low	27.3	Very low	152 Å²	152	139.2 Å²	139.2	92%	0.921	79%	0.787	S	S	*	*			trans	80	135.2	161.6	-163.8	0	0	0	0	115.5
826	G	25.1	Very low	27.5	Very low	68 Å²	68	138.6 Å²	138.6	70%	0.701	79%	0.785	S	S	*	*			cis	-175.3	-172.3	-1.6	0	0	0	0	0	114.2
827	F	26.1	Very low	27.3	Very low	201 Å²	201	140.2 Å²	140.2	88%	0.882	79%	0.786	S	S	*	*			trans	-69.3	155.2	-179.9	-93.6	-114.2	0	0	0	114.3
828	V	26.2	Very low	27.2	Very low	135 Å²	135	141 Å²	141	82%	0.818	79%	0.79	S	S	*	*				171.5	148.5	112	155.8	0	0	0	0	111
829	D	25.6	Very low	27.1	Very low	133 Å²	133	145.3 Å²	145.3	71%	0.711	80%	0.797	S	S	*	*			trans	-69.7	158.9	-178.5	-53.7	-94.6	0	0	0	116.2
830	C	23.2	Very low	27.1	Very low	116 Å²	116	142.2 Å²	142.2	78%	0.784	79%	0.787	S	S	*	*				-173.9	126.9	113	-96.2	0	0	0	0	116
831	L	27.2	Very low	26.8	Very low	136 Å²	136	138.3 Å²	138.3	71%	0.712	78%	0.781	S	S	*	*			trans	20.2	129.6	135.9	-58.5	166.5	0	0	0	120.5
832	Y	27.3	Very low	26.7	Very low	217 Å²	217	140.3 Å²	140.3	85%	0.851	78%	0.778	S	S	*	*				175.5	134.2	94.9	-106	-75.8	0	0	0	115.1
833	G	24.9	Very low	26.6	Very low	63 Å²	63	140.4 Å²	140.4	65%	0.649	78%	0.779	S	S	*	*			trans	65	157.5	143.6	0	0	0	0	0	121
834	T	26.5	Very low	26.4	Very low	144 Å²	144	138.4 Å²	138.4	88%	0.883	77%	0.772	S	S	*	*			cis	-160.9	158.5	-11	-1.7	0	0	0	0	110.3
835	V	28.1	Very low	26.8	Very low	130 Å²	130	141.6 Å²	141.6	79%	0.788	78%	0.778	S	S	*	*			trans	-106.1	144	-176.3	173.9	0	0	0	0	112.8
836	P	32.2	Very low	26.8	Very low	112 Å²	112	138.7 Å²	138.7	73%	0.727	77%	0.77	S	S	*	*			trans	-111.2	120.6	145.5	1.9	19.6	0	0	0	110.5
837	K	25	Very low	26.9	Very low	191 Å²	191	144.5 Å²	144.5	83%	0.83	78%	0.778	S	S	*	*				60.8	107.7	88.3	-66.7	178.9	180	178.2	0	112.9
838	L	27.2	Very low	28.1	Very low	156 Å²	156	140.3 Å²	140.3	82%	0.817	77%	0.772	S	S	*	*			cis	85.2	113.7	38.9	-167.7	150.4	0	0	0	114.5
839	K	25.7	Very low	29	Very low	180 Å²	180	139.9 Å²	139.9	78%	0.783	77%	0.772	S	S	*	*			trans	174.3	124.3	150	-96.8	-171.1	169.9	-169.8	0	108.7
840	D	27.5	Very low	29.1	Very low	125 Å²	125	136.8 Å²	136.8	67%	0.668	77%	0.771	S	S	*	*				75.9	144.2	84	-63.9	-20.8	0	0	0	113.1
841	M	23.8	Very low	29.2	Very low	152 Å²	152	139.9 Å²	139.9	75%	0.749	78%	0.776	S	S	*	*			cis	-167.2	130	24	-147.5	167.9	74.5	0	0	115.2
842	H	29.1	Very low	28.9	Very low	170 Å²	170	141.2 Å²	141.2	79%	0.787	78%	0.779	S	S	*	*			trans	57.9	178	150	-62.4	47.7	0	0	0	119.4
843	V	27.8	Very low	28.9	Very low	127 Å²	127	141 Å²	141	77%	0.77	78%	0.778	S	S	*	*			cis	-157.7	144.7	23.4	-179.4	0	0	0	0	113.4
844	A	27.9	Very low	29.4	Very low	75 Å²	75	143.7 Å²	143.7	62%	0.62	78%	0.784	S	S	*	*			trans	57.9	163.9	152.3	0	0	0	0	0	124
845	H	31.5	Very low	29.4	Very low	190 Å²	190	143.2 Å²	143.2	88%	0.88	78%	0.776	S	S	*	*			cis	-173	146.3	-33.5	-90.1	-43.7	0	0	0	111.6
846	A	25.4	Very low	29.4	Very low	92 Å²	92	143.3 Å²	143.3	76%	0.76	77%	0.771	S	S	*	*			trans	-171.9	134.1	147.7	0	0	0	0	0	112.4
847	H	26.6	Very low	29.1	Very low	189 Å²	189	144.6 Å²	144.6	88%	0.875	77%	0.768	S	S	*	*			trans	-170.7	178	-171	-102.7	18.1	0	0	0	111.1
848	P	51.9	Low	29.1	Very low	114 Å²	114	142.8 Å²	142.8	74%	0.74	76%	0.762	S	S	*	*			cis	-109.9	-106.9	-19.2	37.3	-19.4	0	0	0	107.7
849	P	44	Very low	29	Very low	126 Å²	126	142.9 Å²	142.9	82%	0.818	76%	0.763	S	S	*	*			cis	-102.5	-175.8	-34.5	41.2	-29.7	0	0	0	112.3
850	G	27.6	Very low	29	Very low	68 Å²	68	138.2 Å²	138.2	70%	0.701	76%	0.758	S	S	*	*			cis	172.3	160.3	-13.5	0	0	0	0	0	113.2
851	M	25.4	Very low	28.9	Very low	180 Å²	180	143.5 Å²	143.5	89%	0.887	77%	0.769	S	S	*	*			trans	68.2	142.7	176.6	-71.7	178.8	159.3	0	0	118.3
852	Q	21.9	Very low	29	Very low	165 Å²	165	144.1 Å²	144.1	77%	0.771	77%	0.774	S	S	*	*			cis	-161.6	155.6	-22.6	-162.3	157.4	-8.6	0	0	110.4
853	Y	25.7	Very low	28.7	Very low	213 Å²	213	143.2 Å²	143.2	84%	0.835	77%	0.768	S	S	*	*			trans	-98.4	169.5	179.7	-98.9	-87.7	0	0	0	113.3
854	P	35.5	Very low	28.5	Very low	118 Å²	118	143.7 Å²	143.7	77%	0.766	76%	0.762	S	S	*	*				-138	142.5	105.4	38	-27.3	0	0	0	116.5
855	D	26.9	Very low	28.3	Very low	135 Å²	135	145.1 Å²	145.1	72%	0.722	76%	0.763	S	S	*	*			trans	5.3	151.2	131.5	-64.6	-20.9	0	0	0	120.3
856	L	28.2	Very low	27.9	Very low	132 Å²	132	143 Å²	143	69%	0.691	76%	0.757	S	S	*	*			cis	-151	-148.3	1.8	-119.6	169.3	0	0	0	108.7
857	Q	25.4	Very low	27.7	Very low	139 Å²	139	143.9 Å²	143.9	65%	0.65	75%	0.749	S	S	*	*			cis	-146.9	-102.8	12.6	-172	97.5	14.2	0	0	113.6
858	Q	26.8	Very low	27.5	Very low	153 Å²	153	143 Å²	143	72%	0.715	74%	0.743	S	S	*	*			trans	-148.5	160.2	-158.3	-81.2	162.7	-47.6	0	0	108.2
859	D	25	Very low	26.1	Very low	157 Å²	157	143.1 Å²	143.1	84%	0.84	74%	0.741	S	S	*	*				-155.4	174.3	53.9	-136.2	-24.5	0	0	0	114.9
860	A	24.4	Very low	25.1	Very low	82 Å²	82	141.9 Å²	141.9	68%	0.678	74%	0.742	S	S	*	*			trans	-153.5	156.2	-178	0	0	0	0	0	116.1
861	R	25.1	Very low	24.9	Very low	237 Å²	237	142.5 Å²	142.5	89%	0.894	75%	0.748	S	S	*	*			trans	96.6	123.7	166	-59.7	173.8	167.5	178.7	-2.7	118.4
862	L	26	Very low	24.7	Very low	165 Å²	165	144.5 Å²	144.5	86%	0.864	75%	0.752	S	S	*	*			trans	179	127.3	131.8	-93.9	157.4	0	0	0	104
863	K	23.8	Very low	24.8	Very low	150 Å²	150	140.1 Å²	140.1	65%	0.652	75%	0.751	S	S	*	*			cis	51.1	136.2	35.2	-74	-173.5	161	-82.3	0	113.1
864	E	23.8	Very low	24.5	Very low	138 Å²	138	136.2 Å²	136.2	65%	0.645	75%	0.754	S	S	*	*			cis	-169.1	162.9	-9.5	-103.3	164.6	168.6	0	0	104.2
865	T	22.9	Very low	24	Very low	104 Å²	104	141.9 Å²	141.9	64%	0.638	76%	0.761	S	S	*	*			cis	-170.7	150.9	14.9	5.9	0	0	0	0	109.3
866	L	23	Very low	23.9	Very low	146 Å²	146	144 Å²	144	76%	0.764	77%	0.766	S	S	*	*			trans	70.2	160.5	146.5	-61.5	169.9	0	0	0	117.8
867	L	21.8	Very low	23.7	Very low	110 Å²	110	145.2 Å²	145.2	58%	0.576	77%	0.774	S	S	*	*			cis	-162.9	161.8	-7.4	-114.3	169.8	0	0	0	114.1
868	F	22.7	Very low	23.8	Very low	171 Å²	171	143 Å²	143	75%	0.75	77%	0.771	S	S	*	*			trans	59.2	157.9	150.5	-73.4	-40.9	0	0	0	120.7
869	T	21.6	Very low	23.8	Very low	116 Å²	116	139.6 Å²	139.6	71%	0.712	77%	0.765	S	S	*	*			cis	-146	125.3	-7	4.8	0	0	0	0	107.1
870	A	23.5	Very low	24	Very low	100 Å²	100	141.2 Å²	141.2	83%	0.826	77%	0.767	S	S	*	*				74.5	122.3	88.6	0	0	0	0	0	116.8
871	G	22.4	Very low	24.3	Very low	81 Å²	81	140.7 Å²	140.7	84%	0.835	76%	0.759	S	S	*	*			trans	-158	127.8	167.1	0	0	0	0	0	110
872	K	22.7	Very low	24.4	Very low	223 Å²	223	133 Å²	133	97%	0.97	74%	0.735	S	S	*	*			trans	-94.9	140.6	-178.2	-71.3	-178.2	177	179.5	0	111.2
873	G	22.7	Very low	24.5	Very low	73 Å²	73	134.7 Å²	134.7	75%	0.753	73%	0.731	S	S	*	*			trans	-157.6	130.7	164.2	0	0	0	0	0	109.6
874	C	20.1	Very low	24.9	Very low	131 Å²	131	133.8 Å²	133.8	89%	0.885	73%	0.733	S	S	*	*			trans	-81.3	148.6	-176.9	-61.7	0	0	0	0	111.7
875	Y	24.2	Very low	25.1	Very low	236 Å²	236	132 Å²	132	93%	0.925	73%	0.725	S	S	*	*			trans	-127.5	153.1	159.7	-96	-86.1	0	0	0	110.6
876	H	25.3	Very low	25.2	Very low	180 Å²	180	133.3 Å²	133.3	83%	0.833	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-74.1	148.6	-175.2	-97.4	-106.5	0	0	0	113.1	P878	H876-P878 WeakPolarHBondContact O-CD 3.18Å
877	D	24.3	Very low	25.5	Very low	157 Å²	157	135.6 Å²	135.6	84%	0.84	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-66.8	125.2	153.1	-94.9	-36.9	0	0	0	109.8
878	P	28.4	Very low	25.8	Very low	92 Å²	92	132.7 Å²	132.7	60%	0.597	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-81.6	144.7	160.5	33.7	-31.1	0	0	0	110.4	H876	H876-P878 WeakPolarHBondContact O-CD 3.18Å
879	S	26.9	Very low	25.9	Very low	83 Å²	83	129.8 Å²	129.8	58%	0.58	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-73	166.6	-171.7	73.2	0	0	0	0	114.3	S881 D882	S879-S881 PolarHBondContact O-N 2.86Å; S879-D882 PolarHBondContact O-N 2.91Å
880	Q	29.1	Very low	26	Very low	190 Å²	190	125.3 Å²	125.3	89%	0.888	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.8	0.5	177.9	-157.3	172.5	13.1	0	0	115.7
881	S	29	Very low	26.2	Very low	72 Å²	72	122.1 Å²	122.1	50%	0.503	64%	0.644	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.3	-40	173.2	-173.5	0	0	0	0	112.8	S879 Y883 L884	S879-S881 PolarHBondContact O-N 2.86Å; S881-Y883 PolarHBondContact O-N 3.32Å; S881-Y883 VanDerWaalsContact O-N 3.15Å; S881-L884 PolarHBondContact O-N 2.88Å
882	D	27.5	Very low	26.5	Very low	74 Å²	74	119.3 Å²	119.3	40%	0.396	61%	0.611	S	S	.	*	H	α-helix	trans	-66.6	-25.2	-167.6	-63.8	20.9	0	0	0	112.5	S879 L884 E885 L886	S879-D882 PolarHBondContact O-N 2.91Å; D882-L884 PolarHBondContact O-N 3.31Å; D882-E885 PolarHBondContact O-N 2.96Å; D882-E885 VanDerWaalsContact O-N 3.13Å; D882-L886 WeakPolarHBondContact O-CD1 3.31Å; D882-L886 PolarHBondContact O-N 3.27Å
883	Y	29.4	Very low	27.1	Very low	202 Å²	202	111 Å²	111	79%	0.792	58%	0.575	S	S	*	*	H	α-helix	trans	-60.9	-24.4	174.7	-165.2	-99.5	0	0	0	113.1	S881	S881-Y883 PolarHBondContact O-N 3.32Å; S881-Y883 VanDerWaalsContact O-N 3.15Å
884	L	31	Very low	27.7	Very low	131 Å²	131	108.9 Å²	108.9	69%	0.686	55%	0.547	S	S	*	.	H	α-helix	trans	-86.1	-32.5	173.9	-72.9	167.5	0	0	0	112.8	S881 D882 R887	S881-L884 PolarHBondContact O-N 2.88Å; D882-L884 PolarHBondContact O-N 3.31Å; L884-R887 PolarHBondContact O-N 3.34Å
885	E	29.1	Very low	28.7	Very low	100 Å²	100	103.1 Å²	103.1	47%	0.467	51%	0.508	S	S	.	.	H	α-helix	trans	-76.7	-29.7	175.4	-70.3	-148.8	134.3	0	0	113	K123 D882 R887 A888	K123-E885 IonicContact NZ-OE1 3.2Å; K123-E885 PolarHBondContact NZ-OE1 2.88Å; D882-E885 PolarHBondContact O-N 2.96Å; D882-E885 VanDerWaalsContact O-N 3.13Å; E885-R887 PolarHBondContact O-N 2.84Å; E885-A888 WeakPolarHBondContact O-CB 3.44Å; E885-A888 PolarHBondContact O-N 3.49Å; E885-A888 VanDerWaalsContact O-N 3.09Å
886	L	25.2	Very low	29.5	Very low	132 Å²	132	94 Å²	94	69%	0.691	47%	0.472	S	S	*	.	H	α-helix	trans	-63.9	-30.1	171.3	-95.5	91	0	0	0	112.8	D882 A888	D882-L886 WeakPolarHBondContact O-CD1 3.31Å; D882-L886 PolarHBondContact O-N 3.27Å; L886-A888 PolarHBondContact O-N 3.29Å
887	R	28	Very low	30	Very low	194 Å²	194	85.8 Å²	85.8	73%	0.732	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-13	174.8	-167.1	169.9	-179.7	156	5	112.9	Y145 L884 E885	Y145-R887 WeakPolarHBondContact CE1-O 3.46Å; L884-R887 PolarHBondContact O-N 3.34Å; E885-R887 PolarHBondContact O-N 2.84Å
888	A	28.1	Very low	30.6	Very low	48 Å²	48	81.1 Å²	81.1	40%	0.397	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	5	-172.3	0	0	0	0	0	115.7	Y145 E885 L886	Y145-A888 WeakPolarHBondContact CD1-O 3.45Å; E885-A888 WeakPolarHBondContact O-CB 3.44Å; E885-A888 PolarHBondContact O-N 3.49Å; E885-A888 VanDerWaalsContact O-N 3.09Å; L886-A888 PolarHBondContact O-N 3.29Å
889	K	25.2	Very low	31	Very low	110 Å²	110	78.8 Å²	78.8	48%	0.478	39%	0.391	S	S	.	.	S	Bend	trans	-112.3	36	-174.3	-65.7	-177.3	175	177.6	0	114.1	E121 R522 R523	E121-K889 WeakPolarHBondContact OE1-CA 3.26Å; R522-K889 PolarHBondContact NH2-O 2.92Å; R523-K889 PolarHBondContact NH2-O 3.46Å
890	L	24.2	Very low	31.5	Very low	22 Å²	22	75.3 Å²	75.3	12%	0.115	37%	0.366	C	S	.	.			trans	-138.1	-1.9	-155.2	-113.1	170.9	0	0	0	122.6	E121 Y145 Y476 N500 R523	E121-L890 PolarHBondContact OE1-N 2.8Å; Y145-L890 HydrophobicContact CE1-CB 3.91Å; Y476-L890 HydrophobicContact CE1-CD1 3.73Å; N500-L890 WeakPolarHBondContact ND2-CD2 3.33Å; N500-L890 WeakPolarHBondContact OD1-CD2 3.35Å; R523-L890 VanDerWaalsContact NH1-CG 3.28Å
891	Q	26.6	Very low	31.8	Very low	33 Å²	33	71.5 Å²	71.5	15%	0.154	35%	0.349	C	S	.	.			trans	-135.6	141.3	152.5	-55	165	60.8	0	0	109.1	Y145 N168 D169	Y145-Q891 HydrophobicContact CD2-CB 3.7Å; Y145-Q891 HydrophobicContact CD2-CG 4.39Å; Y145-Q891 VanDerWaalsContact CD2-N 3.35Å; Y145-Q891 WeakPolarHBondContact CD2-O 3.47Å; Y145-Q891 HydrophobicContact CE2-CB 3.23Å; Y145-Q891 HydrophobicContact CE2-CG 3.43Å; Y145-Q891 VanDerWaalsContact CE2-CG 3.43Å; Y145-Q891 VanDerWaalsContact CZ-N 3.25Å; Y145-Q891 PolarHBondContact OH-NE2 2.9Å; N168-Q891 PolarHBondContact ND2-OE1 3.28Å; D169-Q891 VanDerWaalsContact CG-NE2 3.32Å; D169-Q891 PolarHBondContact OD1-NE2 3.25Å; D169-Q891 PolarHBondContact OD2-NE2 2.88Å
892	T	28.4	Very low	32	Very low	23 Å²	23	73.7 Å²	73.7	14%	0.141	35%	0.349	C	S	.	.			trans	-148.1	74.5	170.7	55.8	0	0	0	0	103.7	H120 E121 R522 H547	H120-T892 HydrophobicContact CB-CG2 4.29Å; H120-T892 WeakPolarHBondContact ND1-CG2 3.36Å; E121-T892 HydrophobicContact CG-CG2 3.95Å; R522-T892 PolarHBondContact NH1-OG1 2.87Å; H547-T892 WeakPolarHBondContact NE2-CB 3.38Å; H547-T892 PolarHBondContact NE2-OG1 2.89Å
893	K	35.5	Very low	32.2	Very low	49 Å²	49	73.3 Å²	73.3	21%	0.213	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-61.3	147.2	-179.5	-83.2	-177	166.4	-173.8	0	110.6	Q142 I166 D189 R191	Q142-K893 PolarHBondContact NE2-O 3.24Å; Q142-K893 PolarHBondContact OE1-O 3.48Å; I166-K893 HydrophobicContact CD1-CB 4.16Å; D189-K893 WeakPolarHBondContact OD2-CE 3.34Å; D189-K893 IonicContact OD2-NZ 3.72Å; D189-K893 PolarHBondContact OD2-NZ 2.8Å; R191-K893 VanDerWaalsContact NH2-CE 3.26Å
894	P	36.5	Very low	32.5	Very low	28 Å²	28	71.7 Å²	71.7	18%	0.182	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-80.5	169.9	178.4	27.1	-28.8	0	0	0	114.4	Y140 Q543 V572	Y140-P894 PolarHBondContact OH-O 3.02Å; Q543-P894 HydrophobicContact CG-CG 3.79Å; Q543-P894 VanDerWaalsContact NE2-CG 3.31Å; V572-P894 HydrophobicContact CB-CB 3.83Å; V572-P894 HydrophobicContact CG1-CB 3.41Å; V572-P894 VanDerWaalsContact CG1-CB 3.41Å; V572-P894 HydrophobicContact CG2-CB 4.34Å
895	D	41.2	Very low	32.3	Very low	10 Å²	10	76.2 Å²	76.2	5%	0.053	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-71.7	133	-173.5	-164.8	-30.8	0	0	0	113.7	R116 Y140 L897	R116-D895 WeakPolarHBondContact CD-OD2 3.35Å; R116-D895 WeakPolarHBondContact CG-OD2 3.34Å; R116-D895 IonicContact CZ-OD2 3.6Å; R116-D895 IonicContact NE-OD2 2.66Å; R116-D895 PolarHBondContact NE-OD2 3.29Å; R116-D895 IonicContact NH1-OD2 3.88Å; R116-D895 PolarHBondContact NH1-OD2 3.19Å; Y140-D895 HydrophobicContact CD2-CB 4.46Å; Y140-D895 VanDerWaalsContact CD2-OD1 3.24Å; Y140-D895 WeakPolarHBondContact CD2-OD1 3.48Å; Y140-D895 HydrophobicContact CE2-CB 4.15Å; D895-L897 PolarHBondContact OD1-N 2.86Å
896	Y	40	Very low	32.3	Very low	44 Å²	44	84 Å²	84	17%	0.173	39%	0.387	C	S	.	.			trans	-95.9	-20.1	-172.6	-110.5	-103.6	0	0	0	114.4	H187 E213 E898 V899 L900	H187-Y896 HydrophobicContact CB-CD1 4.48Å; H187-Y896 AromaticContact CD2-CD1 3.29Å; H187-Y896 WeakPolarHBondContact CD2-CD1 3.49Å; H187-Y896 AromaticContact CD2-CE1 3.06Å; H187-Y896 WeakPolarHBondContact CD2-CE1 3.32Å; H187-Y896 AromaticContact CD2-CZ 3.96Å; H187-Y896 AromaticContact CG-CD1 3.67Å; H187-Y896 AromaticContact CG-CE1 3.9Å; H187-Y896 AromaticContact NE2-CD1 3.59Å; H187-Y896 AromaticContact NE2-CE1 3.41Å; H187-Y896 WeakPolarHBondContact NE2-CE1 3.26Å; E213-Y896 WeakPolarHBondContact OE2-CE1 3.49Å; E213-Y896 PolarHBondContact OE2-OH 2.93Å; Y896-E898 PolarHBondContact O-N 3.44Å; Y896-V899 PolarHBondContact O-N 3.14Å; Y896-L900 WeakPolarHBondContact O-CG 3.48Å; Y896-L900 PolarHBondContact O-N 3.39Å
897	L	36.8	Very low	32.6	Very low	8 Å²	8	81.7 Å²	81.7	4%	0.042	37%	0.371	C	S	.	.	H	α-helix	trans	-70.5	-33.2	-166.9	-112.4	118.9	0	0	0	113.4	E139 R163 V164 D895 V899 L900 E901	E139-L897 VanDerWaalsContact C-CD1 3.4Å; E139-L897 HydrophobicContact CB-CD1 3.65Å; E139-L897 HydrophobicContact CB-CD2 3.81Å; E139-L897 HydrophobicContact CB-CG 4.39Å; E139-L897 HydrophobicContact CG-CD2 4.33Å; E139-L897 VanDerWaalsContact O-CD1 3.23Å; E139-L897 WeakPolarHBondContact O-CD1 3.48Å; R163-L897 HydrophobicContact CB-CD1 4.29Å; V164-L897 HydrophobicContact CB-CD1 4.33Å; V164-L897 HydrophobicContact CG2-CD1 3.79Å; V164-L897 HydrophobicContact CG2-CG 4.39Å; D895-L897 PolarHBondContact OD1-N 2.86Å; L897-V899 VanDerWaalsContact C-N 3.34Å; L897-L900 PolarHBondContact O-N 3.2Å; L897-E901 PolarHBondContact O-N 3.44Å
898	E	35.9	Very low	32.8	Very low	58 Å²	58	75.7 Å²	75.7	27%	0.271	35%	0.352	S	S	.	.	H	α-helix	trans	-73.3	-28.6	-179.6	-140	161.8	148.7	0	0	112.5	R116 V570 Y896	R116-E898 IonicContact CZ-OE2 3.83Å; R116-E898 IonicContact NH1-OE2 2.9Å; R116-E898 PolarHBondContact NH1-OE2 3.24Å; R116-E898 IonicContact NH2-OE2 3.41Å; R116-E898 PolarHBondContact NH2-OE2 2.96Å; V570-E898 HydrophobicContact CB-CG 4.45Å; V570-E898 HydrophobicContact CG1-CB 4.27Å; V570-E898 HydrophobicContact CG1-CG 4.04Å; V570-E898 HydrophobicContact CG2-CG 4.11Å; Y896-E898 PolarHBondContact O-N 3.44Å
899	V	37.3	Very low	33.1	Very low	43 Å²	43	77.3 Å²	77.3	26%	0.261	35%	0.35	S	S	.	.	H	α-helix	trans	-67.3	-39.5	171.2	-175.4	0	0	0	0	110.3	V542 Y896 L897 K902 S903	V542-V899 HydrophobicContact CG1-CG2 4.23Å; Y896-V899 PolarHBondContact O-N 3.14Å; L897-V899 VanDerWaalsContact C-N 3.34Å; V899-K902 PolarHBondContact O-N 3.08Å; V899-S903 PolarHBondContact O-N 3.2Å
900	L	36.6	Very low	33.6	Very low	10 Å²	10	75.4 Å²	75.4	5%	0.052	34%	0.342	C	S	.	.	H	α-helix	trans	-69.9	-41	-177.2	-70.5	166.3	0	0	0	113.5	V164 T186 H187 M212 Y896 L897 K902 S903 Y904	V164-L900 HydrophobicContact CG2-CD1 4.46Å; T186-L900 WeakPolarHBondContact OG1-CD1 3.27Å; H187-L900 VanDerWaalsContact CE1-CD2 3.43Å; H187-L900 WeakPolarHBondContact CE1-CD2 3.49Å; M212-L900 HydrophobicContact CE-CD2 4.19Å; M212-L900 HydrophobicContact SD-CD2 3.47Å; M212-L900 WeakPolarHBondContact SD-CD2 3.35Å; Y896-L900 WeakPolarHBondContact O-CG 3.48Å; Y896-L900 PolarHBondContact O-N 3.39Å; L897-L900 PolarHBondContact O-N 3.2Å; L900-K902 PolarHBondContact O-N 2.94Å; L900-S903 PolarHBondContact O-N 3.44Å; L900-S903 VanDerWaalsContact O-N 3.08Å; L900-S903 PolarHBondContact O-OG 3.15Å; L900-Y904 WeakPolarHBondContact O-CD2 3.49Å
901	E	35.6	Very low	34.2	Very low	111 Å²	111	78.7 Å²	78.7	52%	0.519	36%	0.357	S	S	.	.	H	α-helix	trans	-70.9	-17.7	-178.4	-61.2	-161.6	157.2	0	0	112.8	R163 L897	R163-E901 IonicContact CZ-OE1 3.55Å; R163-E901 IonicContact NH1-OE1 3.82Å; R163-E901 PolarHBondContact NH1-OE1 2.91Å; R163-E901 IonicContact NH2-OE1 2.71Å; L897-E901 PolarHBondContact O-N 3.44Å
902	K	33.3	Very low	34.7	Very low	117 Å²	117	81.7 Å²	81.7	51%	0.509	37%	0.37	S	S	.	.	H	α-helix	trans	-82.3	-29.3	166.5	-75.5	-170.5	177.8	170.9	0	114.1	V570 V899 L900 Y904	V570-K902 HydrophobicContact CG1-CD 4Å; V570-K902 VanDerWaalsContact CG2-NZ 3.27Å; V899-K902 PolarHBondContact O-N 3.08Å; L900-K902 PolarHBondContact O-N 2.94Å; K902-Y904 PolarHBondContact O-N 3.21Å
903	S	33.2	Very low	35.1	Very low	66 Å²	66	85.9 Å²	85.9	46%	0.462	39%	0.386	S	S	.	.	H	α-helix	trans	-70.2	-18.3	180	64.3	0	0	0	0	114.1	V899 L900	V899-S903 PolarHBondContact O-N 3.2Å; L900-S903 PolarHBondContact O-N 3.44Å; L900-S903 VanDerWaalsContact O-N 3.08Å; L900-S903 PolarHBondContact O-OG 3.15Å
904	Y	34	Very low	35.1	Very low	169 Å²	169	88.8 Å²	88.8	66%	0.663	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	15.5	-179.4	-80.3	-71.2	0	0	0	115	M212 L900 K902	M212-Y904 HydrophobicContact CE-CE1 4.43Å; M212-Y904 HydrophobicContact CE-CE2 3.78Å; M212-Y904 WeakPolarHBondContact CE-OH 3.48Å; L900-Y904 WeakPolarHBondContact O-CD2 3.49Å; K902-Y904 PolarHBondContact O-N 3.21Å
905	R	27.7	Very low	35	Very low	226 Å²	226	93.8 Å²	93.8	85%	0.853	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125	21.5	-178.5	-78.6	-166.6	173.8	-168.3	1.5	115.4
906	F	28.1	Very low	34.4	Very low	264 Å²	264	101.5 Å²	101.5	100%	1.158	45%	0.451	S	S	*	.			trans	-123.9	0	169.8	-82.9	-80.2	0	0	0	110.9

Retrieved 906 of 906 residues in 1752.8 ms (Link to these results)

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