A0A077YXZ0_TRITR Loading...

NIDO and Sushi and VWD and AMOP domain containing protein

AlphaFold DB , UniProt , Accession A0A077YXZ0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,247 aa.

						>A0A077YXZ0_TRITR|A0A077YXZ0
MGVLVFSACALLVAHTLVLVKHGAVGQFPQLPLDPQESPRTDFQPSPFNILTGFEPRPPGTGVSTDGQAFRISGQNLKNIDWTLIDRRAEEGWWHLYQFGERYYDVDITWRPWRDLQIDLDFFLPFYGFRFNYTFVFPEGFIAFSYPQYIQPPYTMPNRHWPQEPDSSLVAAFMGEQSFVHVGDTRLSHVWYRVVTRPINMINPFGAEFSLRPQQQTFVGPTLPPELAGHRIPIRTYAGQQLKTAFGRIEDPELLDIITRDIQHGMVGARGFKADYALIVTWERMGYGGAPKVTELNLYDTVKKWQNTYQMVIATDEIRTYVMFNYANVNWTSSTQAGALFGRGGKQSALVGFNGGNGTGWYSLPWSADGNSYKLVQYGSTQVAGRWLARVDEEIEYGGCSNNSIGVLQLDKPQATMLGGFTLNVTGPCFRVTDVLKMQIDENTLDCERLDMVMARCVVPVNSIFKTGQVIIRLSVDGGKNYPWWNKFYVLMPSLARRQVNLLNDPVGLKNNWRNFNPDNLTLTWPNYNISVNPNAQVDITLWGYWEDVLGHRFTEVGSIARNTPNRGVYSFNPRTLAKTDMLRDAWRQFSGGLVQIRVSQDWMKDRGDGYSHSIYWSDLVPFGWYFHDVWQYQLGSNWATDMCIDWFQYDGRRENFYMFLENKQPCPCTLDQAVVDVGRYVALSDCDINGDHKCYYTQGAQHCVVATRSVWTGAGQVCCYDWQGWLMFSQDYEFNDQYLRFYSAGVPYRAHPWGSFPYKRPPYVPSMSNFYNDLLPYEYCCKWAGHCEFYFWRRISSGCQDYRPPAVGYIYGEGHFITYDGTRYTFNGKGYYVLTMLKSRSNNMMVQVRMEQPPKTMWNANVMATVVTGVAAQDNDSAIVEIYARKEFRRWRYKTDVYVDNARVFFDTPWQKLQTFKGVTIRSRPRNMNMSALEVMFDTGLGLLVEEARGTLNVMVSVPPEYNETFAYRTDTFGYPRTEAATGIFGTGKCANFYRTMGLLGTFNNDKRDDLTTPDCNVVNTNYPASEIEARNVYYEFGERWRADGIRHHLLFQTKFQPIYNPISFASSHYQPIFDPWRNQNATFWESLIFSREEVTCQGSPPCEFDYLTTGRREIGLDTLMNERKFEELKRLGEKKTISCGPLQKNIGVLKYPPGNNYLDGVTVTFTCQPEYFLHGDQQRTCINGTWSPGWWPWCRWRDEEYALKWFTGIIVSLLILGAIIAIFLYCNSLKNQKLKQRGRPYAIGR
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.1	Very low	33.3	Very low	249 Å²	249	137.7 Å²	137.7	100%	1.227	83%	0.829	S	S	*	*				0	123	0	-79.2	-178.9	178.3	0	0	108.4
2	G	35.2	Very low	33.2	Very low	64 Å²	64	140.2 Å²	140.2	66%	0.66	83%	0.833	S	S	*	*			trans	78.9	67	158.7	0	0	0	0	0	118.4	L4	G2-L4 PolarHBondContact O-N 2.89Å
3	V	33.3	Very low	33.4	Very low	155 Å²	155	139.5 Å²	139.5	94%	0.939	83%	0.83	S	S	*	*			trans	-70	48.7	159.5	178.4	0	0	0	0	110.1
4	L	33.1	Very low	33.3	Very low	153 Å²	153	134.9 Å²	134.9	80%	0.801	82%	0.815	S	S	*	*			trans	-127.4	26.8	-165.8	-95	167.4	0	0	0	115.1	G2	G2-L4 PolarHBondContact O-N 2.89Å
5	V	37.3	Very low	33.2	Very low	131 Å²	131	138.2 Å²	138.2	79%	0.794	82%	0.818	S	S	*	*	S	Bend	trans	-111.4	-8.4	175.6	-174.7	0	0	0	0	113.8
6	F	32.7	Very low	33.1	Very low	217 Å²	217	138.1 Å²	138.1	95%	0.952	82%	0.819	S	S	*	*	S	Bend	trans	-93.7	6.2	-177.3	-97.6	-80	0	0	0	116.9
7	S	34.3	Very low	32.9	Very low	96 Å²	96	139.3 Å²	139.3	67%	0.671	82%	0.819	S	S	*	*	S	Bend	trans	-115.7	10.2	-174.8	-161.7	0	0	0	0	116.5
8	A	32	Very low	32.9	Very low	87 Å²	87	138.2 Å²	138.2	72%	0.719	81%	0.814	S	S	*	*	S	Bend	trans	-102.7	-6.9	-176.6	0	0	0	0	0	116
9	C	31.7	Very low	32.8	Very low	125 Å²	125	138.6 Å²	138.6	85%	0.845	81%	0.811	S	S	*	*	S	Bend	trans	-101.3	0.2	177.8	-81	0	0	0	0	115.2
10	A	34.4	Very low	32.8	Very low	87 Å²	87	137.3 Å²	137.3	72%	0.719	81%	0.805	S	S	*	*	S	Bend	trans	-92.7	-1.5	-178.4	0	0	0	0	0	114.9
11	L	31.9	Very low	32.6	Very low	151 Å²	151	139.4 Å²	139.4	79%	0.791	80%	0.804	S	S	*	*	S	Bend	trans	-111.2	7.4	-170.5	-98.3	152.5	0	0	0	115.8
12	L	32	Very low	32.6	Very low	167 Å²	167	135.6 Å²	135.6	87%	0.874	78%	0.783	S	S	*	*	S	Bend	trans	-108.5	8.6	178.8	-99.8	153.8	0	0	0	115.2
13	V	36	Very low	32.3	Very low	132 Å²	132	136.6 Å²	136.6	80%	0.8	79%	0.793	S	S	*	*	S	Bend	trans	-111.5	-2.3	-179.5	-173.1	0	0	0	0	113.6
14	A	32	Very low	32.2	Very low	75 Å²	75	133.6 Å²	133.6	62%	0.62	79%	0.785	S	S	*	*	S	Bend	trans	-95.6	-1.4	-170.8	0	0	0	0	0	116.8
15	H	30.5	Very low	32.1	Very low	184 Å²	184	132.7 Å²	132.7	85%	0.852	79%	0.785	S	S	*	*	S	Bend	trans	-131.8	67.6	-178.8	-80.6	-50.3	0	0	0	113.5
16	T	32.2	Very low	31.7	Very low	137 Å²	137	129.2 Å²	129.2	84%	0.84	78%	0.776	S	S	*	*			trans	-162.7	50.9	150.2	8	0	0	0	0	110.4	V18	T16-V18 VanDerWaalsContact C-N 3.29Å
17	L	30.2	Very low	31.4	Very low	158 Å²	158	127.1 Å²	127.1	83%	0.827	77%	0.769	S	S	*	*			trans	-96.8	58.3	162.6	-103.4	148.6	0	0	0	108.5	L19	L17-L19 PolarHBondContact O-N 2.75Å
18	V	32.8	Very low	31	Very low	119 Å²	119	131.7 Å²	131.7	72%	0.721	78%	0.777	S	S	*	*			trans	-86.7	98.4	164.9	178.4	0	0	0	0	106.6	T16 V20	T16-V18 VanDerWaalsContact C-N 3.29Å; V18-V20 VanDerWaalsContact C-N 3.34Å; V18-V20 HydrophobicContact CG1-CG2 4.23Å; V18-V20 PolarHBondContact O-N 2.76Å
19	L	30.5	Very low	30.9	Very low	146 Å²	146	133.1 Å²	133.1	76%	0.764	78%	0.779	S	S	*	*			trans	-53.3	90.5	166.5	-82.4	126.1	0	0	0	110.4	L17 K21	L17-L19 PolarHBondContact O-N 2.75Å; L19-K21 PolarHBondContact O-N 3.15Å
20	V	32.4	Very low	30.6	Very low	112 Å²	112	135.4 Å²	135.4	68%	0.679	78%	0.777	S	S	*	*			trans	-89.5	88.2	157.9	-176.7	0	0	0	0	107.4	V18 H22	V18-V20 VanDerWaalsContact C-N 3.34Å; V18-V20 HydrophobicContact CG1-CG2 4.23Å; V18-V20 PolarHBondContact O-N 2.76Å; V20-H22 VanDerWaalsContact C-N 3.29Å; V20-H22 PolarHBondContact O-N 2.86Å
21	K	28.7	Very low	30.3	Very low	182 Å²	182	138.6 Å²	138.6	79%	0.791	78%	0.781	S	S	*	*			trans	-56.6	90.7	159.1	-84.2	178.8	169.2	178.3	0	108.7	L19	L19-K21 PolarHBondContact O-N 3.15Å
22	H	32.5	Very low	30.1	Very low	170 Å²	170	136.7 Å²	136.7	79%	0.787	78%	0.778	S	S	*	*			trans	-122.6	96.3	153.9	-88.9	3.4	0	0	0	108.2	V20 A24	V20-H22 VanDerWaalsContact C-N 3.29Å; V20-H22 PolarHBondContact O-N 2.86Å; H22-A24 VanDerWaalsContact C-N 3.29Å; H22-A24 PolarHBondContact O-N 3.29Å
23	G	27.8	Very low	29.8	Very low	85 Å²	85	136.2 Å²	136.2	88%	0.876	78%	0.776	S	S	*	*			trans	-63.2	94.1	163.8	0	0	0	0	0	108.7
24	A	31.5	Very low	29.6	Very low	92 Å²	92	136.1 Å²	136.1	76%	0.76	77%	0.771	S	S	*	*			trans	-101.6	91.5	148.4	0	0	0	0	0	105	H22 G26	H22-A24 VanDerWaalsContact C-N 3.29Å; H22-A24 PolarHBondContact O-N 3.29Å; A24-G26 PolarHBondContact O-N 3.49Å
25	V	30.9	Very low	29.3	Very low	134 Å²	134	137 Å²	137	81%	0.812	77%	0.77	S	S	*	*			trans	-61.4	86.1	156	177.5	0	0	0	0	104.3	Q27	V25-Q27 PolarHBondContact O-N 2.82Å
26	G	29.7	Very low	29.2	Very low	57 Å²	57	136.8 Å²	136.8	59%	0.588	77%	0.769	S	S	*	*			trans	-62.3	96.8	164.1	0	0	0	0	0	104.8	A24 F28	A24-G26 PolarHBondContact O-N 3.49Å; G26-F28 PolarHBondContact O-N 3.49Å
27	Q	26.3	Very low	29	Very low	174 Å²	174	136.6 Å²	136.6	81%	0.813	76%	0.759	S	S	*	*			trans	-49.2	103.9	157.8	-80.6	176.8	-32.3	0	0	104.9	V25 P29	V25-Q27 PolarHBondContact O-N 2.82Å; Q27-P29 WeakPolarHBondContact O-CD 2.84Å
28	F	26.1	Very low	28.9	Very low	192 Å²	192	132.8 Å²	132.8	84%	0.842	75%	0.745	S	S	*	*			trans	-48.7	120.8	156.6	-89.5	-90.3	0	0	0	104.2	G26 Q30	G26-F28 PolarHBondContact O-N 3.49Å; F28-Q30 PolarHBondContact O-N 3.31Å
29	P	29.9	Very low	28.9	Very low	116 Å²	116	131.9 Å²	131.9	75%	0.753	74%	0.742	S	S	*	*			trans	-53.5	114.8	171.2	20.5	-28	0	0	0	104.5	Q27 L31	Q27-P29 WeakPolarHBondContact O-CD 2.84Å; P29-L31 PolarHBondContact O-N 2.87Å
30	Q	24	Very low	29.1	Very low	173 Å²	173	133.6 Å²	133.6	81%	0.808	74%	0.738	S	S	*	*			trans	-50.3	116.1	169.9	-78	-172.3	-34.1	0	0	104.4	F28 P32	F28-Q30 PolarHBondContact O-N 3.31Å; Q30-P32 WeakPolarHBondContact O-CD 3.29Å
31	L	29.5	Very low	29.4	Very low	154 Å²	154	130.4 Å²	130.4	81%	0.806	72%	0.719	S	S	*	*			trans	-43.1	119.2	163.4	-84.1	150.3	0	0	0	104.9	P29 L33	P29-L31 PolarHBondContact O-N 2.87Å; L31-L33 PolarHBondContact O-N 2.9Å
32	P	27.7	Very low	30.1	Very low	112 Å²	112	127.4 Å²	127.4	73%	0.727	71%	0.712	S	S	*	*			trans	-54.1	110.9	177.9	18.7	-28.7	0	0	0	106.3	Q30 D34	Q30-P32 WeakPolarHBondContact O-CD 3.29Å; P32-D34 PolarHBondContact O-N 3.21Å
33	L	25.6	Very low	30.6	Very low	157 Å²	157	120.8 Å²	120.8	82%	0.822	68%	0.681	S	S	*	*			trans	-51.7	114.5	171	-87.7	149.3	0	0	0	105.7	L31 P35	L31-L33 PolarHBondContact O-N 2.9Å; L33-P35 WeakPolarHBondContact O-CD 3.47Å
34	D	31.5	Very low	31.7	Very low	130 Å²	130	122.3 Å²	122.3	70%	0.695	67%	0.665	S	S	*	*			trans	-43.4	102.1	-175.5	-92.1	-39.2	0	0	0	109.8	P32 Q36	P32-D34 PolarHBondContact O-N 3.21Å; D34-Q36 PolarHBondContact O-N 3.33Å
35	P	25.6	Very low	32.6	Very low	92 Å²	92	118.8 Å²	118.8	60%	0.597	64%	0.635	S	S	*	*			trans	-74.9	102.9	175.8	26.9	-23.1	0	0	0	104.9	L33 E37	L33-P35 WeakPolarHBondContact O-CD 3.47Å; P35-E37 PolarHBondContact O-N 2.86Å
36	Q	27	Very low	33.5	Very low	181 Å²	181	112.5 Å²	112.5	85%	0.846	60%	0.596	S	S	*	*			trans	27.3	84.7	166.3	-68.9	-167.8	-16	0	0	111.7	D34 S38	D34-Q36 PolarHBondContact O-N 3.33Å; Q36-S38 PolarHBondContact O-N 3.34Å
37	E	28.9	Very low	34.2	Very low	132 Å²	132	113.2 Å²	113.2	62%	0.617	59%	0.591	S	S	*	*			trans	-62.4	81.7	163.8	-79.6	-170.4	149.1	0	0	107.5	P35	P35-E37 PolarHBondContact O-N 2.86Å
38	S	28.1	Very low	35	Very low	78 Å²	78	110 Å²	110	55%	0.545	58%	0.575	S	S	.	*			trans	-47.6	139.5	139.2	53.3	0	0	0	0	105.8	Q36 R40	Q36-S38 PolarHBondContact O-N 3.34Å; S38-R40 VanDerWaalsContact C-N 3.29Å; S38-R40 PolarHBondContact O-N 2.82Å
39	P	33.8	Very low	35.6	Very low	100 Å²	100	105.9 Å²	105.9	65%	0.649	56%	0.561	S	S	*	*			trans	-54.1	104.5	173.6	22.8	-30.5	0	0	0	105.7	T41	P39-T41 HydrophobicContact CB-CG2 4.48Å; P39-T41 PolarHBondContact O-N 3.19Å
40	R	33.8	Very low	36.1	Very low	182 Å²	182	102.1 Å²	102.1	69%	0.687	53%	0.534	S	S	*	.			trans	-70.1	81	-178.9	-86.3	-169.3	-171.8	-157.6	4.6	106.1	S38 D42	S38-R40 VanDerWaalsContact C-N 3.29Å; S38-R40 PolarHBondContact O-N 2.82Å; R40-D42 PolarHBondContact O-N 2.87Å
41	T	39.7	Very low	36.7	Very low	46 Å²	46	98.9 Å²	98.9	28%	0.282	52%	0.522	S	S	.	.			trans	-81.2	18.1	167.5	54.9	0	0	0	0	111	P39 F43 Y397	P39-T41 HydrophobicContact CB-CG2 4.48Å; P39-T41 PolarHBondContact O-N 3.19Å; T41-F43 PolarHBondContact O-N 3.44Å; T41-Y397 HydrophobicContact CG2-CE2 4.37Å
42	D	41.9	Very low	37.2	Very low	119 Å²	119	98.3 Å²	98.3	64%	0.636	53%	0.525	S	S	*	.			trans	-72.2	56.5	167.5	-82.2	-9.9	0	0	0	109.4	R40 Q44 N403	R40-D42 PolarHBondContact O-N 2.87Å; D42-Q44 VanDerWaalsContact C-N 3.27Å; D42-Q44 PolarHBondContact O-N 3.31Å; D42-N403 PolarHBondContact O-ND2 2.88Å
43	F	44.6	Very low	37.9	Very low	30 Å²	30	95.5 Å²	95.5	13%	0.132	52%	0.516	C	S	.	.			trans	-63.2	92.5	162.1	-179	-92.3	0	0	0	106.6	T41 P45 P365 W387 C400	T41-F43 PolarHBondContact O-N 3.44Å; F43-P45 WeakPolarHBondContact O-CD 3.38Å; F43-P365 HydrophobicContact CD1-CG 4.06Å; F43-P365 WeakPolarHBondContact O-CG 3.43Å; F43-W387 AromaticContact CD1-CZ3 3.91Å; F43-W387 HydrophobicContact CD1-CZ3 3.91Å; F43-W387 HydrophobicContact CE1-CE3 4.28Å; F43-W387 AromaticContact CE1-CZ3 3.66Å; F43-W387 HydrophobicContact CE1-CZ3 3.66Å; F43-C400 VanDerWaalsContact CZ-O 3.22Å; F43-C400 WeakPolarHBondContact CZ-O 3.17Å
44	Q	50.2	Low	38.6	Very low	118 Å²	118	95.3 Å²	95.3	55%	0.551	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-79.1	124.5	171.9	-63.3	-156.8	-22.3	0	0	109.6	D42 S401 N402 N403	D42-Q44 VanDerWaalsContact C-N 3.27Å; D42-Q44 PolarHBondContact O-N 3.31Å; Q44-S401 PolarHBondContact N-OG 3.07Å; Q44-S401 VanDerWaalsContact O-CA 3.23Å; Q44-S401 WeakPolarHBondContact O-CA 3.39Å; Q44-S401 VanDerWaalsContact O-CB 3.29Å; Q44-S401 WeakPolarHBondContact O-CB 3.32Å; Q44-S401 PolarHBondContact O-OG 2.04Å; Q44-N402 PolarHBondContact O-N 3.22Å; Q44-N402 VanDerWaalsContact O-N 3.08Å; Q44-N403 WeakPolarHBondContact CB-OD1 3.13Å; Q44-N403 WeakPolarHBondContact CG-OD1 3.49Å; Q44-N403 PolarHBondContact N-OD1 3.36Å
45	P	51	Low	39.3	Very low	18 Å²	18	94.4 Å²	94.4	12%	0.117	50%	0.501	C	S	.	.	P	Polyproline II helix	trans	-73.9	168.4	-173.9	26.4	-30.1	0	0	0	112.5	F43 P365 W366 W387	F43-P45 WeakPolarHBondContact O-CD 3.38Å; P45-P365 HydrophobicContact CG-CB 4.38Å; P45-P365 HydrophobicContact CG-CG 4.49Å; P45-W366 HydrophobicContact CB-CH2 4.2Å; P45-W366 HydrophobicContact CG-CH2 3.11Å; P45-W366 HydrophobicContact CG-CZ2 3.71Å; P45-W366 HydrophobicContact CG-CZ3 3.73Å; P45-W387 HydrophobicContact CB-CH2 3.59Å; P45-W387 HydrophobicContact CB-CZ2 4.44Å; P45-W387 HydrophobicContact CB-CZ3 4.24Å; P45-W387 HydrophobicContact CG-CH2 4.03Å
46	S	48.9	Very low	40.3	Very low	1 Å²	1	95.5 Å²	95.5	1%	0.007	51%	0.508	C	S	.	.	P	Polyproline II helix	trans	-69.2	130.8	176.6	78.3	0	0	0	0	112.2	F48 Y378 N402 C429	S46-F48 PolarHBondContact O-N 3.43Å; S46-Y378 WeakPolarHBondContact O-CD1 3.37Å; S46-N402 WeakPolarHBondContact CA-ND2 3.48Å; S46-N402 VanDerWaalsContact CB-ND2 3.34Å; S46-N402 WeakPolarHBondContact CB-ND2 3.37Å; S46-C429 VanDerWaalsContact CB-SG 3.6Å
47	P	44.2	Very low	41.4	Very low	73 Å²	73	92.3 Å²	92.3	47%	0.474	49%	0.488	S	S	.	.			trans	-77.7	1.6	178.1	31.3	-33.3	0	0	0	112.5	N49 Y378 N402	P47-N49 PolarHBondContact O-N 2.87Å; P47-Y378 VanDerWaalsContact CA-CE1 3.47Å; P47-Y378 HydrophobicContact CB-CE1 4.41Å; P47-N402 WeakPolarHBondContact CD-ND2 3.37Å
48	F	42.8	Very low	42.6	Very low	107 Å²	107	88.3 Å²	88.3	47%	0.469	47%	0.474	S	S	.	.			trans	-71.4	108.8	-179.5	-78.6	-78.6	0	0	0	108.9	S46 I50	S46-F48 PolarHBondContact O-N 3.43Å; F48-I50 HydrophobicContact CB-CG1 4.32Å; F48-I50 WeakPolarHBondContact O-CG1 3.41Å; F48-I50 PolarHBondContact O-N 3.46Å
49	N	38.9	Very low	43.8	Very low	105 Å²	105	90.9 Å²	90.9	56%	0.561	49%	0.488	S	S	*	.			trans	-60.3	91.3	158.9	-149.8	-1.2	0	0	0	105.5	P47 L51	P47-N49 PolarHBondContact O-N 2.87Å; N49-L51 PolarHBondContact O-N 3.41Å
50	I	41.6	Very low	44.7	Very low	36 Å²	36	89.1 Å²	89.1	19%	0.185	49%	0.488	C	S	.	.			trans	-74.2	67.4	178.3	-50.1	-179.7	0	0	0	107.1	F48 Q382 A384 M452	F48-I50 HydrophobicContact CB-CG1 4.32Å; F48-I50 WeakPolarHBondContact O-CG1 3.41Å; F48-I50 PolarHBondContact O-N 3.46Å; I50-Q382 VanDerWaalsContact CD1-C 3.48Å; I50-Q382 WeakPolarHBondContact CD1-O 3.45Å; I50-A384 HydrophobicContact CB-CB 4.33Å; I50-M452 HydrophobicContact CD1-CE 4.27Å; I50-M452 HydrophobicContact CD1-SD 4.14Å
51	L	36.3	Very low	45.7	Very low	105 Å²	105	81.5 Å²	81.5	55%	0.55	46%	0.462	S	S	.	.			trans	-84	-0.3	170.8	-78	169.5	0	0	0	111.6	N49 F54	N49-L51 PolarHBondContact O-N 3.41Å; L51-F54 HydrophobicContact CD2-CE2 3.9Å; L51-F54 HydrophobicContact CD2-CZ 4.38Å
52	T	39.9	Very low	46.3	Very low	142 Å²	142	79.6 Å²	79.6	87%	0.871	45%	0.452	S	S	*	.	S	Bend	trans	-95.2	-0.6	-178	52	0	0	0	0	114.5
53	G	40.9	Very low	46.9	Very low	53 Å²	53	77 Å²	77	55%	0.546	44%	0.44	S	S	.	.			trans	-126.2	53.4	178.2	0	0	0	0	0	112.2	E55	G53-E55 PolarHBondContact O-N 2.85Å; G53-E55 VanDerWaalsContact O-N 3.08Å
54	F	40.5	Very low	47.4	Very low	154 Å²	154	77.4 Å²	77.4	68%	0.675	45%	0.447	S	S	*	.			trans	-62.4	112.8	161.2	-88	-82.7	0	0	0	107.2	L51 P56	L51-F54 HydrophobicContact CD2-CE2 3.9Å; L51-F54 HydrophobicContact CD2-CZ 4.38Å; F54-P56 WeakPolarHBondContact O-CD 3.29Å; F54-P56 VanDerWaalsContact O-N 3.14Å
55	E	46.4	Very low	47.7	Very low	111 Å²	111	78.7 Å²	78.7	52%	0.519	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-53.3	121.9	164.6	-85.3	-176.9	155.6	0	0	107.2	G53 R57 W94	G53-E55 PolarHBondContact O-N 2.85Å; G53-E55 VanDerWaalsContact O-N 3.08Å; E55-R57 PolarHBondContact O-N 2.88Å; E55-W94 HydrophobicContact CB-CB 4.17Å
56	P	46.8	Very low	48	Very low	115 Å²	115	84.2 Å²	84.2	75%	0.747	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-58.6	138.6	-178.8	21.2	-30	0	0	0	109.3	F54 P58	F54-P56 WeakPolarHBondContact O-CD 3.29Å; F54-P56 VanDerWaalsContact O-N 3.14Å; P56-P58 WeakPolarHBondContact O-CD 3.39Å; P56-P58 VanDerWaalsContact O-N 3.15Å
57	R	49.8	Very low	48.4	Very low	114 Å²	114	87 Å²	87	43%	0.43	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-50.6	120.9	173.1	-178.2	178.1	-68.4	-161.3	-3.3	108.5	E55 A89 W94	E55-R57 PolarHBondContact O-N 2.88Å; R57-A89 PolarHBondContact NH2-O 3.36Å; R57-W94 HydrophobicContact CB-CZ2 4.4Å; R57-W94 HydrophobicContact CG-CZ2 3.7Å
58	P	54.7	Low	49	Very low	48 Å²	48	90.3 Å²	90.3	31%	0.312	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-60.4	133.1	179.4	-15.5	23.9	0	0	0	109.9	P56 G60 T61 W94	P56-P58 WeakPolarHBondContact O-CD 3.39Å; P56-P58 VanDerWaalsContact O-N 3.15Å; P58-G60 PolarHBondContact O-N 3.19Å; P58-T61 HydrophobicContact CB-CG2 3.99Å; P58-T61 WeakPolarHBondContact CB-OG1 3.37Å; P58-T61 WeakPolarHBondContact CD-OG1 3.24Å; P58-T61 WeakPolarHBondContact CG-OG1 3.3Å; P58-T61 PolarHBondContact O-N 3.4Å; P58-T61 VanDerWaalsContact O-N 3.14Å; P58-T61 PolarHBondContact O-OG1 3.48Å; P58-W94 HydrophobicContact CG-CE3 4.14Å; P58-W94 HydrophobicContact CG-CH2 4.46Å; P58-W94 HydrophobicContact CG-CZ3 4.05Å
59	P	52.7	Low	49.9	Very low	132 Å²	132	88.5 Å²	88.5	86%	0.857	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	131.3	-177.6	21	-30	0	0	0	110.9	T61	P59-T61 VanDerWaalsContact C-N 3.32Å; P59-T61 PolarHBondContact O-N 2.8Å
60	G	53.2	Low	51.3	Low	63 Å²	63	84.5 Å²	84.5	65%	0.649	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.7	-6.9	-179.7	0	0	0	0	0	116	P58	P58-G60 PolarHBondContact O-N 3.19Å
61	T	54.3	Low	52.7	Low	22 Å²	22	91.2 Å²	91.2	14%	0.135	54%	0.535	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	109	176.1	63.7	0	0	0	0	110.3	P58 P59 W94	P58-T61 HydrophobicContact CB-CG2 3.99Å; P58-T61 WeakPolarHBondContact CB-OG1 3.37Å; P58-T61 WeakPolarHBondContact CD-OG1 3.24Å; P58-T61 WeakPolarHBondContact CG-OG1 3.3Å; P58-T61 PolarHBondContact O-N 3.4Å; P58-T61 VanDerWaalsContact O-N 3.14Å; P58-T61 PolarHBondContact O-OG1 3.48Å; P59-T61 VanDerWaalsContact C-N 3.32Å; P59-T61 PolarHBondContact O-N 2.8Å; T61-W94 WeakPolarHBondContact OG1-CH2 3.23Å
62	G	52.2	Low	54.5	Low	6 Å²	6	86.6 Å²	86.6	6%	0.062	51%	0.511	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.3	30.5	-176.9	0	0	0	0	0	114.4	F70	G62-F70 VanDerWaalsContact O-CB 3.23Å; G62-F70 WeakPolarHBondContact O-CB 3.41Å; G62-F70 PolarHBondContact O-N 3.32Å
63	V	54.5	Low	56.1	Low	65 Å²	65	81.8 Å²	81.8	39%	0.394	48%	0.483	S	S	.	.	B	Isolated β-bridge	trans	-101.4	130.6	163.5	-166.4	0	0	0	0	106.7	G67 Q68	V63-G67 WeakPolarHBondContact CG1-O 3.39Å; V63-Q68 CarbonylContact C-O 3.55Å; V63-Q68 VanDerWaalsContact CA-O 3.26Å; V63-Q68 WeakPolarHBondContact CA-O 3.29Å; V63-Q68 WeakPolarHBondContact CG1-O 3.2Å
64	S	55.2	Low	57.5	Low	38 Å²	38	80 Å²	80	27%	0.266	47%	0.465	S	S	.	.			trans	-60.4	167.3	168.1	67.4	0	0	0	0	109.6	D66 G67 Q68	S64-D66 PolarHBondContact O-N 2.83Å; S64-D66 PolarHBondContact OG-N 3.27Å; S64-G67 PolarHBondContact O-N 3.45Å; S64-G67 VanDerWaalsContact O-N 3.08Å; S64-Q68 PolarHBondContact N-O 2.88Å; S64-Q68 PolarHBondContact OG-N 2.86Å
65	T	57.8	Low	59.1	Low	145 Å²	145	81.5 Å²	81.5	89%	0.89	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	-22.8	172.6	48.2	0	0	0	0	113.3
66	D	55.7	Low	60.6	Low	133 Å²	133	78.7 Å²	78.7	71%	0.711	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	10	-172.1	-50	-14.9	0	0	0	113.2	S64 Q68	S64-D66 PolarHBondContact O-N 2.83Å; S64-D66 PolarHBondContact OG-N 3.27Å; D66-Q68 VanDerWaalsContact C-N 3.32Å; D66-Q68 PolarHBondContact O-N 2.86Å
67	G	57.2	Low	62	Low	61 Å²	61	73.6 Å²	73.6	63%	0.629	43%	0.429	S	S	*	.	S	Bend	trans	84.2	-1.3	177.6	0	0	0	0	0	115.1	V63 S64	V63-G67 WeakPolarHBondContact CG1-O 3.39Å; S64-G67 PolarHBondContact O-N 3.45Å; S64-G67 VanDerWaalsContact O-N 3.08Å
68	Q	58.7	Low	63.2	Low	141 Å²	141	74 Å²	74	66%	0.659	43%	0.434	S	S	*	.	S	Bend	trans	-89.4	153.3	-179.5	-66.3	-171.9	-2.8	0	0	112.6	V63 S64 D66 F70	V63-Q68 CarbonylContact C-O 3.55Å; V63-Q68 VanDerWaalsContact CA-O 3.26Å; V63-Q68 WeakPolarHBondContact CA-O 3.29Å; V63-Q68 WeakPolarHBondContact CG1-O 3.2Å; S64-Q68 PolarHBondContact N-O 2.88Å; S64-Q68 PolarHBondContact OG-N 2.86Å; D66-Q68 VanDerWaalsContact C-N 3.32Å; D66-Q68 PolarHBondContact O-N 2.86Å; Q68-F70 PolarHBondContact O-N 3.48Å
69	A	61.4	Low	64.4	Low	69 Å²	69	78.6 Å²	78.6	57%	0.57	46%	0.456	S	S	*	.	B	Isolated β-bridge	trans	-59	121.6	172.5	0	0	0	0	0	110.2	R71	A69-R71 PolarHBondContact O-N 3.5Å
70	F	67.5	Low	65.6	Low	21 Å²	21	73.4 Å²	73.4	9%	0.092	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-60	119.9	176.3	175.3	-101.7	0	0	0	110.1	G62 Q68 I72 I80 W82 I85 E90	G62-F70 VanDerWaalsContact O-CB 3.23Å; G62-F70 WeakPolarHBondContact O-CB 3.41Å; G62-F70 PolarHBondContact O-N 3.32Å; Q68-F70 PolarHBondContact O-N 3.48Å; F70-I72 HydrophobicContact CE1-CD1 4.37Å; F70-I72 HydrophobicContact CE1-CG1 3.76Å; F70-I72 HydrophobicContact CZ-CG1 3.89Å; F70-I80 HydrophobicContact CE2-CD1 4.2Å; F70-I80 HydrophobicContact CE2-CG1 4.12Å; F70-I80 HydrophobicContact CE2-CG2 4.06Å; F70-I80 HydrophobicContact CZ-CD1 3.87Å; F70-I80 HydrophobicContact CZ-CG1 4.19Å; F70-I80 HydrophobicContact CZ-CG2 3.83Å; F70-W82 HydrophobicContact CE1-CH2 4.19Å; F70-W82 HydrophobicContact CE1-CZ3 4.18Å; F70-W82 AromaticContact CZ-CH2 3.88Å; F70-W82 HydrophobicContact CZ-CH2 3.88Å; F70-W82 HydrophobicContact CZ-CZ3 4.05Å; F70-I85 HydrophobicContact CD1-CG2 3.8Å; F70-I85 HydrophobicContact CD2-CD1 3.95Å; F70-I85 HydrophobicContact CD2-CG2 4.27Å; F70-I85 HydrophobicContact CE1-CG2 3.61Å; F70-I85 HydrophobicContact CE2-CD1 3.51Å; F70-I85 HydrophobicContact CE2-CG1 4.43Å; F70-I85 HydrophobicContact CE2-CG2 4.12Å; F70-I85 HydrophobicContact CG-CG2 4.12Å; F70-I85 HydrophobicContact CZ-CD1 4.03Å; F70-I85 HydrophobicContact CZ-CG2 3.77Å; F70-E90 HydrophobicContact CD1-CB 4.43Å; F70-E90 HydrophobicContact CE1-CB 4.5Å
71	R	71.7	Confident	66.9	Low	177 Å²	177	74.2 Å²	74.2	67%	0.668	41%	0.41	S	S	*	.			trans	-128.8	128.9	177.4	-177.1	176.3	-178.9	178.5	0.5	109	A69 N76	A69-R71 PolarHBondContact O-N 3.5Å; R71-N76 PolarHBondContact O-ND2 3.23Å
72	I	74.1	Confident	68.1	Low	8 Å²	8	75.4 Å²	75.4	4%	0.041	41%	0.412	C	S	.	.			trans	-82.8	132.1	172.6	-49.5	177.6	0	0	0	108.3	F70 L77 I80 W82 E90 Y299	F70-I72 HydrophobicContact CE1-CD1 4.37Å; F70-I72 HydrophobicContact CE1-CG1 3.76Å; F70-I72 HydrophobicContact CZ-CG1 3.89Å; I72-L77 HydrophobicContact CG2-CB 4.39Å; I72-L77 HydrophobicContact CG2-CD1 3.5Å; I72-I80 HydrophobicContact CB-CD1 4.46Å; I72-I80 HydrophobicContact CG1-CD1 4.1Å; I72-I80 HydrophobicContact CG2-CD1 3.99Å; I72-W82 HydrophobicContact CD1-CH2 3.34Å; I72-W82 HydrophobicContact CD1-CZ2 3.98Å; I72-W82 HydrophobicContact CD1-CZ3 4.36Å; I72-W82 HydrophobicContact CG1-CH2 4.01Å; I72-E90 WeakPolarHBondContact CB-OE1 3.48Å; I72-E90 WeakPolarHBondContact CD1-OE2 3.43Å; I72-E90 HydrophobicContact CG1-CB 4.36Å; I72-E90 VanDerWaalsContact CG1-CD 3.48Å; I72-E90 HydrophobicContact CG1-CG 4.14Å; I72-E90 VanDerWaalsContact CG1-OE2 3.27Å; I72-E90 WeakPolarHBondContact CG1-OE2 3.21Å; I72-E90 PolarHBondContact N-OE1 3.34Å; I72-Y299 HydrophobicContact CB-CE1 4.02Å; I72-Y299 HydrophobicContact CG2-CE1 3.84Å; I72-Y299 HydrophobicContact CG2-CE2 4.21Å
73	S	73.6	Confident	69.3	Low	42 Å²	42	77.7 Å²	77.7	29%	0.294	43%	0.425	S	S	.	.			trans	-131.6	161.4	171	76.1	0	0	0	0	108.9	Q75 N76 L77	S73-Q75 PolarHBondContact O-N 2.83Å; S73-Q75 PolarHBondContact OG-N 3.31Å; S73-N76 PolarHBondContact N-OD1 2.86Å; S73-N76 PolarHBondContact O-N 3.49Å; S73-N76 PolarHBondContact O-OD1 3.47Å; S73-N76 PolarHBondContact OG-N 2.85Å; S73-L77 WeakPolarHBondContact O-CB 3.49Å; S73-L77 PolarHBondContact O-N 2.82Å
74	G	69.4	Low	70.5	Confident	16 Å²	16	80.3 Å²	80.3	17%	0.165	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-24.4	174.3	0	0	0	0	0	114.1	L296	G74-L296 VanDerWaalsContact CA-O 3.23Å; G74-L296 WeakPolarHBondContact CA-O 3.27Å
75	Q	74.9	Confident	71.6	Confident	185 Å²	185	80.2 Å²	80.2	86%	0.864	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-36	-178.8	-66.4	179	-10.5	0	0	113.4	S73	S73-Q75 PolarHBondContact O-N 2.83Å; S73-Q75 PolarHBondContact OG-N 3.31Å
76	N	78	Confident	72.8	Confident	52 Å²	52	73.3 Å²	73.3	28%	0.278	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-12.8	-178.2	71	4	0	0	0	113.5	R71 S73 K78 N79 I80	R71-N76 PolarHBondContact O-ND2 3.23Å; S73-N76 PolarHBondContact N-OD1 2.86Å; S73-N76 PolarHBondContact O-N 3.49Å; S73-N76 PolarHBondContact O-OD1 3.47Å; S73-N76 PolarHBondContact OG-N 2.85Å; N76-K78 PolarHBondContact O-N 3.37Å; N76-N79 PolarHBondContact O-N 3.48Å; N76-I80 WeakPolarHBondContact O-CG1 3.43Å
77	L	76	Confident	74.4	Confident	7 Å²	7	67.6 Å²	67.6	4%	0.037	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-48.4	-37.7	-174.1	-174.8	70.6	0	0	0	114.3	I72 S73 T185 L187 L296 Y299	I72-L77 HydrophobicContact CG2-CB 4.39Å; I72-L77 HydrophobicContact CG2-CD1 3.5Å; S73-L77 WeakPolarHBondContact O-CB 3.49Å; S73-L77 PolarHBondContact O-N 2.82Å; L77-T185 HydrophobicContact CD2-CG2 3.76Å; L77-T185 HydrophobicContact CG-CG2 3.87Å; L77-L187 HydrophobicContact CD1-CD2 3.55Å; L77-L187 HydrophobicContact CD2-CD2 3.7Å; L77-L187 HydrophobicContact CG-CD2 4.19Å; L77-L296 HydrophobicContact CD2-CD2 3.87Å; L77-Y299 HydrophobicContact CD1-CE2 4.15Å; L77-Y299 HydrophobicContact CD2-CD2 4.39Å
78	K	75.4	Confident	75.8	Confident	123 Å²	123	65.5 Å²	65.5	54%	0.535	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-78	-20.5	-179.5	-72.6	-172.2	174.3	-172.6	0	114.6	N76 T185	N76-K78 PolarHBondContact O-N 3.37Å; K78-T185 WeakPolarHBondContact CE-OG1 3.41Å; K78-T185 WeakPolarHBondContact CG-OG1 3.21Å
79	N	78.2	Confident	76.9	Confident	145 Å²	145	58.8 Å²	58.8	78%	0.775	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-105.4	7.9	-171.2	-62.2	-14	0	0	0	112.8	N76	N76-N79 PolarHBondContact O-N 3.48Å
80	I	77.8	Confident	77.6	Confident	23 Å²	23	57 Å²	57	12%	0.118	28%	0.28	C	S	.	.			trans	-83.4	123	-178.9	-64.1	161	0	0	0	109.2	F70 I72 N76 W82 I85	F70-I80 HydrophobicContact CE2-CD1 4.2Å; F70-I80 HydrophobicContact CE2-CG1 4.12Å; F70-I80 HydrophobicContact CE2-CG2 4.06Å; F70-I80 HydrophobicContact CZ-CD1 3.87Å; F70-I80 HydrophobicContact CZ-CG1 4.19Å; F70-I80 HydrophobicContact CZ-CG2 3.83Å; I72-I80 HydrophobicContact CB-CD1 4.46Å; I72-I80 HydrophobicContact CG1-CD1 4.1Å; I72-I80 HydrophobicContact CG2-CD1 3.99Å; N76-I80 WeakPolarHBondContact O-CG1 3.43Å; I80-W82 HydrophobicContact CB-CH2 4.48Å; I80-W82 HydrophobicContact CB-CZ2 3.95Å; I80-W82 HydrophobicContact CD1-CH2 3.98Å; I80-W82 HydrophobicContact CD1-CZ2 3.69Å; I80-W82 HydrophobicContact CG1-CZ2 4.43Å; I80-W82 HydrophobicContact CG2-CD2 3.71Å; I80-W82 HydrophobicContact CG2-CE3 3.92Å; I80-W82 HydrophobicContact CG2-CG 4.29Å; I80-W82 HydrophobicContact CG2-CH2 3.74Å; I80-W82 HydrophobicContact CG2-CZ2 3.61Å; I80-W82 HydrophobicContact CG2-CZ3 3.94Å; I80-W82 PolarHBondContact O-N 3.33Å; I80-I85 HydrophobicContact CG2-CD1 3.72Å
81	D	80.9	Confident	78.3	Confident	80 Å²	80	59.3 Å²	59.3	43%	0.428	29%	0.291	S	S	.	.			trans	-83.1	97.7	166.9	-172.1	-8.7	0	0	0	110.2	T83 L84	D81-T83 VanDerWaalsContact CG-OG1 3.28Å; D81-T83 PolarHBondContact O-N 3.47Å; D81-T83 WeakPolarHBondContact OD1-CB 3.36Å; D81-T83 WeakPolarHBondContact OD1-CG2 3.32Å; D81-T83 PolarHBondContact OD1-N 2.93Å; D81-T83 PolarHBondContact OD1-OG1 2.83Å; D81-T83 PolarHBondContact OD2-OG1 2.73Å; D81-L84 HydrophobicContact CB-CD1 4.37Å; D81-L84 PolarHBondContact O-N 3.04Å
82	W	79.8	Confident	78.8	Confident	46 Å²	46	52 Å²	52	17%	0.174	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-13.2	179.5	-66.5	111.1	0	0	0	114	F70 I72 I80 L84 I85 R87	F70-W82 HydrophobicContact CE1-CH2 4.19Å; F70-W82 HydrophobicContact CE1-CZ3 4.18Å; F70-W82 AromaticContact CZ-CH2 3.88Å; F70-W82 HydrophobicContact CZ-CH2 3.88Å; F70-W82 HydrophobicContact CZ-CZ3 4.05Å; I72-W82 HydrophobicContact CD1-CH2 3.34Å; I72-W82 HydrophobicContact CD1-CZ2 3.98Å; I72-W82 HydrophobicContact CD1-CZ3 4.36Å; I72-W82 HydrophobicContact CG1-CH2 4.01Å; I80-W82 HydrophobicContact CB-CH2 4.48Å; I80-W82 HydrophobicContact CB-CZ2 3.95Å; I80-W82 HydrophobicContact CD1-CH2 3.98Å; I80-W82 HydrophobicContact CD1-CZ2 3.69Å; I80-W82 HydrophobicContact CG1-CZ2 4.43Å; I80-W82 HydrophobicContact CG2-CD2 3.71Å; I80-W82 HydrophobicContact CG2-CE3 3.92Å; I80-W82 HydrophobicContact CG2-CG 4.29Å; I80-W82 HydrophobicContact CG2-CH2 3.74Å; I80-W82 HydrophobicContact CG2-CZ2 3.61Å; I80-W82 HydrophobicContact CG2-CZ3 3.94Å; I80-W82 PolarHBondContact O-N 3.33Å; W82-L84 VanDerWaalsContact C-N 3.3Å; W82-I85 HydrophobicContact CZ3-CG2 4.45Å; W82-R87 HydrophobicContact CE3-CG 3.68Å; W82-R87 HydrophobicContact CZ3-CG 4.03Å
83	T	78.6	Confident	79.5	Confident	55 Å²	55	52.4 Å²	52.4	34%	0.337	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-22.5	176	71.8	0	0	0	0	112.4	D81 E101 R102	D81-T83 VanDerWaalsContact CG-OG1 3.28Å; D81-T83 PolarHBondContact O-N 3.47Å; D81-T83 WeakPolarHBondContact OD1-CB 3.36Å; D81-T83 WeakPolarHBondContact OD1-CG2 3.32Å; D81-T83 PolarHBondContact OD1-N 2.93Å; D81-T83 PolarHBondContact OD1-OG1 2.83Å; D81-T83 PolarHBondContact OD2-OG1 2.73Å; T83-E101 HydrophobicContact CG2-CB 4.43Å; T83-R102 WeakPolarHBondContact O-CB 3.43Å; T83-R102 WeakPolarHBondContact O-CG 3.25Å
84	L	77.9	Confident	80.1	Confident	120 Å²	120	51.4 Å²	51.4	63%	0.628	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	-20.6	-177.7	-61.6	178.2	0	0	0	113.3	D81 W82 R102	D81-L84 HydrophobicContact CB-CD1 4.37Å; D81-L84 PolarHBondContact O-N 3.04Å; W82-L84 VanDerWaalsContact C-N 3.3Å; L84-R102 PolarHBondContact O-NH1 2.88Å
85	I	78.9	Confident	80.8	Confident	36 Å²	36	52.2 Å²	52.2	19%	0.185	26%	0.261	C	S	.	.	S	Bend	trans	-111	140.4	-170.6	-65.4	156.5	0	0	0	110.7	F70 I80 W82 R87	F70-I85 HydrophobicContact CD1-CG2 3.8Å; F70-I85 HydrophobicContact CD2-CD1 3.95Å; F70-I85 HydrophobicContact CD2-CG2 4.27Å; F70-I85 HydrophobicContact CE1-CG2 3.61Å; F70-I85 HydrophobicContact CE2-CD1 3.51Å; F70-I85 HydrophobicContact CE2-CG1 4.43Å; F70-I85 HydrophobicContact CE2-CG2 4.12Å; F70-I85 HydrophobicContact CG-CG2 4.12Å; F70-I85 HydrophobicContact CZ-CD1 4.03Å; F70-I85 HydrophobicContact CZ-CG2 3.77Å; I80-I85 HydrophobicContact CG2-CD1 3.72Å; W82-I85 HydrophobicContact CZ3-CG2 4.45Å; I85-R87 PolarHBondContact O-N 2.88Å
86	D	84	Confident	81.6	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.22	C	C	.	.			trans	-79.7	117.6	172.8	-166.3	-42.7	0	0	0	109.8	R88 A89 Y103	D86-R88 PolarHBondContact O-N 3.48Å; D86-R88 VanDerWaalsContact O-N 3.09Å; D86-R88 VanDerWaalsContact OD1-CB 3.23Å; D86-R88 WeakPolarHBondContact OD1-CB 3.26Å; D86-R88 WeakPolarHBondContact OD1-CG 3.47Å; D86-R88 IonicContact OD1-CZ 3.06Å; D86-R88 PolarHBondContact OD1-N 3.25Å; D86-R88 IonicContact OD1-NE 3.63Å; D86-R88 PolarHBondContact OD1-NE 2.85Å; D86-R88 IonicContact OD1-NH2 3.89Å; D86-R88 IonicContact OD2-CZ 3.71Å; D86-R88 IonicContact OD2-NE 3.06Å; D86-R88 PolarHBondContact OD2-NE 3.32Å; D86-R88 IonicContact OD2-NH2 3.12Å; D86-R88 PolarHBondContact OD2-NH2 3.45Å; D86-A89 VanDerWaalsContact O-CB 3.3Å; D86-A89 WeakPolarHBondContact O-CB 3.27Å; D86-A89 PolarHBondContact O-N 2.9Å; D86-Y103 PolarHBondContact OD2-OH 3.26Å
87	R	87.4	Confident	82.4	Confident	13 Å²	13	41.7 Å²	41.7	5%	0.049	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-23.9	-180	-71	176.2	169.9	-89.9	-0.4	113.2	W82 I85 A89 F99 E101 E283	W82-R87 HydrophobicContact CE3-CG 3.68Å; W82-R87 HydrophobicContact CZ3-CG 4.03Å; I85-R87 PolarHBondContact O-N 2.88Å; R87-A89 VanDerWaalsContact C-N 3.3Å; R87-A89 PolarHBondContact O-N 3.29Å; R87-F99 HydrophobicContact CB-CE2 4.03Å; R87-F99 HydrophobicContact CB-CZ 4.19Å; R87-E101 IonicContact CZ-OE1 2.79Å; R87-E101 IonicContact CZ-OE2 3.56Å; R87-E101 IonicContact NE-OE2 3.82Å; R87-E101 PolarHBondContact NE-OE2 2.99Å; R87-E101 VanDerWaalsContact NH2-CD 3.28Å; R87-E101 IonicContact NH2-OE1 2.86Å; R87-E101 PolarHBondContact NH2-OE1 3.29Å; R87-E101 IonicContact NH2-OE2 2.76Å; R87-E101 PolarHBondContact NH2-OE2 3.03Å; R87-E283 IonicContact CZ-OE2 2.59Å; R87-E283 IonicContact NE-OE2 3.22Å; R87-E283 IonicContact NH1-OE1 3.29Å; R87-E283 PolarHBondContact NH1-OE1 2.8Å; R87-E283 IonicContact NH1-OE2 2.95Å; R87-E283 PolarHBondContact NH1-OE2 3.16Å; R87-E283 VanDerWaalsContact NH1-OE2 3.12Å
88	R	87.2	Confident	83.1	Confident	17 Å²	17	45 Å²	45	6%	0.064	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-18.8	178.4	-58.4	172.8	-61.3	152	11.1	113.2	D86 G92 W93 W94 L96 F99	D86-R88 PolarHBondContact O-N 3.48Å; D86-R88 VanDerWaalsContact O-N 3.09Å; D86-R88 VanDerWaalsContact OD1-CB 3.23Å; D86-R88 WeakPolarHBondContact OD1-CB 3.26Å; D86-R88 WeakPolarHBondContact OD1-CG 3.47Å; D86-R88 IonicContact OD1-CZ 3.06Å; D86-R88 PolarHBondContact OD1-N 3.25Å; D86-R88 IonicContact OD1-NE 3.63Å; D86-R88 PolarHBondContact OD1-NE 2.85Å; D86-R88 IonicContact OD1-NH2 3.89Å; D86-R88 IonicContact OD2-CZ 3.71Å; D86-R88 IonicContact OD2-NE 3.06Å; D86-R88 PolarHBondContact OD2-NE 3.32Å; D86-R88 IonicContact OD2-NH2 3.12Å; D86-R88 PolarHBondContact OD2-NH2 3.45Å; R88-G92 WeakPolarHBondContact O-CA 3.42Å; R88-G92 PolarHBondContact O-N 2.92Å; R88-W93 HydrophobicContact CB-CB 4.23Å; R88-W93 WeakPolarHBondContact CD-O 3.34Å; R88-W93 HydrophobicContact CG-CB 4.39Å; R88-W93 PolarHBondContact O-N 3.4Å; R88-W93 VanDerWaalsContact O-N 3.07Å; R88-W94 HydrophobicContact CB-CE3 4.2Å; R88-W94 HydrophobicContact CB-CZ3 4.16Å; R88-L96 VanDerWaalsContact CD-O 3.32Å; R88-L96 WeakPolarHBondContact CD-O 3.41Å; R88-L96 PolarHBondContact NH1-O 3.44Å; R88-F99 HydrophobicContact CG-CD1 4.11Å; R88-F99 HydrophobicContact CG-CE1 3.57Å; R88-F99 HydrophobicContact CG-CZ 4.34Å
89	A	81.8	Confident	84	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-33.7	-163.4	0	0	0	0	0	115.3	R57 D86 R87 W94	R57-A89 PolarHBondContact NH2-O 3.36Å; D86-A89 VanDerWaalsContact O-CB 3.3Å; D86-A89 WeakPolarHBondContact O-CB 3.27Å; D86-A89 PolarHBondContact O-N 2.9Å; R87-A89 VanDerWaalsContact C-N 3.3Å; R87-A89 PolarHBondContact O-N 3.29Å; A89-W94 HydrophobicContact CB-CH2 3.65Å; A89-W94 HydrophobicContact CB-CZ2 3.89Å
90	E	77.5	Confident	84.5	Confident	30 Å²	30	32.4 Å²	32.4	14%	0.14	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-52.7	179.4	-175.3	-157.9	-174.7	0	0	110.8	F70 I72 R284 Y299 K303	F70-E90 HydrophobicContact CD1-CB 4.43Å; F70-E90 HydrophobicContact CE1-CB 4.5Å; I72-E90 WeakPolarHBondContact CB-OE1 3.48Å; I72-E90 WeakPolarHBondContact CD1-OE2 3.43Å; I72-E90 HydrophobicContact CG1-CB 4.36Å; I72-E90 VanDerWaalsContact CG1-CD 3.48Å; I72-E90 HydrophobicContact CG1-CG 4.14Å; I72-E90 VanDerWaalsContact CG1-OE2 3.27Å; I72-E90 WeakPolarHBondContact CG1-OE2 3.21Å; I72-E90 PolarHBondContact N-OE1 3.34Å; E90-R284 IonicContact OE2-NH2 2.91Å; E90-R284 PolarHBondContact OE2-NH2 2.83Å; E90-Y299 PolarHBondContact OE2-OH 2.81Å; E90-K303 IonicContact OE1-NZ 3.63Å; E90-K303 PolarHBondContact OE1-NZ 2.95Å; E90-K303 IonicContact OE2-NZ 2.67Å
91	E	82	Confident	84.9	Confident	71 Å²	71	33.7 Å²	33.7	33%	0.332	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-6.7	-173.1	-54.6	-75.5	-174.4	0	0	112.5	W93 R284 K303	E91-W93 HydrophobicContact CB-CD2 3.79Å; E91-W93 HydrophobicContact CB-CE3 4.47Å; E91-W93 HydrophobicContact CB-CG 4.06Å; E91-W93 HydrophobicContact CB-CH2 4.4Å; E91-W93 HydrophobicContact CB-CZ2 3.72Å; E91-W93 VanDerWaalsContact CB-NE1 3.31Å; E91-W93 HydrophobicContact CG-CD2 4.38Å; E91-W93 HydrophobicContact CG-CH2 3.95Å; E91-W93 HydrophobicContact CG-CZ2 3.57Å; E91-R284 VanDerWaalsContact CG-NH2 3.32Å; E91-R284 IonicContact OE1-CZ 2.79Å; E91-R284 IonicContact OE1-NH1 3.43Å; E91-R284 PolarHBondContact OE1-NH1 3.48Å; E91-R284 IonicContact OE1-NH2 3.54Å; E91-R284 PolarHBondContact OE1-NH2 2.93Å; E91-K303 WeakPolarHBondContact OE1-CE 2.98Å; E91-K303 IonicContact OE1-NZ 3.52Å; E91-K303 PolarHBondContact OE1-NZ 3.22Å
92	G	81.9	Confident	85.1	Confident	23 Å²	23	34.1 Å²	34.1	24%	0.237	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.5	32.7	179	0	0	0	0	0	114.3	R88 W94	R88-G92 WeakPolarHBondContact O-CA 3.42Å; R88-G92 PolarHBondContact O-N 2.92Å; G92-W94 PolarHBondContact O-N 3.45Å
93	W	88.1	Confident	85.5	Confident	16 Å²	16	33.3 Å²	33.3	6%	0.061	16%	0.162	C	C	.	.			trans	-77.1	50	-178.7	-59	-26	0	0	0	113.2	R88 E91 H95 L96 F99 R284 T308 A327 N328	R88-W93 HydrophobicContact CB-CB 4.23Å; R88-W93 WeakPolarHBondContact CD-O 3.34Å; R88-W93 HydrophobicContact CG-CB 4.39Å; R88-W93 PolarHBondContact O-N 3.4Å; R88-W93 VanDerWaalsContact O-N 3.07Å; E91-W93 HydrophobicContact CB-CD2 3.79Å; E91-W93 HydrophobicContact CB-CE3 4.47Å; E91-W93 HydrophobicContact CB-CG 4.06Å; E91-W93 HydrophobicContact CB-CH2 4.4Å; E91-W93 HydrophobicContact CB-CZ2 3.72Å; E91-W93 VanDerWaalsContact CB-NE1 3.31Å; E91-W93 HydrophobicContact CG-CD2 4.38Å; E91-W93 HydrophobicContact CG-CH2 3.95Å; E91-W93 HydrophobicContact CG-CZ2 3.57Å; W93-H95 VanDerWaalsContact C-N 3.29Å; W93-H95 PolarHBondContact O-N 2.97Å; W93-L96 HydrophobicContact CB-CD1 3.82Å; W93-L96 HydrophobicContact CB-CG 4.14Å; W93-L96 HydrophobicContact CE3-CD1 4.38Å; W93-L96 HydrophobicContact CG-CD1 4.36Å; W93-L96 WeakPolarHBondContact O-CB 3.3Å; W93-L96 PolarHBondContact O-N 3.37Å; W93-F99 HydrophobicContact CE3-CZ 4.39Å; W93-R284 HydrophobicContact CH2-CG 4.06Å; W93-T308 HydrophobicContact CD2-CG2 4.3Å; W93-T308 HydrophobicContact CE3-CG2 3.81Å; W93-T308 HydrophobicContact CH2-CG2 3.96Å; W93-T308 WeakPolarHBondContact CH2-OG1 3.26Å; W93-T308 HydrophobicContact CZ2-CG2 4.39Å; W93-T308 HydrophobicContact CZ3-CG2 3.64Å; W93-A327 HydrophobicContact CB-CB 4.04Å; W93-A327 HydrophobicContact CD2-CB 4.05Å; W93-A327 HydrophobicContact CG-CB 3.64Å; W93-N328 HydrophobicContact CZ2-CB 4.38Å
94	W	85.6	Confident	85.8	Confident	21 Å²	21	32.8 Å²	32.8	8%	0.08	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-24.7	-170.2	-61.1	118.6	0	0	0	114.2	E55 R57 P58 T61 R88 A89 G92 L96	E55-W94 HydrophobicContact CB-CB 4.17Å; R57-W94 HydrophobicContact CB-CZ2 4.4Å; R57-W94 HydrophobicContact CG-CZ2 3.7Å; P58-W94 HydrophobicContact CG-CE3 4.14Å; P58-W94 HydrophobicContact CG-CH2 4.46Å; P58-W94 HydrophobicContact CG-CZ3 4.05Å; T61-W94 WeakPolarHBondContact OG1-CH2 3.23Å; R88-W94 HydrophobicContact CB-CE3 4.2Å; R88-W94 HydrophobicContact CB-CZ3 4.16Å; A89-W94 HydrophobicContact CB-CH2 3.65Å; A89-W94 HydrophobicContact CB-CZ2 3.89Å; G92-W94 PolarHBondContact O-N 3.45Å; W94-L96 PolarHBondContact O-N 2.9Å
95	H	84.1	Confident	86.4	Confident	34 Å²	34	27.2 Å²	27.2	16%	0.157	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-14.5	175.4	66	-62.1	0	0	0	114.1	W93 Y326 A327 V383 R386	W93-H95 VanDerWaalsContact C-N 3.29Å; W93-H95 PolarHBondContact O-N 2.97Å; H95-Y326 PolarHBondContact NE2-O 3.09Å; H95-A327 WeakPolarHBondContact NE2-CA 3.44Å; H95-V383 HydrophobicContact CB-CG1 3.77Å; H95-R386 PolarHBondContact O-NH2 2.83Å
96	L	92.5	Very high	86.9	Confident	1 Å²	1	27.1 Å²	27.1	1%	0.005	13%	0.126	C	C	.	.	S	Bend	trans	-77.6	136.7	166.7	-56.1	-178.9	0	0	0	109.1	R88 W93 W94 F99 T308 Q310 N325 A327	R88-L96 VanDerWaalsContact CD-O 3.32Å; R88-L96 WeakPolarHBondContact CD-O 3.41Å; R88-L96 PolarHBondContact NH1-O 3.44Å; W93-L96 HydrophobicContact CB-CD1 3.82Å; W93-L96 HydrophobicContact CB-CG 4.14Å; W93-L96 HydrophobicContact CE3-CD1 4.38Å; W93-L96 HydrophobicContact CG-CD1 4.36Å; W93-L96 WeakPolarHBondContact O-CB 3.3Å; W93-L96 PolarHBondContact O-N 3.37Å; W94-L96 PolarHBondContact O-N 2.9Å; L96-F99 HydrophobicContact CB-CE1 4.36Å; L96-F99 HydrophobicContact CD1-CE1 3.73Å; L96-F99 HydrophobicContact CD1-CZ 4.47Å; L96-T308 HydrophobicContact CD1-CG2 3.99Å; L96-Q310 HydrophobicContact CD2-CB 3.76Å; L96-N325 HydrophobicContact CD2-CB 3.54Å; L96-N325 VanDerWaalsContact CD2-O 3.29Å; L96-N325 WeakPolarHBondContact CD2-O 3.4Å; L96-A327 HydrophobicContact CD1-CB 3.7Å; L96-A327 HydrophobicContact CD2-CB 4.07Å; L96-A327 HydrophobicContact CG-CB 3.96Å
97	Y	94.1	Very high	87.1	Confident	14 Å²	14	28.2 Å²	28.2	6%	0.055	13%	0.132	C	C	.	.	P	Polyproline II helix	trans	-61.6	147.1	167	-63.7	-72	0	0	0	109.9	F99 L254 I257 I258 D261 Q310 V312 M323	Y97-F99 WeakPolarHBondContact O-CD1 3.37Å; Y97-F99 PolarHBondContact O-N 2.94Å; Y97-L254 HydrophobicContact CD1-CD1 3.88Å; Y97-L254 HydrophobicContact CG-CD1 4.49Å; Y97-I257 HydrophobicContact CE1-CG2 3.93Å; Y97-I258 HydrophobicContact CD1-CG1 4.36Å; Y97-I258 HydrophobicContact CE1-CG1 3.84Å; Y97-I258 HydrophobicContact CE2-CG1 4.03Å; Y97-D261 PolarHBondContact OH-OD2 3.5Å; Y97-Q310 PolarHBondContact O-NE2 2.77Å; Y97-V312 HydrophobicContact CD2-CG2 3.54Å; Y97-V312 HydrophobicContact CE2-CG2 3.83Å; Y97-M323 HydrophobicContact CE2-SD 3.83Å
98	Q	91.4	Very high	86.8	Confident	78 Å²	78	28.2 Å²	28.2	36%	0.364	13%	0.132	S	C	.	.	P	Polyproline II helix	trans	-46.2	130.2	179.1	-69.4	162.2	23.7	0	0	111.9	Y103 R193	Q98-Y103 HydrophobicContact CB-CD1 3.83Å; Q98-Y103 HydrophobicContact CB-CD2 3.84Å; Q98-Y103 HydrophobicContact CB-CE1 3.7Å; Q98-Y103 HydrophobicContact CB-CE2 3.67Å; Q98-Y103 HydrophobicContact CB-CG 3.9Å; Q98-Y103 HydrophobicContact CG-CD1 4.41Å; Q98-Y103 HydrophobicContact CG-CE1 3.8Å; Q98-Y103 HydrophobicContact CG-CE2 4.11Å; Q98-R193 PolarHBondContact O-NH1 2.99Å; Q98-R193 VanDerWaalsContact O-NH1 3.09Å; Q98-R193 PolarHBondContact O-NH2 3.05Å
99	F	93.6	Very high	86.1	Confident	1 Å²	1	27.8 Å²	27.8	0%	0.004	13%	0.132	C	C	.	.			trans	-145.8	161.6	-178.6	69.5	-92.4	0	0	0	112.2	R87 R88 W93 L96 Y97 Y103 D105 W191 T281 E283	R87-F99 HydrophobicContact CB-CE2 4.03Å; R87-F99 HydrophobicContact CB-CZ 4.19Å; R88-F99 HydrophobicContact CG-CD1 4.11Å; R88-F99 HydrophobicContact CG-CE1 3.57Å; R88-F99 HydrophobicContact CG-CZ 4.34Å; W93-F99 HydrophobicContact CE3-CZ 4.39Å; L96-F99 HydrophobicContact CB-CE1 4.36Å; L96-F99 HydrophobicContact CD1-CE1 3.73Å; L96-F99 HydrophobicContact CD1-CZ 4.47Å; Y97-F99 WeakPolarHBondContact O-CD1 3.37Å; Y97-F99 PolarHBondContact O-N 2.94Å; F99-Y103 WeakPolarHBondContact O-CD2 3.42Å; F99-D105 WeakPolarHBondContact CA-OD2 3.49Å; F99-D105 WeakPolarHBondContact CB-OD2 3.3Å; F99-W191 AromaticContact CD2-CD1 3.55Å; F99-W191 HydrophobicContact CD2-CG 4.26Å; F99-W191 AromaticContact CD2-NE1 3.98Å; F99-T281 HydrophobicContact CB-CG2 4.44Å; F99-T281 HydrophobicContact CD1-CG2 3.85Å; F99-T281 HydrophobicContact CD2-CG2 3.88Å; F99-T281 HydrophobicContact CE1-CG2 4Å; F99-T281 HydrophobicContact CE2-CG2 4.03Å; F99-T281 HydrophobicContact CG-CG2 3.8Å; F99-T281 HydrophobicContact CZ-CG2 4.09Å; F99-E283 HydrophobicContact CE2-CB 4.21Å; F99-E283 HydrophobicContact CE2-CG 4.16Å
100	G	90	Very high	85	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.01	16%	0.158	C	C	.	.	S	Bend	trans	107	-174.3	179.2	0	0	0	0	0	114.2	R102 Y103 Y104 D105	G100-R102 VanDerWaalsContact C-N 3.3Å; G100-R102 PolarHBondContact O-N 2.72Å; G100-Y103 CarbonylContact O-C 3.59Å; G100-Y103 PolarHBondContact O-N 3.4Å; G100-Y104 PolarHBondContact O-N 3.39Å; G100-D105 PolarHBondContact N-OD2 2.97Å; G100-D105 PolarHBondContact O-N 3.35Å
101	E	86.6	Confident	84.1	Confident	51 Å²	51	40.1 Å²	40.1	24%	0.238	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-60.6	-38.6	-172.6	-55.9	91.5	149	0	0	112.5	T83 R87 Y103 Y104 W191	T83-E101 HydrophobicContact CG2-CB 4.43Å; R87-E101 IonicContact CZ-OE1 2.79Å; R87-E101 IonicContact CZ-OE2 3.56Å; R87-E101 IonicContact NE-OE2 3.82Å; R87-E101 PolarHBondContact NE-OE2 2.99Å; R87-E101 VanDerWaalsContact NH2-CD 3.28Å; R87-E101 IonicContact NH2-OE1 2.86Å; R87-E101 PolarHBondContact NH2-OE1 3.29Å; R87-E101 IonicContact NH2-OE2 2.76Å; R87-E101 PolarHBondContact NH2-OE2 3.03Å; E101-Y103 PolarHBondContact O-N 2.86Å; E101-Y103 VanDerWaalsContact O-N 3.09Å; E101-Y104 PolarHBondContact O-N 2.88Å; E101-W191 HydrophobicContact CG-CH2 3.61Å; E101-W191 HydrophobicContact CG-CZ3 3.92Å; E101-W191 VanDerWaalsContact OE1-CH2 3.24Å; E101-W191 WeakPolarHBondContact OE1-CH2 3.2Å
102	R	84.8	Confident	82.7	Confident	88 Å²	88	40.1 Å²	40.1	33%	0.332	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-52.8	-29.9	174	177.5	172.9	176.3	166.3	4.2	113	T83 L84 G100	T83-R102 WeakPolarHBondContact O-CB 3.43Å; T83-R102 WeakPolarHBondContact O-CG 3.25Å; L84-R102 PolarHBondContact O-NH1 2.88Å; G100-R102 VanDerWaalsContact C-N 3.3Å; G100-R102 PolarHBondContact O-N 2.72Å
103	Y	87.5	Confident	81.3	Confident	30 Å²	30	47.6 Å²	47.6	12%	0.118	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-108.2	17.4	-176	-58.6	-73.9	0	0	0	113.1	D86 Q98 F99 G100 E101 D105	D86-Y103 PolarHBondContact OD2-OH 3.26Å; Q98-Y103 HydrophobicContact CB-CD1 3.83Å; Q98-Y103 HydrophobicContact CB-CD2 3.84Å; Q98-Y103 HydrophobicContact CB-CE1 3.7Å; Q98-Y103 HydrophobicContact CB-CE2 3.67Å; Q98-Y103 HydrophobicContact CB-CG 3.9Å; Q98-Y103 HydrophobicContact CG-CD1 4.41Å; Q98-Y103 HydrophobicContact CG-CE1 3.8Å; Q98-Y103 HydrophobicContact CG-CE2 4.11Å; F99-Y103 WeakPolarHBondContact O-CD2 3.42Å; G100-Y103 CarbonylContact O-C 3.59Å; G100-Y103 PolarHBondContact O-N 3.4Å; E101-Y103 PolarHBondContact O-N 2.86Å; E101-Y103 VanDerWaalsContact O-N 3.09Å; Y103-D105 VanDerWaalsContact C-N 3.27Å; Y103-D105 PolarHBondContact O-N 3.38Å
104	Y	86	Confident	80.2	Confident	43 Å²	43	55 Å²	55	17%	0.169	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.6	25.8	177.2	-46.4	-82.7	0	0	0	114.3	G100 E101 I232 P233 R235 F246 G247 I249	G100-Y104 PolarHBondContact O-N 3.39Å; E101-Y104 PolarHBondContact O-N 2.88Å; Y104-I232 HydrophobicContact CE1-CG2 4.1Å; Y104-P233 WeakPolarHBondContact OH-CD 3.41Å; Y104-P233 WeakPolarHBondContact OH-CG 3.14Å; Y104-R235 VanDerWaalsContact CD2-NH2 3.28Å; Y104-F246 HydrophobicContact CD1-CE1 4.38Å; Y104-F246 HydrophobicContact CD1-CE2 4.41Å; Y104-F246 HydrophobicContact CD1-CZ 4.22Å; Y104-F246 CarbonylContact O-C 3.47Å; Y104-F246 WeakPolarHBondContact O-CA 3.36Å; Y104-G247 PolarHBondContact O-N 3.29Å; Y104-I249 HydrophobicContact CD2-CD1 4.28Å
105	D	90.3	Very high	79.5	Confident	4 Å²	4	55.7 Å²	55.7	2%	0.021	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-72.1	148	173.4	-65.1	-4.7	0	0	0	110.3	F99 G100 Y103 W191 Y192 R193	F99-D105 WeakPolarHBondContact CA-OD2 3.49Å; F99-D105 WeakPolarHBondContact CB-OD2 3.3Å; G100-D105 PolarHBondContact N-OD2 2.97Å; G100-D105 PolarHBondContact O-N 3.35Å; Y103-D105 VanDerWaalsContact C-N 3.27Å; Y103-D105 PolarHBondContact O-N 3.38Å; D105-W191 HydrophobicContact CB-CB 4Å; D105-W191 HydrophobicContact CB-CD2 4.38Å; D105-W191 HydrophobicContact CB-CE3 3.81Å; D105-W191 HydrophobicContact CB-CG 4.49Å; D105-Y192 WeakPolarHBondContact CA-O 3.32Å; D105-R193 WeakPolarHBondContact OD1-CB 3.31Å; D105-R193 WeakPolarHBondContact OD1-CD 3.12Å; D105-R193 WeakPolarHBondContact OD1-CG 3.44Å; D105-R193 IonicContact OD1-NE 2.69Å; D105-R193 IonicContact OD1-NH1 2.98Å
106	V	89	Confident	79.4	Confident	34 Å²	34	56 Å²	56	21%	0.206	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	133.3	172.2	170.3	0	0	0	0	109.2	W191 Y192 F246	V106-W191 WeakPolarHBondContact O-CA 3.2Å; V106-Y192 HydrophobicContact CB-CD1 4.04Å; V106-Y192 HydrophobicContact CB-CE1 3.47Å; V106-Y192 VanDerWaalsContact CB-CE1 3.47Å; V106-Y192 HydrophobicContact CG1-CD1 4.29Å; V106-Y192 HydrophobicContact CG1-CE1 3.46Å; V106-Y192 VanDerWaalsContact CG1-CE1 3.46Å; V106-Y192 HydrophobicContact CG2-CE1 4.47Å; V106-Y192 PolarHBondContact N-O 3.44Å; V106-Y192 PolarHBondContact O-N 3.35Å; V106-F246 HydrophobicContact CG2-CB 3.93Å
107	D	88.4	Confident	79.1	Confident	23 Å²	23	60.7 Å²	60.7	12%	0.123	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	124.9	172.1	-164.4	-9.5	0	0	0	110.5	T109 R186 H189 W191	D107-T109 VanDerWaalsContact C-N 3.31Å; D107-T109 WeakPolarHBondContact OD1-CB 3.48Å; D107-T109 WeakPolarHBondContact OD1-CG2 3.29Å; D107-T109 PolarHBondContact OD1-N 3.33Å; D107-T109 PolarHBondContact OD1-OG1 3.25Å; D107-T109 VanDerWaalsContact OD1-OG1 3.07Å; D107-T109 WeakPolarHBondContact OD2-CG2 3.39Å; D107-T109 PolarHBondContact OD2-OG1 2.95Å; D107-R186 IonicContact OD2-CZ 3.92Å; D107-R186 IonicContact OD2-NH2 2.76Å; D107-R186 PolarHBondContact OD2-NH2 2.88Å; D107-H189 IonicContact OD2-CE1 2.86Å; D107-H189 IonicContact OD2-CG 3.74Å; D107-H189 IonicContact OD2-ND1 3.8Å; D107-H189 PolarHBondContact OD2-ND1 2.82Å; D107-W191 HydrophobicContact CB-CE3 3.94Å; D107-W191 HydrophobicContact CB-CH2 3.8Å; D107-W191 HydrophobicContact CB-CZ3 3.45Å; D107-W191 VanDerWaalsContact CB-CZ3 3.45Å
108	I	81.1	Confident	78.7	Confident	12 Å²	12	60.4 Å²	60.4	6%	0.062	26%	0.261	C	S	.	.			trans	-86.7	2.3	176	68.1	171	0	0	0	113.6	W110 R111 L116 V136 P138 V190 Y192	I108-W110 PolarHBondContact O-N 2.83Å; I108-W110 VanDerWaalsContact O-N 3.11Å; I108-R111 PolarHBondContact O-N 2.71Å; I108-L116 HydrophobicContact CG2-CB 4.27Å; I108-L116 HydrophobicContact CG2-CD2 3.62Å; I108-V136 HydrophobicContact CD1-CB 4.45Å; I108-V136 HydrophobicContact CD1-CG1 3.83Å; I108-P138 HydrophobicContact CD1-CG 4Å; I108-V190 HydrophobicContact CD1-CB 3.75Å; I108-V190 HydrophobicContact CD1-CG1 3.43Å; I108-V190 VanDerWaalsContact CD1-CG1 3.43Å; I108-V190 HydrophobicContact CG1-CB 3.52Å; I108-V190 HydrophobicContact CG1-CG1 3.71Å; I108-V190 WeakPolarHBondContact CG1-O 2.97Å; I108-V190 PolarHBondContact N-O 3.45Å; I108-Y192 HydrophobicContact CG2-CD1 3.65Å; I108-Y192 HydrophobicContact CG2-CE1 3.8Å
109	T	71.5	Confident	78.5	Confident	9 Å²	9	60.7 Å²	60.7	6%	0.055	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-23.9	-176.7	51.7	0	0	0	0	115.9	D107 R111 P112 F179 R186	D107-T109 VanDerWaalsContact C-N 3.31Å; D107-T109 WeakPolarHBondContact OD1-CB 3.48Å; D107-T109 WeakPolarHBondContact OD1-CG2 3.29Å; D107-T109 PolarHBondContact OD1-N 3.33Å; D107-T109 PolarHBondContact OD1-OG1 3.25Å; D107-T109 VanDerWaalsContact OD1-OG1 3.07Å; D107-T109 WeakPolarHBondContact OD2-CG2 3.39Å; D107-T109 PolarHBondContact OD2-OG1 2.95Å; T109-R111 PolarHBondContact O-N 3.29Å; T109-P112 WeakPolarHBondContact O-CD 3.38Å; T109-F179 HydrophobicContact CG2-CD1 3.77Å; T109-F179 HydrophobicContact CG2-CE1 3.37Å; T109-F179 HydrophobicContact CG2-CZ 3.94Å; T109-R186 VanDerWaalsContact CB-CZ 3.48Å; T109-R186 PolarHBondContact OG1-NH1 3.28Å; T109-R186 PolarHBondContact OG1-NH2 2.94Å
110	W	60.2	Low	78.1	Confident	146 Å²	146	60.8 Å²	60.8	55%	0.553	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-6.4	-179.4	-63.1	104.6	0	0	0	114	I108 E226	I108-W110 PolarHBondContact O-N 2.83Å; I108-W110 VanDerWaalsContact O-N 3.11Å; W110-E226 WeakPolarHBondContact CH2-OE1 3.37Å; W110-E226 WeakPolarHBondContact CZ2-OE1 3.49Å; W110-E226 WeakPolarHBondContact CZ2-OE2 3.07Å
111	R	57.7	Low	77.8	Confident	142 Å²	142	66.4 Å²	66.4	54%	0.536	30%	0.296	S	S	.	.	S	Bend	trans	-131.5	66	179.5	-60.1	-172.2	177.1	-173.5	1.5	112.2	I108 T109 W113 R114	I108-R111 PolarHBondContact O-N 2.71Å; T109-R111 PolarHBondContact O-N 3.29Å; R111-W113 PolarHBondContact O-N 3.42Å; R111-R114 HydrophobicContact CB-CB 4.14Å; R111-R114 PolarHBondContact O-N 2.74Å; R111-R114 VanDerWaalsContact O-N 3.12Å
112	P	52.3	Low	77.9	Confident	72 Å²	72	64.3 Å²	64.3	47%	0.468	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	133.5	173	25.1	-30.6	0	0	0	109.3	T109	T109-P112 WeakPolarHBondContact O-CD 3.38Å
113	W	52.8	Low	78.2	Confident	179 Å²	179	64 Å²	64	68%	0.678	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	14.5	-175.8	-42.9	101.1	0	0	0	117	R111	R111-W113 PolarHBondContact O-N 3.42Å
114	R	64.2	Low	78.4	Confident	172 Å²	172	62.6 Å²	62.6	65%	0.649	28%	0.282	S	S	*	.			trans	-127.1	138	168.7	-57.3	-176.3	177.9	-171.5	-1.4	110.8	R111	R111-R114 HydrophobicContact CB-CB 4.14Å; R111-R114 PolarHBondContact O-N 2.74Å; R111-R114 VanDerWaalsContact O-N 3.12Å
115	D	72.4	Confident	78.7	Confident	35 Å²	35	60.6 Å²	60.6	19%	0.187	27%	0.274	C	S	.	.			trans	-63.2	153.2	165.2	56.8	-55	0	0	0	111.4	F135 F137	D115-F135 HydrophobicContact CB-CB 4.42Å; D115-F135 WeakPolarHBondContact OD2-CD1 3.46Å; D115-F137 HydrophobicContact CB-CD1 4.13Å; D115-F137 HydrophobicContact CB-CE1 3.61Å; D115-F137 HydrophobicContact CB-CE2 4.04Å; D115-F137 HydrophobicContact CB-CZ 3.54Å
116	L	81.3	Confident	78.7	Confident	40 Å²	40	60.4 Å²	60.4	21%	0.209	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	116.7	166.3	-179.3	68.1	0	0	0	108.7	I108 I118 F135 V136 Y192	I108-L116 HydrophobicContact CG2-CB 4.27Å; I108-L116 HydrophobicContact CG2-CD2 3.62Å; L116-I118 HydrophobicContact CD2-CG1 4.35Å; L116-I118 HydrophobicContact CG-CG1 4.34Å; L116-F135 WeakPolarHBondContact O-CA 3.32Å; L116-V136 PolarHBondContact N-O 2.94Å; L116-V136 PolarHBondContact O-N 3.22Å; L116-Y192 HydrophobicContact CD2-CD1 4.26Å; L116-Y192 HydrophobicContact CD2-CE1 3.36Å
117	Q	85.4	Confident	78.6	Confident	101 Å²	101	60 Å²	60	47%	0.472	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	128.4	165.7	-171.3	178.5	-32.6	0	0	109.6	D119 T134 F135	Q117-D119 PolarHBondContact NE2-OD1 2.95Å; Q117-D119 VanDerWaalsContact NE2-OD1 3.07Å; Q117-T134 CarbonylContact C-O 3.55Å; Q117-T134 WeakPolarHBondContact CA-O 3.36Å; Q117-F135 HydrophobicContact CB-CD1 3.76Å; Q117-F135 HydrophobicContact CB-CE1 3.59Å; Q117-F135 HydrophobicContact CG-CD1 4.12Å; Q117-F135 HydrophobicContact CG-CE1 3.69Å; Q117-F135 HydrophobicContact CG-CZ 4.23Å
118	I	86.7	Confident	78.3	Confident	7 Å²	7	59 Å²	59	4%	0.036	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	119.6	174	-56.2	172.2	0	0	0	106.9	L116 L120 Y133 T134 V136 Y192 V194	L116-I118 HydrophobicContact CD2-CG1 4.35Å; L116-I118 HydrophobicContact CG-CG1 4.34Å; I118-L120 HydrophobicContact CG2-CD2 4.4Å; I118-Y133 CarbonylContact O-C 3.55Å; I118-Y133 VanDerWaalsContact O-CA 3.23Å; I118-Y133 WeakPolarHBondContact O-CA 3.46Å; I118-T134 HydrophobicContact CB-CG2 4.07Å; I118-T134 PolarHBondContact N-O 3.38Å; I118-T134 PolarHBondContact O-N 2.91Å; I118-V136 HydrophobicContact CD1-CB 4.39Å; I118-V136 HydrophobicContact CD1-CG2 3.36Å; I118-V136 HydrophobicContact CG1-CG2 4.37Å; I118-Y192 HydrophobicContact CD1-CD1 4.13Å; I118-Y192 HydrophobicContact CD1-CD2 3.39Å; I118-Y192 HydrophobicContact CD1-CE1 4.26Å; I118-Y192 HydrophobicContact CD1-CE2 3.56Å; I118-Y192 HydrophobicContact CD1-CG 3.69Å; I118-Y192 HydrophobicContact CG1-CD2 4.32Å; I118-Y192 HydrophobicContact CG1-CE2 3.99Å; I118-Y192 HydrophobicContact CG2-CE2 4.25Å; I118-V194 HydrophobicContact CG2-CG2 4.12Å
119	D	86.6	Confident	78.5	Confident	84 Å²	84	58.8 Å²	58.8	45%	0.449	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	127.9	171.3	-59.9	-35.4	0	0	0	109	Q117 R248	Q117-D119 PolarHBondContact NE2-OD1 2.95Å; Q117-D119 VanDerWaalsContact NE2-OD1 3.07Å; D119-R248 PolarHBondContact O-NH2 3.24Å
120	L	85.7	Confident	79.3	Confident	4 Å²	4	62.9 Å²	62.9	2%	0.021	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	107.8	173.5	-55.2	174.6	0	0	0	104.6	I118 F122 L124 N132 T134 V194	I118-L120 HydrophobicContact CG2-CD2 4.4Å; L120-F122 HydrophobicContact CB-CD1 4.25Å; L120-F122 HydrophobicContact CB-CD2 4.38Å; L120-F122 HydrophobicContact CB-CE1 3.99Å; L120-F122 HydrophobicContact CB-CE2 4.13Å; L120-F122 HydrophobicContact CB-CG 4.45Å; L120-F122 HydrophobicContact CB-CZ 3.93Å; L120-F122 HydrophobicContact CD1-CE2 4.34Å; L120-F122 HydrophobicContact CD1-CZ 4.39Å; L120-F122 HydrophobicContact CD2-CE1 4.16Å; L120-F122 HydrophobicContact CD2-CZ 3.82Å; L120-F122 HydrophobicContact CG-CZ 4.25Å; L120-F122 PolarHBondContact O-N 3.43Å; L120-L124 HydrophobicContact CD1-CB 4Å; L120-L124 HydrophobicContact CD1-CD1 3.66Å; L120-L124 HydrophobicContact CD1-CG 4.48Å; L120-N132 CarbonylContact C-O 3.55Å; L120-N132 PolarHBondContact N-O 2.88Å; L120-N132 CarbonylContact O-C 3.59Å; L120-T134 HydrophobicContact CD1-CG2 4.24Å; L120-T134 HydrophobicContact CD2-CG2 4.02Å; L120-T134 HydrophobicContact CG-CG2 4.24Å; L120-V194 HydrophobicContact CD2-CG2 4.46Å
121	D	83.4	Confident	80.7	Confident	119 Å²	119	57 Å²	57	64%	0.636	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.7	21.1	179.1	-58	-46.7	0	0	0	112.8	R248	D121-R248 IonicContact OD1-NH2 2.99Å; D121-R248 IonicContact OD2-CZ 2.71Å; D121-R248 IonicContact OD2-NE 3.89Å; D121-R248 IonicContact OD2-NH1 3.89Å; D121-R248 PolarHBondContact OD2-NH1 3.01Å; D121-R248 IonicContact OD2-NH2 3.27Å; D121-R248 PolarHBondContact OD2-NH2 2.02Å
122	F	89.2	Confident	82.2	Confident	6 Å²	6	54 Å²	54	3%	0.026	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	160.7	-179.3	58.9	-92.4	0	0	0	107.9	L120 L124 V194 Y276 T315 E317	L120-F122 HydrophobicContact CB-CD1 4.25Å; L120-F122 HydrophobicContact CB-CD2 4.38Å; L120-F122 HydrophobicContact CB-CE1 3.99Å; L120-F122 HydrophobicContact CB-CE2 4.13Å; L120-F122 HydrophobicContact CB-CG 4.45Å; L120-F122 HydrophobicContact CB-CZ 3.93Å; L120-F122 HydrophobicContact CD1-CE2 4.34Å; L120-F122 HydrophobicContact CD1-CZ 4.39Å; L120-F122 HydrophobicContact CD2-CE1 4.16Å; L120-F122 HydrophobicContact CD2-CZ 3.82Å; L120-F122 HydrophobicContact CG-CZ 4.25Å; L120-F122 PolarHBondContact O-N 3.43Å; F122-L124 HydrophobicContact CE2-CB 4.23Å; F122-L124 HydrophobicContact CE2-CD1 4.3Å; F122-V194 HydrophobicContact CE1-CG1 3.71Å; F122-V194 HydrophobicContact CZ-CG1 4.5Å; F122-Y276 HydrophobicContact CB-CD1 3.98Å; F122-Y276 HydrophobicContact CB-CD2 3.61Å; F122-Y276 HydrophobicContact CB-CE1 3.93Å; F122-Y276 HydrophobicContact CB-CE2 3.54Å; F122-Y276 HydrophobicContact CB-CG 3.82Å; F122-Y276 AromaticContact CD1-CD1 3.54Å; F122-Y276 HydrophobicContact CD1-CD1 3.54Å; F122-Y276 HydrophobicContact CD1-CD2 4.27Å; F122-Y276 HydrophobicContact CD1-CE1 4.15Å; F122-Y276 AromaticContact CD1-CG 3.6Å; F122-Y276 HydrophobicContact CD1-CG 3.6Å; F122-Y276 AromaticContact CD2-CD2 3.99Å; F122-Y276 HydrophobicContact CD2-CD2 3.99Å; F122-Y276 AromaticContact CD2-CG 3.91Å; F122-Y276 HydrophobicContact CD2-CG 3.91Å; F122-Y276 HydrophobicContact CE1-CD1 4.16Å; F122-Y276 HydrophobicContact CE1-CG 4.09Å; F122-Y276 HydrophobicContact CE2-CG 4.37Å; F122-Y276 AromaticContact CG-CD1 3.82Å; F122-Y276 HydrophobicContact CG-CD1 3.82Å; F122-Y276 AromaticContact CG-CD2 3.71Å; F122-Y276 HydrophobicContact CG-CD2 3.71Å; F122-Y276 HydrophobicContact CG-CE1 4.28Å; F122-Y276 HydrophobicContact CG-CE2 4.16Å; F122-Y276 AromaticContact CG-CG 3.5Å; F122-Y276 HydrophobicContact CG-CG 3.5Å; F122-Y276 VanDerWaalsContact CG-CG 3.5Å; F122-Y276 HydrophobicContact CZ-CG 4.44Å; F122-T315 HydrophobicContact CD2-CG2 3.74Å; F122-T315 HydrophobicContact CE2-CG2 3.55Å; F122-E317 HydrophobicContact CB-CG 4.25Å; F122-E317 WeakPolarHBondContact CB-OE1 3.36Å
123	F	89.9	Confident	84.1	Confident	81 Å²	81	54.2 Å²	54.2	36%	0.355	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	134.1	176.1	-68.8	-73.9	0	0	0	111.8	P125 R130 F131 N132 E317	F123-P125 WeakPolarHBondContact O-CD 3.5Å; F123-R130 HydrophobicContact CB-CG 3.71Å; F123-R130 HydrophobicContact CD1-CG 3.73Å; F123-R130 HydrophobicContact CG-CG 3.97Å; F123-R130 VanDerWaalsContact CG-CZ 3.42Å; F123-F131 CarbonylContact C-O 3.51Å; F123-F131 WeakPolarHBondContact CA-O 3.02Å; F123-N132 HydrophobicContact CD1-CB 4.18Å; F123-N132 HydrophobicContact CE1-CB 4.18Å; F123-E317 HydrophobicContact CB-CB 4.41Å; F123-E317 HydrophobicContact CB-CG 4.48Å; F123-E317 VanDerWaalsContact O-CA 3.3Å; F123-E317 WeakPolarHBondContact O-CA 3.18Å; F123-E317 WeakPolarHBondContact O-CG 3.44Å
124	L	91.6	Very high	86	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	102.5	177.8	-171.9	157.4	0	0	0	108.9	L120 F122 F126 F131 F144 I313 T320	L120-L124 HydrophobicContact CD1-CB 4Å; L120-L124 HydrophobicContact CD1-CD1 3.66Å; L120-L124 HydrophobicContact CD1-CG 4.48Å; F122-L124 HydrophobicContact CE2-CB 4.23Å; F122-L124 HydrophobicContact CE2-CD1 4.3Å; L124-F126 HydrophobicContact CD2-CB 3.9Å; L124-F126 PolarHBondContact O-N 3.03Å; L124-F131 PolarHBondContact N-O 2.76Å; L124-F131 PolarHBondContact O-N 2.85Å; L124-F144 HydrophobicContact CD1-CE1 3.99Å; L124-F144 HydrophobicContact CD1-CZ 4.34Å; L124-F144 HydrophobicContact CD2-CD1 4.49Å; L124-F144 HydrophobicContact CD2-CE1 3.7Å; L124-F144 HydrophobicContact CD2-CE2 4.41Å; L124-F144 HydrophobicContact CD2-CZ 3.65Å; L124-F144 HydrophobicContact CG-CE1 4.47Å; L124-I313 HydrophobicContact CD1-CG2 3.84Å; L124-I313 HydrophobicContact CG-CG2 4.47Å; L124-T320 HydrophobicContact CD2-CG2 4.14Å; L124-T320 HydrophobicContact CG-CG2 4.21Å
125	P	92.3	Very high	87.2	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.006	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	127	170.1	-23.5	33.8	0	0	0	111.1	F123 F129 E317 T320 D392 W892	F123-P125 WeakPolarHBondContact O-CD 3.5Å; P125-F129 CarbonylContact C-O 3.47Å; P125-F129 VanDerWaalsContact CA-O 3.25Å; P125-F129 WeakPolarHBondContact CA-O 3.41Å; P125-E317 WeakPolarHBondContact CG-O 3.45Å; P125-T320 WeakPolarHBondContact CD-OG1 3.27Å; P125-T320 WeakPolarHBondContact O-CB 3.17Å; P125-T320 PolarHBondContact O-OG1 3.01Å; P125-D392 HydrophobicContact CB-CB 4.06Å; P125-W892 HydrophobicContact CB-CZ2 4.31Å; P125-W892 HydrophobicContact CG-CH2 4.43Å; P125-W892 HydrophobicContact CG-CZ2 4.3Å
126	F	91.6	Very high	88	Confident	1 Å²	1	36.7 Å²	36.7	0%	0.004	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	115.7	174.1	179.6	-96.9	0	0	0	109.6	L124 G128 F129 F131 F144 V170 F353 N354 V391	L124-F126 HydrophobicContact CD2-CB 3.9Å; L124-F126 PolarHBondContact O-N 3.03Å; F126-G128 VanDerWaalsContact C-N 3.28Å; F126-G128 PolarHBondContact O-N 2.74Å; F126-F129 PolarHBondContact N-O 2.95Å; F126-F129 WeakPolarHBondContact O-CB 3.16Å; F126-F129 WeakPolarHBondContact O-CD2 3.46Å; F126-F129 PolarHBondContact O-N 3.31Å; F126-F131 HydrophobicContact CB-CD2 3.99Å; F126-F131 HydrophobicContact CB-CE2 3.94Å; F126-F131 HydrophobicContact CD1-CE2 4.13Å; F126-F144 HydrophobicContact CB-CD2 4.38Å; F126-F144 HydrophobicContact CB-CE2 4.11Å; F126-F144 AromaticContact CD1-CD2 3.81Å; F126-F144 HydrophobicContact CD1-CD2 3.81Å; F126-F144 AromaticContact CD1-CE2 3.89Å; F126-F144 HydrophobicContact CD1-CE2 3.89Å; F126-F144 AromaticContact CD2-CE2 3.76Å; F126-F144 HydrophobicContact CD2-CE2 3.76Å; F126-F144 HydrophobicContact CD2-CZ 4.49Å; F126-F144 HydrophobicContact CE1-CD2 4.17Å; F126-F144 HydrophobicContact CE1-CE2 4.2Å; F126-F144 HydrophobicContact CE2-CE2 4.11Å; F126-F144 AromaticContact CG-CD2 3.98Å; F126-F144 HydrophobicContact CG-CD2 3.98Å; F126-F144 AromaticContact CG-CE2 3.64Å; F126-F144 HydrophobicContact CG-CE2 3.64Å; F126-F144 HydrophobicContact CZ-CE2 4.31Å; F126-V170 HydrophobicContact CD2-CG2 4.35Å; F126-V170 HydrophobicContact CE2-CG2 3.59Å; F126-V170 HydrophobicContact CZ-CG2 3.9Å; F126-F353 HydrophobicContact CE2-CD1 4.27Å; F126-F353 HydrophobicContact CZ-CB 4.32Å; F126-N354 VanDerWaalsContact CE1-O 3.25Å; F126-N354 WeakPolarHBondContact CE1-O 3.3Å; F126-V391 CarbonylContact C-O 3.49Å; F126-V391 WeakPolarHBondContact CA-O 3.32Å; F126-V391 HydrophobicContact CD2-CB 3.88Å; F126-V391 HydrophobicContact CD2-CG2 3.67Å; F126-V391 HydrophobicContact CE2-CB 3.99Å; F126-V391 HydrophobicContact CE2-CG1 4.42Å; F126-V391 HydrophobicContact CE2-CG2 4.14Å
127	Y	86.1	Confident	88.4	Confident	26 Å²	26	35.7 Å²	35.7	10%	0.102	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	41.6	177.8	-153.9	-96.6	0	0	0	114	F129 T359 Y362 V391 D392 I395 R890	Y127-F129 VanDerWaalsContact C-N 3.27Å; Y127-F129 WeakPolarHBondContact O-CD2 3.37Å; Y127-F129 PolarHBondContact O-N 2.9Å; Y127-T359 HydrophobicContact CD1-CG2 4.36Å; Y127-T359 VanDerWaalsContact CE1-CB 3.46Å; Y127-T359 HydrophobicContact CE1-CG2 4.02Å; Y127-T359 WeakPolarHBondContact CE1-OG1 3.47Å; Y127-Y362 HydrophobicContact CD2-CE2 4.42Å; Y127-Y362 AromaticContact CE2-CE2 3.57Å; Y127-Y362 HydrophobicContact CE2-CE2 3.57Å; Y127-Y362 AromaticContact CE2-CZ 3.7Å; Y127-Y362 WeakPolarHBondContact CE2-OH 3.3Å; Y127-Y362 AromaticContact CZ-CE2 3.89Å; Y127-Y362 PolarHBondContact OH-OH 2.97Å; Y127-V391 PolarHBondContact N-O 2.97Å; Y127-D392 PolarHBondContact N-O 2.72Å; Y127-I395 HydrophobicContact CD2-CD1 3.64Å; Y127-I395 HydrophobicContact CD2-CG1 3.92Å; Y127-I395 HydrophobicContact CE2-CD1 3.93Å; Y127-I395 HydrophobicContact CE2-CG1 4.29Å; Y127-R890 PolarHBondContact O-NE 3.5Å
128	G	81.9	Confident	88.6	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.8	-8.5	-178.2	0	0	0	0	0	114.4	F126 D392 R890 W892	F126-G128 VanDerWaalsContact C-N 3.28Å; F126-G128 PolarHBondContact O-N 2.74Å; G128-D392 PolarHBondContact N-O 2.81Å; G128-R890 WeakPolarHBondContact O-CA 3.11Å; G128-W892 VanDerWaalsContact O-CD1 3.25Å; G128-W892 PolarHBondContact O-NE1 2.85Å
129	F	85.8	Confident	88.6	Confident	8 Å²	8	31.9 Å²	31.9	4%	0.035	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	165.4	171.4	-57.9	-85.3	0	0	0	110.8	P125 F126 Y127 F131 F889 R890	P125-F129 CarbonylContact C-O 3.47Å; P125-F129 VanDerWaalsContact CA-O 3.25Å; P125-F129 WeakPolarHBondContact CA-O 3.41Å; F126-F129 PolarHBondContact N-O 2.95Å; F126-F129 WeakPolarHBondContact O-CB 3.16Å; F126-F129 WeakPolarHBondContact O-CD2 3.46Å; F126-F129 PolarHBondContact O-N 3.31Å; Y127-F129 VanDerWaalsContact C-N 3.27Å; Y127-F129 WeakPolarHBondContact O-CD2 3.37Å; Y127-F129 PolarHBondContact O-N 2.9Å; F129-F131 HydrophobicContact CB-CD2 4.29Å; F129-F131 HydrophobicContact CB-CE1 4.5Å; F129-F131 HydrophobicContact CB-CE2 3.53Å; F129-F131 HydrophobicContact CB-CZ 3.66Å; F129-F131 HydrophobicContact CG-CE2 4.39Å; F129-F131 HydrophobicContact CG-CZ 4.18Å; F129-F889 HydrophobicContact CD1-CB 3.72Å; F129-F889 HydrophobicContact CE1-CB 3.98Å; F129-R890 HydrophobicContact CD1-CG 3.82Å; F129-R890 HydrophobicContact CD2-CG 4.25Å; F129-R890 HydrophobicContact CE1-CG 3.57Å; F129-R890 HydrophobicContact CE2-CG 4.03Å; F129-R890 HydrophobicContact CG-CG 4.16Å; F129-R890 HydrophobicContact CZ-CG 3.68Å
130	R	87.6	Confident	88.8	Confident	95 Å²	95	27.9 Å²	27.9	36%	0.358	13%	0.128	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	110.1	179.7	-165.4	179.9	-169	-162.7	-3.8	109.1	F123 E317 W892	F123-R130 HydrophobicContact CB-CG 3.71Å; F123-R130 HydrophobicContact CD1-CG 3.73Å; F123-R130 HydrophobicContact CG-CG 3.97Å; F123-R130 VanDerWaalsContact CG-CZ 3.42Å; R130-E317 IonicContact NH2-OE2 2.67Å; R130-E317 PolarHBondContact NH2-OE2 3.02Å; R130-W892 HydrophobicContact CB-CD2 4.29Å; R130-W892 HydrophobicContact CB-CG 4.19Å
131	F	90.4	Very high	89.1	Confident	22 Å²	22	28.2 Å²	28.2	10%	0.096	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	151.6	-176.5	-60.5	-76.6	0	0	0	111.5	F123 L124 F126 F129 F144	F123-F131 CarbonylContact C-O 3.51Å; F123-F131 WeakPolarHBondContact CA-O 3.02Å; L124-F131 PolarHBondContact N-O 2.76Å; L124-F131 PolarHBondContact O-N 2.85Å; F126-F131 HydrophobicContact CB-CD2 3.99Å; F126-F131 HydrophobicContact CB-CE2 3.94Å; F126-F131 HydrophobicContact CD1-CE2 4.13Å; F129-F131 HydrophobicContact CB-CD2 4.29Å; F129-F131 HydrophobicContact CB-CE1 4.5Å; F129-F131 HydrophobicContact CB-CE2 3.53Å; F129-F131 HydrophobicContact CB-CZ 3.66Å; F129-F131 HydrophobicContact CG-CE2 4.39Å; F129-F131 HydrophobicContact CG-CZ 4.18Å; F131-F144 HydrophobicContact CB-CB 4.33Å; F131-F144 HydrophobicContact CB-CD1 4.18Å; F131-F144 HydrophobicContact CD1-CB 3.56Å; F131-F144 HydrophobicContact CD1-CG 4.48Å; F131-F144 HydrophobicContact CD2-CB 3.63Å; F131-F144 HydrophobicContact CD2-CD1 4.16Å; F131-F144 HydrophobicContact CD2-CD2 4.22Å; F131-F144 AromaticContact CD2-CG 3.76Å; F131-F144 HydrophobicContact CD2-CG 3.76Å; F131-F144 HydrophobicContact CE1-CB 3.59Å; F131-F144 HydrophobicContact CE2-CB 3.66Å; F131-F144 HydrophobicContact CE2-CD2 4.19Å; F131-F144 HydrophobicContact CE2-CG 4.02Å; F131-F144 HydrophobicContact CG-CB 3.57Å; F131-F144 HydrophobicContact CG-CD1 4.18Å; F131-F144 HydrophobicContact CG-CG 4.01Å; F131-F144 HydrophobicContact CZ-CB 3.64Å; F131-F144 HydrophobicContact CZ-CG 4.48Å
132	N	89.1	Confident	89.5	Confident	81 Å²	81	22.6 Å²	22.6	43%	0.433	10%	0.099	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	14.4	174.3	65.3	-25.4	0	0	0	111.9	L120 F123	L120-N132 CarbonylContact C-O 3.55Å; L120-N132 PolarHBondContact N-O 2.88Å; L120-N132 CarbonylContact O-C 3.59Å; F123-N132 HydrophobicContact CD1-CB 4.18Å; F123-N132 HydrophobicContact CE1-CB 4.18Å
133	Y	91.7	Very high	89.6	Confident	75 Å²	75	22.3 Å²	22.3	29%	0.294	10%	0.097	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	165.2	173	63	-95.1	0	0	0	109.2	I118 F135 F144	I118-Y133 CarbonylContact O-C 3.55Å; I118-Y133 VanDerWaalsContact O-CA 3.23Å; I118-Y133 WeakPolarHBondContact O-CA 3.46Å; Y133-F135 HydrophobicContact CD2-CD2 4.48Å; Y133-F135 AromaticContact CD2-CE2 3.86Å; Y133-F135 HydrophobicContact CD2-CE2 3.86Å; Y133-F135 HydrophobicContact CD2-CZ 4.15Å; Y133-F135 HydrophobicContact CE2-CD2 4.44Å; Y133-F135 AromaticContact CE2-CE2 3.58Å; Y133-F135 HydrophobicContact CE2-CE2 3.58Å; Y133-F135 HydrophobicContact CE2-CZ 4.03Å; Y133-F144 WeakPolarHBondContact CE2-O 3.41Å; Y133-F144 PolarHBondContact OH-O 3.44Å
134	T	92.2	Very high	89.6	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	158.5	174.5	-171.3	0	0	0	0	110.4	Q117 I118 L120 A143 L278	Q117-T134 CarbonylContact C-O 3.55Å; Q117-T134 WeakPolarHBondContact CA-O 3.36Å; I118-T134 HydrophobicContact CB-CG2 4.07Å; I118-T134 PolarHBondContact N-O 3.38Å; I118-T134 PolarHBondContact O-N 2.91Å; L120-T134 HydrophobicContact CD1-CG2 4.24Å; L120-T134 HydrophobicContact CD2-CG2 4.02Å; L120-T134 HydrophobicContact CG-CG2 4.24Å; T134-A143 CarbonylContact C-O 3.56Å; T134-A143 WeakPolarHBondContact CA-O 3.07Å; T134-A143 PolarHBondContact OG1-O 2.76Å; T134-L278 HydrophobicContact CG2-CD2 3.77Å
135	F	90.4	Very high	89.2	Confident	18 Å²	18	19.9 Å²	19.9	8%	0.079	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	126.9	176.2	-59.2	-82.8	0	0	0	109	D115 L116 Q117 Y133 F137 I142 A143	D115-F135 HydrophobicContact CB-CB 4.42Å; D115-F135 WeakPolarHBondContact OD2-CD1 3.46Å; L116-F135 WeakPolarHBondContact O-CA 3.32Å; Q117-F135 HydrophobicContact CB-CD1 3.76Å; Q117-F135 HydrophobicContact CB-CE1 3.59Å; Q117-F135 HydrophobicContact CG-CD1 4.12Å; Q117-F135 HydrophobicContact CG-CE1 3.69Å; Q117-F135 HydrophobicContact CG-CZ 4.23Å; Y133-F135 HydrophobicContact CD2-CD2 4.48Å; Y133-F135 AromaticContact CD2-CE2 3.86Å; Y133-F135 HydrophobicContact CD2-CE2 3.86Å; Y133-F135 HydrophobicContact CD2-CZ 4.15Å; Y133-F135 HydrophobicContact CE2-CD2 4.44Å; Y133-F135 AromaticContact CE2-CE2 3.58Å; Y133-F135 HydrophobicContact CE2-CE2 3.58Å; Y133-F135 HydrophobicContact CE2-CZ 4.03Å; F135-F137 HydrophobicContact CB-CD2 4.29Å; F135-F137 HydrophobicContact CB-CE2 3.59Å; F135-F137 HydrophobicContact CB-CZ 4.33Å; F135-I142 CarbonylContact O-C 3.55Å; F135-I142 WeakPolarHBondContact O-CA 3.31Å; F135-I142 WeakPolarHBondContact O-CB 3.47Å; F135-A143 WeakPolarHBondContact CD2-O 3.1Å; F135-A143 PolarHBondContact N-O 2.87Å; F135-A143 PolarHBondContact O-N 3.3Å
136	V	90.1	Very high	88.5	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	127	176.4	-177.9	0	0	0	0	110.1	I108 L116 I118 I142 V190 V280 W282	I108-V136 HydrophobicContact CD1-CB 4.45Å; I108-V136 HydrophobicContact CD1-CG1 3.83Å; L116-V136 PolarHBondContact N-O 2.94Å; L116-V136 PolarHBondContact O-N 3.22Å; I118-V136 HydrophobicContact CD1-CB 4.39Å; I118-V136 HydrophobicContact CD1-CG2 3.36Å; I118-V136 HydrophobicContact CG1-CG2 4.37Å; V136-I142 HydrophobicContact CB-CG2 4.45Å; V136-I142 HydrophobicContact CG1-CG2 4.45Å; V136-I142 HydrophobicContact CG2-CG2 3.98Å; V136-V190 HydrophobicContact CG1-CG1 4.32Å; V136-V280 HydrophobicContact CG1-CG1 3.69Å; V136-V280 HydrophobicContact CG2-CG2 4.21Å; V136-W282 HydrophobicContact CG1-CZ2 4.5Å
137	F	88.9	Confident	87.7	Confident	20 Å²	20	27.2 Å²	27.2	9%	0.088	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	130.8	-179.3	-72.8	-94.8	0	0	0	111.3	D115 F135 E139 G140 F141 A143 P147 W282	D115-F137 HydrophobicContact CB-CD1 4.13Å; D115-F137 HydrophobicContact CB-CE1 3.61Å; D115-F137 HydrophobicContact CB-CE2 4.04Å; D115-F137 HydrophobicContact CB-CZ 3.54Å; F135-F137 HydrophobicContact CB-CD2 4.29Å; F135-F137 HydrophobicContact CB-CE2 3.59Å; F135-F137 HydrophobicContact CB-CZ 4.33Å; F137-E139 PolarHBondContact O-N 2.92Å; F137-E139 VanDerWaalsContact O-N 3.09Å; F137-G140 PolarHBondContact O-N 3.34Å; F137-F141 HydrophobicContact CB-CD1 3.9Å; F137-F141 HydrophobicContact CB-CD2 4.31Å; F137-F141 HydrophobicContact CB-CE1 3.65Å; F137-F141 HydrophobicContact CB-CE2 4.06Å; F137-F141 HydrophobicContact CB-CG 4.23Å; F137-F141 HydrophobicContact CB-CZ 3.72Å; F137-F141 WeakPolarHBondContact CB-O 3.36Å; F137-F141 HydrophobicContact CD1-CE1 4.21Å; F137-F141 HydrophobicContact CD1-CE2 4.23Å; F137-F141 AromaticContact CD1-CZ 3.65Å; F137-F141 HydrophobicContact CD1-CZ 3.65Å; F137-F141 AromaticContact CD2-CD2 3.89Å; F137-F141 HydrophobicContact CD2-CD2 3.89Å; F137-F141 HydrophobicContact CD2-CE1 4.41Å; F137-F141 AromaticContact CD2-CE2 3.31Å; F137-F141 HydrophobicContact CD2-CE2 3.31Å; F137-F141 AromaticContact CD2-CZ 3.62Å; F137-F141 HydrophobicContact CD2-CZ 3.62Å; F137-F141 HydrophobicContact CE1-CZ 4.15Å; F137-F141 AromaticContact CE2-CE2 3.74Å; F137-F141 HydrophobicContact CE2-CE2 3.74Å; F137-F141 HydrophobicContact CE2-CZ 4.12Å; F137-F141 HydrophobicContact CG-CD1 4.45Å; F137-F141 HydrophobicContact CG-CD2 4.25Å; F137-F141 AromaticContact CG-CE1 3.84Å; F137-F141 HydrophobicContact CG-CE1 3.84Å; F137-F141 AromaticContact CG-CE2 3.6Å; F137-F141 HydrophobicContact CG-CE2 3.6Å; F137-F141 AromaticContact CG-CZ 3.36Å; F137-F141 HydrophobicContact CG-CZ 3.36Å; F137-F141 HydrophobicContact CZ-CE2 4.37Å; F137-F141 HydrophobicContact CZ-CZ 4.38Å; F137-F141 PolarHBondContact N-O 3.27Å; F137-A143 HydrophobicContact CE2-CB 4.05Å; F137-P147 HydrophobicContact CE1-CG 4.07Å; F137-P147 HydrophobicContact CE2-CG 3.68Å; F137-P147 HydrophobicContact CZ-CG 3.34Å; F137-W282 PolarHBondContact O-NE1 2.84Å
138	P	88.6	Confident	87	Confident	6 Å²	6	30.4 Å²	30.4	4%	0.039	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-21.9	171.1	-26	35	0	0	0	114.2	I108 G140 F179 V190 M285	I108-P138 HydrophobicContact CD1-CG 4Å; P138-G140 PolarHBondContact O-N 2.78Å; P138-G140 VanDerWaalsContact O-N 3.12Å; P138-F179 HydrophobicContact CB-CE2 4.05Å; P138-F179 HydrophobicContact CB-CZ 3.88Å; P138-F179 HydrophobicContact CG-CE2 4.3Å; P138-F179 HydrophobicContact CG-CZ 4.14Å; P138-V190 HydrophobicContact CB-CG2 4.49Å; P138-M285 HydrophobicContact CB-CE 4.49Å
139	E	87.6	Confident	86.1	Confident	21 Å²	21	37 Å²	37	10%	0.098	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	3.3	179.5	-66.9	77.3	-171.3	0	0	114.4	F137 F141 M174 G175 Q177	F137-E139 PolarHBondContact O-N 2.92Å; F137-E139 VanDerWaalsContact O-N 3.09Å; E139-F141 HydrophobicContact CB-CD1 4.02Å; E139-F141 HydrophobicContact CB-CE1 3.78Å; E139-M174 WeakPolarHBondContact O-CA 3.02Å; E139-G175 WeakPolarHBondContact CB-O 3.2Å; E139-G175 PolarHBondContact O-N 3.12Å; E139-Q177 PolarHBondContact O-NE2 2.86Å
140	G	90.2	Very high	84.9	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	96	24.7	171.2	0	0	0	0	0	115	F137 P138 A172 F173 Y309	F137-G140 PolarHBondContact O-N 3.34Å; P138-G140 PolarHBondContact O-N 2.78Å; P138-G140 VanDerWaalsContact O-N 3.12Å; G140-A172 PolarHBondContact O-N 3.18Å; G140-F173 CarbonylContact O-C 3.56Å; G140-F173 PolarHBondContact O-N 3.49Å; G140-Y309 WeakPolarHBondContact CA-OH 3.32Å
141	F	91.5	Very high	83.8	Confident	12 Å²	12	38.8 Å²	38.8	5%	0.053	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	165.8	178.3	71.3	-85.7	0	0	0	112.1	F137 E139 A143 P147 L169 V170 A171 M174	F137-F141 HydrophobicContact CB-CD1 3.9Å; F137-F141 HydrophobicContact CB-CD2 4.31Å; F137-F141 HydrophobicContact CB-CE1 3.65Å; F137-F141 HydrophobicContact CB-CE2 4.06Å; F137-F141 HydrophobicContact CB-CG 4.23Å; F137-F141 HydrophobicContact CB-CZ 3.72Å; F137-F141 WeakPolarHBondContact CB-O 3.36Å; F137-F141 HydrophobicContact CD1-CE1 4.21Å; F137-F141 HydrophobicContact CD1-CE2 4.23Å; F137-F141 AromaticContact CD1-CZ 3.65Å; F137-F141 HydrophobicContact CD1-CZ 3.65Å; F137-F141 AromaticContact CD2-CD2 3.89Å; F137-F141 HydrophobicContact CD2-CD2 3.89Å; F137-F141 HydrophobicContact CD2-CE1 4.41Å; F137-F141 AromaticContact CD2-CE2 3.31Å; F137-F141 HydrophobicContact CD2-CE2 3.31Å; F137-F141 AromaticContact CD2-CZ 3.62Å; F137-F141 HydrophobicContact CD2-CZ 3.62Å; F137-F141 HydrophobicContact CE1-CZ 4.15Å; F137-F141 AromaticContact CE2-CE2 3.74Å; F137-F141 HydrophobicContact CE2-CE2 3.74Å; F137-F141 HydrophobicContact CE2-CZ 4.12Å; F137-F141 HydrophobicContact CG-CD1 4.45Å; F137-F141 HydrophobicContact CG-CD2 4.25Å; F137-F141 AromaticContact CG-CE1 3.84Å; F137-F141 HydrophobicContact CG-CE1 3.84Å; F137-F141 AromaticContact CG-CE2 3.6Å; F137-F141 HydrophobicContact CG-CE2 3.6Å; F137-F141 AromaticContact CG-CZ 3.36Å; F137-F141 HydrophobicContact CG-CZ 3.36Å; F137-F141 HydrophobicContact CZ-CE2 4.37Å; F137-F141 HydrophobicContact CZ-CZ 4.38Å; F137-F141 PolarHBondContact N-O 3.27Å; E139-F141 HydrophobicContact CB-CD1 4.02Å; E139-F141 HydrophobicContact CB-CE1 3.78Å; F141-A143 HydrophobicContact CE2-CB 4.37Å; F141-P147 HydrophobicContact CE2-CG 4.01Å; F141-P147 HydrophobicContact CZ-CG 4.29Å; F141-L169 HydrophobicContact CD2-CD2 4.44Å; F141-V170 VanDerWaalsContact CA-O 3.32Å; F141-V170 WeakPolarHBondContact CA-O 3.4Å; F141-V170 WeakPolarHBondContact CB-O 2.87Å; F141-A171 HydrophobicContact CB-CB 4.27Å; F141-M174 HydrophobicContact CB-CB 4.24Å; F141-M174 HydrophobicContact CD1-CB 4.23Å; F141-M174 HydrophobicContact CD1-CE 4.29Å; F141-M174 HydrophobicContact CD1-CG 3.76Å; F141-M174 HydrophobicContact CD1-SD 4.29Å; F141-M174 HydrophobicContact CE1-CE 4.02Å; F141-M174 HydrophobicContact CE1-CG 4.28Å; F141-M174 HydrophobicContact CG-CG 4.33Å; F141-M174 HydrophobicContact CG-SD 4.5Å; F141-M174 HydrophobicContact CZ-CE 4.31Å
142	I	92.7	Very high	82.6	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	154.6	166.1	66.5	153.9	0	0	0	110	F135 V136 F144 L169 V170 V280 W282 M311 I313	F135-I142 CarbonylContact O-C 3.55Å; F135-I142 WeakPolarHBondContact O-CA 3.31Å; F135-I142 WeakPolarHBondContact O-CB 3.47Å; V136-I142 HydrophobicContact CB-CG2 4.45Å; V136-I142 HydrophobicContact CG1-CG2 4.45Å; V136-I142 HydrophobicContact CG2-CG2 3.98Å; I142-F144 HydrophobicContact CD1-CE1 3.88Å; I142-F144 HydrophobicContact CD1-CE2 4.28Å; I142-F144 HydrophobicContact CD1-CZ 3.6Å; I142-L169 CarbonylContact O-C 3.55Å; I142-L169 VanDerWaalsContact O-CA 3.3Å; I142-L169 WeakPolarHBondContact O-CA 3.43Å; I142-L169 WeakPolarHBondContact O-CB 3.02Å; I142-V170 HydrophobicContact CD1-CB 4.34Å; I142-V170 HydrophobicContact CD1-CG2 4.39Å; I142-V170 HydrophobicContact CG1-CB 3.78Å; I142-V170 HydrophobicContact CG1-CG2 4.28Å; I142-V170 PolarHBondContact N-O 3.04Å; I142-V170 PolarHBondContact O-N 2.89Å; I142-V280 HydrophobicContact CG2-CG2 4.33Å; I142-W282 HydrophobicContact CG2-CH2 4.43Å; I142-M311 HydrophobicContact CB-CE 4.16Å; I142-M311 HydrophobicContact CD1-CE 3.78Å; I142-M311 HydrophobicContact CD1-SD 4.45Å; I142-M311 HydrophobicContact CG1-CE 3.66Å; I142-M311 HydrophobicContact CG1-SD 4.13Å; I142-M311 HydrophobicContact CG2-CE 3.41Å; I142-M311 VanDerWaalsContact CG2-CE 3.41Å; I142-I313 HydrophobicContact CD1-CD1 3.21Å; I142-I313 HydrophobicContact CG1-CD1 4.34Å
143	A	91	Very high	81.6	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	143	176.1	0	0	0	0	0	111	T134 F135 F137 F141 S145 P147 S168 L169	T134-A143 CarbonylContact C-O 3.56Å; T134-A143 WeakPolarHBondContact CA-O 3.07Å; T134-A143 PolarHBondContact OG1-O 2.76Å; F135-A143 WeakPolarHBondContact CD2-O 3.1Å; F135-A143 PolarHBondContact N-O 2.87Å; F135-A143 PolarHBondContact O-N 3.3Å; F137-A143 HydrophobicContact CE2-CB 4.05Å; F141-A143 HydrophobicContact CE2-CB 4.37Å; A143-S145 VanDerWaalsContact CB-O 3.28Å; A143-S145 WeakPolarHBondContact CB-O 3.43Å; A143-P147 HydrophobicContact CB-CG 4.18Å; A143-S168 WeakPolarHBondContact CA-O 3.44Å; A143-L169 HydrophobicContact CB-CB 4.01Å
144	F	89.5	Confident	80.8	Confident	1 Å²	1	37.2 Å²	37.2	0%	0.004	18%	0.179	C	C	.	.	S	Bend	trans	-97.6	-8.3	174.9	-55.3	-70.2	0	0	0	112.4	L124 F126 F131 Y133 I142 S168 V170 I313	L124-F144 HydrophobicContact CD1-CE1 3.99Å; L124-F144 HydrophobicContact CD1-CZ 4.34Å; L124-F144 HydrophobicContact CD2-CD1 4.49Å; L124-F144 HydrophobicContact CD2-CE1 3.7Å; L124-F144 HydrophobicContact CD2-CE2 4.41Å; L124-F144 HydrophobicContact CD2-CZ 3.65Å; L124-F144 HydrophobicContact CG-CE1 4.47Å; F126-F144 HydrophobicContact CB-CD2 4.38Å; F126-F144 HydrophobicContact CB-CE2 4.11Å; F126-F144 AromaticContact CD1-CD2 3.81Å; F126-F144 HydrophobicContact CD1-CD2 3.81Å; F126-F144 AromaticContact CD1-CE2 3.89Å; F126-F144 HydrophobicContact CD1-CE2 3.89Å; F126-F144 AromaticContact CD2-CE2 3.76Å; F126-F144 HydrophobicContact CD2-CE2 3.76Å; F126-F144 HydrophobicContact CD2-CZ 4.49Å; F126-F144 HydrophobicContact CE1-CD2 4.17Å; F126-F144 HydrophobicContact CE1-CE2 4.2Å; F126-F144 HydrophobicContact CE2-CE2 4.11Å; F126-F144 AromaticContact CG-CD2 3.98Å; F126-F144 HydrophobicContact CG-CD2 3.98Å; F126-F144 AromaticContact CG-CE2 3.64Å; F126-F144 HydrophobicContact CG-CE2 3.64Å; F126-F144 HydrophobicContact CZ-CE2 4.31Å; F131-F144 HydrophobicContact CB-CB 4.33Å; F131-F144 HydrophobicContact CB-CD1 4.18Å; F131-F144 HydrophobicContact CD1-CB 3.56Å; F131-F144 HydrophobicContact CD1-CG 4.48Å; F131-F144 HydrophobicContact CD2-CB 3.63Å; F131-F144 HydrophobicContact CD2-CD1 4.16Å; F131-F144 HydrophobicContact CD2-CD2 4.22Å; F131-F144 AromaticContact CD2-CG 3.76Å; F131-F144 HydrophobicContact CD2-CG 3.76Å; F131-F144 HydrophobicContact CE1-CB 3.59Å; F131-F144 HydrophobicContact CE2-CB 3.66Å; F131-F144 HydrophobicContact CE2-CD2 4.19Å; F131-F144 HydrophobicContact CE2-CG 4.02Å; F131-F144 HydrophobicContact CG-CB 3.57Å; F131-F144 HydrophobicContact CG-CD1 4.18Å; F131-F144 HydrophobicContact CG-CG 4.01Å; F131-F144 HydrophobicContact CZ-CB 3.64Å; F131-F144 HydrophobicContact CZ-CG 4.48Å; Y133-F144 WeakPolarHBondContact CE2-O 3.41Å; Y133-F144 PolarHBondContact OH-O 3.44Å; I142-F144 HydrophobicContact CD1-CE1 3.88Å; I142-F144 HydrophobicContact CD1-CE2 4.28Å; I142-F144 HydrophobicContact CD1-CZ 3.6Å; F144-S168 PolarHBondContact N-O 2.85Å; F144-V170 HydrophobicContact CE2-CG2 3.77Å; F144-V170 HydrophobicContact CZ-CG2 4.28Å; F144-I313 HydrophobicContact CZ-CD1 4.23Å
145	S	83.4	Confident	79.9	Confident	31 Å²	31	39.2 Å²	39.2	22%	0.217	19%	0.191	C	C	.	.	S	Bend	trans	-133.9	148	168.4	60.5	0	0	0	0	108.3	A143 P147 S167 S168	A143-S145 VanDerWaalsContact CB-O 3.28Å; A143-S145 WeakPolarHBondContact CB-O 3.43Å; S145-P147 VanDerWaalsContact O-CD 3.23Å; S145-P147 WeakPolarHBondContact O-CD 3.48Å; S145-P147 VanDerWaalsContact O-N 3.1Å; S145-S167 WeakPolarHBondContact OG-CA 3.45Å; S145-S167 VanDerWaalsContact OG-CB 3.25Å; S145-S167 WeakPolarHBondContact OG-CB 3.32Å; S145-S167 PolarHBondContact OG-OG 3.5Å; S145-S168 PolarHBondContact OG-N 2.92Å
146	Y	78.3	Confident	79.4	Confident	141 Å²	141	40.4 Å²	40.4	55%	0.553	20%	0.198	S	C	*	.			trans	-61.7	115.1	-176.7	-170.1	-93.8	0	0	0	110.9	S167	Y146-S167 PolarHBondContact O-OG 3.48Å
147	P	75.1	Confident	78.8	Confident	14 Å²	14	42.5 Å²	42.5	9%	0.091	21%	0.211	C	C	.	.			trans	-73.2	129.3	179	32	-34	0	0	0	109.9	F137 F141 A143 S145 Y149 S167	F137-P147 HydrophobicContact CE1-CG 4.07Å; F137-P147 HydrophobicContact CE2-CG 3.68Å; F137-P147 HydrophobicContact CZ-CG 3.34Å; F141-P147 HydrophobicContact CE2-CG 4.01Å; F141-P147 HydrophobicContact CZ-CG 4.29Å; A143-P147 HydrophobicContact CB-CG 4.18Å; S145-P147 VanDerWaalsContact O-CD 3.23Å; S145-P147 WeakPolarHBondContact O-CD 3.48Å; S145-P147 VanDerWaalsContact O-N 3.1Å; P147-Y149 PolarHBondContact O-N 3.09Å; P147-S167 VanDerWaalsContact CA-OG 3.29Å; P147-S167 WeakPolarHBondContact CA-OG 3.4Å
148	Q	71.3	Confident	78.3	Confident	93 Å²	93	42 Å²	42	44%	0.435	21%	0.21	S	C	.	.			trans	-61.5	126.1	162.7	-81.1	-173.6	-8.3	0	0	108.1	I150 P165	Q148-I150 PolarHBondContact O-N 3.49Å; Q148-P165 HydrophobicContact CG-CG 3.98Å
149	Y	62.1	Low	77.7	Confident	139 Å²	139	51.5 Å²	51.5	55%	0.545	25%	0.245	S	C	.	.			trans	-67.8	114.7	-178	-177.5	-94.4	0	0	0	109.9	P147 Q151	P147-Y149 PolarHBondContact O-N 3.09Å; Y149-Q151 HydrophobicContact CE1-CG 4.26Å; Y149-Q151 VanDerWaalsContact CE1-NE2 3.29Å; Y149-Q151 PolarHBondContact OH-NE2 3.43Å
150	I	60.4	Low	77.1	Confident	58 Å²	58	55.7 Å²	55.7	30%	0.297	26%	0.264	S	S	.	.			trans	-118.2	127.6	179.4	-65.1	165.3	0	0	0	107.8	Q148 Y154	Q148-I150 PolarHBondContact O-N 3.49Å; I150-Y154 WeakPolarHBondContact O-CE1 3.37Å
151	Q	65.3	Low	76.3	Confident	83 Å²	83	57.2 Å²	57.2	39%	0.388	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-70.4	153.1	171.8	-71.6	-67.5	-6.9	0	0	110.7	Y149	Y149-Q151 HydrophobicContact CE1-CG 4.26Å; Y149-Q151 VanDerWaalsContact CE1-NE2 3.29Å; Y149-Q151 PolarHBondContact OH-NE2 3.43Å
152	P	64.8	Low	75.1	Confident	30 Å²	30	58.6 Å²	58.6	20%	0.195	28%	0.28	C	S	.	.	S	Bend	trans	-51.1	136.7	170.8	-21.6	29.5	0	0	0	111.5	Y154	P152-Y154 HydrophobicContact CB-CE2 4.33Å; P152-Y154 HydrophobicContact CG-CD2 4.48Å; P152-Y154 HydrophobicContact CG-CE1 4.34Å; P152-Y154 HydrophobicContact CG-CE2 3.78Å
153	P	68.2	Low	74.2	Confident	89 Å²	89	64.6 Å²	64.6	58%	0.578	31%	0.308	S	S	*	.	S	Bend	cis	-82.8	126.1	10.5	31.3	-33.5	0	0	0	114.1	T155 Q347	P153-T155 PolarHBondContact O-N 2.88Å; P153-Q347 HydrophobicContact CB-CB 4.39Å
154	Y	74.8	Confident	73.5	Confident	25 Å²	25	67.7 Å²	67.7	10%	0.098	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-66.9	118.9	172.6	-54.1	-66.3	0	0	0	110.5	I150 P152 M174 E176 Q347 L350	I150-Y154 WeakPolarHBondContact O-CE1 3.37Å; P152-Y154 HydrophobicContact CB-CE2 4.33Å; P152-Y154 HydrophobicContact CG-CD2 4.48Å; P152-Y154 HydrophobicContact CG-CE1 4.34Å; P152-Y154 HydrophobicContact CG-CE2 3.78Å; Y154-M174 HydrophobicContact CD1-CE 3.69Å; Y154-M174 HydrophobicContact CE1-CE 3.9Å; Y154-M174 HydrophobicContact CG-CE 4.18Å; Y154-E176 PolarHBondContact OH-N 2.01Å; Y154-Q347 VanDerWaalsContact CD2-OE1 3.32Å; Y154-Q347 VanDerWaalsContact N-CD 3.33Å; Y154-Q347 VanDerWaalsContact N-NE2 3.17Å; Y154-Q347 PolarHBondContact O-NE2 3.49Å; Y154-L350 VanDerWaalsContact CB-CD1 3.41Å; Y154-L350 HydrophobicContact CD2-CD1 4.49Å; Y154-L350 HydrophobicContact CG-CD1 4.29Å
155	T	74.5	Confident	73	Confident	43 Å²	43	70.6 Å²	70.6	26%	0.264	34%	0.342	S	S	.	.			trans	-110.6	113.6	175.2	55.4	0	0	0	0	110.1	P153	P153-T155 PolarHBondContact O-N 2.88Å
156	M	78.4	Confident	72.9	Confident	43 Å²	43	69.3 Å²	69.3	21%	0.212	33%	0.332	C	S	.	.	S	Bend	trans	-120.3	139.1	174.1	-69.7	-69.1	167.7	0	0	110.1	L169 L350 N354 W361	M156-L169 HydrophobicContact CE-CD2 3.62Å; M156-L169 HydrophobicContact SD-CD2 4.34Å; M156-L350 HydrophobicContact CG-CD1 4.42Å; M156-N354 HydrophobicContact SD-CB 4.32Å; M156-N354 PolarHBondContact SD-ND2 2.92Å; M156-W361 HydrophobicContact CB-CB 4.07Å; M156-W361 HydrophobicContact CB-CD2 3.9Å; M156-W361 HydrophobicContact CB-CE3 3.78Å; M156-W361 HydrophobicContact CB-CG 4.03Å; M156-W361 HydrophobicContact CG-CE3 4.27Å
157	P	77.6	Confident	73.3	Confident	43 Å²	43	62.9 Å²	62.9	28%	0.279	31%	0.308	S	S	.	.	S	Bend	cis	-62.2	162.9	-13.2	30.8	-36.6	0	0	0	111.3	R159	P157-R159 PolarHBondContact O-N 2.69Å; P157-R159 VanDerWaalsContact O-N 3.12Å
158	N	79.3	Confident	74	Confident	11 Å²	11	62.4 Å²	62.4	6%	0.059	31%	0.305	C	S	.	.			trans	-58	119.9	178.3	-171.8	-15.7	0	0	0	110.6	H160 W161 E164 D166	N158-H160 PolarHBondContact O-N 3.19Å; N158-H160 PolarHBondContact OD1-N 3.46Å; N158-W161 WeakPolarHBondContact O-CB 3.49Å; N158-W161 PolarHBondContact O-N 3.23Å; N158-E164 WeakPolarHBondContact ND2-CB 3.29Å; N158-E164 PolarHBondContact ND2-OE2 3.15Å; N158-D166 HydrophobicContact CB-CB 4Å; N158-D166 PolarHBondContact N-OD1 3.49Å
159	R	75.5	Confident	75	Confident	204 Å²	204	58 Å²	58	77%	0.77	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-20.6	-179.9	-65.9	-177	178.2	-174.4	0.1	113.3	P157	P157-R159 PolarHBondContact O-N 2.69Å; P157-R159 VanDerWaalsContact O-N 3.12Å
160	H	75.4	Confident	76.5	Confident	110 Å²	110	51.3 Å²	51.3	51%	0.509	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	11	178.1	-58.3	-57.3	0	0	0	112.6	N158 Q163 E164	N158-H160 PolarHBondContact O-N 3.19Å; N158-H160 PolarHBondContact OD1-N 3.46Å; H160-Q163 WeakPolarHBondContact O-CA 3.37Å; H160-Q163 VanDerWaalsContact O-CB 3.32Å; H160-Q163 WeakPolarHBondContact O-CB 3.26Å; H160-Q163 PolarHBondContact O-N 2.89Å; H160-Q163 PolarHBondContact O-OE1 3.35Å; H160-E164 HydrophobicContact CB-CB 4.14Å; H160-E164 HydrophobicContact CB-CG 4.07Å; H160-E164 IonicContact CD2-OE2 3.34Å; H160-E164 PolarHBondContact O-N 3.46Å
161	W	72.1	Confident	78.1	Confident	32 Å²	32	48.6 Å²	48.6	12%	0.121	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	138.3	170.7	-177	82.3	0	0	0	110.6	N158 E164 D166 N357 P1063	N158-W161 WeakPolarHBondContact O-CB 3.49Å; N158-W161 PolarHBondContact O-N 3.23Å; W161-E164 WeakPolarHBondContact CA-O 3.45Å; W161-D166 HydrophobicContact CB-CB 4.09Å; W161-D166 HydrophobicContact CG-CB 4Å; W161-N357 VanDerWaalsContact CE2-C 3.46Å; W161-N357 HydrophobicContact CZ2-CB 4.44Å; W161-N357 VanDerWaalsContact CZ2-O 3.28Å; W161-N357 WeakPolarHBondContact CZ2-O 3.16Å; W161-P1063 HydrophobicContact CH2-CG 4.06Å; W161-P1063 HydrophobicContact CZ3-CG 3.68Å
162	P	67.5	Low	79.5	Confident	41 Å²	41	44.6 Å²	44.6	27%	0.266	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	cis	-90.9	5.2	4.2	35.6	-38.5	0	0	0	116.7	E164	P162-E164 PolarHBondContact O-N 2.88Å
163	Q	72.7	Confident	80.8	Confident	126 Å²	126	43.2 Å²	43.2	59%	0.589	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-39	175.7	-66.8	83.2	-1.6	0	0	111.6	H160	H160-Q163 WeakPolarHBondContact O-CA 3.37Å; H160-Q163 VanDerWaalsContact O-CB 3.32Å; H160-Q163 WeakPolarHBondContact O-CB 3.26Å; H160-Q163 PolarHBondContact O-N 2.89Å; H160-Q163 PolarHBondContact O-OE1 3.35Å
164	E	77.2	Confident	81.8	Confident	64 Å²	64	39.6 Å²	39.6	30%	0.299	19%	0.192	S	C	.	.	S	Bend	trans	-111.8	139.3	172.7	-68	178	-176.2	0	0	110.3	N158 H160 W161 P162 D166	N158-E164 WeakPolarHBondContact ND2-CB 3.29Å; N158-E164 PolarHBondContact ND2-OE2 3.15Å; H160-E164 HydrophobicContact CB-CB 4.14Å; H160-E164 HydrophobicContact CB-CG 4.07Å; H160-E164 IonicContact CD2-OE2 3.34Å; H160-E164 PolarHBondContact O-N 3.46Å; W161-E164 WeakPolarHBondContact CA-O 3.45Å; P162-E164 PolarHBondContact O-N 2.88Å; E164-D166 PolarHBondContact O-N 2.89Å
165	P	78.3	Confident	82.4	Confident	63 Å²	63	38.6 Å²	38.6	41%	0.409	19%	0.189	S	C	.	.	P	Polyproline II helix	trans	-64.2	128.7	178.6	27.3	-33.6	0	0	0	110.4	Q148	Q148-P165 HydrophobicContact CG-CG 3.98Å
166	D	83.1	Confident	82.9	Confident	3 Å²	3	37.2 Å²	37.2	2%	0.016	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-92.8	116.2	170.7	178.7	47.5	0	0	0	108.4	N158 W161 E164 N354 G356 N357 G358	N158-D166 HydrophobicContact CB-CB 4Å; N158-D166 PolarHBondContact N-OD1 3.49Å; W161-D166 HydrophobicContact CB-CB 4.09Å; W161-D166 HydrophobicContact CG-CB 4Å; E164-D166 PolarHBondContact O-N 2.89Å; D166-N354 PolarHBondContact OD1-ND2 3.03Å; D166-N354 PolarHBondContact OD2-ND2 2.82Å; D166-G356 CarbonylContact O-C 3.47Å; D166-G356 WeakPolarHBondContact O-CA 3.29Å; D166-G356 WeakPolarHBondContact OD2-CA 3.35Å; D166-N357 PolarHBondContact O-N 2.7Å; D166-N357 PolarHBondContact OD2-N 3.26Å; D166-G358 WeakPolarHBondContact OD2-CA 3.31Å; D166-G358 PolarHBondContact OD2-N 3.18Å
167	S	86.3	Confident	83.3	Confident	6 Å²	6	35.7 Å²	35.7	4%	0.042	17%	0.172	C	C	.	.	P	Polyproline II helix	trans	-87.9	136.1	-168.5	-72.9	0	0	0	0	113.3	S145 Y146 P147 L169 N354	S145-S167 WeakPolarHBondContact OG-CA 3.45Å; S145-S167 VanDerWaalsContact OG-CB 3.25Å; S145-S167 WeakPolarHBondContact OG-CB 3.32Å; S145-S167 PolarHBondContact OG-OG 3.5Å; Y146-S167 PolarHBondContact O-OG 3.48Å; P147-S167 VanDerWaalsContact CA-OG 3.29Å; P147-S167 WeakPolarHBondContact CA-OG 3.4Å; S167-L169 PolarHBondContact O-N 2.86Å; S167-N354 PolarHBondContact O-ND2 3.18Å
168	S	89.7	Confident	83.8	Confident	4 Å²	4	35.4 Å²	35.4	3%	0.028	17%	0.171	C	C	.	.			trans	-71.3	115.9	170.2	-58.8	0	0	0	0	108.6	A143 F144 S145 N354 G355	A143-S168 WeakPolarHBondContact CA-O 3.44Å; F144-S168 PolarHBondContact N-O 2.85Å; S145-S168 PolarHBondContact OG-N 2.92Å; S168-N354 WeakPolarHBondContact CA-O 3.31Å; S168-G355 PolarHBondContact OG-O 3.45Å
169	L	91.4	Very high	84.3	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	160.1	-174.7	69.7	76.9	0	0	0	112.9	F141 I142 A143 M156 S167 A171 N354 W361	F141-L169 HydrophobicContact CD2-CD2 4.44Å; I142-L169 CarbonylContact O-C 3.55Å; I142-L169 VanDerWaalsContact O-CA 3.3Å; I142-L169 WeakPolarHBondContact O-CA 3.43Å; I142-L169 WeakPolarHBondContact O-CB 3.02Å; A143-L169 HydrophobicContact CB-CB 4.01Å; M156-L169 HydrophobicContact CE-CD2 3.62Å; M156-L169 HydrophobicContact SD-CD2 4.34Å; S167-L169 PolarHBondContact O-N 2.86Å; L169-A171 HydrophobicContact CD1-CB 4.22Å; L169-N354 HydrophobicContact CD1-CB 4.13Å; L169-N354 HydrophobicContact CG-CB 3.91Å; L169-N354 PolarHBondContact N-O 3.15Å; L169-N354 VanDerWaalsContact N-O 3.07Å; L169-N354 PolarHBondContact O-N 2.93Å; L169-W361 HydrophobicContact CD1-CZ3 4.13Å
170	V	94.4	Very high	84.9	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	112.8	175.6	-176.8	0	0	0	0	108.2	F126 F141 I142 F144 M311 V322 F324 F353	F126-V170 HydrophobicContact CD2-CG2 4.35Å; F126-V170 HydrophobicContact CE2-CG2 3.59Å; F126-V170 HydrophobicContact CZ-CG2 3.9Å; F141-V170 VanDerWaalsContact CA-O 3.32Å; F141-V170 WeakPolarHBondContact CA-O 3.4Å; F141-V170 WeakPolarHBondContact CB-O 2.87Å; I142-V170 HydrophobicContact CD1-CB 4.34Å; I142-V170 HydrophobicContact CD1-CG2 4.39Å; I142-V170 HydrophobicContact CG1-CB 3.78Å; I142-V170 HydrophobicContact CG1-CG2 4.28Å; I142-V170 PolarHBondContact N-O 3.04Å; I142-V170 PolarHBondContact O-N 2.89Å; F144-V170 HydrophobicContact CE2-CG2 3.77Å; F144-V170 HydrophobicContact CZ-CG2 4.28Å; V170-M311 HydrophobicContact CB-SD 4.12Å; V170-M311 HydrophobicContact CG1-SD 3.55Å; V170-M311 VanDerWaalsContact CG1-SD 3.55Å; V170-V322 HydrophobicContact CG1-CG1 4.03Å; V170-F324 HydrophobicContact CG1-CE1 3.77Å; V170-F324 HydrophobicContact CG1-CZ 3.56Å; V170-F353 HydrophobicContact CB-CD1 4.38Å; V170-F353 HydrophobicContact CG1-CD1 3.77Å; V170-F353 HydrophobicContact CG1-CE1 3.73Å; V170-F353 HydrophobicContact CG2-CD1 4.08Å
171	A	93	Very high	85.3	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	104.7	179.1	0	0	0	0	0	110.1	F141 L169 M174 V351 G352 W361	F141-A171 HydrophobicContact CB-CB 4.27Å; L169-A171 HydrophobicContact CD1-CB 4.22Å; A171-M174 HydrophobicContact CB-CB 3.66Å; A171-V351 WeakPolarHBondContact O-CA 3.34Å; A171-G352 PolarHBondContact N-O 2.9Å; A171-G352 PolarHBondContact O-N 2.67Å; A171-W361 HydrophobicContact CB-CH2 3.82Å; A171-W361 HydrophobicContact CB-CZ3 4.39Å
172	A	94.2	Very high	85.8	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	-43.2	170.9	0	0	0	0	0	110.6	G140 W282 Y309 M311 F324 Y326	G140-A172 PolarHBondContact O-N 3.18Å; A172-W282 HydrophobicContact CB-CE3 4.45Å; A172-W282 HydrophobicContact CB-CH2 4.09Å; A172-W282 HydrophobicContact CB-CZ3 3.76Å; A172-Y309 HydrophobicContact CB-CD2 3.95Å; A172-Y309 HydrophobicContact CB-CE2 3.92Å; A172-M311 HydrophobicContact CB-CB 4.1Å; A172-M311 HydrophobicContact CB-SD 4.48Å; A172-F324 VanDerWaalsContact CA-CE1 3.48Å; A172-F324 HydrophobicContact CB-CD1 3.74Å; A172-F324 HydrophobicContact CB-CE1 3.72Å; A172-Y326 VanDerWaalsContact O-CE1 3.31Å; A172-Y326 WeakPolarHBondContact O-CE1 3.02Å; A172-Y326 PolarHBondContact O-OH 3.28Å
173	F	92.6	Very high	86.3	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	68.2	172.4	-161.6	-95	0	0	0	108.8	G140 G175 Q177 N307 Y309 Y326 V329 W331 A349 V351	G140-F173 CarbonylContact O-C 3.56Å; G140-F173 PolarHBondContact O-N 3.49Å; F173-G175 PolarHBondContact O-N 3.12Å; F173-G175 VanDerWaalsContact O-N 3.11Å; F173-Q177 PolarHBondContact O-NE2 2.82Å; F173-N307 WeakPolarHBondContact CE1-ND2 3.34Å; F173-Y309 HydrophobicContact CB-CD1 4.24Å; F173-Y309 HydrophobicContact CB-CD2 4.1Å; F173-Y309 HydrophobicContact CB-CE1 3.82Å; F173-Y309 HydrophobicContact CB-CE2 3.61Å; F173-Y309 HydrophobicContact CB-CG 4.41Å; F173-Y309 VanDerWaalsContact CB-CZ 3.5Å; F173-Y309 HydrophobicContact CD1-CE1 4.41Å; F173-Y309 HydrophobicContact CG-CE1 4.28Å; F173-Y326 HydrophobicContact CD2-CE1 4.2Å; F173-V329 HydrophobicContact CE2-CG1 3.64Å; F173-V329 HydrophobicContact CE2-CG2 4.35Å; F173-V329 HydrophobicContact CZ-CG1 3.63Å; F173-W331 HydrophobicContact CD1-CH2 4.27Å; F173-W331 HydrophobicContact CE1-CE3 4.44Å; F173-W331 AromaticContact CE1-CH2 3.91Å; F173-W331 HydrophobicContact CE1-CH2 3.91Å; F173-W331 HydrophobicContact CE1-CZ2 4.34Å; F173-W331 HydrophobicContact CE1-CZ3 4.01Å; F173-W331 WeakPolarHBondContact CZ-O 3.31Å; F173-A349 HydrophobicContact CD1-CB 3.65Å; F173-A349 HydrophobicContact CD2-CB 4.29Å; F173-A349 HydrophobicContact CE1-CB 3.41Å; F173-A349 VanDerWaalsContact CE1-CB 3.41Å; F173-A349 HydrophobicContact CE2-CB 4.1Å; F173-A349 HydrophobicContact CG-CB 4.09Å; F173-A349 HydrophobicContact CZ-CB 3.66Å; F173-V351 HydrophobicContact CD2-CG2 4.05Å
174	M	89.4	Confident	86.6	Confident	13 Å²	13	25.2 Å²	25.2	6%	0.064	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	111.6	-174.3	178.5	-179.9	-170	0	0	110.6	E139 F141 Y154 A171 A349 L350	E139-M174 WeakPolarHBondContact O-CA 3.02Å; F141-M174 HydrophobicContact CB-CB 4.24Å; F141-M174 HydrophobicContact CD1-CB 4.23Å; F141-M174 HydrophobicContact CD1-CE 4.29Å; F141-M174 HydrophobicContact CD1-CG 3.76Å; F141-M174 HydrophobicContact CD1-SD 4.29Å; F141-M174 HydrophobicContact CE1-CE 4.02Å; F141-M174 HydrophobicContact CE1-CG 4.28Å; F141-M174 HydrophobicContact CG-CG 4.33Å; F141-M174 HydrophobicContact CG-SD 4.5Å; F141-M174 HydrophobicContact CZ-CE 4.31Å; Y154-M174 HydrophobicContact CD1-CE 3.69Å; Y154-M174 HydrophobicContact CE1-CE 3.9Å; Y154-M174 HydrophobicContact CG-CE 4.18Å; A171-M174 HydrophobicContact CB-CB 3.66Å; M174-A349 CarbonylContact O-C 3.53Å; M174-A349 WeakPolarHBondContact O-CA 3.5Å; M174-A349 WeakPolarHBondContact O-CB 3.49Å; M174-L350 HydrophobicContact CB-CB 4.16Å; M174-L350 PolarHBondContact N-O 2.79Å; M174-L350 PolarHBondContact O-N 2.65Å; M174-L350 HydrophobicContact SD-CD1 4.44Å
175	G	86.8	Confident	86.8	Confident	5 Å²	5	23.5 Å²	23.5	5%	0.052	14%	0.137	C	C	.	.	S	Bend	trans	-163.2	161.8	178.3	0	0	0	0	0	109.8	E139 F173 Q177	E139-G175 WeakPolarHBondContact CB-O 3.2Å; E139-G175 PolarHBondContact O-N 3.12Å; F173-G175 PolarHBondContact O-N 3.12Å; F173-G175 VanDerWaalsContact O-N 3.11Å; G175-Q177 WeakPolarHBondContact O-CG 3.33Å; G175-Q177 PolarHBondContact O-N 2.88Å; G175-Q177 VanDerWaalsContact O-N 3.09Å
176	E	86.3	Confident	87.1	Confident	14 Å²	14	23.8 Å²	23.8	7%	0.065	13%	0.13	C	C	.	.			trans	-69.3	113	174	-173.6	-160.6	169.9	0	0	108.8	Y154 G288 S334 Q336	Y154-E176 PolarHBondContact OH-N 2.01Å; E176-G288 PolarHBondContact O-N 2.81Å; E176-S334 VanDerWaalsContact OE2-CB 3.24Å; E176-S334 WeakPolarHBondContact OE2-CB 3.48Å; E176-S334 PolarHBondContact OE2-OG 2.96Å; E176-Q336 VanDerWaalsContact CD-CD 3.47Å; E176-Q336 VanDerWaalsContact OE1-CD 3.23Å; E176-Q336 PolarHBondContact OE1-NE2 3.04Å; E176-Q336 VanDerWaalsContact OE2-CB 3.26Å; E176-Q336 WeakPolarHBondContact OE2-CB 3.38Å; E176-Q336 VanDerWaalsContact OE2-CD 3.24Å; E176-Q336 WeakPolarHBondContact OE2-CG 3.48Å
177	Q	87.5	Confident	87.2	Confident	10 Å²	10	24 Å²	24	5%	0.047	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	155.6	-177.8	-31.1	-159.9	0.2	0	0	109.9	E139 F173 G175 M285 G286 Y309 W331	E139-Q177 PolarHBondContact O-NE2 2.86Å; F173-Q177 PolarHBondContact O-NE2 2.82Å; G175-Q177 WeakPolarHBondContact O-CG 3.33Å; G175-Q177 PolarHBondContact O-N 2.88Å; G175-Q177 VanDerWaalsContact O-N 3.09Å; Q177-M285 HydrophobicContact CB-CB 4.33Å; Q177-M285 HydrophobicContact CB-CE 4.12Å; Q177-G286 CarbonylContact C-O 3.54Å; Q177-G286 WeakPolarHBondContact CA-O 3.39Å; Q177-G286 WeakPolarHBondContact CB-O 3.49Å; Q177-Y309 VanDerWaalsContact CD-OH 3.24Å; Q177-Y309 PolarHBondContact NE2-OH 3Å; Q177-Y309 PolarHBondContact OE1-OH 3.3Å; Q177-W331 HydrophobicContact CB-CH2 4.23Å; Q177-W331 HydrophobicContact CB-CZ2 4.01Å; Q177-W331 HydrophobicContact CG-CH2 3.61Å; Q177-W331 HydrophobicContact CG-CZ2 3.73Å
178	S	87.2	Confident	87.4	Confident	37 Å²	37	23.8 Å²	23.8	26%	0.259	13%	0.129	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	149.9	177.5	65.6	0	0	0	0	111.5	V180 G286 Y287	S178-V180 PolarHBondContact O-N 2.95Å; S178-G286 PolarHBondContact N-O 3.07Å; S178-G286 PolarHBondContact O-N 3.22Å; S178-Y287 PolarHBondContact OG-O 3.29Å
179	F	88.9	Confident	87.5	Confident	38 Å²	38	24.2 Å²	24.2	17%	0.167	13%	0.131	C	C	.	.			trans	-73.9	123.3	174.4	-66.1	-79.3	0	0	0	110.6	T109 P138 H181 V190 M285	T109-F179 HydrophobicContact CG2-CD1 3.77Å; T109-F179 HydrophobicContact CG2-CE1 3.37Å; T109-F179 HydrophobicContact CG2-CZ 3.94Å; P138-F179 HydrophobicContact CB-CE2 4.05Å; P138-F179 HydrophobicContact CB-CZ 3.88Å; P138-F179 HydrophobicContact CG-CE2 4.3Å; P138-F179 HydrophobicContact CG-CZ 4.14Å; F179-H181 PolarHBondContact O-ND1 3.43Å; F179-H181 VanDerWaalsContact O-ND1 3.11Å; F179-V190 HydrophobicContact CE1-CG2 3.94Å; F179-V190 HydrophobicContact CZ-CG2 4.21Å; F179-M285 HydrophobicContact CD1-CE 4.02Å; F179-M285 HydrophobicContact CD1-SD 4.04Å; F179-M285 HydrophobicContact CE1-CE 3.93Å; F179-M285 HydrophobicContact CE1-SD 4.02Å; F179-M285 HydrophobicContact CG-CE 4.44Å; F179-M285 HydrophobicContact CZ-CE 4.28Å
180	V	87.9	Confident	87.6	Confident	11 Å²	11	24.2 Å²	24.2	7%	0.067	13%	0.131	C	C	.	.			trans	-88.5	135.1	-177.9	-175	0	0	0	0	110.5	S178 L187 S188 V302 Q306	S178-V180 PolarHBondContact O-N 2.95Å; V180-L187 PolarHBondContact O-N 3.33Å; V180-S188 WeakPolarHBondContact CA-OG 3.47Å; V180-S188 WeakPolarHBondContact CB-OG 3.46Å; V180-S188 WeakPolarHBondContact CG2-OG 3.44Å; V180-S188 PolarHBondContact N-OG 3.18Å; V180-S188 PolarHBondContact O-N 3.14Å; V180-V302 HydrophobicContact CG1-CG1 3.25Å; V180-Q306 HydrophobicContact CG2-CG 4.49Å
181	H	85.1	Confident	87.6	Confident	82 Å²	82	24.4 Å²	24.4	38%	0.38	13%	0.132	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	146.7	177.4	-60.9	72.7	0	0	0	109.3	F179 T185	F179-H181 PolarHBondContact O-ND1 3.43Å; F179-H181 VanDerWaalsContact O-ND1 3.11Å; H181-T185 CarbonylContact C-O 3.54Å; H181-T185 WeakPolarHBondContact CA-O 3.49Å
182	V	81.6	Confident	87.6	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	107.7	170.7	-179	0	0	0	0	108	D184 T185 L187 V293 E295 L296 V302	V182-D184 PolarHBondContact O-N 2.95Å; V182-T185 PolarHBondContact N-O 3.01Å; V182-T185 PolarHBondContact O-N 3Å; V182-T185 VanDerWaalsContact O-N 3.09Å; V182-L187 HydrophobicContact CB-CD1 4.47Å; V182-L187 HydrophobicContact CG2-CD1 3.5Å; V182-L187 VanDerWaalsContact CG2-CD1 3.5Å; V182-L187 HydrophobicContact CG2-CG 4.15Å; V182-V293 WeakPolarHBondContact CA-O 3.03Å; V182-E295 WeakPolarHBondContact CG1-O 3.47Å; V182-L296 HydrophobicContact CG1-CB 4.48Å; V182-L296 HydrophobicContact CG1-CD2 3.9Å; V182-L296 HydrophobicContact CG1-CG 4.31Å; V182-V302 HydrophobicContact CG2-CB 4.42Å; V182-V302 HydrophobicContact CG2-CG1 4.44Å; V182-V302 HydrophobicContact CG2-CG2 3.8Å
183	G	79.6	Confident	87.6	Confident	31 Å²	31	26 Å²	26	32%	0.32	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	-130.3	-162.2	0	0	0	0	0	110.1	T185 V293 T294	G183-T185 VanDerWaalsContact C-N 3.34Å; G183-V293 PolarHBondContact N-O 2.94Å; G183-T294 WeakPolarHBondContact CA-O 3.17Å; G183-T294 PolarHBondContact N-O 3Å
184	D	78.6	Confident	87.6	Confident	149 Å²	149	26 Å²	26	80%	0.797	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-6.4	175.7	-53	-49	0	0	0	113.4	V182	V182-D184 PolarHBondContact O-N 2.95Å
185	T	81.6	Confident	87.8	Confident	27 Å²	27	25.4 Å²	25.4	17%	0.166	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	119	-175.5	-51.2	0	0	0	0	110.8	L77 K78 H181 V182 G183	L77-T185 HydrophobicContact CD2-CG2 3.76Å; L77-T185 HydrophobicContact CG-CG2 3.87Å; K78-T185 WeakPolarHBondContact CE-OG1 3.41Å; K78-T185 WeakPolarHBondContact CG-OG1 3.21Å; H181-T185 CarbonylContact C-O 3.54Å; H181-T185 WeakPolarHBondContact CA-O 3.49Å; V182-T185 PolarHBondContact N-O 3.01Å; V182-T185 PolarHBondContact O-N 3Å; V182-T185 VanDerWaalsContact O-N 3.09Å; G183-T185 VanDerWaalsContact C-N 3.34Å
186	R	83.8	Confident	88.1	Confident	69 Å²	69	26.5 Å²	26.5	26%	0.26	14%	0.141	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	137.1	173.6	-173.3	170.5	68.7	-141.5	3.5	110.8	D107 T109 S188 H189	D107-R186 IonicContact OD2-CZ 3.92Å; D107-R186 IonicContact OD2-NH2 2.76Å; D107-R186 PolarHBondContact OD2-NH2 2.88Å; T109-R186 VanDerWaalsContact CB-CZ 3.48Å; T109-R186 PolarHBondContact OG1-NH1 3.28Å; T109-R186 PolarHBondContact OG1-NH2 2.94Å; R186-S188 VanDerWaalsContact CD-O 3.24Å; R186-S188 WeakPolarHBondContact CD-O 3.36Å; R186-S188 VanDerWaalsContact CG-O 3.24Å; R186-S188 WeakPolarHBondContact CG-O 3.35Å; R186-H189 PolarHBondContact NE-CE1 2.69Å
187	L	86	Confident	88.3	Confident	9 Å²	9	26 Å²	26	5%	0.047	14%	0.138	C	C	.	.			trans	-108.6	-32.1	174.1	-64	-175	0	0	0	112.8	L77 V180 V182 H189 Y299	L77-L187 HydrophobicContact CD1-CD2 3.55Å; L77-L187 HydrophobicContact CD2-CD2 3.7Å; L77-L187 HydrophobicContact CG-CD2 4.19Å; V180-L187 PolarHBondContact O-N 3.33Å; V182-L187 HydrophobicContact CB-CD1 4.47Å; V182-L187 HydrophobicContact CG2-CD1 3.5Å; V182-L187 VanDerWaalsContact CG2-CD1 3.5Å; V182-L187 HydrophobicContact CG2-CG 4.15Å; L187-H189 PolarHBondContact O-CD2 3.3Å; L187-Y299 HydrophobicContact CD1-CD2 3.83Å; L187-Y299 HydrophobicContact CD1-CE2 3.68Å; L187-Y299 HydrophobicContact CD2-CD2 4.3Å; L187-Y299 HydrophobicContact CD2-CE2 3.8Å; L187-Y299 HydrophobicContact CG-CE2 4.42Å
188	S	90.2	Very high	88.1	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.138	C	C	.	.			trans	-91.4	140.5	-175.9	-46.6	0	0	0	0	112	V180 R186 E283 R284	V180-S188 WeakPolarHBondContact CA-OG 3.47Å; V180-S188 WeakPolarHBondContact CB-OG 3.46Å; V180-S188 WeakPolarHBondContact CG2-OG 3.44Å; V180-S188 PolarHBondContact N-OG 3.18Å; V180-S188 PolarHBondContact O-N 3.14Å; R186-S188 VanDerWaalsContact CD-O 3.24Å; R186-S188 WeakPolarHBondContact CD-O 3.36Å; R186-S188 VanDerWaalsContact CG-O 3.24Å; R186-S188 WeakPolarHBondContact CG-O 3.35Å; S188-E283 WeakPolarHBondContact CA-O 3.36Å; S188-E283 WeakPolarHBondContact CB-O 3.31Å; S188-R284 WeakPolarHBondContact CB-O 3.34Å; S188-R284 PolarHBondContact OG-O 2.77Å
189	H	91.8	Very high	87.6	Confident	13 Å²	13	29.6 Å²	29.6	6%	0.06	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	154.7	179.6	-64	-94.6	0	0	0	109.9	D107 R186 L187 W191 E283	D107-H189 IonicContact OD2-CE1 2.86Å; D107-H189 IonicContact OD2-CG 3.74Å; D107-H189 IonicContact OD2-ND1 3.8Å; D107-H189 PolarHBondContact OD2-ND1 2.82Å; R186-H189 PolarHBondContact NE-CE1 2.69Å; L187-H189 PolarHBondContact O-CD2 3.3Å; H189-W191 HydrophobicContact CB-CD2 4.28Å; H189-W191 HydrophobicContact CB-CZ2 3.54Å; H189-W191 AromaticContact CG-CE2 3.88Å; H189-W191 AromaticContact CG-CZ2 3.46Å; H189-W191 VanDerWaalsContact CG-CZ2 3.46Å; H189-W191 AromaticContact CG-NE1 3.99Å; H189-W191 AromaticContact ND1-CH2 3.92Å; H189-W191 AromaticContact ND1-CZ2 3.46Å; H189-W191 WeakPolarHBondContact ND1-CZ2 3.31Å; H189-E283 HydrophobicContact CB-CB 4.39Å; H189-E283 IonicContact CD2-OE2 2.75Å; H189-E283 PolarHBondContact N-O 3.21Å; H189-E283 VanDerWaalsContact N-O 3.12Å; H189-E283 PolarHBondContact O-N 3.36Å
190	V	92.5	Very high	86.8	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	111	169	179.6	0	0	0	0	107.7	I108 V136 P138 F179 V280 T281 W282 M285	I108-V190 HydrophobicContact CD1-CB 3.75Å; I108-V190 HydrophobicContact CD1-CG1 3.43Å; I108-V190 VanDerWaalsContact CD1-CG1 3.43Å; I108-V190 HydrophobicContact CG1-CB 3.52Å; I108-V190 HydrophobicContact CG1-CG1 3.71Å; I108-V190 WeakPolarHBondContact CG1-O 2.97Å; I108-V190 PolarHBondContact N-O 3.45Å; V136-V190 HydrophobicContact CG1-CG1 4.32Å; P138-V190 HydrophobicContact CB-CG2 4.49Å; F179-V190 HydrophobicContact CE1-CG2 3.94Å; F179-V190 HydrophobicContact CZ-CG2 4.21Å; V190-V280 HydrophobicContact CG1-CG1 4.3Å; V190-T281 WeakPolarHBondContact CA-O 3.31Å; V190-W282 HydrophobicContact CG1-CG 4.28Å; V190-W282 HydrophobicContact CG2-CG 4.12Å; V190-M285 HydrophobicContact CG2-CE 4.06Å; V190-M285 HydrophobicContact CG2-SD 3.76Å
191	W	94	Very high	86	Confident	4 Å²	4	32.9 Å²	32.9	2%	0.015	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	141.7	-173.5	-59.6	107.4	0	0	0	109.9	F99 E101 D105 V106 D107 H189 V280 T281 E283	F99-W191 AromaticContact CD2-CD1 3.55Å; F99-W191 HydrophobicContact CD2-CG 4.26Å; F99-W191 AromaticContact CD2-NE1 3.98Å; E101-W191 HydrophobicContact CG-CH2 3.61Å; E101-W191 HydrophobicContact CG-CZ3 3.92Å; E101-W191 VanDerWaalsContact OE1-CH2 3.24Å; E101-W191 WeakPolarHBondContact OE1-CH2 3.2Å; D105-W191 HydrophobicContact CB-CB 4Å; D105-W191 HydrophobicContact CB-CD2 4.38Å; D105-W191 HydrophobicContact CB-CE3 3.81Å; D105-W191 HydrophobicContact CB-CG 4.49Å; V106-W191 WeakPolarHBondContact O-CA 3.2Å; D107-W191 HydrophobicContact CB-CE3 3.94Å; D107-W191 HydrophobicContact CB-CH2 3.8Å; D107-W191 HydrophobicContact CB-CZ3 3.45Å; D107-W191 VanDerWaalsContact CB-CZ3 3.45Å; H189-W191 HydrophobicContact CB-CD2 4.28Å; H189-W191 HydrophobicContact CB-CZ2 3.54Å; H189-W191 AromaticContact CG-CE2 3.88Å; H189-W191 AromaticContact CG-CZ2 3.46Å; H189-W191 VanDerWaalsContact CG-CZ2 3.46Å; H189-W191 AromaticContact CG-NE1 3.99Å; H189-W191 AromaticContact ND1-CH2 3.92Å; H189-W191 AromaticContact ND1-CZ2 3.46Å; H189-W191 WeakPolarHBondContact ND1-CZ2 3.31Å; W191-V280 CarbonylContact O-C 3.22Å; W191-V280 VanDerWaalsContact O-CA 3.28Å; W191-V280 WeakPolarHBondContact O-CA 2.99Å; W191-T281 PolarHBondContact N-O 2.89Å; W191-T281 PolarHBondContact O-N 2.84Å; W191-E283 PolarHBondContact NE1-OE2 2.79Å
192	Y	93.7	Very high	85.3	Confident	31 Å²	31	31.5 Å²	31.5	12%	0.122	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	153.4	163.8	81.7	-85.6	0	0	0	112.8	D105 V106 I108 L116 I118 L278 I279	D105-Y192 WeakPolarHBondContact CA-O 3.32Å; V106-Y192 HydrophobicContact CB-CD1 4.04Å; V106-Y192 HydrophobicContact CB-CE1 3.47Å; V106-Y192 VanDerWaalsContact CB-CE1 3.47Å; V106-Y192 HydrophobicContact CG1-CD1 4.29Å; V106-Y192 HydrophobicContact CG1-CE1 3.46Å; V106-Y192 VanDerWaalsContact CG1-CE1 3.46Å; V106-Y192 HydrophobicContact CG2-CE1 4.47Å; V106-Y192 PolarHBondContact N-O 3.44Å; V106-Y192 PolarHBondContact O-N 3.35Å; I108-Y192 HydrophobicContact CG2-CD1 3.65Å; I108-Y192 HydrophobicContact CG2-CE1 3.8Å; L116-Y192 HydrophobicContact CD2-CD1 4.26Å; L116-Y192 HydrophobicContact CD2-CE1 3.36Å; I118-Y192 HydrophobicContact CD1-CD1 4.13Å; I118-Y192 HydrophobicContact CD1-CD2 3.39Å; I118-Y192 HydrophobicContact CD1-CE1 4.26Å; I118-Y192 HydrophobicContact CD1-CE2 3.56Å; I118-Y192 HydrophobicContact CD1-CG 3.69Å; I118-Y192 HydrophobicContact CG1-CD2 4.32Å; I118-Y192 HydrophobicContact CG1-CE2 3.99Å; I118-Y192 HydrophobicContact CG2-CE2 4.25Å; Y192-L278 HydrophobicContact CD2-CD1 4.49Å; Y192-I279 CarbonylContact C-O 3.46Å; Y192-I279 VanDerWaalsContact CA-O 3.22Å; Y192-I279 WeakPolarHBondContact CA-O 3.46Å
193	R	93.6	Very high	84.4	Confident	4 Å²	4	35.3 Å²	35.3	2%	0.015	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	146.3	164.6	59.2	165	-179.6	-141.8	-1	112	Q98 D105 V195 G247 L254 I279	Q98-R193 PolarHBondContact O-NH1 2.99Å; Q98-R193 VanDerWaalsContact O-NH1 3.09Å; Q98-R193 PolarHBondContact O-NH2 3.05Å; D105-R193 WeakPolarHBondContact OD1-CB 3.31Å; D105-R193 WeakPolarHBondContact OD1-CD 3.12Å; D105-R193 WeakPolarHBondContact OD1-CG 3.44Å; D105-R193 IonicContact OD1-NE 2.69Å; D105-R193 IonicContact OD1-NH1 2.98Å; R193-V195 HydrophobicContact CG-CG2 4.3Å; R193-G247 CarbonylContact C-O 3.48Å; R193-G247 WeakPolarHBondContact CA-O 3.32Å; R193-L254 VanDerWaalsContact NH2-CD2 3.33Å; R193-I279 HydrophobicContact CG-CB 4.05Å; R193-I279 PolarHBondContact N-O 3.22Å; R193-I279 PolarHBondContact O-N 2.02Å
194	V	94.1	Very high	83.1	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	116.3	168.6	179.7	0	0	0	0	108.3	I118 L120 F122 T196 G247 R248 I249 A277 L278	I118-V194 HydrophobicContact CG2-CG2 4.12Å; L120-V194 HydrophobicContact CD2-CG2 4.46Å; F122-V194 HydrophobicContact CE1-CG1 3.71Å; F122-V194 HydrophobicContact CZ-CG1 4.5Å; V194-T196 HydrophobicContact CG1-CG2 3.97Å; V194-G247 PolarHBondContact N-O 3.45Å; V194-R248 HydrophobicContact CB-CG 4.27Å; V194-R248 WeakPolarHBondContact O-CA 2.78Å; V194-I249 PolarHBondContact O-N 3.33Å; V194-A277 CarbonylContact C-O 3.53Å; V194-A277 WeakPolarHBondContact CA-O 3.11Å; V194-L278 HydrophobicContact CG2-CD1 3.92Å
195	V	94	Very high	81.7	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	131.9	175.8	-168.6	0	0	0	0	108.7	R193 I249 D251 L254 L255 Y276 A277 I279	R193-V195 HydrophobicContact CG-CG2 4.3Å; V195-I249 CarbonylContact C-O 3.53Å; V195-I249 WeakPolarHBondContact CA-O 3.38Å; V195-I249 HydrophobicContact CB-CG2 4.04Å; V195-I249 HydrophobicContact CG1-CG2 4.03Å; V195-I249 HydrophobicContact CG2-CG2 3.76Å; V195-D251 HydrophobicContact CG1-CB 3.85Å; V195-L254 HydrophobicContact CG1-CD2 4.28Å; V195-L254 HydrophobicContact CG2-CD2 3.89Å; V195-L255 HydrophobicContact CB-CD2 4.16Å; V195-L255 HydrophobicContact CG1-CD1 4.16Å; V195-L255 HydrophobicContact CG1-CD2 3.88Å; V195-L255 HydrophobicContact CG1-CG 3.7Å; V195-Y276 CarbonylContact O-C 3.58Å; V195-Y276 WeakPolarHBondContact O-CA 3.29Å; V195-A277 HydrophobicContact CB-CB 4.31Å; V195-A277 PolarHBondContact N-O 2.96Å; V195-A277 PolarHBondContact O-N 3.17Å; V195-I279 HydrophobicContact CG2-CD1 4.07Å
196	T	92.6	Very high	79.9	Confident	28 Å²	28	39.8 Å²	39.8	17%	0.172	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	153.1	-178.2	63.9	0	0	0	0	110.4	V194 I249 E250 D251 D275 Y276	V194-T196 HydrophobicContact CG1-CG2 3.97Å; T196-I249 PolarHBondContact N-O 3.4Å; T196-I249 PolarHBondContact OG1-O 3.3Å; T196-E250 VanDerWaalsContact O-CA 3.28Å; T196-E250 WeakPolarHBondContact O-CA 2.96Å; T196-E250 WeakPolarHBondContact OG1-CG 2.91Å; T196-D251 PolarHBondContact O-N 2.93Å; T196-D251 VanDerWaalsContact O-N 3.12Å; T196-D275 CarbonylContact C-O 3.6Å; T196-Y276 HydrophobicContact CG2-CD1 3.85Å; T196-Y276 HydrophobicContact CG2-CE1 4.29Å
197	R	89.4	Confident	78.1	Confident	4 Å²	4	39.6 Å²	39.6	2%	0.015	22%	0.218	C	C	.	.			trans	-94.1	141.1	170.9	-169.8	174	-61.2	-88.4	4	109.5	I199 M201 I202 L255 D256 K273 A274 D275	R197-I199 PolarHBondContact O-N 3.17Å; R197-M201 HydrophobicContact CG-CB 3.87Å; R197-I202 HydrophobicContact CB-CD1 4.19Å; R197-I202 HydrophobicContact CB-CG1 3.88Å; R197-I202 HydrophobicContact CG-CG1 4.13Å; R197-I202 WeakPolarHBondContact O-CD1 3.32Å; R197-L255 HydrophobicContact CB-CD1 3.75Å; R197-D256 IonicContact CZ-OD1 3.91Å; R197-D256 VanDerWaalsContact CZ-OD1 3.29Å; R197-D256 IonicContact NH1-OD1 3.98Å; R197-D256 PolarHBondContact NH1-OD1 3.12Å; R197-D256 IonicContact NH1-OD2 2.96Å; R197-D256 IonicContact NH2-OD1 3.05Å; R197-D256 PolarHBondContact NH2-OD1 3.4Å; R197-K273 VanDerWaalsContact NE-CE 3.32Å; R197-A274 PolarHBondContact NE-O 3.5Å; R197-A274 PolarHBondContact NH2-O 2.78Å; R197-D275 WeakPolarHBondContact CB-O 3.25Å; R197-D275 PolarHBondContact N-O 2.84Å; R197-D275 IonicContact NE-OD1 3.65Å; R197-D275 PolarHBondContact NE-OD1 2.91Å
198	P	84.4	Confident	76.1	Confident	5 Å²	5	47.2 Å²	47.2	3%	0.032	25%	0.253	C	S	.	.			trans	-54.3	134.9	172.6	-28.1	36.4	0	0	0	112	N200 M201 I202 L242 E250	P198-N200 WeakPolarHBondContact CB-OD1 3.01Å; P198-N200 PolarHBondContact O-N 3.16Å; P198-N200 VanDerWaalsContact O-N 3.13Å; P198-M201 HydrophobicContact CB-CG 4.41Å; P198-M201 HydrophobicContact CG-SD 4.43Å; P198-M201 WeakPolarHBondContact O-CA 3.36Å; P198-M201 WeakPolarHBondContact O-CB 3.5Å; P198-M201 PolarHBondContact O-N 3.03Å; P198-I202 PolarHBondContact O-N 3.47Å; P198-L242 HydrophobicContact CG-CD2 3.62Å; P198-E250 HydrophobicContact CG-CB 4.5Å
199	I	76.3	Confident	73.7	Confident	116 Å²	116	56.5 Å²	56.5	60%	0.595	29%	0.294	S	S	*	.	H	α-helix	trans	-54.8	-37.5	-172.4	-65.9	168.7	0	0	0	112.5	R197 M201 I202 N203	R197-I199 PolarHBondContact O-N 3.17Å; I199-M201 PolarHBondContact O-N 2.92Å; I199-I202 PolarHBondContact O-N 2.65Å; I199-N203 PolarHBondContact O-N 3.35Å
200	N	71.7	Confident	71.2	Confident	62 Å²	62	60.5 Å²	60.5	33%	0.332	32%	0.323	S	S	.	.	H	α-helix	trans	-64.7	-23.6	177	59.9	-43	0	0	0	113.7	P198 P204 Q240	P198-N200 WeakPolarHBondContact CB-OD1 3.01Å; P198-N200 PolarHBondContact O-N 3.16Å; P198-N200 VanDerWaalsContact O-N 3.13Å; N200-P204 WeakPolarHBondContact O-CA 3.13Å; N200-Q240 PolarHBondContact ND2-NE2 3.38Å; N200-Q240 PolarHBondContact ND2-OE1 3.45Å
201	M	71.5	Confident	68.6	Low	56 Å²	56	68 Å²	68	28%	0.276	36%	0.363	S	S	.	.	H	α-helix	trans	-91.4	-19.5	175	-62.2	-172	83.3	0	0	113.4	R197 P198 I199 Y237 P252	R197-M201 HydrophobicContact CG-CB 3.87Å; P198-M201 HydrophobicContact CB-CG 4.41Å; P198-M201 HydrophobicContact CG-SD 4.43Å; P198-M201 WeakPolarHBondContact O-CA 3.36Å; P198-M201 WeakPolarHBondContact O-CB 3.5Å; P198-M201 PolarHBondContact O-N 3.03Å; I199-M201 PolarHBondContact O-N 2.92Å; M201-Y237 HydrophobicContact CE-CD1 4.47Å; M201-Y237 HydrophobicContact CE-CE1 3.64Å; M201-Y237 HydrophobicContact SD-CD1 4.18Å; M201-Y237 HydrophobicContact SD-CE1 3.92Å; M201-P252 HydrophobicContact SD-CB 4.18Å; M201-P252 HydrophobicContact SD-CG 4.46Å
202	I	70.8	Confident	65.8	Low	53 Å²	53	77.8 Å²	77.8	27%	0.272	40%	0.4	S	S	.	.	H	α-helix	trans	-74.6	-48.7	171.4	-59.8	176.1	0	0	0	108.6	R197 P198 I199 D275 Y276	R197-I202 HydrophobicContact CB-CD1 4.19Å; R197-I202 HydrophobicContact CB-CG1 3.88Å; R197-I202 HydrophobicContact CG-CG1 4.13Å; R197-I202 WeakPolarHBondContact O-CD1 3.32Å; P198-I202 PolarHBondContact O-N 3.47Å; I199-I202 PolarHBondContact O-N 2.65Å; I202-D275 HydrophobicContact CD1-CB 4.05Å; I202-D275 HydrophobicContact CG1-CB 4.08Å; I202-Y276 HydrophobicContact CD1-CE1 4.31Å
203	N	62.7	Low	63	Low	81 Å²	81	82.6 Å²	82.6	43%	0.433	44%	0.435	S	S	.	.			trans	-125.1	90.7	179.2	-167.1	-5.6	0	0	0	111.2	I199 F205 G206	I199-N203 PolarHBondContact O-N 3.35Å; N203-F205 PolarHBondContact O-N 3Å; N203-F205 VanDerWaalsContact O-N 3.14Å; N203-F205 PolarHBondContact OD1-N 3.35Å; N203-G206 PolarHBondContact O-N 2.83Å; N203-G206 PolarHBondContact OD1-N 3.22Å
204	P	52.4	Low	60.3	Low	93 Å²	93	89 Å²	89	60%	0.604	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-22.7	-179.9	22.6	-31.1	0	0	0	113	N200	N200-P204 WeakPolarHBondContact O-CA 3.13Å
205	F	49.6	Very low	57.5	Low	183 Å²	183	98 Å²	98	80%	0.803	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-13	176.1	-59	-73.1	0	0	0	113.4	N203 A207	N203-F205 PolarHBondContact O-N 3Å; N203-F205 VanDerWaalsContact O-N 3.14Å; N203-F205 PolarHBondContact OD1-N 3.35Å; F205-A207 VanDerWaalsContact C-N 3.29Å; F205-A207 PolarHBondContact O-N 3.04Å
206	G	43	Very low	54.8	Low	25 Å²	25	105.2 Å²	105.2	26%	0.258	54%	0.541	S	S	.	.	G	3₁₀ helix	trans	-78.4	-8.1	-176.1	0	0	0	0	0	114.8	N203 E208 F209	N203-G206 PolarHBondContact O-N 2.83Å; N203-G206 PolarHBondContact OD1-N 3.22Å; G206-E208 PolarHBondContact O-N 2.88Å; G206-F209 PolarHBondContact O-N 3.21Å
207	A	46.7	Very low	52	Low	64 Å²	64	109.9 Å²	109.9	53%	0.529	57%	0.569	S	S	.	*	G	3₁₀ helix	trans	-62.6	-23.3	-175.5	0	0	0	0	0	113.7	F205 F209	F205-A207 VanDerWaalsContact C-N 3.29Å; F205-A207 PolarHBondContact O-N 3.04Å; A207-F209 VanDerWaalsContact C-N 3.25Å; A207-F209 PolarHBondContact O-N 3.36Å
208	E	43	Very low	49.6	Very low	169 Å²	169	116.6 Å²	116.6	79%	0.79	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-69	-19.8	178	-73.1	-169.9	165.3	0	0	113.7	G206	G206-E208 PolarHBondContact O-N 2.88Å
209	F	39.9	Very low	47.5	Very low	196 Å²	196	122.5 Å²	122.5	86%	0.86	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-96.4	-0.5	-175.7	-89.7	-85	0	0	0	115.9	G206 A207	G206-F209 PolarHBondContact O-N 3.21Å; A207-F209 VanDerWaalsContact C-N 3.25Å; A207-F209 PolarHBondContact O-N 3.36Å
210	S	39.6	Very low	45.9	Very low	96 Å²	96	118.1 Å²	118.1	67%	0.671	62%	0.618	S	S	*	*			trans	-119.9	40.4	-176.8	-61.2	0	0	0	0	113.6	R212	S210-R212 VanDerWaalsContact C-N 3.26Å; S210-R212 PolarHBondContact O-N 2.04Å
211	L	36.6	Very low	44.5	Very low	157 Å²	157	119.2 Å²	119.2	82%	0.822	63%	0.628	S	S	*	*			trans	-88.6	60.5	164.4	-73.7	168.5	0	0	0	110.6
212	R	35.4	Very low	43.2	Very low	211 Å²	211	122.9 Å²	122.9	80%	0.796	65%	0.654	S	S	*	*			trans	-132.6	108.7	155.2	-73.5	-168	-177	-161.6	1.6	107.8	S210 Q214	S210-R212 VanDerWaalsContact C-N 3.26Å; S210-R212 PolarHBondContact O-N 2.04Å; R212-Q214 PolarHBondContact O-N 3.21Å
213	P	35	Very low	41.9	Very low	132 Å²	132	123.7 Å²	123.7	86%	0.857	66%	0.659	S	S	*	*			trans	-70	78.4	165.5	29.5	-30	0	0	0	107.2	Q215	P213-Q215 PolarHBondContact O-N 2.89Å
214	Q	38	Very low	41.3	Very low	138 Å²	138	122 Å²	122	65%	0.645	65%	0.652	S	S	*	*			trans	-70	111.9	157.3	-81.8	-171.8	-7.3	0	0	105.6	R212 Q216	R212-Q214 PolarHBondContact O-N 3.21Å; Q214-Q216 HydrophobicContact CB-CG 4.35Å; Q214-Q216 PolarHBondContact O-N 2.86Å
215	Q	35.6	Very low	41.2	Very low	190 Å²	190	123.3 Å²	123.3	89%	0.888	66%	0.661	S	S	*	*			trans	-58.7	71.9	155.2	-73.9	176.6	-16.8	0	0	107.9	P213 T217	P213-Q215 PolarHBondContact O-N 2.89Å; Q215-T217 VanDerWaalsContact C-N 3.31Å; Q215-T217 PolarHBondContact O-N 3.44Å; Q215-T217 VanDerWaalsContact O-N 3.13Å
216	Q	35.9	Very low	41.3	Very low	151 Å²	151	120.2 Å²	120.2	71%	0.706	65%	0.649	S	S	*	*			trans	-75.2	99.4	159.5	-82.9	-176.8	-9.2	0	0	105.2	Q214 F218	Q214-Q216 HydrophobicContact CB-CG 4.35Å; Q214-Q216 PolarHBondContact O-N 2.86Å; Q216-F218 PolarHBondContact O-N 3.49Å
217	T	34.2	Very low	41.6	Very low	125 Å²	125	121 Å²	121	77%	0.767	65%	0.647	S	S	*	*			trans	-53.7	94.8	155.4	44.8	0	0	0	0	106.6	Q215 V219	Q215-T217 VanDerWaalsContact C-N 3.31Å; Q215-T217 PolarHBondContact O-N 3.44Å; Q215-T217 VanDerWaalsContact O-N 3.13Å; T217-V219 PolarHBondContact O-N 3.16Å
218	F	39.3	Very low	41.7	Very low	145 Å²	145	122.1 Å²	122.1	64%	0.636	66%	0.656	S	S	*	*			trans	-64.1	104.1	172.9	-170.8	-101.8	0	0	0	106.5	Q216 G220	Q216-F218 PolarHBondContact O-N 3.49Å; F218-G220 VanDerWaalsContact CD1-CA 3.5Å; F218-G220 VanDerWaalsContact CE1-CA 3.41Å; F218-G220 PolarHBondContact O-N 3.22Å
219	V	40.7	Very low	42.2	Very low	129 Å²	129	117.6 Å²	117.6	78%	0.782	65%	0.654	S	S	*	*			trans	-72.9	84.4	163.3	-174.8	0	0	0	0	104.4	T217	T217-V219 PolarHBondContact O-N 3.16Å
220	G	42.9	Very low	42.9	Very low	25 Å²	25	113.4 Å²	113.4	26%	0.258	64%	0.637	S	S	.	*	P	Polyproline II helix	trans	-56.2	156.5	168.9	0	0	0	0	0	109.3	F218 T222	F218-G220 VanDerWaalsContact CD1-CA 3.5Å; F218-G220 VanDerWaalsContact CE1-CA 3.41Å; F218-G220 PolarHBondContact O-N 3.22Å; G220-T222 PolarHBondContact O-N 2.96Å; G220-T222 VanDerWaalsContact O-N 3.11Å
221	P	42.5	Very low	43.9	Very low	84 Å²	84	120.4 Å²	120.4	55%	0.545	65%	0.649	S	S	.	*	P	Polyproline II helix	trans	-48.1	128.8	171.2	20.7	-30.8	0	0	0	108.2	L223	P221-L223 PolarHBondContact O-N 2.04Å
222	T	43.8	Very low	45.1	Very low	133 Å²	133	115.6 Å²	115.6	82%	0.816	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-48.6	118.6	177.4	41.1	0	0	0	0	108.1	G220	G220-T222 PolarHBondContact O-N 2.96Å; G220-T222 VanDerWaalsContact O-N 3.11Å
223	L	43.5	Very low	46.6	Very low	71 Å²	71	108.8 Å²	108.8	37%	0.372	61%	0.607	S	S	.	*	P	Polyproline II helix	trans	-50.1	141.3	173	-73	162.7	0	0	0	108.5	P221 L227 F246	P221-L223 PolarHBondContact O-N 2.04Å; L223-L227 HydrophobicContact CB-CB 4.42Å; L223-L227 HydrophobicContact CD2-CB 4.31Å; L223-F246 HydrophobicContact CD2-CB 4.29Å; L223-F246 HydrophobicContact CD2-CD2 3.29Å; L223-F246 HydrophobicContact CD2-CE2 3.77Å; L223-F246 HydrophobicContact CD2-CG 3.97Å
224	P	50.2	Low	48	Very low	46 Å²	46	107.8 Å²	107.8	30%	0.299	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-47.7	139.5	163.6	-23.7	32.2	0	0	0	109.1	E226 L227	P224-E226 PolarHBondContact O-N 3.07Å; P224-L227 HydrophobicContact CG-CD1 4.22Å; P224-L227 PolarHBondContact O-N 3.36Å
225	P	50.3	Low	49.5	Very low	119 Å²	119	103.9 Å²	103.9	77%	0.773	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-50.8	-30.1	-177.9	-26.7	32.8	0	0	0	113.6	L227 A228	P225-L227 PolarHBondContact O-N 3.23Å; P225-A228 WeakPolarHBondContact O-CB 3.4Å; P225-A228 PolarHBondContact O-N 3.28Å
226	E	50.7	Low	51.1	Low	119 Å²	119	99.1 Å²	99.1	56%	0.556	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-63.8	-20.7	178	-66	133.6	-170.7	0	0	114.2	W110 P224	W110-E226 WeakPolarHBondContact CH2-OE1 3.37Å; W110-E226 WeakPolarHBondContact CZ2-OE1 3.49Å; W110-E226 WeakPolarHBondContact CZ2-OE2 3.07Å; P224-E226 PolarHBondContact O-N 3.07Å
227	L	49	Very low	52.7	Low	42 Å²	42	94.9 Å²	94.9	22%	0.22	54%	0.535	C	S	.	.	G	3₁₀ helix	trans	-106.7	5.3	-175.2	-72.6	163.9	0	0	0	113.7	L223 P224 P225 G229 H230 F246	L223-L227 HydrophobicContact CB-CB 4.42Å; L223-L227 HydrophobicContact CD2-CB 4.31Å; P224-L227 HydrophobicContact CG-CD1 4.22Å; P224-L227 PolarHBondContact O-N 3.36Å; P225-L227 PolarHBondContact O-N 3.23Å; L227-G229 PolarHBondContact O-N 2.68Å; L227-H230 PolarHBondContact O-N 3.4Å; L227-H230 VanDerWaalsContact O-N 3.15Å; L227-F246 HydrophobicContact CD1-CD1 4.32Å; L227-F246 HydrophobicContact CD1-CE1 4Å; L227-F246 HydrophobicContact CD1-CZ 4.17Å; L227-F246 HydrophobicContact CD2-CE1 4.47Å; L227-F246 HydrophobicContact CD2-CZ 4.13Å
228	A	50.2	Low	54.3	Low	86 Å²	86	93.5 Å²	93.5	71%	0.711	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	2.8	-173.4	0	0	0	0	0	116.3	P225	P225-A228 WeakPolarHBondContact O-CB 3.4Å; P225-A228 PolarHBondContact O-N 3.28Å
229	G	52.7	Low	55.7	Low	74 Å²	74	90.1 Å²	90.1	76%	0.763	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.4	-1.6	177.8	0	0	0	0	0	115.9	L227 R231	L227-G229 PolarHBondContact O-N 2.68Å; G229-R231 PolarHBondContact O-N 3.12Å
230	H	55.3	Low	57.1	Low	109 Å²	109	88.6 Å²	88.6	51%	0.505	53%	0.526	S	S	.	.			trans	-87	113.6	-173.9	-76.9	61.7	0	0	0	111.5	L227 I232	L227-H230 PolarHBondContact O-N 3.4Å; L227-H230 VanDerWaalsContact O-N 3.15Å; H230-I232 PolarHBondContact O-N 2.84Å
231	R	59.7	Low	58.6	Low	242 Å²	242	94 Å²	94	91%	0.913	54%	0.544	S	S	*	.			trans	-74.7	114.8	173.9	-140.4	-174.6	-76.3	-157.8	-1.2	108.2	G229 P233	G229-R231 PolarHBondContact O-N 3.12Å; R231-P233 WeakPolarHBondContact O-CD 3.4Å
232	I	63.1	Low	60.3	Low	57 Å²	57	90.9 Å²	90.9	29%	0.292	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-67.7	120.3	178.9	-52.6	176.9	0	0	0	108.2	Y104 H230 T244	Y104-I232 HydrophobicContact CE1-CG2 4.1Å; H230-I232 PolarHBondContact O-N 2.84Å; I232-T244 WeakPolarHBondContact CD1-O 3.41Å; I232-T244 WeakPolarHBondContact CG2-OG1 3.33Å
233	P	65.5	Low	61.9	Low	68 Å²	68	91.2 Å²	91.2	44%	0.442	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-65.9	139	178.3	25.3	-31.4	0	0	0	110.3	Y104 R231 R235	Y104-P233 WeakPolarHBondContact OH-CD 3.41Å; Y104-P233 WeakPolarHBondContact OH-CG 3.14Å; R231-P233 WeakPolarHBondContact O-CD 3.4Å; P233-R235 PolarHBondContact O-N 3.42Å
234	I	65	Low	63.5	Low	110 Å²	110	89.1 Å²	89.1	56%	0.564	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-69.7	117.2	174.9	-59.1	173	0	0	0	107.4	T236 Q241	I234-T236 HydrophobicContact CG2-CG2 4.28Å; I234-Q241 HydrophobicContact CG2-CB 4.07Å; I234-Q241 HydrophobicContact CG2-CG 3.54Å
235	R	69.9	Low	64.9	Low	56 Å²	56	87.9 Å²	87.9	21%	0.211	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	143.7	168.7	-81.8	-178.3	-82.2	161.9	-8.9	109.7	Y104 P233 Q241 L242 T244 I249 D251	Y104-R235 VanDerWaalsContact CD2-NH2 3.28Å; P233-R235 PolarHBondContact O-N 3.42Å; R235-Q241 WeakPolarHBondContact O-CA 3.49Å; R235-L242 HydrophobicContact CB-CB 4.28Å; R235-L242 HydrophobicContact CB-CD1 4.3Å; R235-L242 PolarHBondContact O-N 3.43Å; R235-T244 HydrophobicContact CB-CG2 4.29Å; R235-T244 VanDerWaalsContact CZ-CG2 3.44Å; R235-I249 VanDerWaalsContact CZ-CD1 3.5Å; R235-D251 IonicContact NH1-OD2 3.28Å
236	T	69.9	Low	66.3	Low	91 Å²	91	83.5 Å²	83.5	56%	0.558	47%	0.466	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.8	133.1	178	56.2	0	0	0	0	110.6	I234 Q240 Q241	I234-T236 HydrophobicContact CG2-CG2 4.28Å; T236-Q240 CarbonylContact C-O 3.21Å; T236-Q240 WeakPolarHBondContact CA-O 3.4Å; T236-Q241 HydrophobicContact CG2-CG 4.17Å
237	Y	68.6	Low	68	Low	62 Å²	62	77.9 Å²	77.9	24%	0.243	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	129.8	171.3	179.5	-92.9	0	0	0	109.3	M201 G239 Q240 P252 E253	M201-Y237 HydrophobicContact CE-CD1 4.47Å; M201-Y237 HydrophobicContact CE-CE1 3.64Å; M201-Y237 HydrophobicContact SD-CD1 4.18Å; M201-Y237 HydrophobicContact SD-CE1 3.92Å; Y237-G239 PolarHBondContact O-N 3.18Å; Y237-G239 VanDerWaalsContact O-N 3.08Å; Y237-Q240 PolarHBondContact N-O 3.33Å; Y237-Q240 PolarHBondContact O-N 3.39Å; Y237-P252 HydrophobicContact CD1-CG 3.66Å; Y237-P252 HydrophobicContact CD2-CG 3.85Å; Y237-P252 HydrophobicContact CE1-CB 4.42Å; Y237-P252 HydrophobicContact CE1-CG 3.92Å; Y237-P252 HydrophobicContact CE2-CG 4.09Å; Y237-P252 HydrophobicContact CG-CG 3.61Å; Y237-E253 HydrophobicContact CD2-CG 3.84Å; Y237-E253 WeakPolarHBondContact CD2-OE1 3.5Å; Y237-E253 HydrophobicContact CE2-CG 3.53Å; Y237-E253 WeakPolarHBondContact CE2-OE1 3.25Å
238	A	67.3	Low	69.9	Low	95 Å²	95	78.5 Å²	78.5	79%	0.785	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.1	36.3	-174.3	0	0	0	0	0	113.8	Q240	A238-Q240 VanDerWaalsContact C-N 3.32Å; A238-Q240 PolarHBondContact O-N 3.36Å
239	G	68.6	Low	71.8	Confident	74 Å²	74	74.7 Å²	74.7	76%	0.763	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.6	-4.6	-178.8	0	0	0	0	0	115.8	Y237	Y237-G239 PolarHBondContact O-N 3.18Å; Y237-G239 VanDerWaalsContact O-N 3.08Å
240	Q	70.1	Confident	73.5	Confident	98 Å²	98	72.1 Å²	72.1	46%	0.458	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	138.9	177	-65.1	-174.2	-16.2	0	0	111.6	N200 T236 Y237 A238	N200-Q240 PolarHBondContact ND2-NE2 3.38Å; N200-Q240 PolarHBondContact ND2-OE1 3.45Å; T236-Q240 CarbonylContact C-O 3.21Å; T236-Q240 WeakPolarHBondContact CA-O 3.4Å; Y237-Q240 PolarHBondContact N-O 3.33Å; Y237-Q240 PolarHBondContact O-N 3.39Å; A238-Q240 VanDerWaalsContact C-N 3.32Å; A238-Q240 PolarHBondContact O-N 3.36Å
241	Q	74.2	Confident	75.2	Confident	137 Å²	137	68.4 Å²	68.4	64%	0.64	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.6	126.6	173.4	-66.6	-173.3	-12.9	0	0	110.3	I234 R235 T236	I234-Q241 HydrophobicContact CG2-CB 4.07Å; I234-Q241 HydrophobicContact CG2-CG 3.54Å; R235-Q241 WeakPolarHBondContact O-CA 3.49Å; T236-Q241 HydrophobicContact CG2-CG 4.17Å
242	L	77.9	Confident	76.6	Confident	19 Å²	19	57 Å²	57	10%	0.099	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	142	178.1	-64.1	177.6	0	0	0	110.3	P198 R235 T244 E250	P198-L242 HydrophobicContact CG-CD2 3.62Å; R235-L242 HydrophobicContact CB-CB 4.28Å; R235-L242 HydrophobicContact CB-CD1 4.3Å; R235-L242 PolarHBondContact O-N 3.43Å; L242-T244 PolarHBondContact O-N 3.16Å; L242-E250 HydrophobicContact CB-CB 4.03Å; L242-E250 WeakPolarHBondContact CD1-O 3.36Å; L242-E250 HydrophobicContact CD2-CB 4.07Å
243	K	78.9	Confident	77.8	Confident	140 Å²	140	59.9 Å²	59.9	61%	0.609	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-72.4	128.3	173.8	-61.8	-179.4	-169.4	165.8	0	110.4	E250	K243-E250 HydrophobicContact CB-CG 4.04Å; K243-E250 WeakPolarHBondContact CD-OE1 3.31Å; K243-E250 PolarHBondContact N-OE2 3Å; K243-E250 PolarHBondContact O-N 2.95Å
244	T	76.9	Confident	79.1	Confident	27 Å²	27	57.2 Å²	57.2	17%	0.166	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	120.3	-176.9	53.7	0	0	0	0	109.5	I232 R235 L242	I232-T244 WeakPolarHBondContact CD1-O 3.41Å; I232-T244 WeakPolarHBondContact CG2-OG1 3.33Å; R235-T244 HydrophobicContact CB-CG2 4.29Å; R235-T244 VanDerWaalsContact CZ-CG2 3.44Å; L242-T244 PolarHBondContact O-N 3.16Å
245	A	79.2	Confident	80.5	Confident	21 Å²	21	52 Å²	52	17%	0.174	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	158.9	173.8	0	0	0	0	0	109	G247 R248	A245-G247 PolarHBondContact O-N 3.25Å; A245-R248 CarbonylContact C-O 3.58Å; A245-R248 PolarHBondContact N-O 3.24Å; A245-R248 CarbonylContact O-C 3.59Å; A245-R248 PolarHBondContact O-N 3.35Å; A245-R248 VanDerWaalsContact O-N 3.15Å
246	F	79.5	Confident	81.6	Confident	26 Å²	26	52.3 Å²	52.3	11%	0.114	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	127.4	172.6	-77.8	-93.7	0	0	0	109.7	Y104 V106 L223 L227 R248	Y104-F246 HydrophobicContact CD1-CE1 4.38Å; Y104-F246 HydrophobicContact CD1-CE2 4.41Å; Y104-F246 HydrophobicContact CD1-CZ 4.22Å; Y104-F246 CarbonylContact O-C 3.47Å; Y104-F246 WeakPolarHBondContact O-CA 3.36Å; V106-F246 HydrophobicContact CG2-CB 3.93Å; L223-F246 HydrophobicContact CD2-CB 4.29Å; L223-F246 HydrophobicContact CD2-CD2 3.29Å; L223-F246 HydrophobicContact CD2-CE2 3.77Å; L223-F246 HydrophobicContact CD2-CG 3.97Å; L227-F246 HydrophobicContact CD1-CD1 4.32Å; L227-F246 HydrophobicContact CD1-CE1 4Å; L227-F246 HydrophobicContact CD1-CZ 4.17Å; L227-F246 HydrophobicContact CD2-CE1 4.47Å; L227-F246 HydrophobicContact CD2-CZ 4.13Å; F246-R248 PolarHBondContact O-N 3.39Å
247	G	86.4	Confident	82.7	Confident	1 Å²	1	51 Å²	51	1%	0.01	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.8	-7.5	-178.3	0	0	0	0	0	114.5	Y104 R193 V194 A245	Y104-G247 PolarHBondContact O-N 3.29Å; R193-G247 CarbonylContact C-O 3.48Å; R193-G247 WeakPolarHBondContact CA-O 3.32Å; V194-G247 PolarHBondContact N-O 3.45Å; A245-G247 PolarHBondContact O-N 3.25Å
248	R	88.7	Confident	84	Confident	56 Å²	56	48.1 Å²	48.1	21%	0.211	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	122.1	-178.8	-68.7	-176.4	179.3	-94.7	10.6	112.3	D119 D121 V194 A245 F246	D119-R248 PolarHBondContact O-NH2 3.24Å; D121-R248 IonicContact OD1-NH2 2.99Å; D121-R248 IonicContact OD2-CZ 2.71Å; D121-R248 IonicContact OD2-NE 3.89Å; D121-R248 IonicContact OD2-NH1 3.89Å; D121-R248 PolarHBondContact OD2-NH1 3.01Å; D121-R248 IonicContact OD2-NH2 3.27Å; D121-R248 PolarHBondContact OD2-NH2 2.02Å; V194-R248 HydrophobicContact CB-CG 4.27Å; V194-R248 WeakPolarHBondContact O-CA 2.78Å; A245-R248 CarbonylContact C-O 3.58Å; A245-R248 PolarHBondContact N-O 3.24Å; A245-R248 CarbonylContact O-C 3.59Å; A245-R248 PolarHBondContact O-N 3.35Å; A245-R248 VanDerWaalsContact O-N 3.15Å; F246-R248 PolarHBondContact O-N 3.39Å
249	I	90.3	Very high	85.2	Confident	6 Å²	6	44 Å²	44	3%	0.031	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	134	-167.2	-160.4	173.7	0	0	0	110.3	Y104 V194 V195 T196 R235	Y104-I249 HydrophobicContact CD2-CD1 4.28Å; V194-I249 PolarHBondContact O-N 3.33Å; V195-I249 CarbonylContact C-O 3.53Å; V195-I249 WeakPolarHBondContact CA-O 3.38Å; V195-I249 HydrophobicContact CB-CG2 4.04Å; V195-I249 HydrophobicContact CG1-CG2 4.03Å; V195-I249 HydrophobicContact CG2-CG2 3.76Å; T196-I249 PolarHBondContact N-O 3.4Å; T196-I249 PolarHBondContact OG1-O 3.3Å; R235-I249 VanDerWaalsContact CZ-CD1 3.5Å
250	E	88.8	Confident	86.3	Confident	20 Å²	20	46.5 Å²	46.5	9%	0.093	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	116.5	162.5	-75	176.7	178.1	0	0	108.2	T196 P198 L242 K243	T196-E250 VanDerWaalsContact O-CA 3.28Å; T196-E250 WeakPolarHBondContact O-CA 2.96Å; T196-E250 WeakPolarHBondContact OG1-CG 2.91Å; P198-E250 HydrophobicContact CG-CB 4.5Å; L242-E250 HydrophobicContact CB-CB 4.03Å; L242-E250 WeakPolarHBondContact CD1-O 3.36Å; L242-E250 HydrophobicContact CD2-CB 4.07Å; K243-E250 HydrophobicContact CB-CG 4.04Å; K243-E250 WeakPolarHBondContact CD-OE1 3.31Å; K243-E250 PolarHBondContact N-OE2 3Å; K243-E250 PolarHBondContact O-N 2.95Å
251	D	91.1	Very high	87.3	Confident	31 Å²	31	43.2 Å²	43.2	17%	0.166	21%	0.205	C	C	.	.			trans	-148.2	85.2	-179.8	-162.9	-32.3	0	0	0	110.9	V195 T196 R235 E253 L254 L255	V195-D251 HydrophobicContact CG1-CB 3.85Å; T196-D251 PolarHBondContact O-N 2.93Å; T196-D251 VanDerWaalsContact O-N 3.12Å; R235-D251 IonicContact NH1-OD2 3.28Å; D251-E253 VanDerWaalsContact C-N 3.29Å; D251-E253 PolarHBondContact O-N 3.06Å; D251-E253 PolarHBondContact OD1-N 2.77Å; D251-L254 HydrophobicContact CB-CB 4.03Å; D251-L254 VanDerWaalsContact CG-CB 3.47Å; D251-L254 WeakPolarHBondContact OD1-CB 3.05Å; D251-L254 PolarHBondContact OD1-N 2.89Å; D251-L255 WeakPolarHBondContact O-CG 3.28Å; D251-L255 PolarHBondContact O-N 3.16Å
252	P	88.6	Confident	88.2	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.006	18%	0.175	C	C	.	.	H	α-helix	trans	-66.3	-30.9	-179.6	26.2	-33.1	0	0	0	112.5	M201 Y237 L255 D256	M201-P252 HydrophobicContact SD-CB 4.18Å; M201-P252 HydrophobicContact SD-CG 4.46Å; Y237-P252 HydrophobicContact CD1-CG 3.66Å; Y237-P252 HydrophobicContact CD2-CG 3.85Å; Y237-P252 HydrophobicContact CE1-CB 4.42Å; Y237-P252 HydrophobicContact CE1-CG 3.92Å; Y237-P252 HydrophobicContact CE2-CG 4.09Å; Y237-P252 HydrophobicContact CG-CG 3.61Å; P252-L255 PolarHBondContact O-N 3.16Å; P252-D256 WeakPolarHBondContact O-CB 3.28Å; P252-D256 PolarHBondContact O-N 3.4Å
253	E	88.8	Confident	88.8	Confident	119 Å²	119	38.4 Å²	38.4	56%	0.556	18%	0.181	S	C	*	.	H	α-helix	trans	-68.3	-45	-179.1	-65.3	-177.8	-179.6	0	0	111	Y237 D251 L255 D256 I257	Y237-E253 HydrophobicContact CD2-CG 3.84Å; Y237-E253 WeakPolarHBondContact CD2-OE1 3.5Å; Y237-E253 HydrophobicContact CE2-CG 3.53Å; Y237-E253 WeakPolarHBondContact CE2-OE1 3.25Å; D251-E253 VanDerWaalsContact C-N 3.29Å; D251-E253 PolarHBondContact O-N 3.06Å; D251-E253 PolarHBondContact OD1-N 2.77Å; E253-L255 VanDerWaalsContact C-N 3.34Å; E253-L255 PolarHBondContact O-N 2.94Å; E253-D256 PolarHBondContact O-N 3.12Å; E253-I257 WeakPolarHBondContact O-CG1 3.23Å; E253-I257 PolarHBondContact O-N 2.7Å
254	L	92.8	Very high	89.1	Confident	12 Å²	12	36.5 Å²	36.5	6%	0.063	18%	0.175	C	C	.	.	H	α-helix	trans	-61.8	-42.9	174.2	177.9	60.5	0	0	0	111.5	Y97 R193 V195 D251 D256 I257 I258 I279	Y97-L254 HydrophobicContact CD1-CD1 3.88Å; Y97-L254 HydrophobicContact CG-CD1 4.49Å; R193-L254 VanDerWaalsContact NH2-CD2 3.33Å; V195-L254 HydrophobicContact CG1-CD2 4.28Å; V195-L254 HydrophobicContact CG2-CD2 3.89Å; D251-L254 HydrophobicContact CB-CB 4.03Å; D251-L254 VanDerWaalsContact CG-CB 3.47Å; D251-L254 WeakPolarHBondContact OD1-CB 3.05Å; D251-L254 PolarHBondContact OD1-N 2.89Å; L254-D256 VanDerWaalsContact C-N 3.28Å; L254-D256 PolarHBondContact O-N 3.01Å; L254-I257 PolarHBondContact O-N 3.47Å; L254-I258 HydrophobicContact CD1-CD1 4.22Å; L254-I258 HydrophobicContact CD1-CG1 4.43Å; L254-I258 HydrophobicContact CG-CD1 3.99Å; L254-I258 WeakPolarHBondContact O-CG1 2.98Å; L254-I258 PolarHBondContact O-N 3.27Å; L254-I279 HydrophobicContact CD2-CD1 4.07Å
255	L	94.6	Very high	89.5	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63.2	-34.5	175.8	-71	174.3	0	0	0	112.3	V195 R197 D251 P252 E253 I258 T259 A274 D275 A277	V195-L255 HydrophobicContact CB-CD2 4.16Å; V195-L255 HydrophobicContact CG1-CD1 4.16Å; V195-L255 HydrophobicContact CG1-CD2 3.88Å; V195-L255 HydrophobicContact CG1-CG 3.7Å; R197-L255 HydrophobicContact CB-CD1 3.75Å; D251-L255 WeakPolarHBondContact O-CG 3.28Å; D251-L255 PolarHBondContact O-N 3.16Å; P252-L255 PolarHBondContact O-N 3.16Å; E253-L255 VanDerWaalsContact C-N 3.34Å; E253-L255 PolarHBondContact O-N 2.94Å; L255-I258 PolarHBondContact O-N 3.07Å; L255-T259 WeakPolarHBondContact O-CB 3.45Å; L255-T259 PolarHBondContact O-N 3.4Å; L255-T259 PolarHBondContact O-OG1 2.91Å; L255-A274 HydrophobicContact CD2-CB 4.05Å; L255-D275 WeakPolarHBondContact CD1-O 3.2Å; L255-A277 HydrophobicContact CD2-CB 3.61Å
256	D	91.4	Very high	89.9	Confident	62 Å²	62	34.5 Å²	34.5	33%	0.332	16%	0.16	S	C	.	.	H	α-helix	trans	-70.4	-37	176	-68.1	-12.8	0	0	0	111.5	R197 P252 E253 L254 T259 R260	R197-D256 IonicContact CZ-OD1 3.91Å; R197-D256 VanDerWaalsContact CZ-OD1 3.29Å; R197-D256 IonicContact NH1-OD1 3.98Å; R197-D256 PolarHBondContact NH1-OD1 3.12Å; R197-D256 IonicContact NH1-OD2 2.96Å; R197-D256 IonicContact NH2-OD1 3.05Å; R197-D256 PolarHBondContact NH2-OD1 3.4Å; P252-D256 WeakPolarHBondContact O-CB 3.28Å; P252-D256 PolarHBondContact O-N 3.4Å; E253-D256 PolarHBondContact O-N 3.12Å; L254-D256 VanDerWaalsContact C-N 3.28Å; L254-D256 PolarHBondContact O-N 3.01Å; D256-T259 PolarHBondContact O-N 3.35Å; D256-R260 VanDerWaalsContact O-CB 3.32Å; D256-R260 WeakPolarHBondContact O-CB 3.35Å; D256-R260 PolarHBondContact O-N 2.95Å
257	I	93.7	Very high	90.2	Very high	65 Å²	65	33.8 Å²	33.8	33%	0.333	16%	0.158	S	C	.	.	H	α-helix	trans	-63	-49	171.4	-64.9	167.3	0	0	0	110.5	Y97 E253 L254 T259 R260 D261	Y97-I257 HydrophobicContact CE1-CG2 3.93Å; E253-I257 WeakPolarHBondContact O-CG1 3.23Å; E253-I257 PolarHBondContact O-N 2.7Å; L254-I257 PolarHBondContact O-N 3.47Å; I257-T259 VanDerWaalsContact C-N 3.3Å; I257-T259 PolarHBondContact O-N 3.06Å; I257-R260 WeakPolarHBondContact O-CB 3.41Å; I257-R260 PolarHBondContact O-N 2.9Å; I257-D261 PolarHBondContact O-N 2.8Å
258	I	95.7	Very high	90.1	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-59.3	-45.2	177.4	-68.8	164.6	0	0	0	110.3	Y97 L254 L255 R260 D261 I262 A277 I279 V312 A314	Y97-I258 HydrophobicContact CD1-CG1 4.36Å; Y97-I258 HydrophobicContact CE1-CG1 3.84Å; Y97-I258 HydrophobicContact CE2-CG1 4.03Å; L254-I258 HydrophobicContact CD1-CD1 4.22Å; L254-I258 HydrophobicContact CD1-CG1 4.43Å; L254-I258 HydrophobicContact CG-CD1 3.99Å; L254-I258 WeakPolarHBondContact O-CG1 2.98Å; L254-I258 PolarHBondContact O-N 3.27Å; L255-I258 PolarHBondContact O-N 3.07Å; I258-R260 PolarHBondContact O-N 3Å; I258-D261 PolarHBondContact O-N 2.9Å; I258-I262 HydrophobicContact CG2-CD1 3.71Å; I258-I262 HydrophobicContact CG2-CG1 4.46Å; I258-I262 VanDerWaalsContact O-CG1 3.27Å; I258-I262 WeakPolarHBondContact O-CG1 3.33Å; I258-I262 PolarHBondContact O-N 3.43Å; I258-A277 HydrophobicContact CD1-CB 4.13Å; I258-I279 HydrophobicContact CD1-CD1 4.12Å; I258-V312 HydrophobicContact CD1-CG1 4.14Å; I258-V312 HydrophobicContact CG2-CG1 4.28Å; I258-A314 HydrophobicContact CG2-CB 3.87Å
259	T	93.8	Very high	90	Very high	9 Å²	9	32.7 Å²	32.7	6%	0.055	16%	0.164	C	C	.	.	H	α-helix	trans	-56.8	-50	176.4	-65	0	0	0	0	110.6	L255 D256 I257 D261 I262 Q263 F272 A274	L255-T259 WeakPolarHBondContact O-CB 3.45Å; L255-T259 PolarHBondContact O-N 3.4Å; L255-T259 PolarHBondContact O-OG1 2.91Å; D256-T259 PolarHBondContact O-N 3.35Å; I257-T259 VanDerWaalsContact C-N 3.3Å; I257-T259 PolarHBondContact O-N 3.06Å; T259-D261 PolarHBondContact O-N 2.83Å; T259-I262 PolarHBondContact O-N 2.85Å; T259-Q263 HydrophobicContact CG2-CG 4.32Å; T259-Q263 WeakPolarHBondContact O-CB 3.5Å; T259-Q263 WeakPolarHBondContact O-CG 3.45Å; T259-Q263 PolarHBondContact O-N 2.73Å; T259-F272 WeakPolarHBondContact CG2-O 3.49Å; T259-A274 WeakPolarHBondContact OG1-CB 3.5Å; T259-A274 PolarHBondContact OG1-N 3.48Å
260	R	90.6	Very high	89.4	Confident	126 Å²	126	38.7 Å²	38.7	48%	0.475	19%	0.186	S	C	.	.	H	α-helix	trans	-58.8	-47.5	178.4	179.9	-173.3	70.5	-165.1	0.7	111.4	D256 I257 I258 I262 Q263 H264	D256-R260 VanDerWaalsContact O-CB 3.32Å; D256-R260 WeakPolarHBondContact O-CB 3.35Å; D256-R260 PolarHBondContact O-N 2.95Å; I257-R260 WeakPolarHBondContact O-CB 3.41Å; I257-R260 PolarHBondContact O-N 2.9Å; I258-R260 PolarHBondContact O-N 3Å; R260-I262 VanDerWaalsContact C-N 3.31Å; R260-I262 PolarHBondContact O-N 2.99Å; R260-Q263 WeakPolarHBondContact O-CB 3.19Å; R260-Q263 PolarHBondContact O-N 3.17Å; R260-Q263 VanDerWaalsContact O-N 3.14Å; R260-H264 PolarHBondContact O-CD2 2.82Å; R260-H264 PolarHBondContact O-N 3.31Å
261	D	91.8	Very high	88.8	Confident	30 Å²	30	40.5 Å²	40.5	16%	0.16	21%	0.211	C	C	.	.	H	α-helix	trans	-62.9	-38.3	-179.1	-70	-1.4	0	0	0	111.9	Y97 I257 I258 T259 G265 M323 R386	Y97-D261 PolarHBondContact OH-OD2 3.5Å; I257-D261 PolarHBondContact O-N 2.8Å; I258-D261 PolarHBondContact O-N 2.9Å; T259-D261 PolarHBondContact O-N 2.83Å; D261-G265 PolarHBondContact O-N 3.3Å; D261-M323 HydrophobicContact CB-CE 4.08Å; D261-R386 VanDerWaalsContact CG-NH1 3.32Å; D261-R386 IonicContact OD2-CZ 2.85Å; D261-R386 IonicContact OD2-NH1 3.21Å; D261-R386 PolarHBondContact OD2-NH1 3.49Å; D261-R386 IonicContact OD2-NH2 3.97Å
262	I	93.3	Very high	88.8	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-65.6	-44	173.2	-67.4	167	0	0	0	110.7	I258 T259 R260 H264 G265 M266 A269 F272 A314 Y321 M323 L388	I258-I262 HydrophobicContact CG2-CD1 3.71Å; I258-I262 HydrophobicContact CG2-CG1 4.46Å; I258-I262 VanDerWaalsContact O-CG1 3.27Å; I258-I262 WeakPolarHBondContact O-CG1 3.33Å; I258-I262 PolarHBondContact O-N 3.43Å; T259-I262 PolarHBondContact O-N 2.85Å; R260-I262 VanDerWaalsContact C-N 3.31Å; R260-I262 PolarHBondContact O-N 2.99Å; I262-H264 VanDerWaalsContact C-N 3.32Å; I262-H264 PolarHBondContact O-N 3.41Å; I262-G265 PolarHBondContact O-N 3.42Å; I262-M266 PolarHBondContact O-N 3.15Å; I262-A269 HydrophobicContact CG2-CB 3.88Å; I262-F272 HydrophobicContact CD1-CE1 3.82Å; I262-F272 HydrophobicContact CG2-CD1 4.13Å; I262-F272 HydrophobicContact CG2-CE1 4.42Å; I262-A314 HydrophobicContact CD1-CB 3.74Å; I262-Y321 HydrophobicContact CD1-CG 4.39Å; I262-Y321 HydrophobicContact CG2-CD1 3.68Å; I262-Y321 HydrophobicContact CG2-CD2 4.18Å; I262-Y321 HydrophobicContact CG2-CE1 3.97Å; I262-Y321 HydrophobicContact CG2-CE2 4.46Å; I262-Y321 HydrophobicContact CG2-CG 3.79Å; I262-M323 HydrophobicContact CG1-CE 3.9Å; I262-L388 HydrophobicContact CG1-CD1 4.03Å; I262-L388 HydrophobicContact CG2-CD2 4.37Å
263	Q	89.3	Confident	88.8	Confident	52 Å²	52	43 Å²	43	24%	0.243	22%	0.22	C	C	.	.	H	α-helix	trans	-63.1	-34	179	-73.4	178.7	-0.5	0	0	113.6	T259 R260 A269 R270 F272	T259-Q263 HydrophobicContact CG2-CG 4.32Å; T259-Q263 WeakPolarHBondContact O-CB 3.5Å; T259-Q263 WeakPolarHBondContact O-CG 3.45Å; T259-Q263 PolarHBondContact O-N 2.73Å; R260-Q263 WeakPolarHBondContact O-CB 3.19Å; R260-Q263 PolarHBondContact O-N 3.17Å; R260-Q263 VanDerWaalsContact O-N 3.14Å; Q263-A269 WeakPolarHBondContact CG-O 3.32Å; Q263-R270 PolarHBondContact NE2-O 3.04Å; Q263-F272 PolarHBondContact NE2-O 2.59Å
264	H	85.1	Confident	89.1	Confident	101 Å²	101	37.3 Å²	37.3	47%	0.468	19%	0.194	S	C	.	.	H	α-helix	trans	-83.9	-22.7	174.3	-74.1	-75.4	0	0	0	113.3	R260 I262 M454	R260-H264 PolarHBondContact O-CD2 2.82Å; R260-H264 PolarHBondContact O-N 3.31Å; I262-H264 VanDerWaalsContact C-N 3.32Å; I262-H264 PolarHBondContact O-N 3.41Å; H264-M454 VanDerWaalsContact O-CE 3.3Å; H264-M454 WeakPolarHBondContact O-CE 3.36Å
265	G	85.2	Confident	89.1	Confident	2 Å²	2	37.8 Å²	37.8	2%	0.021	20%	0.196	C	C	.	.	H	α-helix	trans	-86.1	-22.7	-179	0	0	0	0	0	114.4	D261 I262 G399	D261-G265 PolarHBondContact O-N 3.3Å; I262-G265 PolarHBondContact O-N 3.42Å; G265-G399 WeakPolarHBondContact O-CA 3.19Å; G265-G399 PolarHBondContact O-N 3.49Å
266	M	87.4	Confident	89.2	Confident	3 Å²	3	39.5 Å²	39.5	2%	0.015	20%	0.203	C	C	.	.	S	Bend	trans	-143.5	134.9	-172.5	-172	170.8	-174.1	0	0	112.8	I262 A269 Y321 L388 R390 E396	I262-M266 PolarHBondContact O-N 3.15Å; M266-A269 HydrophobicContact CB-CB 4.48Å; M266-A269 WeakPolarHBondContact O-CB 3.46Å; M266-Y321 HydrophobicContact SD-CD1 4.1Å; M266-Y321 HydrophobicContact SD-CE1 3.7Å; M266-L388 HydrophobicContact CB-CD2 3.66Å; M266-L388 HydrophobicContact CB-CG 4.49Å; M266-R390 HydrophobicContact CE-CB 3.73Å; M266-R390 HydrophobicContact SD-CB 3.97Å; M266-E396 HydrophobicContact CE-CB 3.67Å; M266-E396 WeakPolarHBondContact CE-O 3.43Å
267	V	87.2	Confident	89.4	Confident	12 Å²	12	36.6 Å²	36.6	7%	0.073	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	147.4	173.8	84.6	0	0	0	0	110.6	A269 Q409 D411 N424 T426	V267-A269 PolarHBondContact O-N 3.38Å; V267-Q409 HydrophobicContact CG1-CB 3.6Å; V267-D411 HydrophobicContact CG2-CB 3.73Å; V267-N424 HydrophobicContact CG2-CB 4.07Å; V267-N424 VanDerWaalsContact CG2-O 3.22Å; V267-N424 WeakPolarHBondContact CG2-O 3.22Å; V267-T426 HydrophobicContact CB-CG2 3.63Å; V267-T426 HydrophobicContact CG1-CG2 3.47Å; V267-T426 VanDerWaalsContact CG1-CG2 3.47Å
268	G	84.3	Confident	89.5	Confident	34 Å²	34	33.5 Å²	33.5	35%	0.351	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.4	-10.8	-178.9	0	0	0	0	0	115.2	R270	G268-R270 PolarHBondContact O-N 3.2Å
269	A	87.3	Confident	89.6	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-80.2	-7.3	178.8	0	0	0	0	0	114.8	I262 Q263 M266 V267 G271 F272 Y321	I262-A269 HydrophobicContact CG2-CB 3.88Å; Q263-A269 WeakPolarHBondContact CG-O 3.32Å; M266-A269 HydrophobicContact CB-CB 4.48Å; M266-A269 WeakPolarHBondContact O-CB 3.46Å; V267-A269 PolarHBondContact O-N 3.38Å; A269-G271 PolarHBondContact O-N 3.49Å; A269-G271 VanDerWaalsContact O-N 3.08Å; A269-F272 WeakPolarHBondContact O-CA 3.31Å; A269-F272 WeakPolarHBondContact O-CB 3.46Å; A269-F272 PolarHBondContact O-N 2.8Å; A269-Y321 HydrophobicContact CB-CE1 4.22Å
270	R	76.5	Confident	89.6	Confident	131 Å²	131	33.1 Å²	33.1	49%	0.494	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-55.9	-29.7	-178	-76	-171.2	-178.2	-158.7	-3.6	115	Q263 G268 F272	Q263-R270 PolarHBondContact NE2-O 3.04Å; G268-R270 PolarHBondContact O-N 3.2Å; R270-F272 VanDerWaalsContact C-N 3.33Å
271	G	77.2	Confident	89.9	Confident	59 Å²	59	27.1 Å²	27.1	61%	0.608	15%	0.146	S	C	*	.	G	3₁₀ helix	trans	-89.7	3.1	175.8	0	0	0	0	0	113.9	A269 R319	A269-G271 PolarHBondContact O-N 3.49Å; A269-G271 VanDerWaalsContact O-N 3.08Å; G271-R319 VanDerWaalsContact C-NH1 3.34Å; G271-R319 PolarHBondContact O-NH1 2.86Å; G271-R319 VanDerWaalsContact O-NH1 3.14Å; G271-R319 PolarHBondContact O-NH2 3.28Å
272	F	89.6	Confident	90.1	Very high	1 Å²	1	25.7 Å²	25.7	0%	0.004	14%	0.139	C	C	.	.			trans	-89.6	139.9	175.4	173.6	-103.2	0	0	0	110.2	T259 I262 Q263 A269 R270 A274 A314 D316 R319 Y321	T259-F272 WeakPolarHBondContact CG2-O 3.49Å; I262-F272 HydrophobicContact CD1-CE1 3.82Å; I262-F272 HydrophobicContact CG2-CD1 4.13Å; I262-F272 HydrophobicContact CG2-CE1 4.42Å; Q263-F272 PolarHBondContact NE2-O 2.59Å; A269-F272 WeakPolarHBondContact O-CA 3.31Å; A269-F272 WeakPolarHBondContact O-CB 3.46Å; A269-F272 PolarHBondContact O-N 2.8Å; R270-F272 VanDerWaalsContact C-N 3.33Å; F272-A274 HydrophobicContact CE1-CB 4.02Å; F272-A274 HydrophobicContact CZ-CB 4Å; F272-A314 HydrophobicContact CE1-CB 4.36Å; F272-A314 HydrophobicContact CZ-CB 4.16Å; F272-D316 HydrophobicContact CD2-CB 4.47Å; F272-D316 HydrophobicContact CE2-CB 4.11Å; F272-R319 HydrophobicContact CD2-CB 4.14Å; F272-R319 HydrophobicContact CE2-CB 4.34Å; F272-Y321 HydrophobicContact CB-CE2 3.95Å; F272-Y321 AromaticContact CD1-CD2 3.81Å; F272-Y321 HydrophobicContact CD1-CD2 3.81Å; F272-Y321 AromaticContact CD1-CE2 3.72Å; F272-Y321 HydrophobicContact CD1-CE2 3.72Å; F272-Y321 AromaticContact CD2-CD2 3.93Å; F272-Y321 HydrophobicContact CD2-CD2 3.93Å; F272-Y321 AromaticContact CD2-CE2 3.52Å; F272-Y321 HydrophobicContact CD2-CE2 3.52Å; F272-Y321 AromaticContact CE1-CD2 3.66Å; F272-Y321 HydrophobicContact CE1-CD2 3.66Å; F272-Y321 HydrophobicContact CE1-CE2 4.05Å; F272-Y321 AromaticContact CE2-CD2 3.77Å; F272-Y321 HydrophobicContact CE2-CD2 3.77Å; F272-Y321 AromaticContact CE2-CE2 3.85Å; F272-Y321 HydrophobicContact CE2-CE2 3.85Å; F272-Y321 AromaticContact CG-CD2 3.93Å; F272-Y321 HydrophobicContact CG-CD2 3.93Å; F272-Y321 AromaticContact CG-CE2 3.43Å; F272-Y321 HydrophobicContact CG-CE2 3.43Å; F272-Y321 VanDerWaalsContact CG-CE2 3.43Å; F272-Y321 AromaticContact CZ-CD2 3.63Å; F272-Y321 HydrophobicContact CZ-CD2 3.63Å; F272-Y321 HydrophobicContact CZ-CE2 4.11Å
273	K	89.8	Confident	90.1	Very high	83 Å²	83	25.9 Å²	25.9	36%	0.361	14%	0.139	S	C	.	.			trans	-137.8	123.5	172.7	177.9	-177.6	173.7	-167.4	0	106.4	R197 D275	R197-K273 VanDerWaalsContact NE-CE 3.32Å; K273-D275 PolarHBondContact O-N 2.03Å
274	A	93.6	Very high	90.3	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.129	C	C	.	.			trans	-71.4	122.5	176.6	0	0	0	0	0	109.4	R197 L255 T259 F272 A314	R197-A274 PolarHBondContact NE-O 3.5Å; R197-A274 PolarHBondContact NH2-O 2.78Å; L255-A274 HydrophobicContact CD2-CB 4.05Å; T259-A274 WeakPolarHBondContact OG1-CB 3.5Å; T259-A274 PolarHBondContact OG1-N 3.48Å; F272-A274 HydrophobicContact CE1-CB 4.02Å; F272-A274 HydrophobicContact CZ-CB 4Å; A274-A314 HydrophobicContact CB-CB 3.98Å
275	D	94.1	Very high	90.6	Very high	21 Å²	21	19 Å²	19	11%	0.112	11%	0.107	C	C	.	.	S	Bend	trans	-97.4	-28.1	170	-68.7	-38.5	0	0	0	111	T196 R197 I202 L255 K273 T315	T196-D275 CarbonylContact C-O 3.6Å; R197-D275 WeakPolarHBondContact CB-O 3.25Å; R197-D275 PolarHBondContact N-O 2.84Å; R197-D275 IonicContact NE-OD1 3.65Å; R197-D275 PolarHBondContact NE-OD1 2.91Å; I202-D275 HydrophobicContact CD1-CB 4.05Å; I202-D275 HydrophobicContact CG1-CB 4.08Å; L255-D275 WeakPolarHBondContact CD1-O 3.2Å; K273-D275 PolarHBondContact O-N 2.03Å; D275-T315 PolarHBondContact N-O 3.27Å; D275-T315 VanDerWaalsContact N-O 3.08Å
276	Y	95.4	Very high	90.9	Very high	37 Å²	37	18.9 Å²	18.9	15%	0.145	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	147.3	175.2	-50.8	-76.7	0	0	0	110.4	F122 V195 T196 I202 A314 T315 E317	F122-Y276 HydrophobicContact CB-CD1 3.98Å; F122-Y276 HydrophobicContact CB-CD2 3.61Å; F122-Y276 HydrophobicContact CB-CE1 3.93Å; F122-Y276 HydrophobicContact CB-CE2 3.54Å; F122-Y276 HydrophobicContact CB-CG 3.82Å; F122-Y276 AromaticContact CD1-CD1 3.54Å; F122-Y276 HydrophobicContact CD1-CD1 3.54Å; F122-Y276 HydrophobicContact CD1-CD2 4.27Å; F122-Y276 HydrophobicContact CD1-CE1 4.15Å; F122-Y276 AromaticContact CD1-CG 3.6Å; F122-Y276 HydrophobicContact CD1-CG 3.6Å; F122-Y276 AromaticContact CD2-CD2 3.99Å; F122-Y276 HydrophobicContact CD2-CD2 3.99Å; F122-Y276 AromaticContact CD2-CG 3.91Å; F122-Y276 HydrophobicContact CD2-CG 3.91Å; F122-Y276 HydrophobicContact CE1-CD1 4.16Å; F122-Y276 HydrophobicContact CE1-CG 4.09Å; F122-Y276 HydrophobicContact CE2-CG 4.37Å; F122-Y276 AromaticContact CG-CD1 3.82Å; F122-Y276 HydrophobicContact CG-CD1 3.82Å; F122-Y276 AromaticContact CG-CD2 3.71Å; F122-Y276 HydrophobicContact CG-CD2 3.71Å; F122-Y276 HydrophobicContact CG-CE1 4.28Å; F122-Y276 HydrophobicContact CG-CE2 4.16Å; F122-Y276 AromaticContact CG-CG 3.5Å; F122-Y276 HydrophobicContact CG-CG 3.5Å; F122-Y276 VanDerWaalsContact CG-CG 3.5Å; F122-Y276 HydrophobicContact CZ-CG 4.44Å; V195-Y276 CarbonylContact O-C 3.58Å; V195-Y276 WeakPolarHBondContact O-CA 3.29Å; T196-Y276 HydrophobicContact CG2-CD1 3.85Å; T196-Y276 HydrophobicContact CG2-CE1 4.29Å; I202-Y276 HydrophobicContact CD1-CE1 4.31Å; Y276-A314 CarbonylContact O-C 3.58Å; Y276-A314 WeakPolarHBondContact O-CA 3.26Å; Y276-T315 HydrophobicContact CD2-CG2 4.49Å; Y276-T315 PolarHBondContact N-O 3.45Å; Y276-T315 PolarHBondContact O-N 2.95Å; Y276-E317 HydrophobicContact CD2-CG 4.11Å; Y276-E317 HydrophobicContact CE2-CG 3.76Å; Y276-E317 WeakPolarHBondContact CE2-OE1 3.5Å
277	A	96.5	Very high	91	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	141.7	167	0	0	0	0	0	112.2	V194 V195 L255 I258 V312 I313 A314	V194-A277 CarbonylContact C-O 3.53Å; V194-A277 WeakPolarHBondContact CA-O 3.11Å; V195-A277 HydrophobicContact CB-CB 4.31Å; V195-A277 PolarHBondContact N-O 2.96Å; V195-A277 PolarHBondContact O-N 3.17Å; L255-A277 HydrophobicContact CD2-CB 3.61Å; I258-A277 HydrophobicContact CD1-CB 4.13Å; A277-V312 HydrophobicContact CB-CG1 4.5Å; A277-I313 CarbonylContact C-O 3.47Å; A277-I313 WeakPolarHBondContact CA-O 3.36Å; A277-I313 WeakPolarHBondContact CB-O 3.23Å; A277-A314 HydrophobicContact CB-CB 4.36Å
278	L	96	Very high	90.9	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.005	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	122.9	167.6	172.8	67.3	0	0	0	108.3	T134 Y192 V194 V280 V312 I313	T134-L278 HydrophobicContact CG2-CD2 3.77Å; Y192-L278 HydrophobicContact CD2-CD1 4.49Å; V194-L278 HydrophobicContact CG2-CD1 3.92Å; L278-V280 HydrophobicContact CD1-CG2 4.2Å; L278-V280 HydrophobicContact CD2-CG2 4.25Å; L278-V280 HydrophobicContact CG-CG2 3.99Å; L278-V312 CarbonylContact O-C 3.57Å; L278-V312 WeakPolarHBondContact O-CA 3.43Å; L278-I313 HydrophobicContact CB-CB 4.47Å; L278-I313 PolarHBondContact N-O 3.34Å; L278-I313 PolarHBondContact O-N 2.86Å
279	I	96.8	Very high	90.9	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.005	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	124.7	176.4	-59.8	177.9	0	0	0	107.5	Y192 R193 V195 L254 I258 Q310 M311 V312	Y192-I279 CarbonylContact C-O 3.46Å; Y192-I279 VanDerWaalsContact CA-O 3.22Å; Y192-I279 WeakPolarHBondContact CA-O 3.46Å; R193-I279 HydrophobicContact CG-CB 4.05Å; R193-I279 PolarHBondContact N-O 3.22Å; R193-I279 PolarHBondContact O-N 2.02Å; V195-I279 HydrophobicContact CG2-CD1 4.07Å; L254-I279 HydrophobicContact CD2-CD1 4.07Å; I258-I279 HydrophobicContact CD1-CD1 4.12Å; I279-Q310 HydrophobicContact CG2-CG 3.96Å; I279-M311 WeakPolarHBondContact CA-O 3.12Å; I279-V312 HydrophobicContact CD1-CG2 4.49Å; I279-V312 HydrophobicContact CG1-CB 4.44Å; I279-V312 HydrophobicContact CG1-CG1 4.02Å; I279-V312 HydrophobicContact CG1-CG2 3.94Å; I279-V312 HydrophobicContact CG2-CG2 4.24Å
280	V	95.8	Very high	90.8	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	127.9	175.5	-172.9	0	0	0	0	108.6	V136 I142 V190 W191 L278 W282 Q310 M311	V136-V280 HydrophobicContact CG1-CG1 3.69Å; V136-V280 HydrophobicContact CG2-CG2 4.21Å; I142-V280 HydrophobicContact CG2-CG2 4.33Å; V190-V280 HydrophobicContact CG1-CG1 4.3Å; W191-V280 CarbonylContact O-C 3.22Å; W191-V280 VanDerWaalsContact O-CA 3.28Å; W191-V280 WeakPolarHBondContact O-CA 2.99Å; L278-V280 HydrophobicContact CD1-CG2 4.2Å; L278-V280 HydrophobicContact CD2-CG2 4.25Å; L278-V280 HydrophobicContact CG-CG2 3.99Å; V280-W282 HydrophobicContact CB-CH2 3.91Å; V280-W282 HydrophobicContact CB-CZ3 3.94Å; V280-W282 HydrophobicContact CG1-CD2 4.27Å; V280-W282 HydrophobicContact CG1-CE3 4.09Å; V280-W282 HydrophobicContact CG1-CH2 3.46Å; V280-W282 VanDerWaalsContact CG1-CH2 3.46Å; V280-W282 HydrophobicContact CG1-CZ2 3.63Å; V280-W282 HydrophobicContact CG1-CZ3 3.69Å; V280-Q310 CarbonylContact O-C 3.47Å; V280-Q310 WeakPolarHBondContact O-CA 3.45Å; V280-M311 HydrophobicContact CB-CE 4.2Å; V280-M311 HydrophobicContact CG2-CE 4.02Å; V280-M311 PolarHBondContact N-O 2.95Å; V280-M311 PolarHBondContact O-N 3.12Å
281	T	96.7	Very high	91.1	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	122.1	-178.6	-49.5	0	0	0	0	110.1	F99 V190 W191 Q310	F99-T281 HydrophobicContact CB-CG2 4.44Å; F99-T281 HydrophobicContact CD1-CG2 3.85Å; F99-T281 HydrophobicContact CD2-CG2 3.88Å; F99-T281 HydrophobicContact CE1-CG2 4Å; F99-T281 HydrophobicContact CE2-CG2 4.03Å; F99-T281 HydrophobicContact CG-CG2 3.8Å; F99-T281 HydrophobicContact CZ-CG2 4.09Å; V190-T281 WeakPolarHBondContact CA-O 3.31Å; W191-T281 PolarHBondContact N-O 2.89Å; W191-T281 PolarHBondContact O-N 2.84Å; T281-Q310 HydrophobicContact CG2-CB 4.19Å; T281-Q310 WeakPolarHBondContact OG1-CG 3.36Å; T281-Q310 PolarHBondContact OG1-NE2 2.76Å
282	W	94.9	Very high	91.3	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	108	171.2	-67.2	-98.1	0	0	0	107.6	V136 F137 I142 A172 V190 V280 M285 T308 Y309 M311	V136-W282 HydrophobicContact CG1-CZ2 4.5Å; F137-W282 PolarHBondContact O-NE1 2.84Å; I142-W282 HydrophobicContact CG2-CH2 4.43Å; A172-W282 HydrophobicContact CB-CE3 4.45Å; A172-W282 HydrophobicContact CB-CH2 4.09Å; A172-W282 HydrophobicContact CB-CZ3 3.76Å; V190-W282 HydrophobicContact CG1-CG 4.28Å; V190-W282 HydrophobicContact CG2-CG 4.12Å; V280-W282 HydrophobicContact CB-CH2 3.91Å; V280-W282 HydrophobicContact CB-CZ3 3.94Å; V280-W282 HydrophobicContact CG1-CD2 4.27Å; V280-W282 HydrophobicContact CG1-CE3 4.09Å; V280-W282 HydrophobicContact CG1-CH2 3.46Å; V280-W282 VanDerWaalsContact CG1-CH2 3.46Å; V280-W282 HydrophobicContact CG1-CZ2 3.63Å; V280-W282 HydrophobicContact CG1-CZ3 3.69Å; W282-M285 HydrophobicContact CB-CG 3.78Å; W282-M285 HydrophobicContact CG-CG 4.49Å; W282-T308 VanDerWaalsContact O-CA 3.25Å; W282-T308 WeakPolarHBondContact O-CA 3.27Å; W282-Y309 HydrophobicContact CB-CD1 4.39Å; W282-Y309 HydrophobicContact CB-CD2 4.28Å; W282-Y309 HydrophobicContact CB-CE1 3.83Å; W282-Y309 HydrophobicContact CB-CE2 3.75Å; W282-Y309 VanDerWaalsContact CB-CZ 3.46Å; W282-Y309 HydrophobicContact CD2-CD2 4.22Å; W282-Y309 AromaticContact CD2-CE2 3.46Å; W282-Y309 HydrophobicContact CD2-CE2 3.46Å; W282-Y309 VanDerWaalsContact CD2-CE2 3.46Å; W282-Y309 AromaticContact CD2-CZ 3.9Å; W282-Y309 AromaticContact CE3-CD2 3.6Å; W282-Y309 HydrophobicContact CE3-CD2 3.6Å; W282-Y309 AromaticContact CE3-CE2 3.25Å; W282-Y309 HydrophobicContact CE3-CE2 3.25Å; W282-Y309 HydrophobicContact CG-CE1 4.46Å; W282-Y309 AromaticContact CG-CE2 3.69Å; W282-Y309 HydrophobicContact CG-CE2 3.69Å; W282-Y309 AromaticContact CG-CZ 3.61Å; W282-Y309 HydrophobicContact CZ3-CD2 4.25Å; W282-Y309 AromaticContact CZ3-CE2 3.97Å; W282-Y309 HydrophobicContact CZ3-CE2 3.97Å; W282-Y309 PolarHBondContact N-O 3.39Å; W282-Y309 PolarHBondContact O-N 3.32Å; W282-M311 HydrophobicContact CH2-CB 4.39Å; W282-M311 HydrophobicContact CH2-CE 4.19Å; W282-M311 HydrophobicContact CZ3-CB 3.86Å
283	E	94.2	Very high	91	Very high	5 Å²	5	25.4 Å²	25.4	2%	0.023	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	126.6	-175.8	-179.4	-175.3	-170.1	0	0	110.3	R87 F99 S188 H189 W191 M285	R87-E283 IonicContact CZ-OE2 2.59Å; R87-E283 IonicContact NE-OE2 3.22Å; R87-E283 IonicContact NH1-OE1 3.29Å; R87-E283 PolarHBondContact NH1-OE1 2.8Å; R87-E283 IonicContact NH1-OE2 2.95Å; R87-E283 PolarHBondContact NH1-OE2 3.16Å; R87-E283 VanDerWaalsContact NH1-OE2 3.12Å; F99-E283 HydrophobicContact CE2-CB 4.21Å; F99-E283 HydrophobicContact CE2-CG 4.16Å; S188-E283 WeakPolarHBondContact CA-O 3.36Å; S188-E283 WeakPolarHBondContact CB-O 3.31Å; H189-E283 HydrophobicContact CB-CB 4.39Å; H189-E283 IonicContact CD2-OE2 2.75Å; H189-E283 PolarHBondContact N-O 3.21Å; H189-E283 VanDerWaalsContact N-O 3.12Å; H189-E283 PolarHBondContact O-N 3.36Å; W191-E283 PolarHBondContact NE1-OE2 2.79Å; E283-M285 PolarHBondContact O-N 3.11Å
284	R	92.2	Very high	90.6	Very high	8 Å²	8	26.9 Å²	26.9	3%	0.03	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	51.1	34	170.5	-64.9	-178.5	-179.9	-75.1	3.3	114.1	E90 E91 W93 S188 Q306 N307 T308	E90-R284 IonicContact OE2-NH2 2.91Å; E90-R284 PolarHBondContact OE2-NH2 2.83Å; E91-R284 VanDerWaalsContact CG-NH2 3.32Å; E91-R284 IonicContact OE1-CZ 2.79Å; E91-R284 IonicContact OE1-NH1 3.43Å; E91-R284 PolarHBondContact OE1-NH1 3.48Å; E91-R284 IonicContact OE1-NH2 3.54Å; E91-R284 PolarHBondContact OE1-NH2 2.93Å; W93-R284 HydrophobicContact CH2-CG 4.06Å; S188-R284 WeakPolarHBondContact CB-O 3.34Å; S188-R284 PolarHBondContact OG-O 2.77Å; R284-Q306 HydrophobicContact CB-CB 4.33Å; R284-Q306 HydrophobicContact CB-CG 4.21Å; R284-Q306 VanDerWaalsContact NH1-OE1 3.13Å; R284-Q306 WeakPolarHBondContact O-CG 3.5Å; R284-N307 CarbonylContact C-O 3.59Å; R284-N307 WeakPolarHBondContact CA-O 3.26Å; R284-N307 PolarHBondContact N-O 2.86Å; R284-N307 VanDerWaalsContact N-O 3.14Å; R284-T308 PolarHBondContact N-OG1 3.3Å
285	M	92.8	Very high	90	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	133	-178.1	-62.5	-57	-70.8	0	0	111.5	P138 Q177 F179 V190 W282 E283 Q306 N307 W331	P138-M285 HydrophobicContact CB-CE 4.49Å; Q177-M285 HydrophobicContact CB-CB 4.33Å; Q177-M285 HydrophobicContact CB-CE 4.12Å; F179-M285 HydrophobicContact CD1-CE 4.02Å; F179-M285 HydrophobicContact CD1-SD 4.04Å; F179-M285 HydrophobicContact CE1-CE 3.93Å; F179-M285 HydrophobicContact CE1-SD 4.02Å; F179-M285 HydrophobicContact CG-CE 4.44Å; F179-M285 HydrophobicContact CZ-CE 4.28Å; V190-M285 HydrophobicContact CG2-CE 4.06Å; V190-M285 HydrophobicContact CG2-SD 3.76Å; W282-M285 HydrophobicContact CB-CG 3.78Å; W282-M285 HydrophobicContact CG-CG 4.49Å; E283-M285 PolarHBondContact O-N 3.11Å; M285-Q306 CarbonylContact O-C 3.59Å; M285-Q306 WeakPolarHBondContact O-CA 3.48Å; M285-N307 PolarHBondContact N-O 3.18Å; M285-N307 PolarHBondContact O-N 2.93Å; M285-W331 PolarHBondContact O-NE1 3.19Å
286	G	91.3	Very high	89.1	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	162.8	175.9	0	0	0	0	0	111.9	Q177 S178 W305	Q177-G286 CarbonylContact C-O 3.54Å; Q177-G286 WeakPolarHBondContact CA-O 3.39Å; Q177-G286 WeakPolarHBondContact CB-O 3.49Å; S178-G286 PolarHBondContact N-O 3.07Å; S178-G286 PolarHBondContact O-N 3.22Å; G286-W305 WeakPolarHBondContact CA-O 3.39Å
287	Y	89	Confident	88.3	Confident	11 Å²	11	36.8 Å²	36.8	4%	0.043	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	153.7	171	61.4	-90.1	0	0	0	111.3	S178 G289 A290 P291 W305 W331 T335	S178-Y287 PolarHBondContact OG-O 3.29Å; Y287-G289 PolarHBondContact O-N 3.01Å; Y287-A290 HydrophobicContact CD1-CB 4.1Å; Y287-A290 HydrophobicContact CD2-CB 4.15Å; Y287-A290 HydrophobicContact CE1-CB 3.96Å; Y287-A290 VanDerWaalsContact CE2-CA 3.47Å; Y287-A290 HydrophobicContact CE2-CB 4.01Å; Y287-A290 HydrophobicContact CG-CB 4.18Å; Y287-A290 VanDerWaalsContact O-CB 3.26Å; Y287-A290 WeakPolarHBondContact O-CB 3.48Å; Y287-A290 PolarHBondContact O-N 3.09Å; Y287-A290 VanDerWaalsContact O-N 3.08Å; Y287-P291 VanDerWaalsContact OH-CD 3.27Å; Y287-P291 WeakPolarHBondContact OH-CD 3.18Å; Y287-W305 HydrophobicContact CD1-CB 3.85Å; Y287-W305 HydrophobicContact CD1-CG 4.42Å; Y287-W305 HydrophobicContact CE1-CB 3.57Å; Y287-W305 AromaticContact CE1-CG 3.93Å; Y287-W305 HydrophobicContact CE1-CG 3.93Å; Y287-W331 VanDerWaalsContact CB-CD2 3.45Å; Y287-W331 VanDerWaalsContact CB-CE3 3.48Å; Y287-W331 HydrophobicContact CD1-CB 4.06Å; Y287-W331 HydrophobicContact CD1-CG 4.1Å; Y287-W331 HydrophobicContact CG-CG 4.45Å; Y287-T335 WeakPolarHBondContact CE2-OG1 3.33Å
288	G	85.6	Confident	87.4	Confident	2 Å²	2	40 Å²	40	2%	0.021	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	122.5	171.7	0	0	0	0	0	111.2	E176 T335	E176-G288 PolarHBondContact O-N 2.81Å; G288-T335 WeakPolarHBondContact O-CB 3.25Å; G288-T335 PolarHBondContact O-N 2.79Å; G288-T335 PolarHBondContact O-OG1 2.94Å
289	G	84.9	Confident	86.5	Confident	54 Å²	54	40 Å²	40	56%	0.557	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	89	11	-173.2	0	0	0	0	0	115.2	Y287	Y287-G289 PolarHBondContact O-N 3.01Å
290	A	85	Confident	85.7	Confident	19 Å²	19	44.2 Å²	44.2	16%	0.157	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-58.5	142.5	174.7	0	0	0	0	0	112.3	Y287	Y287-A290 HydrophobicContact CD1-CB 4.1Å; Y287-A290 HydrophobicContact CD2-CB 4.15Å; Y287-A290 HydrophobicContact CE1-CB 3.96Å; Y287-A290 VanDerWaalsContact CE2-CA 3.47Å; Y287-A290 HydrophobicContact CE2-CB 4.01Å; Y287-A290 HydrophobicContact CG-CB 4.18Å; Y287-A290 VanDerWaalsContact O-CB 3.26Å; Y287-A290 WeakPolarHBondContact O-CB 3.48Å; Y287-A290 PolarHBondContact O-N 3.09Å; Y287-A290 VanDerWaalsContact O-N 3.08Å
291	P	83.1	Confident	84.9	Confident	67 Å²	67	46.8 Å²	46.8	44%	0.435	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-64.5	137.2	179.8	27.1	-34.4	0	0	0	110.9	Y287 W305	Y287-P291 VanDerWaalsContact OH-CD 3.27Å; Y287-P291 WeakPolarHBondContact OH-CD 3.18Å; P291-W305 HydrophobicContact CG-CH2 4.31Å; P291-W305 HydrophobicContact CG-CZ2 4.05Å
292	K	81.3	Confident	84.3	Confident	206 Å²	206	46.8 Å²	46.8	90%	0.896	26%	0.261	S	S	*	.	P	Polyproline II helix	trans	-73.9	129.5	171.8	-69.1	-172.6	178.6	-175.9	0	109.6
293	V	82.8	Confident	83.6	Confident	19 Å²	19	48.4 Å²	48.4	12%	0.115	27%	0.268	C	S	.	.	B	Isolated β-bridge	trans	-108.1	117.9	178.4	178	0	0	0	0	109	V182 G183 L298 V302 W305	V182-V293 WeakPolarHBondContact CA-O 3.03Å; G183-V293 PolarHBondContact N-O 2.94Å; V293-L298 HydrophobicContact CG1-CB 3.6Å; V293-L298 HydrophobicContact CG1-CD1 4.01Å; V293-L298 HydrophobicContact CG1-CG 4.46Å; V293-V302 HydrophobicContact CB-CG2 3.87Å; V293-V302 HydrophobicContact CG1-CG2 3.86Å; V293-V302 HydrophobicContact CG2-CG2 3.78Å; V293-W305 HydrophobicContact CG2-CH2 4.11Å; V293-W305 HydrophobicContact CG2-CZ2 3.73Å
294	T	80.6	Confident	83.1	Confident	113 Å²	113	55.2 Å²	55.2	69%	0.693	30%	0.298	S	S	*	.			trans	-90.7	-28.2	-177.2	49.4	0	0	0	0	113	G183	G183-T294 WeakPolarHBondContact CA-O 3.17Å; G183-T294 PolarHBondContact N-O 3Å
295	E	81.4	Confident	82.8	Confident	102 Å²	102	56.4 Å²	56.4	48%	0.477	30%	0.302	S	S	.	.			trans	-93.2	131.3	-175.2	-50.6	-177.8	-171.2	0	0	112.7	V182 N297 L298	V182-E295 WeakPolarHBondContact CG1-O 3.47Å; E295-N297 WeakPolarHBondContact CB-OD1 3.5Å; E295-N297 PolarHBondContact O-N 3.12Å; E295-N297 PolarHBondContact OE2-ND2 2.8Å; E295-N297 PolarHBondContact OE2-OD1 3.25Å; E295-L298 HydrophobicContact CB-CD1 4.16Å; E295-L298 HydrophobicContact CB-CG 4.31Å; E295-L298 PolarHBondContact O-N 3Å
296	L	75.8	Confident	82.7	Confident	50 Å²	50	56.4 Å²	56.4	26%	0.262	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-68.6	-30.9	-178.3	-75.5	158.7	0	0	0	114	G74 L77 V182 L298 Y299	G74-L296 VanDerWaalsContact CA-O 3.23Å; G74-L296 WeakPolarHBondContact CA-O 3.27Å; L77-L296 HydrophobicContact CD2-CD2 3.87Å; V182-L296 HydrophobicContact CG1-CB 4.48Å; V182-L296 HydrophobicContact CG1-CD2 3.9Å; V182-L296 HydrophobicContact CG1-CG 4.31Å; L296-L298 PolarHBondContact O-N 2.86Å; L296-Y299 WeakPolarHBondContact O-CB 3.46Å; L296-Y299 PolarHBondContact O-N 3.33Å
297	N	78	Confident	82.8	Confident	115 Å²	115	56.4 Å²	56.4	62%	0.615	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-59.7	-24.4	173.5	59.9	-11	0	0	0	112.9	E295 Y299	E295-N297 WeakPolarHBondContact CB-OD1 3.5Å; E295-N297 PolarHBondContact O-N 3.12Å; E295-N297 PolarHBondContact OE2-ND2 2.8Å; E295-N297 PolarHBondContact OE2-OD1 3.25Å; N297-Y299 VanDerWaalsContact C-N 3.25Å; N297-Y299 PolarHBondContact O-N 3.07Å
298	L	78.1	Confident	83.1	Confident	66 Å²	66	55.9 Å²	55.9	35%	0.346	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-84.3	6.5	179.1	-66.8	175.1	0	0	0	113.2	V293 E295 L296 D300 T301 V302	V293-L298 HydrophobicContact CG1-CB 3.6Å; V293-L298 HydrophobicContact CG1-CD1 4.01Å; V293-L298 HydrophobicContact CG1-CG 4.46Å; E295-L298 HydrophobicContact CB-CD1 4.16Å; E295-L298 HydrophobicContact CB-CG 4.31Å; E295-L298 PolarHBondContact O-N 3Å; L296-L298 PolarHBondContact O-N 2.86Å; L298-D300 VanDerWaalsContact C-N 3.28Å; L298-D300 PolarHBondContact O-N 3.01Å; L298-T301 WeakPolarHBondContact O-CA 3.43Å; L298-T301 VanDerWaalsContact O-CB 3.27Å; L298-T301 WeakPolarHBondContact O-CB 3.44Å; L298-T301 PolarHBondContact O-N 2.75Å; L298-V302 WeakPolarHBondContact O-CG2 3.27Å; L298-V302 PolarHBondContact O-N 3.01Å
299	Y	77.5	Confident	83.7	Confident	3 Å²	3	55.9 Å²	55.9	1%	0.012	30%	0.299	C	S	.	.	H	α-helix	trans	-44.3	-48.8	178.2	174.9	-108.2	0	0	0	113.4	I72 L77 E90 L187 L296 N297 T301 V302 K303	I72-Y299 HydrophobicContact CB-CE1 4.02Å; I72-Y299 HydrophobicContact CG2-CE1 3.84Å; I72-Y299 HydrophobicContact CG2-CE2 4.21Å; L77-Y299 HydrophobicContact CD1-CE2 4.15Å; L77-Y299 HydrophobicContact CD2-CD2 4.39Å; E90-Y299 PolarHBondContact OE2-OH 2.81Å; L187-Y299 HydrophobicContact CD1-CD2 3.83Å; L187-Y299 HydrophobicContact CD1-CE2 3.68Å; L187-Y299 HydrophobicContact CD2-CD2 4.3Å; L187-Y299 HydrophobicContact CD2-CE2 3.8Å; L187-Y299 HydrophobicContact CG-CE2 4.42Å; L296-Y299 WeakPolarHBondContact O-CB 3.46Å; L296-Y299 PolarHBondContact O-N 3.33Å; N297-Y299 VanDerWaalsContact C-N 3.25Å; N297-Y299 PolarHBondContact O-N 3.07Å; Y299-T301 VanDerWaalsContact C-N 3.27Å; Y299-T301 PolarHBondContact O-N 3.04Å; Y299-V302 WeakPolarHBondContact O-CB 3.45Å; Y299-V302 PolarHBondContact O-N 3.02Å; Y299-V302 VanDerWaalsContact O-N 3.13Å; Y299-K303 HydrophobicContact CE1-CD 4.48Å; Y299-K303 VanDerWaalsContact CZ-CE 3.49Å; Y299-K303 PolarHBondContact O-N 2.71Å
300	D	78.3	Confident	84.2	Confident	88 Å²	88	53.3 Å²	53.3	47%	0.471	27%	0.273	S	S	.	.	H	α-helix	trans	-67.2	-27	-179.9	-70.9	-36.2	0	0	0	113.3	L298 V302	L298-D300 VanDerWaalsContact C-N 3.28Å; L298-D300 PolarHBondContact O-N 3.01Å; D300-V302 VanDerWaalsContact C-N 3.33Å
301	T	80.7	Confident	84.8	Confident	54 Å²	54	52.4 Å²	52.4	33%	0.331	27%	0.266	S	S	.	.	H	α-helix	trans	-69.3	-37	174.8	-56.9	0	0	0	0	110.5	L298 Y299 K303 K304 W305	L298-T301 WeakPolarHBondContact O-CA 3.43Å; L298-T301 VanDerWaalsContact O-CB 3.27Å; L298-T301 WeakPolarHBondContact O-CB 3.44Å; L298-T301 PolarHBondContact O-N 2.75Å; Y299-T301 VanDerWaalsContact C-N 3.27Å; Y299-T301 PolarHBondContact O-N 3.04Å; T301-K303 VanDerWaalsContact C-N 3.29Å; T301-K303 PolarHBondContact O-N 2.63Å; T301-K304 VanDerWaalsContact O-CB 3.31Å; T301-K304 WeakPolarHBondContact O-CB 3.35Å; T301-K304 WeakPolarHBondContact O-CG 3.28Å; T301-K304 PolarHBondContact O-N 3.21Å; T301-W305 HydrophobicContact CG2-CH2 3.91Å; T301-W305 HydrophobicContact CG2-CZ3 3.83Å; T301-W305 WeakPolarHBondContact O-CZ3 3.16Å
302	V	82.1	Confident	85.5	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-66.1	-31.8	-179	-166.4	0	0	0	0	112.4	V180 V182 V293 L298 Y299 D300 K304 W305 Q306	V180-V302 HydrophobicContact CG1-CG1 3.25Å; V182-V302 HydrophobicContact CG2-CB 4.42Å; V182-V302 HydrophobicContact CG2-CG1 4.44Å; V182-V302 HydrophobicContact CG2-CG2 3.8Å; V293-V302 HydrophobicContact CB-CG2 3.87Å; V293-V302 HydrophobicContact CG1-CG2 3.86Å; V293-V302 HydrophobicContact CG2-CG2 3.78Å; L298-V302 WeakPolarHBondContact O-CG2 3.27Å; L298-V302 PolarHBondContact O-N 3.01Å; Y299-V302 WeakPolarHBondContact O-CB 3.45Å; Y299-V302 PolarHBondContact O-N 3.02Å; Y299-V302 VanDerWaalsContact O-N 3.13Å; D300-V302 VanDerWaalsContact C-N 3.33Å; V302-K304 PolarHBondContact O-N 3Å; V302-W305 HydrophobicContact CB-CZ2 4.07Å; V302-W305 HydrophobicContact CG1-CZ2 3.89Å; V302-W305 HydrophobicContact CG2-CZ2 4.12Å; V302-W305 PolarHBondContact O-N 3.38Å; V302-Q306 WeakPolarHBondContact O-CG 3.4Å
303	K	81.8	Confident	86.2	Confident	35 Å²	35	39.6 Å²	39.6	15%	0.152	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-56	-26.6	176.2	-62.7	-170.3	-179.5	-162.7	0	112.9	E90 E91 Y299 T301 W305 Q306 N330	E90-K303 IonicContact OE1-NZ 3.63Å; E90-K303 PolarHBondContact OE1-NZ 2.95Å; E90-K303 IonicContact OE2-NZ 2.67Å; E91-K303 WeakPolarHBondContact OE1-CE 2.98Å; E91-K303 IonicContact OE1-NZ 3.52Å; E91-K303 PolarHBondContact OE1-NZ 3.22Å; Y299-K303 HydrophobicContact CE1-CD 4.48Å; Y299-K303 VanDerWaalsContact CZ-CE 3.49Å; Y299-K303 PolarHBondContact O-N 2.71Å; T301-K303 VanDerWaalsContact C-N 3.29Å; T301-K303 PolarHBondContact O-N 2.63Å; K303-W305 PolarHBondContact O-N 2.98Å; K303-W305 VanDerWaalsContact O-N 3.16Å; K303-Q306 PolarHBondContact O-N 3.13Å; K303-N330 PolarHBondContact O-ND2 3.1Å
304	K	82.9	Confident	86.9	Confident	147 Å²	147	38.8 Å²	38.8	64%	0.639	20%	0.198	S	C	*	.	G	3₁₀ helix	trans	-65.6	-14.8	-177.9	-63.1	179.3	-179	176	0	114.4	T301 V302 N330	T301-K304 VanDerWaalsContact O-CB 3.31Å; T301-K304 WeakPolarHBondContact O-CB 3.35Å; T301-K304 WeakPolarHBondContact O-CG 3.28Å; T301-K304 PolarHBondContact O-N 3.21Å; V302-K304 PolarHBondContact O-N 3Å; K304-N330 WeakPolarHBondContact O-CB 3.28Å
305	W	86.3	Confident	87.6	Confident	34 Å²	34	33.4 Å²	33.4	13%	0.129	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-132.2	32.1	178.6	59.9	81	0	0	0	113	G286 Y287 P291 V293 T301 V302 K303	G286-W305 WeakPolarHBondContact CA-O 3.39Å; Y287-W305 HydrophobicContact CD1-CB 3.85Å; Y287-W305 HydrophobicContact CD1-CG 4.42Å; Y287-W305 HydrophobicContact CE1-CB 3.57Å; Y287-W305 AromaticContact CE1-CG 3.93Å; Y287-W305 HydrophobicContact CE1-CG 3.93Å; P291-W305 HydrophobicContact CG-CH2 4.31Å; P291-W305 HydrophobicContact CG-CZ2 4.05Å; V293-W305 HydrophobicContact CG2-CH2 4.11Å; V293-W305 HydrophobicContact CG2-CZ2 3.73Å; T301-W305 HydrophobicContact CG2-CH2 3.91Å; T301-W305 HydrophobicContact CG2-CZ3 3.83Å; T301-W305 WeakPolarHBondContact O-CZ3 3.16Å; V302-W305 HydrophobicContact CB-CZ2 4.07Å; V302-W305 HydrophobicContact CG1-CZ2 3.89Å; V302-W305 HydrophobicContact CG2-CZ2 4.12Å; V302-W305 PolarHBondContact O-N 3.38Å; K303-W305 PolarHBondContact O-N 2.98Å; K303-W305 VanDerWaalsContact O-N 3.16Å
306	Q	90.9	Very high	88.1	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	140.6	175	-72	175.5	-4.7	0	0	111.2	V180 R284 M285 V302 K303 N328	V180-Q306 HydrophobicContact CG2-CG 4.49Å; R284-Q306 HydrophobicContact CB-CB 4.33Å; R284-Q306 HydrophobicContact CB-CG 4.21Å; R284-Q306 VanDerWaalsContact NH1-OE1 3.13Å; R284-Q306 WeakPolarHBondContact O-CG 3.5Å; M285-Q306 CarbonylContact O-C 3.59Å; M285-Q306 WeakPolarHBondContact O-CA 3.48Å; V302-Q306 WeakPolarHBondContact O-CG 3.4Å; K303-Q306 PolarHBondContact O-N 3.13Å; Q306-N328 PolarHBondContact O-ND2 3.41Å; Q306-N328 VanDerWaalsContact O-ND2 3.15Å
307	N	93.7	Very high	88.8	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	136.8	171.1	-69.8	0.8	0	0	0	109.7	F173 R284 M285 Y309 N328 V329 N330 W331	F173-N307 WeakPolarHBondContact CE1-ND2 3.34Å; R284-N307 CarbonylContact C-O 3.59Å; R284-N307 WeakPolarHBondContact CA-O 3.26Å; R284-N307 PolarHBondContact N-O 2.86Å; R284-N307 VanDerWaalsContact N-O 3.14Å; M285-N307 PolarHBondContact N-O 3.18Å; M285-N307 PolarHBondContact O-N 2.93Å; N307-Y309 HydrophobicContact CB-CD1 4.23Å; N307-Y309 HydrophobicContact CB-CE1 4.14Å; N307-N328 CarbonylContact C-O 3.54Å; N307-N328 VanDerWaalsContact CA-O 3.25Å; N307-N328 WeakPolarHBondContact CA-O 3.27Å; N307-V329 VanDerWaalsContact OD1-CA 3.31Å; N307-V329 WeakPolarHBondContact OD1-CA 3.09Å; N307-N330 PolarHBondContact OD1-N 3.39Å; N307-W331 PolarHBondContact ND2-NE1 3.12Å; N307-W331 PolarHBondContact ND2-O 3.14Å; N307-W331 PolarHBondContact OD1-N 3.01Å; N307-W331 VanDerWaalsContact OD1-N 3.1Å; N307-W331 PolarHBondContact OD1-NE1 2.96Å
308	T	95.3	Very high	89.3	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	123.7	172.3	-59.1	0	0	0	0	110	W93 L96 W282 R284 A327 N328	W93-T308 HydrophobicContact CD2-CG2 4.3Å; W93-T308 HydrophobicContact CE3-CG2 3.81Å; W93-T308 HydrophobicContact CH2-CG2 3.96Å; W93-T308 WeakPolarHBondContact CH2-OG1 3.26Å; W93-T308 HydrophobicContact CZ2-CG2 4.39Å; W93-T308 HydrophobicContact CZ3-CG2 3.64Å; L96-T308 HydrophobicContact CD1-CG2 3.99Å; W282-T308 VanDerWaalsContact O-CA 3.25Å; W282-T308 WeakPolarHBondContact O-CA 3.27Å; R284-T308 PolarHBondContact N-OG1 3.3Å; T308-A327 HydrophobicContact CG2-CB 4.4Å; T308-A327 PolarHBondContact O-N 3.38Å; T308-N328 PolarHBondContact N-O 2.89Å; T308-N328 PolarHBondContact O-N 3.41Å
309	Y	96.6	Very high	90	Very high	1 Å²	1	27.8 Å²	27.8	0%	0.004	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	158.3	-179.8	54.6	-84.2	0	0	0	110.8	G140 A172 F173 Q177 W282 N307 N325 Y326	G140-Y309 WeakPolarHBondContact CA-OH 3.32Å; A172-Y309 HydrophobicContact CB-CD2 3.95Å; A172-Y309 HydrophobicContact CB-CE2 3.92Å; F173-Y309 HydrophobicContact CB-CD1 4.24Å; F173-Y309 HydrophobicContact CB-CD2 4.1Å; F173-Y309 HydrophobicContact CB-CE1 3.82Å; F173-Y309 HydrophobicContact CB-CE2 3.61Å; F173-Y309 HydrophobicContact CB-CG 4.41Å; F173-Y309 VanDerWaalsContact CB-CZ 3.5Å; F173-Y309 HydrophobicContact CD1-CE1 4.41Å; F173-Y309 HydrophobicContact CG-CE1 4.28Å; Q177-Y309 VanDerWaalsContact CD-OH 3.24Å; Q177-Y309 PolarHBondContact NE2-OH 3Å; Q177-Y309 PolarHBondContact OE1-OH 3.3Å; W282-Y309 HydrophobicContact CB-CD1 4.39Å; W282-Y309 HydrophobicContact CB-CD2 4.28Å; W282-Y309 HydrophobicContact CB-CE1 3.83Å; W282-Y309 HydrophobicContact CB-CE2 3.75Å; W282-Y309 VanDerWaalsContact CB-CZ 3.46Å; W282-Y309 HydrophobicContact CD2-CD2 4.22Å; W282-Y309 AromaticContact CD2-CE2 3.46Å; W282-Y309 HydrophobicContact CD2-CE2 3.46Å; W282-Y309 VanDerWaalsContact CD2-CE2 3.46Å; W282-Y309 AromaticContact CD2-CZ 3.9Å; W282-Y309 AromaticContact CE3-CD2 3.6Å; W282-Y309 HydrophobicContact CE3-CD2 3.6Å; W282-Y309 AromaticContact CE3-CE2 3.25Å; W282-Y309 HydrophobicContact CE3-CE2 3.25Å; W282-Y309 HydrophobicContact CG-CE1 4.46Å; W282-Y309 AromaticContact CG-CE2 3.69Å; W282-Y309 HydrophobicContact CG-CE2 3.69Å; W282-Y309 AromaticContact CG-CZ 3.61Å; W282-Y309 HydrophobicContact CZ3-CD2 4.25Å; W282-Y309 AromaticContact CZ3-CE2 3.97Å; W282-Y309 HydrophobicContact CZ3-CE2 3.97Å; W282-Y309 PolarHBondContact N-O 3.39Å; W282-Y309 PolarHBondContact O-N 3.32Å; N307-Y309 HydrophobicContact CB-CD1 4.23Å; N307-Y309 HydrophobicContact CB-CE1 4.14Å; Y309-N325 CarbonylContact C-O 3.43Å; Y309-N325 WeakPolarHBondContact CA-O 3.42Å; Y309-Y326 HydrophobicContact CG-CD1 4.21Å; Y309-Y326 HydrophobicContact CG-CE1 4.32Å
310	Q	97	Very high	90.9	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.005	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	143	-177.2	178.7	179.6	78.1	0	0	110.3	L96 Y97 I279 V280 T281 V312 F324 N325	L96-Q310 HydrophobicContact CD2-CB 3.76Å; Y97-Q310 PolarHBondContact O-NE2 2.77Å; I279-Q310 HydrophobicContact CG2-CG 3.96Å; V280-Q310 CarbonylContact O-C 3.47Å; V280-Q310 WeakPolarHBondContact O-CA 3.45Å; T281-Q310 HydrophobicContact CG2-CB 4.19Å; T281-Q310 WeakPolarHBondContact OG1-CG 3.36Å; T281-Q310 PolarHBondContact OG1-NE2 2.76Å; Q310-V312 HydrophobicContact CG-CG2 4.2Å; Q310-F324 CarbonylContact O-C 3.52Å; Q310-F324 WeakPolarHBondContact O-CA 3.27Å; Q310-N325 HydrophobicContact CB-CB 4.37Å; Q310-N325 PolarHBondContact N-O 2.74Å; Q310-N325 PolarHBondContact O-N 3.16Å; Q310-N325 PolarHBondContact OE1-ND2 3.01Å
311	M	97.1	Very high	91.7	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	134	170.1	-177.6	-172.1	64.9	0	0	109.2	I142 V170 A172 I279 V280 W282 I313 V322 M323 F324	I142-M311 HydrophobicContact CB-CE 4.16Å; I142-M311 HydrophobicContact CD1-CE 3.78Å; I142-M311 HydrophobicContact CD1-SD 4.45Å; I142-M311 HydrophobicContact CG1-CE 3.66Å; I142-M311 HydrophobicContact CG1-SD 4.13Å; I142-M311 HydrophobicContact CG2-CE 3.41Å; I142-M311 VanDerWaalsContact CG2-CE 3.41Å; V170-M311 HydrophobicContact CB-SD 4.12Å; V170-M311 HydrophobicContact CG1-SD 3.55Å; V170-M311 VanDerWaalsContact CG1-SD 3.55Å; A172-M311 HydrophobicContact CB-CB 4.1Å; A172-M311 HydrophobicContact CB-SD 4.48Å; I279-M311 WeakPolarHBondContact CA-O 3.12Å; V280-M311 HydrophobicContact CB-CE 4.2Å; V280-M311 HydrophobicContact CG2-CE 4.02Å; V280-M311 PolarHBondContact N-O 2.95Å; V280-M311 PolarHBondContact O-N 3.12Å; W282-M311 HydrophobicContact CH2-CB 4.39Å; W282-M311 HydrophobicContact CH2-CE 4.19Å; W282-M311 HydrophobicContact CZ3-CB 3.86Å; M311-I313 HydrophobicContact CE-CD1 3.9Å; M311-I313 HydrophobicContact CE-CG1 4.2Å; M311-I313 HydrophobicContact CG-CG1 4.31Å; M311-I313 HydrophobicContact SD-CD1 4.16Å; M311-I313 HydrophobicContact SD-CG1 4.32Å; M311-V322 HydrophobicContact CG-CG1 4Å; M311-V322 HydrophobicContact SD-CG1 4.44Å; M311-M323 CarbonylContact C-O 3.57Å; M311-M323 WeakPolarHBondContact CA-O 3.41Å; M311-F324 HydrophobicContact CB-CD1 4.05Å; M311-F324 HydrophobicContact CB-CE1 4.29Å; M311-F324 HydrophobicContact CG-CD1 3.81Å; M311-F324 HydrophobicContact CG-CE1 3.67Å; M311-F324 HydrophobicContact SD-CE1 3.87Å
312	V	97.3	Very high	92.4	Very high	2 Å²	2	21.1 Å²	21.1	1%	0.012	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	125.8	174	-179	0	0	0	0	108.8	Y97 I258 A277 L278 I279 Q310 V322 M323	Y97-V312 HydrophobicContact CD2-CG2 3.54Å; Y97-V312 HydrophobicContact CE2-CG2 3.83Å; I258-V312 HydrophobicContact CD1-CG1 4.14Å; I258-V312 HydrophobicContact CG2-CG1 4.28Å; A277-V312 HydrophobicContact CB-CG1 4.5Å; L278-V312 CarbonylContact O-C 3.57Å; L278-V312 WeakPolarHBondContact O-CA 3.43Å; I279-V312 HydrophobicContact CD1-CG2 4.49Å; I279-V312 HydrophobicContact CG1-CB 4.44Å; I279-V312 HydrophobicContact CG1-CG1 4.02Å; I279-V312 HydrophobicContact CG1-CG2 3.94Å; I279-V312 HydrophobicContact CG2-CG2 4.24Å; Q310-V312 HydrophobicContact CG-CG2 4.2Å; V312-V322 CarbonylContact O-C 3.58Å; V312-V322 WeakPolarHBondContact O-CA 3.18Å; V312-M323 HydrophobicContact CB-CB 4.28Å; V312-M323 PolarHBondContact N-O 3.46Å; V312-M323 PolarHBondContact O-N 3.34Å
313	I	96.9	Very high	93.1	Very high	2 Å²	2	21.2 Å²	21.2	1%	0.01	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	119.7	172.9	-51	-176.1	0	0	0	107.3	L124 I142 F144 A277 L278 M311 T320 Y321 V322	L124-I313 HydrophobicContact CD1-CG2 3.84Å; L124-I313 HydrophobicContact CG-CG2 4.47Å; I142-I313 HydrophobicContact CD1-CD1 3.21Å; I142-I313 HydrophobicContact CG1-CD1 4.34Å; F144-I313 HydrophobicContact CZ-CD1 4.23Å; A277-I313 CarbonylContact C-O 3.47Å; A277-I313 WeakPolarHBondContact CA-O 3.36Å; A277-I313 WeakPolarHBondContact CB-O 3.23Å; L278-I313 HydrophobicContact CB-CB 4.47Å; L278-I313 PolarHBondContact N-O 3.34Å; L278-I313 PolarHBondContact O-N 2.86Å; M311-I313 HydrophobicContact CE-CD1 3.9Å; M311-I313 HydrophobicContact CE-CG1 4.2Å; M311-I313 HydrophobicContact CG-CG1 4.31Å; M311-I313 HydrophobicContact SD-CD1 4.16Å; M311-I313 HydrophobicContact SD-CG1 4.32Å; I313-T320 HydrophobicContact CG2-CG2 3.53Å; I313-Y321 CarbonylContact C-O 3.56Å; I313-Y321 WeakPolarHBondContact CA-O 3.23Å; I313-V322 HydrophobicContact CD1-CG2 4.46Å; I313-V322 HydrophobicContact CG1-CG1 4.34Å; I313-V322 HydrophobicContact CG1-CG2 4.09Å; I313-V322 HydrophobicContact CG2-CG2 4.18Å
314	A	96.8	Very high	93.8	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.008	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	136.8	-179.1	0	0	0	0	0	110.1	I258 I262 F272 A274 Y276 A277 T320 Y321	I258-A314 HydrophobicContact CG2-CB 3.87Å; I262-A314 HydrophobicContact CD1-CB 3.74Å; F272-A314 HydrophobicContact CE1-CB 4.36Å; F272-A314 HydrophobicContact CZ-CB 4.16Å; A274-A314 HydrophobicContact CB-CB 3.98Å; Y276-A314 CarbonylContact O-C 3.58Å; Y276-A314 WeakPolarHBondContact O-CA 3.26Å; A277-A314 HydrophobicContact CB-CB 4.36Å; A314-T320 WeakPolarHBondContact O-CA 3.33Å; A314-Y321 PolarHBondContact N-O 3.07Å; A314-Y321 PolarHBondContact O-N 2.97Å
315	T	95.5	Very high	94.4	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	154.8	-177.5	-172.4	0	0	0	0	113	F122 D275 Y276 E317 R319 T320	F122-T315 HydrophobicContact CD2-CG2 3.74Å; F122-T315 HydrophobicContact CE2-CG2 3.55Å; D275-T315 PolarHBondContact N-O 3.27Å; D275-T315 VanDerWaalsContact N-O 3.08Å; Y276-T315 HydrophobicContact CD2-CG2 4.49Å; Y276-T315 PolarHBondContact N-O 3.45Å; Y276-T315 PolarHBondContact O-N 2.95Å; T315-E317 PolarHBondContact OG1-N 2.94Å; T315-R319 VanDerWaalsContact CA-O 3.23Å; T315-R319 WeakPolarHBondContact CA-O 3.25Å; T315-R319 WeakPolarHBondContact CB-O 3.39Å; T315-R319 PolarHBondContact OG1-O 3.47Å; T315-T320 PolarHBondContact OG1-OG1 3.1Å
316	D	91.9	Very high	94.7	Very high	22 Å²	22	11.1 Å²	11.1	12%	0.118	5%	0.052	C	C	.	.			trans	-112.7	22.9	168.2	63.9	1.4	0	0	0	111.1	F272 I318 R319	F272-D316 HydrophobicContact CD2-CB 4.47Å; F272-D316 HydrophobicContact CE2-CB 4.11Å; D316-I318 PolarHBondContact O-N 3.5Å; D316-I318 VanDerWaalsContact O-N 3.08Å; D316-I318 WeakPolarHBondContact OD1-CA 3.47Å; D316-I318 PolarHBondContact OD1-N 3.33Å; D316-R319 PolarHBondContact N-O 2.86Å; D316-R319 WeakPolarHBondContact OD1-CA 3.3Å; D316-R319 PolarHBondContact OD1-N 3.39Å; D316-R319 IonicContact OD1-NE 3.08Å; D316-R319 IonicContact OD2-CZ 3.57Å; D316-R319 IonicContact OD2-NE 3.97Å; D316-R319 PolarHBondContact OD2-NE 3.06Å; D316-R319 IonicContact OD2-NH2 3.69Å; D316-R319 PolarHBondContact OD2-NH2 3.42Å
317	E	91	Very high	94.8	Very high	47 Å²	47	11.8 Å²	11.8	22%	0.22	6%	0.058	C	C	.	.	S	Bend	trans	62.6	-1.9	-170.2	-51.1	-166.4	-179.2	0	0	116.8	F122 F123 P125 R130 Y276 T315	F122-E317 HydrophobicContact CB-CG 4.25Å; F122-E317 WeakPolarHBondContact CB-OE1 3.36Å; F123-E317 HydrophobicContact CB-CB 4.41Å; F123-E317 HydrophobicContact CB-CG 4.48Å; F123-E317 VanDerWaalsContact O-CA 3.3Å; F123-E317 WeakPolarHBondContact O-CA 3.18Å; F123-E317 WeakPolarHBondContact O-CG 3.44Å; P125-E317 WeakPolarHBondContact CG-O 3.45Å; R130-E317 IonicContact NH2-OE2 2.67Å; R130-E317 PolarHBondContact NH2-OE2 3.02Å; Y276-E317 HydrophobicContact CD2-CG 4.11Å; Y276-E317 HydrophobicContact CE2-CG 3.76Å; Y276-E317 WeakPolarHBondContact CE2-OE1 3.5Å; T315-E317 PolarHBondContact OG1-N 2.94Å
318	I	88.4	Confident	94.7	Very high	87 Å²	87	13.5 Å²	13.5	45%	0.446	7%	0.067	S	C	.	.	S	Bend	trans	-115.6	-42.1	179.2	-58.7	176.8	0	0	0	110.5	D316	D316-I318 PolarHBondContact O-N 3.5Å; D316-I318 VanDerWaalsContact O-N 3.08Å; D316-I318 WeakPolarHBondContact OD1-CA 3.47Å; D316-I318 PolarHBondContact OD1-N 3.33Å
319	R	91.8	Very high	94.5	Very high	59 Å²	59	13.7 Å²	13.7	22%	0.223	7%	0.068	C	C	.	.			trans	-120.9	145.5	179	-64.2	171.5	-70.1	-171.2	-4.3	108.9	G271 F272 T315 D316 Y321	G271-R319 VanDerWaalsContact C-NH1 3.34Å; G271-R319 PolarHBondContact O-NH1 2.86Å; G271-R319 VanDerWaalsContact O-NH1 3.14Å; G271-R319 PolarHBondContact O-NH2 3.28Å; F272-R319 HydrophobicContact CD2-CB 4.14Å; F272-R319 HydrophobicContact CE2-CB 4.34Å; T315-R319 VanDerWaalsContact CA-O 3.23Å; T315-R319 WeakPolarHBondContact CA-O 3.25Å; T315-R319 WeakPolarHBondContact CB-O 3.39Å; T315-R319 PolarHBondContact OG1-O 3.47Å; D316-R319 PolarHBondContact N-O 2.86Å; D316-R319 WeakPolarHBondContact OD1-CA 3.3Å; D316-R319 PolarHBondContact OD1-N 3.39Å; D316-R319 IonicContact OD1-NE 3.08Å; D316-R319 IonicContact OD2-CZ 3.57Å; D316-R319 IonicContact OD2-NE 3.97Å; D316-R319 PolarHBondContact OD2-NE 3.06Å; D316-R319 IonicContact OD2-NH2 3.69Å; D316-R319 PolarHBondContact OD2-NH2 3.42Å; R319-Y321 HydrophobicContact CB-CE2 4.14Å
320	T	95.6	Very high	94.2	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	131.8	179.8	-55	0	0	0	0	109.2	L124 P125 I313 A314 T315 R390 V391	L124-T320 HydrophobicContact CD2-CG2 4.14Å; L124-T320 HydrophobicContact CG-CG2 4.21Å; P125-T320 WeakPolarHBondContact CD-OG1 3.27Å; P125-T320 WeakPolarHBondContact O-CB 3.17Å; P125-T320 PolarHBondContact O-OG1 3.01Å; I313-T320 HydrophobicContact CG2-CG2 3.53Å; A314-T320 WeakPolarHBondContact O-CA 3.33Å; T315-T320 PolarHBondContact OG1-OG1 3.1Å; T320-R390 WeakPolarHBondContact O-CA 3.48Å; T320-V391 HydrophobicContact CG2-CG2 3.64Å; T320-V391 PolarHBondContact O-N 3.11Å
321	Y	96	Very high	93.9	Very high	4 Å²	4	16 Å²	16	2%	0.016	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	138.2	175.4	-66.2	-93.1	0	0	0	109.1	I262 M266 A269 F272 I313 A314 R319 L388 A389 R390	I262-Y321 HydrophobicContact CD1-CG 4.39Å; I262-Y321 HydrophobicContact CG2-CD1 3.68Å; I262-Y321 HydrophobicContact CG2-CD2 4.18Å; I262-Y321 HydrophobicContact CG2-CE1 3.97Å; I262-Y321 HydrophobicContact CG2-CE2 4.46Å; I262-Y321 HydrophobicContact CG2-CG 3.79Å; M266-Y321 HydrophobicContact SD-CD1 4.1Å; M266-Y321 HydrophobicContact SD-CE1 3.7Å; A269-Y321 HydrophobicContact CB-CE1 4.22Å; F272-Y321 HydrophobicContact CB-CE2 3.95Å; F272-Y321 AromaticContact CD1-CD2 3.81Å; F272-Y321 HydrophobicContact CD1-CD2 3.81Å; F272-Y321 AromaticContact CD1-CE2 3.72Å; F272-Y321 HydrophobicContact CD1-CE2 3.72Å; F272-Y321 AromaticContact CD2-CD2 3.93Å; F272-Y321 HydrophobicContact CD2-CD2 3.93Å; F272-Y321 AromaticContact CD2-CE2 3.52Å; F272-Y321 HydrophobicContact CD2-CE2 3.52Å; F272-Y321 AromaticContact CE1-CD2 3.66Å; F272-Y321 HydrophobicContact CE1-CD2 3.66Å; F272-Y321 HydrophobicContact CE1-CE2 4.05Å; F272-Y321 AromaticContact CE2-CD2 3.77Å; F272-Y321 HydrophobicContact CE2-CD2 3.77Å; F272-Y321 AromaticContact CE2-CE2 3.85Å; F272-Y321 HydrophobicContact CE2-CE2 3.85Å; F272-Y321 AromaticContact CG-CD2 3.93Å; F272-Y321 HydrophobicContact CG-CD2 3.93Å; F272-Y321 AromaticContact CG-CE2 3.43Å; F272-Y321 HydrophobicContact CG-CE2 3.43Å; F272-Y321 VanDerWaalsContact CG-CE2 3.43Å; F272-Y321 AromaticContact CZ-CD2 3.63Å; F272-Y321 HydrophobicContact CZ-CD2 3.63Å; F272-Y321 HydrophobicContact CZ-CE2 4.11Å; I313-Y321 CarbonylContact C-O 3.56Å; I313-Y321 WeakPolarHBondContact CA-O 3.23Å; A314-Y321 PolarHBondContact N-O 3.07Å; A314-Y321 PolarHBondContact O-N 2.97Å; R319-Y321 HydrophobicContact CB-CE2 4.14Å; Y321-L388 HydrophobicContact CD1-CD1 4.49Å; Y321-A389 CarbonylContact C-O 3.5Å; Y321-A389 WeakPolarHBondContact CA-O 3.49Å; Y321-R390 HydrophobicContact CD1-CB 3.9Å; Y321-R390 HydrophobicContact CD1-CG 4.36Å; Y321-R390 HydrophobicContact CE1-CB 3.76Å; Y321-R390 HydrophobicContact CE1-CG 4.02Å
322	V	96.2	Very high	93.5	Very high	1 Å²	1	16 Å²	16	1%	0.006	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	130.7	173	-177.8	0	0	0	0	108.9	V170 M311 V312 I313 F324 F353 L388 A389 V391	V170-V322 HydrophobicContact CG1-CG1 4.03Å; M311-V322 HydrophobicContact CG-CG1 4Å; M311-V322 HydrophobicContact SD-CG1 4.44Å; V312-V322 CarbonylContact O-C 3.58Å; V312-V322 WeakPolarHBondContact O-CA 3.18Å; I313-V322 HydrophobicContact CD1-CG2 4.46Å; I313-V322 HydrophobicContact CG1-CG1 4.34Å; I313-V322 HydrophobicContact CG1-CG2 4.09Å; I313-V322 HydrophobicContact CG2-CG2 4.18Å; V322-F324 HydrophobicContact CG1-CD1 4.43Å; V322-F324 HydrophobicContact CG1-CE1 3.91Å; V322-F324 HydrophobicContact CG1-CE2 4.35Å; V322-F324 HydrophobicContact CG1-CZ 3.88Å; V322-F353 HydrophobicContact CB-CE1 3.73Å; V322-F353 HydrophobicContact CB-CZ 4.16Å; V322-F353 HydrophobicContact CG1-CE1 3.8Å; V322-F353 HydrophobicContact CG1-CZ 4.29Å; V322-F353 HydrophobicContact CG2-CE1 3.96Å; V322-L388 CarbonylContact O-C 3.52Å; V322-L388 WeakPolarHBondContact O-CA 3.3Å; V322-A389 PolarHBondContact N-O 3.23Å; V322-A389 PolarHBondContact O-N 2.9Å; V322-V391 HydrophobicContact CB-CG1 4.41Å; V322-V391 HydrophobicContact CG2-CB 4.5Å; V322-V391 HydrophobicContact CG2-CG1 3.93Å; V322-V391 HydrophobicContact CG2-CG2 3.72Å
323	M	95.8	Very high	93.1	Very high	3 Å²	3	16 Å²	16	2%	0.015	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	127.8	175.8	-174.3	-171.1	-60.8	0	0	109.7	Y97 D261 I262 M311 V312 R386 W387 L388	Y97-M323 HydrophobicContact CE2-SD 3.83Å; D261-M323 HydrophobicContact CB-CE 4.08Å; I262-M323 HydrophobicContact CG1-CE 3.9Å; M311-M323 CarbonylContact C-O 3.57Å; M311-M323 WeakPolarHBondContact CA-O 3.41Å; V312-M323 HydrophobicContact CB-CB 4.28Å; V312-M323 PolarHBondContact N-O 3.46Å; V312-M323 PolarHBondContact O-N 3.34Å; M323-R386 HydrophobicContact CG-CG 3.92Å; M323-R386 HydrophobicContact SD-CG 4.05Å; M323-R386 PolarHBondContact SD-NE 3.46Å; M323-W387 CarbonylContact C-O 3.6Å; M323-W387 WeakPolarHBondContact CA-O 3.25Å; M323-L388 HydrophobicContact CB-CD1 4.25Å; M323-L388 HydrophobicContact CE-CD1 4.49Å
324	F	95.8	Very high	92.6	Very high	3 Å²	3	16.2 Å²	16.2	1%	0.013	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	131	168.3	-53.2	-65.7	0	0	0	109.5	V170 A172 Q310 M311 V322 Y326 F353 L364 R386 W387	V170-F324 HydrophobicContact CG1-CE1 3.77Å; V170-F324 HydrophobicContact CG1-CZ 3.56Å; A172-F324 VanDerWaalsContact CA-CE1 3.48Å; A172-F324 HydrophobicContact CB-CD1 3.74Å; A172-F324 HydrophobicContact CB-CE1 3.72Å; Q310-F324 CarbonylContact O-C 3.52Å; Q310-F324 WeakPolarHBondContact O-CA 3.27Å; M311-F324 HydrophobicContact CB-CD1 4.05Å; M311-F324 HydrophobicContact CB-CE1 4.29Å; M311-F324 HydrophobicContact CG-CD1 3.81Å; M311-F324 HydrophobicContact CG-CE1 3.67Å; M311-F324 HydrophobicContact SD-CE1 3.87Å; V322-F324 HydrophobicContact CG1-CD1 4.43Å; V322-F324 HydrophobicContact CG1-CE1 3.91Å; V322-F324 HydrophobicContact CG1-CE2 4.35Å; V322-F324 HydrophobicContact CG1-CZ 3.88Å; F324-Y326 HydrophobicContact CB-CD2 4.43Å; F324-Y326 HydrophobicContact CB-CE2 3.65Å; F324-F353 AromaticContact CE2-CE1 3.93Å; F324-F353 HydrophobicContact CE2-CE1 3.93Å; F324-F353 HydrophobicContact CE2-CE2 4.18Å; F324-F353 AromaticContact CE2-CZ 3.48Å; F324-F353 HydrophobicContact CE2-CZ 3.48Å; F324-F353 VanDerWaalsContact CE2-CZ 3.48Å; F324-F353 AromaticContact CZ-CE1 3.76Å; F324-F353 HydrophobicContact CZ-CE1 3.76Å; F324-F353 AromaticContact CZ-CZ 3.83Å; F324-F353 HydrophobicContact CZ-CZ 3.83Å; F324-L364 HydrophobicContact CD2-CD1 4.29Å; F324-L364 HydrophobicContact CD2-CD2 3.78Å; F324-L364 HydrophobicContact CE2-CD1 3.84Å; F324-L364 HydrophobicContact CE2-CD2 4.18Å; F324-R386 CarbonylContact O-C 3.6Å; F324-R386 VanDerWaalsContact O-CA 3.31Å; F324-R386 WeakPolarHBondContact O-CA 3.06Å; F324-W387 HydrophobicContact CB-CB 4.22Å; F324-W387 HydrophobicContact CD2-CB 4.26Å; F324-W387 PolarHBondContact N-O 3Å; F324-W387 PolarHBondContact O-N 3.32Å
325	N	95.5	Very high	92.1	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	109	173.6	-62.7	-47.7	0	0	0	108.7	L96 Y309 Q310 G385 R386	L96-N325 HydrophobicContact CD2-CB 3.54Å; L96-N325 VanDerWaalsContact CD2-O 3.29Å; L96-N325 WeakPolarHBondContact CD2-O 3.4Å; Y309-N325 CarbonylContact C-O 3.43Å; Y309-N325 WeakPolarHBondContact CA-O 3.42Å; Q310-N325 HydrophobicContact CB-CB 4.37Å; Q310-N325 PolarHBondContact N-O 2.74Å; Q310-N325 PolarHBondContact O-N 3.16Å; Q310-N325 PolarHBondContact OE1-ND2 3.01Å; N325-G385 CarbonylContact C-O 3.57Å; N325-G385 WeakPolarHBondContact CA-O 3.04Å; N325-R386 WeakPolarHBondContact OD1-CB 3.2Å; N325-R386 VanDerWaalsContact OD1-CG 3.27Å; N325-R386 WeakPolarHBondContact OD1-CG 3.38Å; N325-R386 PolarHBondContact OD1-NE 3.07Å
326	Y	94.5	Very high	91.4	Very high	1 Å²	1	25 Å²	25	0%	0.004	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	121	177.2	-60.1	-82.1	0	0	0	110.1	H95 A172 F173 Y309 F324 V329 V351 L375 G385 W387	H95-Y326 PolarHBondContact NE2-O 3.09Å; A172-Y326 VanDerWaalsContact O-CE1 3.31Å; A172-Y326 WeakPolarHBondContact O-CE1 3.02Å; A172-Y326 PolarHBondContact O-OH 3.28Å; F173-Y326 HydrophobicContact CD2-CE1 4.2Å; Y309-Y326 HydrophobicContact CG-CD1 4.21Å; Y309-Y326 HydrophobicContact CG-CE1 4.32Å; F324-Y326 HydrophobicContact CB-CD2 4.43Å; F324-Y326 HydrophobicContact CB-CE2 3.65Å; Y326-V329 HydrophobicContact CD1-CG2 4.01Å; Y326-V351 WeakPolarHBondContact OH-CG1 3.4Å; Y326-L375 HydrophobicContact CD2-CB 3.74Å; Y326-L375 HydrophobicContact CE1-CD1 4.3Å; Y326-L375 HydrophobicContact CE2-CB 3.95Å; Y326-L375 HydrophobicContact CE2-CD1 4.05Å; Y326-L375 HydrophobicContact CE2-CG 4.42Å; Y326-L375 HydrophobicContact CG-CB 4.08Å; Y326-G385 WeakPolarHBondContact CD2-O 2.88Å; Y326-G385 PolarHBondContact N-O 3.46Å; Y326-W387 AromaticContact CD2-CD1 3.58Å; Y326-W387 AromaticContact CD2-NE1 3.84Å; Y326-W387 AromaticContact CE2-CD1 3.53Å; Y326-W387 HydrophobicContact CE2-CG 4.35Å
327	A	91.7	Very high	90.9	Very high	14 Å²	14	24.4 Å²	24.4	12%	0.116	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	-41	178.7	0	0	0	0	0	112.5	W93 H95 L96 T308 V376	W93-A327 HydrophobicContact CB-CB 4.04Å; W93-A327 HydrophobicContact CD2-CB 4.05Å; W93-A327 HydrophobicContact CG-CB 3.64Å; H95-A327 WeakPolarHBondContact NE2-CA 3.44Å; L96-A327 HydrophobicContact CD1-CB 3.7Å; L96-A327 HydrophobicContact CD2-CB 4.07Å; L96-A327 HydrophobicContact CG-CB 3.96Å; T308-A327 HydrophobicContact CG2-CB 4.4Å; T308-A327 PolarHBondContact O-N 3.38Å; A327-V376 WeakPolarHBondContact O-CG1 3.46Å
328	N	91.7	Very high	90.5	Very high	35 Å²	35	24.8 Å²	24.8	19%	0.187	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	131.5	177.1	-175.5	23.5	0	0	0	110.1	W93 Q306 N307 T308 N330	W93-N328 HydrophobicContact CZ2-CB 4.38Å; Q306-N328 PolarHBondContact O-ND2 3.41Å; Q306-N328 VanDerWaalsContact O-ND2 3.15Å; N307-N328 CarbonylContact C-O 3.54Å; N307-N328 VanDerWaalsContact CA-O 3.25Å; N307-N328 WeakPolarHBondContact CA-O 3.27Å; T308-N328 PolarHBondContact N-O 2.89Å; T308-N328 PolarHBondContact O-N 3.41Å; N328-N330 PolarHBondContact ND2-ND2 3.43Å; N328-N330 VanDerWaalsContact ND2-ND2 3.14Å; N328-N330 PolarHBondContact OD1-ND2 2.03Å; N328-N330 PolarHBondContact OD1-OD1 3.46Å
329	V	91.2	Very high	90.3	Very high	5 Å²	5	20.9 Å²	20.9	3%	0.03	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	94	175.9	177	0	0	0	0	107.4	F173 N307 Y326 T332 Y373 V376	F173-V329 HydrophobicContact CE2-CG1 3.64Å; F173-V329 HydrophobicContact CE2-CG2 4.35Å; F173-V329 HydrophobicContact CZ-CG1 3.63Å; N307-V329 VanDerWaalsContact OD1-CA 3.31Å; N307-V329 WeakPolarHBondContact OD1-CA 3.09Å; Y326-V329 HydrophobicContact CD1-CG2 4.01Å; V329-T332 HydrophobicContact CG1-CG2 4.49Å; V329-Y373 WeakPolarHBondContact O-CB 3.49Å; V329-V376 HydrophobicContact CB-CG2 3.66Å; V329-V376 HydrophobicContact CG2-CG2 3.54Å
330	N	89.7	Confident	89.8	Confident	48 Å²	48	24.3 Å²	24.3	26%	0.257	15%	0.145	S	C	.	.			trans	-94.9	-29.7	-178	-77.7	-28.4	0	0	0	112.9	K303 K304 N307 N328 R343	K303-N330 PolarHBondContact O-ND2 3.1Å; K304-N330 WeakPolarHBondContact O-CB 3.28Å; N307-N330 PolarHBondContact OD1-N 3.39Å; N328-N330 PolarHBondContact ND2-ND2 3.43Å; N328-N330 VanDerWaalsContact ND2-ND2 3.14Å; N328-N330 PolarHBondContact OD1-ND2 2.03Å; N328-N330 PolarHBondContact OD1-OD1 3.46Å; N330-R343 VanDerWaalsContact O-CZ 3.3Å; N330-R343 PolarHBondContact O-NE 2.73Å; N330-R343 PolarHBondContact O-NH2 2.78Å
331	W	91	Very high	89.1	Confident	1 Å²	1	32 Å²	32	0%	0.004	18%	0.179	C	C	.	.			trans	-117.6	154.3	176.3	69.2	-93.2	0	0	0	110.8	F173 Q177 M285 Y287 N307 G342	F173-W331 HydrophobicContact CD1-CH2 4.27Å; F173-W331 HydrophobicContact CE1-CE3 4.44Å; F173-W331 AromaticContact CE1-CH2 3.91Å; F173-W331 HydrophobicContact CE1-CH2 3.91Å; F173-W331 HydrophobicContact CE1-CZ2 4.34Å; F173-W331 HydrophobicContact CE1-CZ3 4.01Å; F173-W331 WeakPolarHBondContact CZ-O 3.31Å; Q177-W331 HydrophobicContact CB-CH2 4.23Å; Q177-W331 HydrophobicContact CB-CZ2 4.01Å; Q177-W331 HydrophobicContact CG-CH2 3.61Å; Q177-W331 HydrophobicContact CG-CZ2 3.73Å; M285-W331 PolarHBondContact O-NE1 3.19Å; Y287-W331 VanDerWaalsContact CB-CD2 3.45Å; Y287-W331 VanDerWaalsContact CB-CE3 3.48Å; Y287-W331 HydrophobicContact CD1-CB 4.06Å; Y287-W331 HydrophobicContact CD1-CG 4.1Å; Y287-W331 HydrophobicContact CG-CG 4.45Å; N307-W331 PolarHBondContact ND2-NE1 3.12Å; N307-W331 PolarHBondContact ND2-O 3.14Å; N307-W331 PolarHBondContact OD1-N 3.01Å; N307-W331 VanDerWaalsContact OD1-N 3.1Å; N307-W331 PolarHBondContact OD1-NE1 2.96Å; W331-G342 CarbonylContact C-O 3.49Å; W331-G342 WeakPolarHBondContact CA-O 3.27Å; W331-G342 WeakPolarHBondContact CB-O 3.38Å
332	T	89.8	Confident	88.5	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.006	18%	0.178	C	C	.	.			trans	-130	-14.7	-176.7	55.8	0	0	0	0	114.3	V329 G342 S348 A349 G370 Y373	V329-T332 HydrophobicContact CG1-CG2 4.49Å; T332-G342 PolarHBondContact N-O 3.49Å; T332-S348 CarbonylContact O-C 3.45Å; T332-S348 WeakPolarHBondContact O-CA 3.4Å; T332-S348 WeakPolarHBondContact O-CB 3.39Å; T332-A349 PolarHBondContact O-N 2.83Å; T332-G370 WeakPolarHBondContact CG2-O 3.5Å; T332-G370 PolarHBondContact OG1-O 3.34Å; T332-Y373 HydrophobicContact CG2-CD1 4.21Å
333	S	88.7	Confident	87.9	Confident	3 Å²	3	37 Å²	37	2%	0.021	20%	0.198	C	C	.	.	S	Bend	trans	-145.7	150.8	-176.6	46.9	0	0	0	0	111	A339 G342 R343 G344 G345	S333-A339 WeakPolarHBondContact O-CB 3.48Å; S333-A339 WeakPolarHBondContact OG-CB 3.49Å; S333-G342 PolarHBondContact N-O 2.87Å; S333-G342 CarbonylContact O-C 3.59Å; S333-G342 VanDerWaalsContact O-C 3.22Å; S333-G342 WeakPolarHBondContact O-CA 3.03Å; S333-G342 PolarHBondContact OG-O 2.87Å; S333-R343 VanDerWaalsContact OG-C 3.27Å; S333-R343 VanDerWaalsContact OG-CA 3.3Å; S333-R343 WeakPolarHBondContact OG-CA 3.05Å; S333-G344 PolarHBondContact OG-N 2.91Å; S333-G345 PolarHBondContact OG-N 2.94Å; S333-G345 VanDerWaalsContact OG-N 3.07Å
334	S	87	Confident	87.2	Confident	5 Å²	5	40.3 Å²	40.3	4%	0.035	23%	0.232	C	C	.	.			trans	-90.1	166.8	178.9	76.2	0	0	0	0	112.7	E176 Q336 A337 G338 A339	E176-S334 VanDerWaalsContact OE2-CB 3.24Å; E176-S334 WeakPolarHBondContact OE2-CB 3.48Å; E176-S334 PolarHBondContact OE2-OG 2.96Å; S334-Q336 VanDerWaalsContact C-N 3.27Å; S334-Q336 PolarHBondContact O-N 3.49Å; S334-Q336 PolarHBondContact OG-N 3.48Å; S334-A337 WeakPolarHBondContact O-CB 3.17Å; S334-A337 PolarHBondContact O-N 3.39Å; S334-A337 PolarHBondContact OG-N 2.81Å; S334-G338 PolarHBondContact O-N 2.86Å; S334-A339 WeakPolarHBondContact O-CB 3.35Å; S334-A339 PolarHBondContact O-N 3.38Å
335	T	85.5	Confident	86.5	Confident	68 Å²	68	40.8 Å²	40.8	42%	0.417	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-31.9	175.8	-52.5	0	0	0	0	111.9	Y287 G288 A337 G338	Y287-T335 WeakPolarHBondContact CE2-OG1 3.33Å; G288-T335 WeakPolarHBondContact O-CB 3.25Å; G288-T335 PolarHBondContact O-N 2.79Å; G288-T335 PolarHBondContact O-OG1 2.94Å; T335-A337 VanDerWaalsContact C-N 3.32Å; T335-A337 PolarHBondContact O-N 3.3Å; T335-G338 WeakPolarHBondContact O-CA 3.43Å; T335-G338 PolarHBondContact O-N 2.83Å
336	Q	81.1	Confident	85.6	Confident	119 Å²	119	50.7 Å²	50.7	56%	0.556	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-34.3	174	-59.4	-169.3	22.2	0	0	112.2	E176 S334 G338	E176-Q336 VanDerWaalsContact CD-CD 3.47Å; E176-Q336 VanDerWaalsContact OE1-CD 3.23Å; E176-Q336 PolarHBondContact OE1-NE2 3.04Å; E176-Q336 VanDerWaalsContact OE2-CB 3.26Å; E176-Q336 WeakPolarHBondContact OE2-CB 3.38Å; E176-Q336 VanDerWaalsContact OE2-CD 3.24Å; E176-Q336 WeakPolarHBondContact OE2-CG 3.48Å; S334-Q336 VanDerWaalsContact C-N 3.27Å; S334-Q336 PolarHBondContact O-N 3.49Å; S334-Q336 PolarHBondContact OG-N 3.48Å; Q336-G338 PolarHBondContact O-N 3.13Å; Q336-G338 VanDerWaalsContact O-N 3.16Å
337	A	81.7	Confident	85	Confident	9 Å²	9	52.1 Å²	52.1	7%	0.074	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-4.7	169.3	0	0	0	0	0	112.6	S334 T335 G345 K346 Q347	S334-A337 WeakPolarHBondContact O-CB 3.17Å; S334-A337 PolarHBondContact O-N 3.39Å; S334-A337 PolarHBondContact OG-N 2.81Å; T335-A337 VanDerWaalsContact C-N 3.32Å; T335-A337 PolarHBondContact O-N 3.3Å; A337-G345 CarbonylContact O-C 3.57Å; A337-G345 VanDerWaalsContact O-CA 3.27Å; A337-G345 WeakPolarHBondContact O-CA 2.97Å; A337-K346 PolarHBondContact O-N 2.8Å; A337-Q347 WeakPolarHBondContact CB-O 3.31Å
338	G	82.3	Confident	84.8	Confident	54 Å²	54	51.8 Å²	51.8	56%	0.557	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.8	14.3	-179.4	0	0	0	0	0	114.3	S334 T335 Q336	S334-G338 PolarHBondContact O-N 2.86Å; T335-G338 WeakPolarHBondContact O-CA 3.43Å; T335-G338 PolarHBondContact O-N 2.83Å; Q336-G338 PolarHBondContact O-N 3.13Å; Q336-G338 VanDerWaalsContact O-N 3.16Å
339	A	83.8	Confident	84.7	Confident	5 Å²	5	50.2 Å²	50.2	4%	0.041	28%	0.276	C	S	.	.			trans	-74.2	139.5	180	0	0	0	0	0	112.4	S333 S334 R343	S333-A339 WeakPolarHBondContact O-CB 3.48Å; S333-A339 WeakPolarHBondContact OG-CB 3.49Å; S334-A339 WeakPolarHBondContact O-CB 3.35Å; S334-A339 PolarHBondContact O-N 3.38Å; A339-R343 WeakPolarHBondContact CA-O 3.17Å; A339-R343 WeakPolarHBondContact CB-O 3.46Å
340	L	80.7	Confident	84.6	Confident	132 Å²	132	50.5 Å²	50.5	69%	0.691	28%	0.277	S	S	*	.	B	Isolated β-bridge	trans	-100.3	124.3	168.6	-161.2	77.8	0	0	0	108.2	G342 R343	L340-G342 PolarHBondContact O-N 3Å; L340-R343 PolarHBondContact N-O 2.82Å; L340-R343 VanDerWaalsContact N-O 3.14Å; L340-R343 PolarHBondContact O-N 3.07Å
341	F	81.2	Confident	84.7	Confident	162 Å²	162	48.2 Å²	48.2	71%	0.711	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	31	-175.2	-51.5	-72.6	0	0	0	114.7
342	G	83	Confident	84.8	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.2	6.8	175.5	0	0	0	0	0	115.7	W331 T332 S333 L340	W331-G342 CarbonylContact C-O 3.49Å; W331-G342 WeakPolarHBondContact CA-O 3.27Å; W331-G342 WeakPolarHBondContact CB-O 3.38Å; T332-G342 PolarHBondContact N-O 3.49Å; S333-G342 PolarHBondContact N-O 2.87Å; S333-G342 CarbonylContact O-C 3.59Å; S333-G342 VanDerWaalsContact O-C 3.22Å; S333-G342 WeakPolarHBondContact O-CA 3.03Å; S333-G342 PolarHBondContact OG-O 2.87Å; L340-G342 PolarHBondContact O-N 3Å
343	R	85.4	Confident	85	Confident	110 Å²	110	48.1 Å²	48.1	42%	0.415	27%	0.265	S	S	.	.	B	Isolated β-bridge	trans	-132	156.1	176.8	-64.6	-172.8	-179.2	-162.5	-1.7	112.3	N330 S333 A339 L340	N330-R343 VanDerWaalsContact O-CZ 3.3Å; N330-R343 PolarHBondContact O-NE 2.73Å; N330-R343 PolarHBondContact O-NH2 2.78Å; S333-R343 VanDerWaalsContact OG-C 3.27Å; S333-R343 VanDerWaalsContact OG-CA 3.3Å; S333-R343 WeakPolarHBondContact OG-CA 3.05Å; A339-R343 WeakPolarHBondContact CA-O 3.17Å; A339-R343 WeakPolarHBondContact CB-O 3.46Å; L340-R343 PolarHBondContact N-O 2.82Å; L340-R343 VanDerWaalsContact N-O 3.14Å; L340-R343 PolarHBondContact O-N 3.07Å
344	G	80.7	Confident	85.1	Confident	71 Å²	71	48 Å²	48	73%	0.732	26%	0.264	S	S	*	.			trans	78.7	17.9	172.2	0	0	0	0	0	115.7	S333	S333-G344 PolarHBondContact OG-N 2.91Å
345	G	80.1	Confident	85	Confident	13 Å²	13	47.8 Å²	47.8	13%	0.134	26%	0.262	C	S	.	.			trans	-66.5	160.7	172.1	0	0	0	0	0	113	S333 A337 Q347	S333-G345 PolarHBondContact OG-N 2.94Å; S333-G345 VanDerWaalsContact OG-N 3.07Å; A337-G345 CarbonylContact O-C 3.57Å; A337-G345 VanDerWaalsContact O-CA 3.27Å; A337-G345 WeakPolarHBondContact O-CA 2.97Å; G345-Q347 PolarHBondContact O-N 2.79Å
346	K	78	Confident	84.8	Confident	208 Å²	208	44.5 Å²	44.5	90%	0.904	24%	0.242	S	C	*	.	S	Bend	trans	-55.9	-28.3	175.4	-68	-176.2	179	178.7	0	113.2	A337	A337-K346 PolarHBondContact O-N 2.8Å
347	Q	81.2	Confident	84.6	Confident	31 Å²	31	41.4 Å²	41.4	15%	0.145	23%	0.23	C	C	.	.	S	Bend	trans	-138.6	135	171.4	-164	-168.6	39.6	0	0	109.9	P153 Y154 A337 G345	P153-Q347 HydrophobicContact CB-CB 4.39Å; Y154-Q347 VanDerWaalsContact CD2-OE1 3.32Å; Y154-Q347 VanDerWaalsContact N-CD 3.33Å; Y154-Q347 VanDerWaalsContact N-NE2 3.17Å; Y154-Q347 PolarHBondContact O-NE2 3.49Å; A337-Q347 WeakPolarHBondContact CB-O 3.31Å; G345-Q347 PolarHBondContact O-N 2.79Å
348	S	87.9	Confident	84.1	Confident	8 Å²	8	42 Å²	42	6%	0.056	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-99.4	169	173.9	-59.4	0	0	0	0	111.8	T332 G370	T332-S348 CarbonylContact O-C 3.45Å; T332-S348 WeakPolarHBondContact O-CA 3.4Å; T332-S348 WeakPolarHBondContact O-CB 3.39Å; S348-G370 VanDerWaalsContact CB-CA 3.42Å; S348-G370 VanDerWaalsContact CB-N 3.27Å; S348-G370 WeakPolarHBondContact OG-CA 3.37Å; S348-G370 PolarHBondContact OG-N 2.78Å; S348-G370 VanDerWaalsContact OG-N 3.16Å
349	A	88.9	Confident	83.7	Confident	2 Å²	2	41.3 Å²	41.3	2%	0.017	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-54.1	139.8	-178.3	0	0	0	0	0	112.6	F173 M174 T332 A368	F173-A349 HydrophobicContact CD1-CB 3.65Å; F173-A349 HydrophobicContact CD2-CB 4.29Å; F173-A349 HydrophobicContact CE1-CB 3.41Å; F173-A349 VanDerWaalsContact CE1-CB 3.41Å; F173-A349 HydrophobicContact CE2-CB 4.1Å; F173-A349 HydrophobicContact CG-CB 4.09Å; F173-A349 HydrophobicContact CZ-CB 3.66Å; M174-A349 CarbonylContact O-C 3.53Å; M174-A349 WeakPolarHBondContact O-CA 3.5Å; M174-A349 WeakPolarHBondContact O-CB 3.49Å; T332-A349 PolarHBondContact O-N 2.83Å; A349-A368 PolarHBondContact O-N 2.81Å
350	L	89.9	Confident	83.5	Confident	10 Å²	10	41.9 Å²	41.9	5%	0.052	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	138.9	174.2	-72.2	176.9	0	0	0	110.6	Y154 M156 M174 W361 A368	Y154-L350 VanDerWaalsContact CB-CD1 3.41Å; Y154-L350 HydrophobicContact CD2-CD1 4.49Å; Y154-L350 HydrophobicContact CG-CD1 4.29Å; M156-L350 HydrophobicContact CG-CD1 4.42Å; M174-L350 HydrophobicContact CB-CB 4.16Å; M174-L350 PolarHBondContact N-O 2.79Å; M174-L350 PolarHBondContact O-N 2.65Å; M174-L350 HydrophobicContact SD-CD1 4.44Å; L350-W361 HydrophobicContact CB-CH2 4.21Å; L350-W361 HydrophobicContact CB-CZ2 4.06Å; L350-W361 HydrophobicContact CD2-CZ2 4.27Å; L350-A368 HydrophobicContact CD2-CB 3.79Å
351	V	91.8	Very high	83.9	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	122.6	177.6	-173.8	0	0	0	0	108.5	A171 F173 Y326 W361 S363 L364 S367 L375	A171-V351 WeakPolarHBondContact O-CA 3.34Å; F173-V351 HydrophobicContact CD2-CG2 4.05Å; Y326-V351 WeakPolarHBondContact OH-CG1 3.4Å; V351-W361 WeakPolarHBondContact O-CZ2 3.46Å; V351-S363 WeakPolarHBondContact O-CA 3.39Å; V351-L364 HydrophobicContact CB-CB 4.22Å; V351-L364 HydrophobicContact CG1-CB 3.77Å; V351-L364 HydrophobicContact CG1-CD1 4.17Å; V351-L364 HydrophobicContact CG1-CD2 3.84Å; V351-L364 HydrophobicContact CG1-CG 4.13Å; V351-L364 PolarHBondContact O-N 3.16Å; V351-S367 PolarHBondContact N-OG 3.07Å; V351-S367 WeakPolarHBondContact O-CB 3.45Å; V351-S367 PolarHBondContact O-OG 2.87Å; V351-L375 HydrophobicContact CB-CD1 4.3Å; V351-L375 HydrophobicContact CG1-CD1 4.13Å; V351-L375 HydrophobicContact CG2-CD1 3.82Å
352	G	92.7	Very high	84.3	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	152.3	-161.6	-174.6	0	0	0	0	0	114.5	A171 W361 Y362	A171-G352 PolarHBondContact N-O 2.9Å; A171-G352 PolarHBondContact O-N 2.67Å; G352-W361 VanDerWaalsContact C-CH2 3.47Å; G352-Y362 CarbonylContact C-O 3.58Å; G352-Y362 WeakPolarHBondContact CA-O 3.41Å
353	F	93.7	Very high	84.6	Confident	1 Å²	1	34.1 Å²	34.1	0%	0.004	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	132.8	-174.6	-48.7	-84.2	0	0	0	109.8	F126 V170 V322 F324 W361 Y362 L364 A389 V391 I395 Y397	F126-F353 HydrophobicContact CE2-CD1 4.27Å; F126-F353 HydrophobicContact CZ-CB 4.32Å; V170-F353 HydrophobicContact CB-CD1 4.38Å; V170-F353 HydrophobicContact CG1-CD1 3.77Å; V170-F353 HydrophobicContact CG1-CE1 3.73Å; V170-F353 HydrophobicContact CG2-CD1 4.08Å; V322-F353 HydrophobicContact CB-CE1 3.73Å; V322-F353 HydrophobicContact CB-CZ 4.16Å; V322-F353 HydrophobicContact CG1-CE1 3.8Å; V322-F353 HydrophobicContact CG1-CZ 4.29Å; V322-F353 HydrophobicContact CG2-CE1 3.96Å; F324-F353 AromaticContact CE2-CE1 3.93Å; F324-F353 HydrophobicContact CE2-CE1 3.93Å; F324-F353 HydrophobicContact CE2-CE2 4.18Å; F324-F353 AromaticContact CE2-CZ 3.48Å; F324-F353 HydrophobicContact CE2-CZ 3.48Å; F324-F353 VanDerWaalsContact CE2-CZ 3.48Å; F324-F353 AromaticContact CZ-CE1 3.76Å; F324-F353 HydrophobicContact CZ-CE1 3.76Å; F324-F353 AromaticContact CZ-CZ 3.83Å; F324-F353 HydrophobicContact CZ-CZ 3.83Å; F353-W361 VanDerWaalsContact C-CE3 3.43Å; F353-W361 WeakPolarHBondContact O-CA 3.44Å; F353-W361 VanDerWaalsContact O-CE3 3.22Å; F353-Y362 PolarHBondContact N-O 2.76Å; F353-Y362 PolarHBondContact O-N 2.95Å; F353-L364 HydrophobicContact CE2-CD1 3.92Å; F353-A389 HydrophobicContact CE2-CB 3.69Å; F353-A389 HydrophobicContact CZ-CB 3.6Å; F353-V391 HydrophobicContact CD1-CG1 3.99Å; F353-V391 HydrophobicContact CE1-CG1 3.85Å; F353-V391 HydrophobicContact CG-CG1 4.49Å; F353-V391 HydrophobicContact CZ-CG1 4.23Å; F353-I395 HydrophobicContact CB-CD1 3.56Å; F353-I395 HydrophobicContact CB-CG1 4.38Å; F353-I395 HydrophobicContact CD2-CG2 3.78Å; F353-I395 HydrophobicContact CE2-CG2 4.19Å; F353-I395 HydrophobicContact CG-CD1 4.21Å; F353-I395 HydrophobicContact CG-CG2 4.46Å; F353-Y397 HydrophobicContact CE2-CE1 4.1Å
354	N	90.8	Very high	84.8	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	120.4	167.3	-165.4	31.4	0	0	0	108.6	F126 M156 D166 S167 S168 L169 G356 G360 W361	F126-N354 VanDerWaalsContact CE1-O 3.25Å; F126-N354 WeakPolarHBondContact CE1-O 3.3Å; M156-N354 HydrophobicContact SD-CB 4.32Å; M156-N354 PolarHBondContact SD-ND2 2.92Å; D166-N354 PolarHBondContact OD1-ND2 3.03Å; D166-N354 PolarHBondContact OD2-ND2 2.82Å; S167-N354 PolarHBondContact O-ND2 3.18Å; S168-N354 WeakPolarHBondContact CA-O 3.31Å; L169-N354 HydrophobicContact CD1-CB 4.13Å; L169-N354 HydrophobicContact CG-CB 3.91Å; L169-N354 PolarHBondContact N-O 3.15Å; L169-N354 VanDerWaalsContact N-O 3.07Å; L169-N354 PolarHBondContact O-N 2.93Å; N354-G356 PolarHBondContact O-N 3Å; N354-G360 PolarHBondContact OD1-O 3.32Å; N354-G360 VanDerWaalsContact OD1-O 3.11Å; N354-W361 HydrophobicContact CB-CE3 3.87Å; N354-W361 HydrophobicContact CB-CZ3 4.23Å
355	G	84.6	Confident	84.9	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.144	C	C	.	.			trans	-66.6	-22.7	178.8	0	0	0	0	0	113.1	S168 T359 G360	S168-G355 PolarHBondContact OG-O 3.45Å; G355-T359 VanDerWaalsContact C-OG1 3.23Å; G355-T359 VanDerWaalsContact CA-OG1 3.23Å; G355-T359 WeakPolarHBondContact CA-OG1 3.06Å; G355-G360 PolarHBondContact N-O 2.95Å; G355-G360 VanDerWaalsContact N-O 3.13Å
356	G	82.3	Confident	85.3	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.147	C	C	.	.	S	Bend	trans	83.1	166.9	-178.8	0	0	0	0	0	113.2	D166 N354 G358 T359	D166-G356 CarbonylContact O-C 3.47Å; D166-G356 WeakPolarHBondContact O-CA 3.29Å; D166-G356 WeakPolarHBondContact OD2-CA 3.35Å; N354-G356 PolarHBondContact O-N 3Å; G356-G358 PolarHBondContact O-N 2.82Å; G356-T359 PolarHBondContact N-OG1 2.94Å; G356-T359 WeakPolarHBondContact O-CB 3.38Å; G356-T359 WeakPolarHBondContact O-CG2 3.3Å; G356-T359 PolarHBondContact O-N 2.56Å; G356-T359 VanDerWaalsContact O-N 3.17Å; G356-T359 PolarHBondContact O-OG1 3.49Å
357	N	75.5	Confident	85.8	Confident	54 Å²	54	19.7 Å²	19.7	29%	0.289	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	39.4	-177.6	-66.8	-46	0	0	0	114.7	W161 D166 T359 K887	W161-N357 VanDerWaalsContact CE2-C 3.46Å; W161-N357 HydrophobicContact CZ2-CB 4.44Å; W161-N357 VanDerWaalsContact CZ2-O 3.28Å; W161-N357 WeakPolarHBondContact CZ2-O 3.16Å; D166-N357 PolarHBondContact O-N 2.7Å; D166-N357 PolarHBondContact OD2-N 3.26Å; N357-T359 VanDerWaalsContact C-N 3.3Å; N357-T359 PolarHBondContact O-N 2.84Å; N357-K887 PolarHBondContact O-NZ 2.81Å
358	G	72.1	Confident	86	Confident	21 Å²	21	20.2 Å²	20.2	22%	0.216	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.7	12.6	176.3	0	0	0	0	0	114.4	D166 G356 G360	D166-G358 WeakPolarHBondContact OD2-CA 3.31Å; D166-G358 PolarHBondContact OD2-N 3.18Å; G356-G358 PolarHBondContact O-N 2.82Å; G358-G360 VanDerWaalsContact C-N 3.33Å; G358-G360 PolarHBondContact O-N 3.1Å
359	T	74.1	Confident	85.9	Confident	39 Å²	39	24.6 Å²	24.6	24%	0.239	14%	0.142	C	C	.	.	S	Bend	trans	-78.7	-14.5	-174.7	62.5	0	0	0	0	114.5	Y127 G355 G356 N357	Y127-T359 HydrophobicContact CD1-CG2 4.36Å; Y127-T359 VanDerWaalsContact CE1-CB 3.46Å; Y127-T359 HydrophobicContact CE1-CG2 4.02Å; Y127-T359 WeakPolarHBondContact CE1-OG1 3.47Å; G355-T359 VanDerWaalsContact C-OG1 3.23Å; G355-T359 VanDerWaalsContact CA-OG1 3.23Å; G355-T359 WeakPolarHBondContact CA-OG1 3.06Å; G356-T359 PolarHBondContact N-OG1 2.94Å; G356-T359 WeakPolarHBondContact O-CB 3.38Å; G356-T359 WeakPolarHBondContact O-CG2 3.3Å; G356-T359 PolarHBondContact O-N 2.56Å; G356-T359 VanDerWaalsContact O-N 3.17Å; G356-T359 PolarHBondContact O-OG1 3.49Å; N357-T359 VanDerWaalsContact C-N 3.3Å; N357-T359 PolarHBondContact O-N 2.84Å
360	G	80	Confident	85.6	Confident	17 Å²	17	25.3 Å²	25.3	18%	0.175	15%	0.15	C	C	.	.			trans	119.7	160.7	172.4	0	0	0	0	0	115.2	N354 G355 G358	N354-G360 PolarHBondContact OD1-O 3.32Å; N354-G360 VanDerWaalsContact OD1-O 3.11Å; G355-G360 PolarHBondContact N-O 2.95Å; G355-G360 VanDerWaalsContact N-O 3.13Å; G358-G360 VanDerWaalsContact C-N 3.33Å; G358-G360 PolarHBondContact O-N 3.1Å
361	W	87.5	Confident	85.5	Confident	50 Å²	50	27 Å²	27	19%	0.189	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	134.2	179.8	170.9	-106.8	0	0	0	111	M156 L169 A171 L350 V351 G352 F353 N354	M156-W361 HydrophobicContact CB-CB 4.07Å; M156-W361 HydrophobicContact CB-CD2 3.9Å; M156-W361 HydrophobicContact CB-CE3 3.78Å; M156-W361 HydrophobicContact CB-CG 4.03Å; M156-W361 HydrophobicContact CG-CE3 4.27Å; L169-W361 HydrophobicContact CD1-CZ3 4.13Å; A171-W361 HydrophobicContact CB-CH2 3.82Å; A171-W361 HydrophobicContact CB-CZ3 4.39Å; L350-W361 HydrophobicContact CB-CH2 4.21Å; L350-W361 HydrophobicContact CB-CZ2 4.06Å; L350-W361 HydrophobicContact CD2-CZ2 4.27Å; V351-W361 WeakPolarHBondContact O-CZ2 3.46Å; G352-W361 VanDerWaalsContact C-CH2 3.47Å; F353-W361 VanDerWaalsContact C-CE3 3.43Å; F353-W361 WeakPolarHBondContact O-CA 3.44Å; F353-W361 VanDerWaalsContact O-CE3 3.22Å; N354-W361 HydrophobicContact CB-CE3 3.87Å; N354-W361 HydrophobicContact CB-CZ3 4.23Å
362	Y	89.9	Confident	85.3	Confident	48 Å²	48	27 Å²	27	19%	0.188	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	93.4	-177.2	-64.9	-96.9	0	0	0	109.3	Y127 G352 F353 I395 Y397	Y127-Y362 HydrophobicContact CD2-CE2 4.42Å; Y127-Y362 AromaticContact CE2-CE2 3.57Å; Y127-Y362 HydrophobicContact CE2-CE2 3.57Å; Y127-Y362 AromaticContact CE2-CZ 3.7Å; Y127-Y362 WeakPolarHBondContact CE2-OH 3.3Å; Y127-Y362 AromaticContact CZ-CE2 3.89Å; Y127-Y362 PolarHBondContact OH-OH 2.97Å; G352-Y362 CarbonylContact C-O 3.58Å; G352-Y362 WeakPolarHBondContact CA-O 3.41Å; F353-Y362 PolarHBondContact N-O 2.76Å; F353-Y362 PolarHBondContact O-N 2.95Å; Y362-I395 HydrophobicContact CD1-CB 3.95Å; Y362-I395 HydrophobicContact CD1-CD1 4.22Å; Y362-I395 HydrophobicContact CD1-CG2 4.17Å; Y362-I395 HydrophobicContact CD2-CB 4.46Å; Y362-I395 HydrophobicContact CD2-CD1 3.19Å; Y362-I395 HydrophobicContact CD2-CG1 4.39Å; Y362-I395 HydrophobicContact CE1-CB 4.27Å; Y362-I395 HydrophobicContact CE2-CD1 3.64Å; Y362-I395 HydrophobicContact CG-CB 4.05Å; Y362-I395 HydrophobicContact CG-CD1 3.53Å; Y362-I395 HydrophobicContact CG-CG1 4.4Å; Y362-I395 HydrophobicContact CG-CG2 4.16Å; Y362-Y397 WeakPolarHBondContact CB-OH 3.33Å; Y362-Y397 PolarHBondContact O-OH 3.07Å
363	S	90.3	Very high	85	Confident	34 Å²	34	29.9 Å²	29.9	24%	0.238	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	142.4	-176.1	51.5	0	0	0	0	113.5	V351 Y397	V351-S363 WeakPolarHBondContact O-CA 3.39Å; S363-Y397 PolarHBondContact O-OH 3.07Å
364	L	88.9	Confident	84.7	Confident	6 Å²	6	32.5 Å²	32.5	3%	0.031	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-74.5	162.3	160.4	-87.3	74.1	0	0	0	111	F324 V351 F353 S367 L375 W387 Y397	F324-L364 HydrophobicContact CD2-CD1 4.29Å; F324-L364 HydrophobicContact CD2-CD2 3.78Å; F324-L364 HydrophobicContact CE2-CD1 3.84Å; F324-L364 HydrophobicContact CE2-CD2 4.18Å; V351-L364 HydrophobicContact CB-CB 4.22Å; V351-L364 HydrophobicContact CG1-CB 3.77Å; V351-L364 HydrophobicContact CG1-CD1 4.17Å; V351-L364 HydrophobicContact CG1-CD2 3.84Å; V351-L364 HydrophobicContact CG1-CG 4.13Å; V351-L364 PolarHBondContact O-N 3.16Å; F353-L364 HydrophobicContact CE2-CD1 3.92Å; L364-S367 WeakPolarHBondContact O-CB 3.48Å; L364-S367 PolarHBondContact O-N 2.9Å; L364-L375 HydrophobicContact CD2-CD2 4.49Å; L364-W387 HydrophobicContact CD2-CB 3.73Å; L364-W387 HydrophobicContact CD2-CD2 3.87Å; L364-W387 HydrophobicContact CD2-CE3 4.02Å; L364-W387 HydrophobicContact CD2-CG 3.74Å; L364-Y397 HydrophobicContact CD1-CE1 3.91Å; L364-Y397 HydrophobicContact CG-CE1 4.3Å
365	P	83.8	Confident	84.6	Confident	21 Å²	21	32.5 Å²	32.5	14%	0.136	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	141.6	174.1	-27	37.8	0	0	0	112.4	F43 P45 S367 L375 W387	F43-P365 HydrophobicContact CD1-CG 4.06Å; F43-P365 WeakPolarHBondContact O-CG 3.43Å; P45-P365 HydrophobicContact CG-CB 4.38Å; P45-P365 HydrophobicContact CG-CG 4.49Å; P365-S367 PolarHBondContact O-N 3.43Å; P365-S367 VanDerWaalsContact O-N 3.14Å; P365-L375 WeakPolarHBondContact O-CD2 3.43Å; P365-W387 HydrophobicContact CB-CH2 4.29Å; P365-W387 HydrophobicContact CG-CH2 3.87Å; P365-W387 HydrophobicContact CG-CZ3 3.75Å
366	W	87.2	Confident	84.8	Confident	53 Å²	53	34.1 Å²	34.1	20%	0.201	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.6	11.8	-177.6	-44.6	-69.9	0	0	0	116.3	P45 N371 S372 K374 L375 Y378 W387	P45-W366 HydrophobicContact CB-CH2 4.2Å; P45-W366 HydrophobicContact CG-CH2 3.11Å; P45-W366 HydrophobicContact CG-CZ2 3.71Å; P45-W366 HydrophobicContact CG-CZ3 3.73Å; W366-N371 HydrophobicContact CB-CB 4.02Å; W366-N371 HydrophobicContact CG-CB 3.99Å; W366-S372 PolarHBondContact O-OG 3.27Å; W366-K374 HydrophobicContact CD2-CB 3.75Å; W366-K374 HydrophobicContact CD2-CD 4.15Å; W366-K374 HydrophobicContact CE3-CB 3.73Å; W366-K374 HydrophobicContact CG-CB 4.41Å; W366-K374 HydrophobicContact CG-CD 4.41Å; W366-K374 HydrophobicContact CH2-CB 3.9Å; W366-K374 HydrophobicContact CZ2-CB 3.97Å; W366-K374 HydrophobicContact CZ2-CD 3.91Å; W366-K374 HydrophobicContact CZ3-CB 3.8Å; W366-L375 HydrophobicContact CE3-CD2 3.89Å; W366-L375 HydrophobicContact CE3-CG 4.18Å; W366-L375 HydrophobicContact CZ3-CD2 4.23Å; W366-Y378 AromaticContact CH2-CD2 3.16Å; W366-Y378 HydrophobicContact CH2-CD2 3.16Å; W366-Y378 AromaticContact CH2-CE2 3.83Å; W366-Y378 HydrophobicContact CH2-CE2 3.83Å; W366-Y378 AromaticContact CH2-CG 3.79Å; W366-Y378 HydrophobicContact CH2-CG 3.79Å; W366-Y378 AromaticContact CZ2-CD2 3.86Å; W366-Y378 HydrophobicContact CZ2-CD2 3.86Å; W366-Y378 HydrophobicContact CZ2-CE2 4.05Å; W366-Y378 AromaticContact CZ3-CD2 3.89Å; W366-Y378 HydrophobicContact CZ3-CD2 3.89Å; W366-Y378 HydrophobicContact CZ3-CG 4.45Å; W366-W387 HydrophobicContact CZ3-CH2 4.05Å; W366-W387 HydrophobicContact CZ3-CZ2 4.02Å
367	S	88.7	Confident	84.9	Confident	19 Å²	19	38.5 Å²	38.5	13%	0.133	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	137.4	165.6	176.1	0	0	0	0	109.9	V351 L364 P365 D369	V351-S367 PolarHBondContact N-OG 3.07Å; V351-S367 WeakPolarHBondContact O-CB 3.45Å; V351-S367 PolarHBondContact O-OG 2.87Å; L364-S367 WeakPolarHBondContact O-CB 3.48Å; L364-S367 PolarHBondContact O-N 2.9Å; P365-S367 PolarHBondContact O-N 3.43Å; P365-S367 VanDerWaalsContact O-N 3.14Å; S367-D369 PolarHBondContact O-N 3.29Å
368	A	85.5	Confident	85.4	Confident	42 Å²	42	38.8 Å²	38.8	35%	0.347	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.8	-10.5	-178.1	0	0	0	0	0	117.7	A349 L350	A349-A368 PolarHBondContact O-N 2.81Å; L350-A368 HydrophobicContact CD2-CB 3.79Å
369	D	84.9	Confident	86	Confident	100 Å²	100	37.9 Å²	37.9	54%	0.535	20%	0.2	S	C	.	.	S	Bend	trans	-89.3	-4.8	-172.3	-178.8	49.2	0	0	0	114.3	S367 N371	S367-D369 PolarHBondContact O-N 3.29Å; D369-N371 PolarHBondContact O-N 2.98Å; D369-N371 PolarHBondContact OD2-ND2 2.91Å
370	G	84	Confident	86.4	Confident	17 Å²	17	36 Å²	36	18%	0.175	19%	0.189	C	C	.	.	S	Bend	trans	79.5	-4.1	-179.9	0	0	0	0	0	115.3	T332 S348	T332-G370 WeakPolarHBondContact CG2-O 3.5Å; T332-G370 PolarHBondContact OG1-O 3.34Å; S348-G370 VanDerWaalsContact CB-CA 3.42Å; S348-G370 VanDerWaalsContact CB-N 3.27Å; S348-G370 WeakPolarHBondContact OG-CA 3.37Å; S348-G370 PolarHBondContact OG-N 2.78Å; S348-G370 VanDerWaalsContact OG-N 3.16Å
371	N	87.6	Confident	86.6	Confident	45 Å²	45	35.6 Å²	35.6	24%	0.241	18%	0.182	C	C	.	.			trans	-96	14.5	173.5	-69.1	-51.8	0	0	0	113.6	W366 D369 Y373 K374	W366-N371 HydrophobicContact CB-CB 4.02Å; W366-N371 HydrophobicContact CG-CB 3.99Å; D369-N371 PolarHBondContact O-N 2.98Å; D369-N371 PolarHBondContact OD2-ND2 2.91Å; N371-Y373 HydrophobicContact CB-CE1 4.38Å; N371-Y373 PolarHBondContact O-N 3.43Å; N371-K374 HydrophobicContact CB-CD 4.13Å; N371-K374 VanDerWaalsContact O-CB 3.26Å; N371-K374 WeakPolarHBondContact O-CB 3.39Å; N371-K374 WeakPolarHBondContact O-CG 3.32Å; N371-K374 PolarHBondContact O-N 3.19Å
372	S	87.2	Confident	86.3	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-15.7	-175.3	-38	0	0	0	0	113.7	W366 K374 L375	W366-S372 PolarHBondContact O-OG 3.27Å; S372-K374 PolarHBondContact O-N 3.23Å; S372-L375 WeakPolarHBondContact O-CB 3.48Å; S372-L375 VanDerWaalsContact O-CG 3.3Å; S372-L375 WeakPolarHBondContact O-CG 3.31Å; S372-L375 PolarHBondContact O-N 3.31Å
373	Y	85.7	Confident	86	Confident	60 Å²	60	36.8 Å²	36.8	24%	0.235	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-23.6	169.8	67.2	-93.3	0	0	0	113.3	V329 T332 N371 L375 V376	V329-Y373 WeakPolarHBondContact O-CB 3.49Å; T332-Y373 HydrophobicContact CG2-CD1 4.21Å; N371-Y373 HydrophobicContact CB-CE1 4.38Å; N371-Y373 PolarHBondContact O-N 3.43Å; Y373-L375 PolarHBondContact O-N 2.98Å; Y373-V376 PolarHBondContact O-N 3.26Å
374	K	88.5	Confident	85.7	Confident	56 Å²	56	36.5 Å²	36.5	24%	0.243	19%	0.194	C	C	.	.	H	α-helix	trans	-65.8	-21	173.9	-67.8	-178.6	-176.5	173.2	0	112.5	W366 N371 S372 V376 Q377 Y378	W366-K374 HydrophobicContact CD2-CB 3.75Å; W366-K374 HydrophobicContact CD2-CD 4.15Å; W366-K374 HydrophobicContact CE3-CB 3.73Å; W366-K374 HydrophobicContact CG-CB 4.41Å; W366-K374 HydrophobicContact CG-CD 4.41Å; W366-K374 HydrophobicContact CH2-CB 3.9Å; W366-K374 HydrophobicContact CZ2-CB 3.97Å; W366-K374 HydrophobicContact CZ2-CD 3.91Å; W366-K374 HydrophobicContact CZ3-CB 3.8Å; N371-K374 HydrophobicContact CB-CD 4.13Å; N371-K374 VanDerWaalsContact O-CB 3.26Å; N371-K374 WeakPolarHBondContact O-CB 3.39Å; N371-K374 WeakPolarHBondContact O-CG 3.32Å; N371-K374 PolarHBondContact O-N 3.19Å; S372-K374 PolarHBondContact O-N 3.23Å; K374-V376 PolarHBondContact O-N 3.39Å; K374-V376 VanDerWaalsContact O-N 3.14Å; K374-Q377 PolarHBondContact O-N 3.13Å; K374-Y378 HydrophobicContact CB-CD2 3.92Å; K374-Y378 HydrophobicContact CB-CE2 4.09Å; K374-Y378 HydrophobicContact CD-CE2 4.38Å; K374-Y378 HydrophobicContact CG-CE2 4.34Å; K374-Y378 VanDerWaalsContact O-CD2 3.27Å; K374-Y378 WeakPolarHBondContact O-CD2 3.17Å; K374-Y378 PolarHBondContact O-N 3.12Å
375	L	88.6	Confident	85.7	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-60.5	-21.5	174.7	-67.2	170.7	0	0	0	113.3	Y326 V351 L364 P365 W366 S372 Y373 G385 W387	Y326-L375 HydrophobicContact CD2-CB 3.74Å; Y326-L375 HydrophobicContact CE1-CD1 4.3Å; Y326-L375 HydrophobicContact CE2-CB 3.95Å; Y326-L375 HydrophobicContact CE2-CD1 4.05Å; Y326-L375 HydrophobicContact CE2-CG 4.42Å; Y326-L375 HydrophobicContact CG-CB 4.08Å; V351-L375 HydrophobicContact CB-CD1 4.3Å; V351-L375 HydrophobicContact CG1-CD1 4.13Å; V351-L375 HydrophobicContact CG2-CD1 3.82Å; L364-L375 HydrophobicContact CD2-CD2 4.49Å; P365-L375 WeakPolarHBondContact O-CD2 3.43Å; W366-L375 HydrophobicContact CE3-CD2 3.89Å; W366-L375 HydrophobicContact CE3-CG 4.18Å; W366-L375 HydrophobicContact CZ3-CD2 4.23Å; S372-L375 WeakPolarHBondContact O-CB 3.48Å; S372-L375 VanDerWaalsContact O-CG 3.3Å; S372-L375 WeakPolarHBondContact O-CG 3.31Å; S372-L375 PolarHBondContact O-N 3.31Å; Y373-L375 PolarHBondContact O-N 2.98Å; L375-G385 VanDerWaalsContact O-CA 3.32Å; L375-G385 WeakPolarHBondContact O-CA 3.44Å; L375-W387 HydrophobicContact CD2-CD2 4.3Å; L375-W387 HydrophobicContact CD2-CH2 4.07Å; L375-W387 HydrophobicContact CD2-CZ2 3.49Å; L375-W387 VanDerWaalsContact CD2-CZ2 3.49Å; L375-W387 PolarHBondContact O-NE1 2.75Å; L375-W387 VanDerWaalsContact O-NE1 3.09Å
376	V	89.4	Confident	86.1	Confident	34 Å²	34	35.9 Å²	35.9	21%	0.206	19%	0.189	C	C	.	.	H	α-helix	trans	-79.6	-39.6	174.2	-177.2	0	0	0	0	111.2	A327 V329 Y373 K374 G385	A327-V376 WeakPolarHBondContact O-CG1 3.46Å; V329-V376 HydrophobicContact CB-CG2 3.66Å; V329-V376 HydrophobicContact CG2-CG2 3.54Å; Y373-V376 PolarHBondContact O-N 3.26Å; K374-V376 PolarHBondContact O-N 3.39Å; K374-V376 VanDerWaalsContact O-N 3.14Å; V376-G385 PolarHBondContact O-N 3.49Å
377	Q	84.2	Confident	86.4	Confident	93 Å²	93	33.7 Å²	33.7	44%	0.435	18%	0.181	S	C	.	.	H	α-helix	trans	-77.6	-28	-175.2	-64.4	178.2	-10.3	0	0	112.2	K374	K374-Q377 PolarHBondContact O-N 3.13Å
378	Y	85.9	Confident	86.5	Confident	60 Å²	60	33 Å²	33	24%	0.235	18%	0.175	C	C	.	.			trans	-116.6	164.3	-178	-57.4	-64.9	0	0	0	111.4	S46 P47 W366 K374 G385	S46-Y378 WeakPolarHBondContact O-CD1 3.37Å; P47-Y378 VanDerWaalsContact CA-CE1 3.47Å; P47-Y378 HydrophobicContact CB-CE1 4.41Å; W366-Y378 AromaticContact CH2-CD2 3.16Å; W366-Y378 HydrophobicContact CH2-CD2 3.16Å; W366-Y378 AromaticContact CH2-CE2 3.83Å; W366-Y378 HydrophobicContact CH2-CE2 3.83Å; W366-Y378 AromaticContact CH2-CG 3.79Å; W366-Y378 HydrophobicContact CH2-CG 3.79Å; W366-Y378 AromaticContact CZ2-CD2 3.86Å; W366-Y378 HydrophobicContact CZ2-CD2 3.86Å; W366-Y378 HydrophobicContact CZ2-CE2 4.05Å; W366-Y378 AromaticContact CZ3-CD2 3.89Å; W366-Y378 HydrophobicContact CZ3-CD2 3.89Å; W366-Y378 HydrophobicContact CZ3-CG 4.45Å; K374-Y378 HydrophobicContact CB-CD2 3.92Å; K374-Y378 HydrophobicContact CB-CE2 4.09Å; K374-Y378 HydrophobicContact CD-CE2 4.38Å; K374-Y378 HydrophobicContact CG-CE2 4.34Å; K374-Y378 VanDerWaalsContact O-CD2 3.27Å; K374-Y378 WeakPolarHBondContact O-CD2 3.17Å; K374-Y378 PolarHBondContact O-N 3.12Å; Y378-G385 PolarHBondContact O-N 3.04Å
379	G	83.6	Confident	86.9	Confident	1 Å²	1	31 Å²	31	1%	0.01	16%	0.159	C	C	.	.			trans	-152.9	159.7	176.2	0	0	0	0	0	110.8	R386	G379-R386 WeakPolarHBondContact CA-O 3.28Å
380	S	82.6	Confident	87.3	Confident	1 Å²	1	29.5 Å²	29.5	1%	0.007	15%	0.146	C	C	.	.	S	Bend	trans	-77.9	-29.5	170	65.8	0	0	0	0	111.5	R386 W387 L388 G398 G399 C400	S380-R386 PolarHBondContact N-O 2.76Å; S380-R386 PolarHBondContact OG-O 3.05Å; S380-W387 WeakPolarHBondContact OG-CA 3.33Å; S380-L388 PolarHBondContact OG-N 2.93Å; S380-G398 WeakPolarHBondContact CB-O 3.14Å; S380-G399 CarbonylContact O-C 3.54Å; S380-G399 WeakPolarHBondContact O-CA 3.27Å; S380-C400 PolarHBondContact O-N 2.82Å
381	T	84	Confident	87.8	Confident	7 Å²	7	28.7 Å²	28.7	4%	0.043	14%	0.138	C	C	.	.	S	Bend	trans	-99.9	-169.7	-176.1	73.5	0	0	0	0	111.6	V383 R386 L388	T381-V383 PolarHBondContact O-N 2.76Å; T381-V383 PolarHBondContact OG1-N 2.93Å; T381-R386 HydrophobicContact CG2-CG 4.14Å; T381-R386 WeakPolarHBondContact OG1-CB 3.48Å; T381-L388 HydrophobicContact CG2-CB 4.17Å
382	Q	81.3	Confident	87.9	Confident	78 Å²	78	26.8 Å²	26.8	36%	0.364	13%	0.127	S	C	.	.	S	Bend	trans	-72.4	-5.7	174.1	-44.8	-172.1	18	0	0	113.9	I50 D451 M452 V453	I50-Q382 VanDerWaalsContact CD1-C 3.48Å; I50-Q382 WeakPolarHBondContact CD1-O 3.45Å; Q382-D451 PolarHBondContact NE2-OD1 2.94Å; Q382-D451 PolarHBondContact NE2-OD2 3.38Å; Q382-D451 VanDerWaalsContact NE2-OD2 3.11Å; Q382-M452 HydrophobicContact CB-CG 4.36Å; Q382-M452 HydrophobicContact CB-SD 4.01Å; Q382-M452 HydrophobicContact CG-CG 3.71Å; Q382-M452 HydrophobicContact CG-SD 4.03Å; Q382-V453 HydrophobicContact CG-CG2 4.13Å
383	V	84.5	Confident	87.8	Confident	46 Å²	46	27.4 Å²	27.4	28%	0.279	13%	0.13	S	C	.	.	S	Bend	trans	-110.4	122.6	-178.9	-177.7	0	0	0	0	108.6	H95 T381 R386	H95-V383 HydrophobicContact CB-CG1 3.77Å; T381-V383 PolarHBondContact O-N 2.76Å; T381-V383 PolarHBondContact OG1-N 2.93Å; V383-R386 HydrophobicContact CB-CB 3.97Å; V383-R386 HydrophobicContact CG1-CB 4.26Å; V383-R386 WeakPolarHBondContact O-CB 3.43Å; V383-R386 PolarHBondContact O-N 2.68Å; V383-R386 VanDerWaalsContact O-N 3.15Å
384	A	84.3	Confident	87.7	Confident	27 Å²	27	27.9 Å²	27.9	22%	0.223	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	140.6	173.6	0	0	0	0	0	110.1	I50 R386	I50-A384 HydrophobicContact CB-CB 4.33Å; A384-R386 PolarHBondContact O-N 2.75Å
385	G	89	Confident	87.6	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	83	-9.8	-174.7	0	0	0	0	0	114.8	N325 Y326 L375 V376 Y378	N325-G385 CarbonylContact C-O 3.57Å; N325-G385 WeakPolarHBondContact CA-O 3.04Å; Y326-G385 WeakPolarHBondContact CD2-O 2.88Å; Y326-G385 PolarHBondContact N-O 3.46Å; L375-G385 VanDerWaalsContact O-CA 3.32Å; L375-G385 WeakPolarHBondContact O-CA 3.44Å; V376-G385 PolarHBondContact O-N 3.49Å; Y378-G385 PolarHBondContact O-N 3.04Å
386	R	91.8	Very high	87.5	Confident	15 Å²	15	29.7 Å²	29.7	6%	0.057	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	124.3	-175.9	-177.1	170.8	-69.3	-176.6	-1.6	113.3	H95 D261 M323 F324 N325 G379 S380 T381 V383 A384	H95-R386 PolarHBondContact O-NH2 2.83Å; D261-R386 VanDerWaalsContact CG-NH1 3.32Å; D261-R386 IonicContact OD2-CZ 2.85Å; D261-R386 IonicContact OD2-NH1 3.21Å; D261-R386 PolarHBondContact OD2-NH1 3.49Å; D261-R386 IonicContact OD2-NH2 3.97Å; M323-R386 HydrophobicContact CG-CG 3.92Å; M323-R386 HydrophobicContact SD-CG 4.05Å; M323-R386 PolarHBondContact SD-NE 3.46Å; F324-R386 CarbonylContact O-C 3.6Å; F324-R386 VanDerWaalsContact O-CA 3.31Å; F324-R386 WeakPolarHBondContact O-CA 3.06Å; N325-R386 WeakPolarHBondContact OD1-CB 3.2Å; N325-R386 VanDerWaalsContact OD1-CG 3.27Å; N325-R386 WeakPolarHBondContact OD1-CG 3.38Å; N325-R386 PolarHBondContact OD1-NE 3.07Å; G379-R386 WeakPolarHBondContact CA-O 3.28Å; S380-R386 PolarHBondContact N-O 2.76Å; S380-R386 PolarHBondContact OG-O 3.05Å; T381-R386 HydrophobicContact CG2-CG 4.14Å; T381-R386 WeakPolarHBondContact OG1-CB 3.48Å; V383-R386 HydrophobicContact CB-CB 3.97Å; V383-R386 HydrophobicContact CG1-CB 4.26Å; V383-R386 WeakPolarHBondContact O-CB 3.43Å; V383-R386 PolarHBondContact O-N 2.68Å; V383-R386 VanDerWaalsContact O-N 3.15Å; A384-R386 PolarHBondContact O-N 2.75Å
387	W	92.3	Very high	87.5	Confident	6 Å²	6	29.4 Å²	29.4	2%	0.023	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	132.6	-179.7	-58.8	81.8	0	0	0	109.8	F43 P45 M323 F324 Y326 L364 P365 W366 L375 S380	F43-W387 AromaticContact CD1-CZ3 3.91Å; F43-W387 HydrophobicContact CD1-CZ3 3.91Å; F43-W387 HydrophobicContact CE1-CE3 4.28Å; F43-W387 AromaticContact CE1-CZ3 3.66Å; F43-W387 HydrophobicContact CE1-CZ3 3.66Å; P45-W387 HydrophobicContact CB-CH2 3.59Å; P45-W387 HydrophobicContact CB-CZ2 4.44Å; P45-W387 HydrophobicContact CB-CZ3 4.24Å; P45-W387 HydrophobicContact CG-CH2 4.03Å; M323-W387 CarbonylContact C-O 3.6Å; M323-W387 WeakPolarHBondContact CA-O 3.25Å; F324-W387 HydrophobicContact CB-CB 4.22Å; F324-W387 HydrophobicContact CD2-CB 4.26Å; F324-W387 PolarHBondContact N-O 3Å; F324-W387 PolarHBondContact O-N 3.32Å; Y326-W387 AromaticContact CD2-CD1 3.58Å; Y326-W387 AromaticContact CD2-NE1 3.84Å; Y326-W387 AromaticContact CE2-CD1 3.53Å; Y326-W387 HydrophobicContact CE2-CG 4.35Å; L364-W387 HydrophobicContact CD2-CB 3.73Å; L364-W387 HydrophobicContact CD2-CD2 3.87Å; L364-W387 HydrophobicContact CD2-CE3 4.02Å; L364-W387 HydrophobicContact CD2-CG 3.74Å; P365-W387 HydrophobicContact CB-CH2 4.29Å; P365-W387 HydrophobicContact CG-CH2 3.87Å; P365-W387 HydrophobicContact CG-CZ3 3.75Å; W366-W387 HydrophobicContact CZ3-CH2 4.05Å; W366-W387 HydrophobicContact CZ3-CZ2 4.02Å; L375-W387 HydrophobicContact CD2-CD2 4.3Å; L375-W387 HydrophobicContact CD2-CH2 4.07Å; L375-W387 HydrophobicContact CD2-CZ2 3.49Å; L375-W387 VanDerWaalsContact CD2-CZ2 3.49Å; L375-W387 PolarHBondContact O-NE1 2.75Å; L375-W387 VanDerWaalsContact O-NE1 3.09Å; S380-W387 WeakPolarHBondContact OG-CA 3.33Å
388	L	92.3	Very high	87.6	Confident	5 Å²	5	25 Å²	25	3%	0.026	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	140.1	-176.5	-179.7	61.9	0	0	0	109.6	I262 M266 Y321 V322 M323 S380 T381 G398	I262-L388 HydrophobicContact CG1-CD1 4.03Å; I262-L388 HydrophobicContact CG2-CD2 4.37Å; M266-L388 HydrophobicContact CB-CD2 3.66Å; M266-L388 HydrophobicContact CB-CG 4.49Å; Y321-L388 HydrophobicContact CD1-CD1 4.49Å; V322-L388 CarbonylContact O-C 3.52Å; V322-L388 WeakPolarHBondContact O-CA 3.3Å; M323-L388 HydrophobicContact CB-CD1 4.25Å; M323-L388 HydrophobicContact CE-CD1 4.49Å; S380-L388 PolarHBondContact OG-N 2.93Å; T381-L388 HydrophobicContact CG2-CB 4.17Å; L388-G398 PolarHBondContact O-N 2.85Å
389	A	93.1	Very high	87.6	Confident	1 Å²	1	22.3 Å²	22.3	1%	0.008	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	144.8	170.5	0	0	0	0	0	110.6	Y321 V322 F353 V391 E396 Y397	Y321-A389 CarbonylContact C-O 3.5Å; Y321-A389 WeakPolarHBondContact CA-O 3.49Å; V322-A389 PolarHBondContact N-O 3.23Å; V322-A389 PolarHBondContact O-N 2.9Å; F353-A389 HydrophobicContact CE2-CB 3.69Å; F353-A389 HydrophobicContact CZ-CB 3.6Å; A389-V391 HydrophobicContact CB-CG1 4.29Å; A389-E396 CarbonylContact C-O 3.53Å; A389-E396 VanDerWaalsContact CA-O 3.27Å; A389-E396 WeakPolarHBondContact CA-O 3.29Å; A389-Y397 HydrophobicContact CB-CD1 4.34Å
390	R	93.6	Very high	87.8	Confident	67 Å²	67	22.3 Å²	22.3	25%	0.253	11%	0.109	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	139.2	164.2	-179.6	-178	175.7	-166.3	-1.6	108.6	M266 T320 Y321 D392 I395 E396	M266-R390 HydrophobicContact CE-CB 3.73Å; M266-R390 HydrophobicContact SD-CB 3.97Å; T320-R390 WeakPolarHBondContact O-CA 3.48Å; Y321-R390 HydrophobicContact CD1-CB 3.9Å; Y321-R390 HydrophobicContact CD1-CG 4.36Å; Y321-R390 HydrophobicContact CE1-CB 3.76Å; Y321-R390 HydrophobicContact CE1-CG 4.02Å; R390-D392 WeakPolarHBondContact CD-OD1 3.37Å; R390-D392 WeakPolarHBondContact CG-OD1 3.48Å; R390-D392 IonicContact CZ-OD1 2.69Å; R390-D392 IonicContact CZ-OD2 2.75Å; R390-D392 IonicContact NE-OD1 3.41Å; R390-D392 PolarHBondContact NE-OD1 2.94Å; R390-D392 IonicContact NE-OD2 3.64Å; R390-D392 PolarHBondContact NE-OD2 3.15Å; R390-D392 IonicContact NH2-OD1 2.68Å; R390-D392 PolarHBondContact NH2-OD1 2.91Å; R390-D392 IonicContact NH2-OD2 2.86Å; R390-D392 PolarHBondContact NH2-OD2 2.89Å; R390-I395 VanDerWaalsContact O-CA 3.3Å; R390-I395 WeakPolarHBondContact O-CA 3.15Å; R390-E396 HydrophobicContact CB-CB 4.33Å; R390-E396 PolarHBondContact N-O 3.12Å; R390-E396 IonicContact NH1-OE2 3.7Å; R390-E396 PolarHBondContact O-N 3.18Å
391	V	93.4	Very high	87.8	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.11	C	C	.	.			trans	-137.3	11.4	-167.9	-56.7	0	0	0	0	114.5	F126 Y127 T320 V322 F353 A389 I395	F126-V391 CarbonylContact C-O 3.49Å; F126-V391 WeakPolarHBondContact CA-O 3.32Å; F126-V391 HydrophobicContact CD2-CB 3.88Å; F126-V391 HydrophobicContact CD2-CG2 3.67Å; F126-V391 HydrophobicContact CE2-CB 3.99Å; F126-V391 HydrophobicContact CE2-CG1 4.42Å; F126-V391 HydrophobicContact CE2-CG2 4.14Å; Y127-V391 PolarHBondContact N-O 2.97Å; T320-V391 HydrophobicContact CG2-CG2 3.64Å; T320-V391 PolarHBondContact O-N 3.11Å; V322-V391 HydrophobicContact CB-CG1 4.41Å; V322-V391 HydrophobicContact CG2-CB 4.5Å; V322-V391 HydrophobicContact CG2-CG1 3.93Å; V322-V391 HydrophobicContact CG2-CG2 3.72Å; F353-V391 HydrophobicContact CD1-CG1 3.99Å; F353-V391 HydrophobicContact CE1-CG1 3.85Å; F353-V391 HydrophobicContact CG-CG1 4.49Å; F353-V391 HydrophobicContact CZ-CG1 4.23Å; A389-V391 HydrophobicContact CB-CG1 4.29Å; V391-I395 HydrophobicContact CB-CG1 4.35Å; V391-I395 HydrophobicContact CG1-CG1 4.18Å
392	D	90.1	Very high	87.6	Confident	5 Å²	5	24.5 Å²	24.5	3%	0.027	12%	0.121	C	C	.	.	S	Bend	trans	-72.2	-53.5	-172.3	56.1	-31.2	0	0	0	114.4	P125 Y127 G128 R390	P125-D392 HydrophobicContact CB-CB 4.06Å; Y127-D392 PolarHBondContact N-O 2.72Å; G128-D392 PolarHBondContact N-O 2.81Å; R390-D392 WeakPolarHBondContact CD-OD1 3.37Å; R390-D392 WeakPolarHBondContact CG-OD1 3.48Å; R390-D392 IonicContact CZ-OD1 2.69Å; R390-D392 IonicContact CZ-OD2 2.75Å; R390-D392 IonicContact NE-OD1 3.41Å; R390-D392 PolarHBondContact NE-OD1 2.94Å; R390-D392 IonicContact NE-OD2 3.64Å; R390-D392 PolarHBondContact NE-OD2 3.15Å; R390-D392 IonicContact NH2-OD1 2.68Å; R390-D392 PolarHBondContact NH2-OD1 2.91Å; R390-D392 IonicContact NH2-OD2 2.86Å; R390-D392 PolarHBondContact NH2-OD2 2.89Å
393	E	86.2	Confident	87.6	Confident	13 Å²	13	22.7 Å²	22.7	6%	0.061	11%	0.114	C	C	.	.	S	Bend	trans	-113.9	-36.7	177.6	-82.1	-73.1	161.3	0	0	113	R886 Y894 R904	E393-R886 IonicContact OE1-NH1 3.77Å; E393-R886 IonicContact OE2-CZ 2.83Å; E393-R886 IonicContact OE2-NH1 3.39Å; E393-R886 PolarHBondContact OE2-NH1 2.8Å; E393-R886 IonicContact OE2-NH2 2.87Å; E393-Y894 HydrophobicContact CG-CE2 4.26Å; E393-Y894 WeakPolarHBondContact OE1-CD2 3.39Å; E393-Y894 WeakPolarHBondContact OE1-CE2 3.17Å; E393-R904 PolarHBondContact O-NH1 3.33Å; E393-R904 IonicContact OE2-CZ 3.69Å; E393-R904 IonicContact OE2-NH1 3.79Å; E393-R904 IonicContact OE2-NH2 2.81Å; E393-R904 PolarHBondContact OE2-NH2 3.43Å
394	E	83.1	Confident	87.5	Confident	71 Å²	71	25.6 Å²	25.6	33%	0.332	14%	0.136	S	C	.	.	S	Bend	trans	-139.4	159.8	173.2	-63.8	-169.9	178.6	0	0	108.5	R904	E394-R904 VanDerWaalsContact CG-NH1 3.25Å; E394-R904 WeakPolarHBondContact OE1-CD 3.45Å; E394-R904 IonicContact OE1-CZ 3.66Å; E394-R904 IonicContact OE1-NE 3.79Å; E394-R904 IonicContact OE1-NH1 3.93Å; E394-R904 PolarHBondContact OE1-NH1 3.25Å
395	I	86.8	Confident	87.6	Confident	16 Å²	16	28.2 Å²	28.2	8%	0.082	15%	0.146	C	C	.	.			trans	-91.5	107.1	178.2	-69.3	152.7	0	0	0	108.8	Y127 F353 Y362 R390 V391 Y397	Y127-I395 HydrophobicContact CD2-CD1 3.64Å; Y127-I395 HydrophobicContact CD2-CG1 3.92Å; Y127-I395 HydrophobicContact CE2-CD1 3.93Å; Y127-I395 HydrophobicContact CE2-CG1 4.29Å; F353-I395 HydrophobicContact CB-CD1 3.56Å; F353-I395 HydrophobicContact CB-CG1 4.38Å; F353-I395 HydrophobicContact CD2-CG2 3.78Å; F353-I395 HydrophobicContact CE2-CG2 4.19Å; F353-I395 HydrophobicContact CG-CD1 4.21Å; F353-I395 HydrophobicContact CG-CG2 4.46Å; Y362-I395 HydrophobicContact CD1-CB 3.95Å; Y362-I395 HydrophobicContact CD1-CD1 4.22Å; Y362-I395 HydrophobicContact CD1-CG2 4.17Å; Y362-I395 HydrophobicContact CD2-CB 4.46Å; Y362-I395 HydrophobicContact CD2-CD1 3.19Å; Y362-I395 HydrophobicContact CD2-CG1 4.39Å; Y362-I395 HydrophobicContact CE1-CB 4.27Å; Y362-I395 HydrophobicContact CE2-CD1 3.64Å; Y362-I395 HydrophobicContact CG-CB 4.05Å; Y362-I395 HydrophobicContact CG-CD1 3.53Å; Y362-I395 HydrophobicContact CG-CG1 4.4Å; Y362-I395 HydrophobicContact CG-CG2 4.16Å; R390-I395 VanDerWaalsContact O-CA 3.3Å; R390-I395 WeakPolarHBondContact O-CA 3.15Å; V391-I395 HydrophobicContact CB-CG1 4.35Å; V391-I395 HydrophobicContact CG1-CG1 4.18Å; I395-Y397 HydrophobicContact CG2-CE2 4.45Å
396	E	86.9	Confident	87.5	Confident	77 Å²	77	29 Å²	29	36%	0.36	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	113.2	177.4	-65.9	175.2	172.6	0	0	108.6	M266 A389 R390 G398	M266-E396 HydrophobicContact CE-CB 3.67Å; M266-E396 WeakPolarHBondContact CE-O 3.43Å; A389-E396 CarbonylContact C-O 3.53Å; A389-E396 VanDerWaalsContact CA-O 3.27Å; A389-E396 WeakPolarHBondContact CA-O 3.29Å; R390-E396 HydrophobicContact CB-CB 4.33Å; R390-E396 PolarHBondContact N-O 3.12Å; R390-E396 IonicContact NH1-OE2 3.7Å; R390-E396 PolarHBondContact O-N 3.18Å; E396-G398 PolarHBondContact O-N 3.13Å
397	Y	87.9	Confident	87.3	Confident	29 Å²	29	32.3 Å²	32.3	11%	0.114	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	132.2	173.6	-62.7	-80.6	0	0	0	110	T41 F353 Y362 S363 L364 A389 I395 Q409	T41-Y397 HydrophobicContact CG2-CE2 4.37Å; F353-Y397 HydrophobicContact CE2-CE1 4.1Å; Y362-Y397 WeakPolarHBondContact CB-OH 3.33Å; Y362-Y397 PolarHBondContact O-OH 3.07Å; S363-Y397 PolarHBondContact O-OH 3.07Å; L364-Y397 HydrophobicContact CD1-CE1 3.91Å; L364-Y397 HydrophobicContact CG-CE1 4.3Å; A389-Y397 HydrophobicContact CB-CD1 4.34Å; I395-Y397 HydrophobicContact CG2-CE2 4.45Å; Y397-Q409 PolarHBondContact O-NE2 3.39Å; Y397-Q409 PolarHBondContact O-OE1 2.92Å
398	G	87.1	Confident	87.3	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.175	C	C	.	.			trans	-84.4	174.1	170	0	0	0	0	0	111.4	S380 L388 E396	S380-G398 WeakPolarHBondContact CB-O 3.14Å; L388-G398 PolarHBondContact O-N 2.85Å; E396-G398 PolarHBondContact O-N 3.13Å
399	G	85.7	Confident	87.2	Confident	4 Å²	4	34.1 Å²	34.1	4%	0.041	19%	0.185	C	C	.	.	S	Bend	trans	87.4	-163.2	179.3	0	0	0	0	0	114.6	G265 S380 T426	G265-G399 WeakPolarHBondContact O-CA 3.19Å; G265-G399 PolarHBondContact O-N 3.49Å; S380-G399 CarbonylContact O-C 3.54Å; S380-G399 WeakPolarHBondContact O-CA 3.27Å; G399-T426 PolarHBondContact O-OG1 3.33Å
400	C	87.6	Confident	87.1	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.19	C	C	.	.			trans	-123.7	158.3	-178.9	70	0	0	0	0	112.4	F43 S380 C429 V453	F43-C400 VanDerWaalsContact CZ-O 3.22Å; F43-C400 WeakPolarHBondContact CZ-O 3.17Å; S380-C400 PolarHBondContact O-N 2.82Å; C400-C429 HydrophobicContact CB-CB 3.92Å; C400-C429 WeakPolarHBondContact CB-SG 3.27Å; C400-C429 PolarHBondContact O-SG 2.9Å; C400-C429 WeakPolarHBondContact SG-CA 3.47Å; C400-C429 WeakPolarHBondContact SG-CB 3.26Å; C400-C429 CovalentContact SG-SG 2.04Å; C400-C429 PolarHBondContact SG-SG 2.68Å; C400-V453 HydrophobicContact CB-CB 4.48Å; C400-V453 HydrophobicContact CB-CG1 4.36Å; C400-V453 HydrophobicContact CB-CG2 4.43Å
401	S	84	Confident	86.8	Confident	4 Å²	4	33.7 Å²	33.7	3%	0.028	19%	0.187	C	C	.	.	B	Isolated β-bridge	trans	-122.7	152.9	179.7	171.6	0	0	0	0	111.9	Q44 N403 G427 P428 C429	Q44-S401 PolarHBondContact N-OG 3.07Å; Q44-S401 VanDerWaalsContact O-CA 3.23Å; Q44-S401 WeakPolarHBondContact O-CA 3.39Å; Q44-S401 VanDerWaalsContact O-CB 3.29Å; Q44-S401 WeakPolarHBondContact O-CB 3.32Å; Q44-S401 PolarHBondContact O-OG 2.04Å; S401-N403 VanDerWaalsContact OG-CG 3.22Å; S401-N403 PolarHBondContact OG-N 3.15Å; S401-N403 PolarHBondContact OG-ND2 3.01Å; S401-G427 PolarHBondContact N-O 2.68Å; S401-P428 CarbonylContact O-C 3.57Å; S401-P428 WeakPolarHBondContact O-CA 3.44Å; S401-C429 PolarHBondContact O-N 3.03Å
402	N	78.1	Confident	86.6	Confident	51 Å²	51	37 Å²	37	27%	0.273	20%	0.202	S	C	.	.			trans	-97.4	16.8	173.1	-83.7	-102.8	0	0	0	113.4	Q44 S46 P47 C429	Q44-N402 PolarHBondContact O-N 3.22Å; Q44-N402 VanDerWaalsContact O-N 3.08Å; S46-N402 WeakPolarHBondContact CA-ND2 3.48Å; S46-N402 VanDerWaalsContact CB-ND2 3.34Å; S46-N402 WeakPolarHBondContact CB-ND2 3.37Å; P47-N402 WeakPolarHBondContact CD-ND2 3.37Å; N402-C429 WeakPolarHBondContact ND2-CB 3.36Å; N402-C429 PolarHBondContact ND2-SG 2.81Å
403	N	81.6	Confident	86.4	Confident	40 Å²	40	40.6 Å²	40.6	21%	0.214	23%	0.225	C	C	.	.			trans	-58.5	148.7	173.7	-74.8	-10.7	0	0	0	112	D42 Q44 S401 I405 W484	D42-N403 PolarHBondContact O-ND2 2.88Å; Q44-N403 WeakPolarHBondContact CB-OD1 3.13Å; Q44-N403 WeakPolarHBondContact CG-OD1 3.49Å; Q44-N403 PolarHBondContact N-OD1 3.36Å; S401-N403 VanDerWaalsContact OG-CG 3.22Å; S401-N403 PolarHBondContact OG-N 3.15Å; S401-N403 PolarHBondContact OG-ND2 3.01Å; N403-I405 VanDerWaalsContact C-N 3.27Å; N403-I405 WeakPolarHBondContact CB-O 3.27Å; N403-W484 HydrophobicContact CB-CH2 4.09Å; N403-W484 HydrophobicContact CB-CZ2 4.15Å; N403-W484 VanDerWaalsContact O-CZ2 3.26Å; N403-W484 WeakPolarHBondContact O-CZ2 3.22Å
404	S	81.9	Confident	86.5	Confident	106 Å²	106	41 Å²	41	74%	0.741	23%	0.227	S	C	*	.	S	Bend	trans	-70.8	-25.7	173	55	0	0	0	0	112.7	P483	S404-P483 WeakPolarHBondContact O-CB 3.33Å
405	I	87.5	Confident	86.9	Confident	82 Å²	82	38.2 Å²	38.2	42%	0.421	22%	0.216	S	C	.	.	S	Bend	trans	-145.4	145.7	-179.3	-159.3	-178.8	0	0	0	109.5	N403 P483	N403-I405 VanDerWaalsContact C-N 3.27Å; N403-I405 WeakPolarHBondContact CB-O 3.27Å; I405-P483 HydrophobicContact CB-CB 4.37Å; I405-P483 HydrophobicContact CG1-CB 4.17Å; I405-P483 WeakPolarHBondContact CG1-O 3.28Å
406	G	86.6	Confident	87.2	Confident	18 Å²	18	38.5 Å²	38.5	19%	0.186	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.4	177.4	179.2	0	0	0	0	0	114.3	W484 W485	G406-W484 VanDerWaalsContact C-CE3 3.42Å; G406-W484 WeakPolarHBondContact O-CA 3.45Å; G406-W485 PolarHBondContact O-N 2.78Å
407	V	88.6	Confident	87.4	Confident	84 Å²	84	34.8 Å²	34.8	51%	0.509	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	129.7	178.7	-177.3	0	0	0	0	109.5	W485 N486	V407-W485 WeakPolarHBondContact CA-O 3.21Å; V407-N486 HydrophobicContact CG1-CB 4.45Å
408	L	90.9	Very high	87.6	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-84.7	118.1	178	-174.2	74.1	0	0	0	110.3	L410 V425 T426 I472 L474 W484 W485 N486	L408-L410 HydrophobicContact CD2-CD2 3.93Å; L408-L410 HydrophobicContact CG-CD2 4.08Å; L408-V425 HydrophobicContact CD1-CB 4.1Å; L408-V425 HydrophobicContact CD1-CG2 4.36Å; L408-V425 HydrophobicContact CD2-CB 4.39Å; L408-V425 HydrophobicContact CD2-CG1 4.41Å; L408-V425 HydrophobicContact CG-CB 4.3Å; L408-T426 CarbonylContact C-O 3.58Å; L408-T426 WeakPolarHBondContact CD1-O 3.42Å; L408-I472 HydrophobicContact CD2-CD1 3.92Å; L408-I472 HydrophobicContact CD2-CG1 4.4Å; L408-L474 HydrophobicContact CD1-CB 3.9Å; L408-L474 HydrophobicContact CD1-CD2 3.59Å; L408-L474 HydrophobicContact CD1-CG 4.39Å; L408-L474 HydrophobicContact CD2-CB 3.94Å; L408-W484 HydrophobicContact CB-CB 4.42Å; L408-W484 HydrophobicContact CD1-CB 4.28Å; L408-W485 PolarHBondContact N-O 3.4Å; L408-N486 HydrophobicContact CB-CB 4.16Å; L408-N486 WeakPolarHBondContact O-CB 3.42Å; L408-N486 VanDerWaalsContact O-CG 3.31Å; L408-N486 PolarHBondContact O-ND2 2.65Å
409	Q	90.2	Very high	87.8	Confident	49 Å²	49	33.5 Å²	33.5	23%	0.229	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	145.2	175	-68.6	178	-8.4	0	0	111.3	V267 Y397 V425 T426	V267-Q409 HydrophobicContact CG1-CB 3.6Å; Y397-Q409 PolarHBondContact O-NE2 3.39Å; Y397-Q409 PolarHBondContact O-OE1 2.92Å; Q409-V425 WeakPolarHBondContact O-CA 3.42Å; Q409-T426 HydrophobicContact CB-CG2 3.61Å; Q409-T426 HydrophobicContact CG-CG2 4.42Å; Q409-T426 PolarHBondContact N-O 2.93Å; Q409-T426 PolarHBondContact O-N 3.45Å
410	L	91	Very high	87.8	Confident	24 Å²	24	33.4 Å²	33.4	13%	0.126	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	144.8	-173.4	-48.3	174.1	0	0	0	111.3	L408 K412 V425 I472 F488	L408-L410 HydrophobicContact CD2-CD2 3.93Å; L408-L410 HydrophobicContact CG-CD2 4.08Å; L410-K412 VanDerWaalsContact C-N 3.27Å; L410-K412 WeakPolarHBondContact CB-O 3.47Å; L410-K412 PolarHBondContact O-N 3.1Å; L410-V425 HydrophobicContact CD2-CB 4.31Å; L410-V425 HydrophobicContact CD2-CG1 3.64Å; L410-I472 HydrophobicContact CD1-CD1 3.26Å; L410-I472 HydrophobicContact CD1-CG1 4.41Å; L410-I472 HydrophobicContact CD2-CD1 3.22Å; L410-I472 HydrophobicContact CG-CD1 3.75Å; L410-F488 HydrophobicContact CD1-CB 4.39Å; L410-F488 HydrophobicContact CD1-CD2 3.75Å
411	D	88.4	Confident	87.8	Confident	34 Å²	34	34.3 Å²	34.3	18%	0.182	20%	0.2	C	C	.	.	S	Bend	trans	-71.7	-25.6	173.8	71.7	-32.2	0	0	0	113.2	V267 N424	V267-D411 HydrophobicContact CG2-CB 3.73Å; D411-N424 HydrophobicContact CB-CB 4.02Å; D411-N424 PolarHBondContact N-O 3.49Å; D411-N424 PolarHBondContact OD1-N 2.7Å; D411-N424 PolarHBondContact OD2-ND2 2.99Å
412	K	87.9	Confident	87.9	Confident	71 Å²	71	34.7 Å²	34.7	31%	0.309	20%	0.201	S	C	.	.			trans	-129	120	176.8	-58.2	177.3	-165.7	74.8	0	107.7	L410 Q414 T422 L423 F488	L410-K412 VanDerWaalsContact C-N 3.27Å; L410-K412 WeakPolarHBondContact CB-O 3.47Å; L410-K412 PolarHBondContact O-N 3.1Å; K412-Q414 PolarHBondContact O-N 2.75Å; K412-T422 PolarHBondContact NZ-O 3.44Å; K412-L423 HydrophobicContact CB-CD2 4.05Å; K412-F488 WeakPolarHBondContact O-CE2 3.32Å
413	P	86.1	Confident	88.5	Confident	80 Å²	80	32.2 Å²	32.2	52%	0.519	19%	0.188	S	C	.	.	S	Bend	trans	-72.1	-13.7	176.4	29.3	-34.6	0	0	0	112.5	F488 Y489	P413-F488 VanDerWaalsContact O-CD2 3.29Å; P413-F488 WeakPolarHBondContact O-CD2 3.45Å; P413-Y489 PolarHBondContact O-N 3Å
414	Q	89.7	Confident	88.9	Confident	21 Å²	21	30.6 Å²	30.6	10%	0.098	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	153.9	-174.6	63.1	-154.8	88.9	0	0	113.1	K412 Y489 L491 W911 Q912	K412-Q414 PolarHBondContact O-N 2.75Å; Q414-Y489 WeakPolarHBondContact CA-O 3.07Å; Q414-Y489 WeakPolarHBondContact CB-O 3.29Å; Q414-L491 HydrophobicContact CB-CD1 4.31Å; Q414-L491 HydrophobicContact CB-CG 4.44Å; Q414-L491 HydrophobicContact CG-CD1 4Å; Q414-W911 VanDerWaalsContact NE2-CD1 3.27Å; Q414-Q912 VanDerWaalsContact NE2-CG 3.26Å
415	A	90.7	Very high	89.3	Confident	13 Å²	13	25.5 Å²	25.5	11%	0.107	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	173.7	173.8	0	0	0	0	0	112	F421 F488 Y489 L491	A415-F421 HydrophobicContact CB-CD1 3.91Å; A415-F421 HydrophobicContact CB-CD2 3.89Å; A415-F421 HydrophobicContact CB-CE1 3.53Å; A415-F421 HydrophobicContact CB-CE2 3.48Å; A415-F421 VanDerWaalsContact CB-CE2 3.48Å; A415-F421 HydrophobicContact CB-CG 4.1Å; A415-F421 HydrophobicContact CB-CZ 3.32Å; A415-F488 HydrophobicContact CB-CE1 4.38Å; A415-F488 HydrophobicContact CB-CZ 3.62Å; A415-Y489 PolarHBondContact N-O 3Å; A415-L491 PolarHBondContact O-N 3.09Å
416	T	91.9	Very high	89.5	Confident	21 Å²	21	21.6 Å²	21.6	13%	0.129	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	143.9	179	-178.9	0	0	0	0	112.7	L418 G419 F421 L491	T416-L418 HydrophobicContact CG2-CB 4.19Å; T416-L418 PolarHBondContact O-N 3.12Å; T416-L418 PolarHBondContact OG1-N 2.57Å; T416-G419 PolarHBondContact O-N 2.86Å; T416-F421 WeakPolarHBondContact O-CE1 3.14Å; T416-L491 CarbonylContact C-O 3.54Å; T416-L491 WeakPolarHBondContact CA-O 3.31Å
417	M	92.7	Very high	89.6	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-15.1	173.3	65.2	-178.2	-92.8	0	0	114.5	G419 F465 K466 V490 L491 M492 P493 V765 P766	M417-G419 PolarHBondContact O-N 2.59Å; M417-F465 VanDerWaalsContact CE-CA 3.49Å; M417-F465 HydrophobicContact CE-CB 4.05Å; M417-F465 HydrophobicContact CE-CD1 3.45Å; M417-F465 VanDerWaalsContact CE-CD1 3.45Å; M417-F465 HydrophobicContact CE-CE1 4.31Å; M417-F465 HydrophobicContact CE-CG 4.14Å; M417-F465 PolarHBondContact O-N 3.5Å; M417-K466 VanDerWaalsContact CB-O 3.24Å; M417-K466 WeakPolarHBondContact CB-O 3.43Å; M417-V490 HydrophobicContact CB-CG1 3.6Å; M417-L491 PolarHBondContact N-O 3.26Å; M417-M492 HydrophobicContact SD-CB 4.28Å; M417-P493 HydrophobicContact CG-CG 4.17Å; M417-P493 HydrophobicContact SD-CG 4.44Å; M417-V765 HydrophobicContact CE-CG1 3.7Å; M417-P766 HydrophobicContact CE-CB 4.39Å; M417-P766 HydrophobicContact CE-CG 4.26Å; M417-P766 HydrophobicContact SD-CB 3.78Å; M417-P766 HydrophobicContact SD-CG 3.96Å
418	L	92.4	Very high	89.7	Confident	1 Å²	1	17.6 Å²	17.6	1%	0.005	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-21.6	179.2	-61.4	178.9	0	0	0	112.8	T416 V461 N462 F465 P493 F554 L594 W617 M768	T416-L418 HydrophobicContact CG2-CB 4.19Å; T416-L418 PolarHBondContact O-N 3.12Å; T416-L418 PolarHBondContact OG1-N 2.57Å; L418-V461 VanDerWaalsContact O-CA 3.25Å; L418-V461 WeakPolarHBondContact O-CA 3.34Å; L418-N462 PolarHBondContact O-N 2.88Å; L418-F465 HydrophobicContact CD2-CE1 4.39Å; L418-P493 HydrophobicContact CD1-CB 4.28Å; L418-P493 HydrophobicContact CD1-CG 4.12Å; L418-P493 HydrophobicContact CD2-CG 3.92Å; L418-P493 HydrophobicContact CG-CG 3.91Å; L418-F554 HydrophobicContact CD2-CD1 4.44Å; L418-F554 HydrophobicContact CD2-CE1 4.02Å; L418-F554 HydrophobicContact CD2-CZ 4.31Å; L418-L594 HydrophobicContact CD1-CD1 4.34Å; L418-L594 HydrophobicContact CD1-CD2 3.55Å; L418-W617 HydrophobicContact CB-CZ2 4.33Å; L418-W617 HydrophobicContact CD1-CD2 4.06Å; L418-W617 HydrophobicContact CD1-CE3 4.49Å; L418-W617 HydrophobicContact CD1-CG 4.09Å; L418-M768 HydrophobicContact CD2-SD 4.38Å
419	G	89.7	Confident	89.6	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.102	C	C	.	.			trans	74.1	-162.5	-171.7	0	0	0	0	0	112.7	T416 M417 W617	T416-G419 PolarHBondContact O-N 2.86Å; M417-G419 PolarHBondContact O-N 2.59Å; G419-W617 PolarHBondContact O-NE1 3.07Å
420	G	85.9	Confident	89.6	Confident	3 Å²	3	16 Å²	16	3%	0.031	9%	0.092	C	C	.	.			trans	82.9	30.4	-177.8	0	0	0	0	0	113.7	V459 I615	G420-V459 WeakPolarHBondContact CA-O 3.27Å; G420-V459 PolarHBondContact N-O 2.89Å; G420-I615 WeakPolarHBondContact O-CA 3.27Å; G420-I615 VanDerWaalsContact O-CB 3.22Å; G420-I615 WeakPolarHBondContact O-CB 3.3Å; G420-I615 PolarHBondContact O-N 3.34Å
421	F	87.9	Confident	89.5	Confident	19 Å²	19	21.1 Å²	21.1	8%	0.083	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	160.5	179.1	61.2	-88.3	0	0	0	110.3	A415 T416 L423 V459 I464 F488	A415-F421 HydrophobicContact CB-CD1 3.91Å; A415-F421 HydrophobicContact CB-CD2 3.89Å; A415-F421 HydrophobicContact CB-CE1 3.53Å; A415-F421 HydrophobicContact CB-CE2 3.48Å; A415-F421 VanDerWaalsContact CB-CE2 3.48Å; A415-F421 HydrophobicContact CB-CG 4.1Å; A415-F421 HydrophobicContact CB-CZ 3.32Å; T416-F421 WeakPolarHBondContact O-CE1 3.14Å; F421-L423 HydrophobicContact CD2-CD2 4.04Å; F421-L423 HydrophobicContact CD2-CG 3.91Å; F421-L423 HydrophobicContact CE2-CD1 3.79Å; F421-L423 HydrophobicContact CE2-CD2 3.74Å; F421-L423 HydrophobicContact CE2-CG 3.53Å; F421-V459 HydrophobicContact CD1-CB 4.4Å; F421-V459 HydrophobicContact CD2-CB 4.31Å; F421-V459 HydrophobicContact CD2-CG2 4.24Å; F421-V459 HydrophobicContact CE1-CB 4.07Å; F421-V459 HydrophobicContact CE1-CG1 3.92Å; F421-V459 HydrophobicContact CE2-CB 3.99Å; F421-V459 HydrophobicContact CE2-CG1 4.45Å; F421-V459 HydrophobicContact CE2-CG2 3.69Å; F421-V459 HydrophobicContact CG-CB 4.5Å; F421-V459 HydrophobicContact CZ-CB 3.83Å; F421-V459 HydrophobicContact CZ-CG1 3.81Å; F421-V459 HydrophobicContact CZ-CG2 3.86Å; F421-V459 PolarHBondContact N-O 3.18Å; F421-V459 WeakPolarHBondContact O-CB 3.44Å; F421-V459 PolarHBondContact O-N 3.42Å; F421-I464 HydrophobicContact CZ-CD1 4.34Å; F421-F488 HydrophobicContact CE2-CZ 4.14Å; F421-F488 HydrophobicContact CZ-CE1 4.43Å; F421-F488 HydrophobicContact CZ-CZ 4.15Å
422	T	86.6	Confident	89.5	Confident	11 Å²	11	25.3 Å²	25.3	7%	0.067	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	135.5	173.9	63.3	0	0	0	0	109.9	K412 R456 C457 V458 H613	K412-T422 PolarHBondContact NZ-O 3.44Å; T422-R456 HydrophobicContact CG2-CG 4.42Å; T422-C457 CarbonylContact C-O 3.54Å; T422-C457 WeakPolarHBondContact CA-O 3.4Å; T422-V458 HydrophobicContact CG2-CG2 4.18Å; T422-H613 HydrophobicContact CG2-CB 3.87Å
423	L	89.4	Confident	89.6	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	119.1	169.7	-70.7	173.2	0	0	0	108.5	K412 F421 V425 M438 I440 R456 C457 V459 F488	K412-L423 HydrophobicContact CB-CD2 4.05Å; F421-L423 HydrophobicContact CD2-CD2 4.04Å; F421-L423 HydrophobicContact CD2-CG 3.91Å; F421-L423 HydrophobicContact CE2-CD1 3.79Å; F421-L423 HydrophobicContact CE2-CD2 3.74Å; F421-L423 HydrophobicContact CE2-CG 3.53Å; L423-V425 HydrophobicContact CB-CG1 4.21Å; L423-M438 HydrophobicContact CD1-CE 4.11Å; L423-I440 HydrophobicContact CD1-CD1 4.45Å; L423-R456 CarbonylContact O-C 3.54Å; L423-R456 WeakPolarHBondContact O-CA 3.29Å; L423-C457 PolarHBondContact N-O 3.46Å; L423-C457 PolarHBondContact O-N 2.96Å; L423-V459 HydrophobicContact CD1-CG2 4.03Å; L423-V459 HydrophobicContact CG-CG2 4.33Å; L423-F488 HydrophobicContact CD1-CE2 4.26Å; L423-F488 HydrophobicContact CD1-CZ 4.27Å; L423-F488 HydrophobicContact CD2-CE2 3.97Å; L423-F488 HydrophobicContact CD2-CZ 4.3Å
424	N	89.9	Confident	89.8	Confident	5 Å²	5	26 Å²	26	3%	0.027	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	133.3	165.6	-57.7	-37.1	0	0	0	107.1	V267 D411 A455 R456	V267-N424 HydrophobicContact CG2-CB 4.07Å; V267-N424 VanDerWaalsContact CG2-O 3.22Å; V267-N424 WeakPolarHBondContact CG2-O 3.22Å; D411-N424 HydrophobicContact CB-CB 4.02Å; D411-N424 PolarHBondContact N-O 3.49Å; D411-N424 PolarHBondContact OD1-N 2.7Å; D411-N424 PolarHBondContact OD2-ND2 2.99Å; N424-A455 CarbonylContact C-O 3.53Å; N424-A455 VanDerWaalsContact CA-O 3.32Å; N424-A455 WeakPolarHBondContact CA-O 3.43Å; N424-R456 PolarHBondContact OD1-NE 3.41Å
425	V	92.2	Very high	90	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	147.8	-174	-54	0	0	0	0	110.3	L408 Q409 L410 L423 M438 M454 A455 L474	L408-V425 HydrophobicContact CD1-CB 4.1Å; L408-V425 HydrophobicContact CD1-CG2 4.36Å; L408-V425 HydrophobicContact CD2-CB 4.39Å; L408-V425 HydrophobicContact CD2-CG1 4.41Å; L408-V425 HydrophobicContact CG-CB 4.3Å; Q409-V425 WeakPolarHBondContact O-CA 3.42Å; L410-V425 HydrophobicContact CD2-CB 4.31Å; L410-V425 HydrophobicContact CD2-CG1 3.64Å; L423-V425 HydrophobicContact CB-CG1 4.21Å; V425-M438 HydrophobicContact CG1-SD 4.47Å; V425-M454 WeakPolarHBondContact O-CA 3.05Å; V425-A455 HydrophobicContact CG2-CB 4Å; V425-A455 PolarHBondContact N-O 3.3Å; V425-A455 PolarHBondContact O-N 3.47Å; V425-L474 HydrophobicContact CG2-CD1 4.45Å; V425-L474 HydrophobicContact CG2-CD2 3.98Å
426	T	90.5	Very high	90.2	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	161.2	171.8	-168.2	0	0	0	0	110.4	V267 G399 L408 Q409 V453	V267-T426 HydrophobicContact CB-CG2 3.63Å; V267-T426 HydrophobicContact CG1-CG2 3.47Å; V267-T426 VanDerWaalsContact CG1-CG2 3.47Å; G399-T426 PolarHBondContact O-OG1 3.33Å; L408-T426 CarbonylContact C-O 3.58Å; L408-T426 WeakPolarHBondContact CD1-O 3.42Å; Q409-T426 HydrophobicContact CB-CG2 3.61Å; Q409-T426 HydrophobicContact CG-CG2 4.42Å; Q409-T426 PolarHBondContact N-O 2.93Å; Q409-T426 PolarHBondContact O-N 3.45Å; T426-V453 VanDerWaalsContact CB-O 3.28Å; T426-V453 WeakPolarHBondContact CB-O 3.45Å; T426-V453 WeakPolarHBondContact OG1-CG1 3.39Å; T426-V453 PolarHBondContact OG1-O 2.94Å
427	G	88.9	Confident	90.3	Very high	8 Å²	8	30.3 Å²	30.3	8%	0.082	16%	0.164	C	C	.	.	S	Bend	trans	160.5	-82.5	-173.7	0	0	0	0	0	109.4	S401 W484	S401-G427 PolarHBondContact N-O 2.68Å; G427-W484 VanDerWaalsContact C-CZ3 3.42Å; G427-W484 WeakPolarHBondContact O-CH2 3.48Å
428	P	90.5	Very high	90.3	Very high	9 Å²	9	30.3 Å²	30.3	6%	0.058	16%	0.164	C	C	.	.	B	Isolated β-bridge	trans	-75.5	150.8	173.4	26.3	-26	0	0	0	112.4	S401 F430 L474 V476 W484	S401-P428 CarbonylContact O-C 3.57Å; S401-P428 WeakPolarHBondContact O-CA 3.44Å; P428-F430 HydrophobicContact CB-CE1 4.5Å; P428-F430 HydrophobicContact CG-CD1 4.23Å; P428-F430 HydrophobicContact CG-CE1 3.54Å; P428-F430 HydrophobicContact CG-CZ 3.82Å; P428-F430 PolarHBondContact O-N 3.11Å; P428-L474 HydrophobicContact CG-CD2 4.14Å; P428-V476 HydrophobicContact CB-CG1 4.18Å; P428-V476 HydrophobicContact CG-CG1 3.84Å; P428-W484 HydrophobicContact CB-CD2 4.27Å; P428-W484 HydrophobicContact CB-CZ2 3.82Å; P428-W484 HydrophobicContact CG-CD2 4.09Å; P428-W484 HydrophobicContact CG-CG 4.02Å
429	C	89.1	Confident	90.4	Very high	13 Å²	13	32.5 Å²	32.5	9%	0.088	18%	0.175	C	C	.	.			trans	-77	110.5	168.7	-64.5	0	0	0	0	111.3	S46 C400 S401 N402 M452	S46-C429 VanDerWaalsContact CB-SG 3.6Å; C400-C429 HydrophobicContact CB-CB 3.92Å; C400-C429 WeakPolarHBondContact CB-SG 3.27Å; C400-C429 PolarHBondContact O-SG 2.9Å; C400-C429 WeakPolarHBondContact SG-CA 3.47Å; C400-C429 WeakPolarHBondContact SG-CB 3.26Å; C400-C429 CovalentContact SG-SG 2.04Å; C400-C429 PolarHBondContact SG-SG 2.68Å; S401-C429 PolarHBondContact O-N 3.03Å; N402-C429 WeakPolarHBondContact ND2-CB 3.36Å; N402-C429 PolarHBondContact ND2-SG 2.81Å; C429-M452 CarbonylContact C-O 3.6Å; C429-M452 WeakPolarHBondContact CA-O 3.12Å
430	F	90.4	Very high	90.4	Very high	4 Å²	4	32.6 Å²	32.6	2%	0.018	18%	0.175	C	C	.	.			trans	-80.1	125.2	-173.7	-56.1	-67.6	0	0	0	112.9	P428 L436 R449 M452 V453 A455 L474 V476	P428-F430 HydrophobicContact CB-CE1 4.5Å; P428-F430 HydrophobicContact CG-CD1 4.23Å; P428-F430 HydrophobicContact CG-CE1 3.54Å; P428-F430 HydrophobicContact CG-CZ 3.82Å; P428-F430 PolarHBondContact O-N 3.11Å; F430-L436 HydrophobicContact CD1-CD1 3.77Å; F430-L436 HydrophobicContact CD1-CD2 3.58Å; F430-L436 HydrophobicContact CD1-CG 4.34Å; F430-L436 HydrophobicContact CE1-CD1 3.96Å; F430-L436 HydrophobicContact CE1-CD2 3.86Å; F430-L436 HydrophobicContact CG-CD1 4.28Å; F430-R449 HydrophobicContact CB-CG 3.79Å; F430-R449 PolarHBondContact O-NH1 3.22Å; F430-M452 PolarHBondContact N-O 3.32Å; F430-M452 WeakPolarHBondContact O-CA 3.19Å; F430-V453 WeakPolarHBondContact CE2-O 3.43Å; F430-A455 HydrophobicContact CD2-CB 4.07Å; F430-A455 HydrophobicContact CE1-CB 4.11Å; F430-A455 HydrophobicContact CE2-CB 3.62Å; F430-A455 HydrophobicContact CZ-CB 3.63Å; F430-L474 HydrophobicContact CE1-CD2 3.65Å; F430-L474 HydrophobicContact CZ-CD2 3.61Å; F430-V476 HydrophobicContact CD1-CG1 4.19Å; F430-V476 HydrophobicContact CE1-CG1 4.11Å
431	R	89.2	Confident	90.2	Very high	131 Å²	131	34.3 Å²	34.3	49%	0.494	18%	0.183	S	C	.	.			trans	-88.6	157.2	172.7	-54.7	175.5	179.9	176.2	0.8	110.3	T433 D434 R449	R431-T433 PolarHBondContact O-N 2.99Å; R431-D434 PolarHBondContact N-OD2 2.85Å; R431-D434 PolarHBondContact O-N 2.71Å; R431-D434 VanDerWaalsContact O-N 3.16Å; R431-R449 WeakPolarHBondContact O-CD 3.11Å
432	V	88.8	Confident	89.8	Confident	122 Å²	122	40.2 Å²	40.2	74%	0.739	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-26.6	178.6	-176.8	0	0	0	0	112
433	T	90	Very high	89.8	Confident	120 Å²	120	41.9 Å²	41.9	74%	0.736	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-5.1	-179.6	54.6	0	0	0	0	114.4	R431	R431-T433 PolarHBondContact O-N 2.99Å
434	D	90.4	Very high	89.9	Confident	44 Å²	44	45.5 Å²	45.5	24%	0.235	24%	0.242	C	C	.	.			trans	-73.8	142	-175.1	-66.7	-13.9	0	0	0	110.8	R431 L436	R431-D434 PolarHBondContact N-OD2 2.85Å; R431-D434 PolarHBondContact O-N 2.71Å; R431-D434 VanDerWaalsContact O-N 3.16Å; D434-L436 HydrophobicContact CB-CD2 3.83Å
435	V	93.1	Very high	89.8	Confident	83 Å²	83	46.1 Å²	46.1	50%	0.503	25%	0.245	S	C	.	.	B	Isolated β-bridge	trans	-107.6	104.1	177.1	-177.6	0	0	0	0	108.1	V476 G478	V435-V476 PolarHBondContact N-O 3.33Å; V435-V476 CarbonylContact O-C 3.49Å; V435-V476 VanDerWaalsContact O-C 3.3Å; V435-G478 WeakPolarHBondContact O-CA 3.37Å; V435-G478 PolarHBondContact O-N 3.39Å
436	L	94.6	Very high	89.6	Confident	8 Å²	8	51.1 Å²	51.1	4%	0.042	27%	0.272	C	S	.	.			trans	-89	125.8	-169.6	-51.1	-175.2	0	0	0	111.2	F430 D434 C447 R449 A455 S475 V476	F430-L436 HydrophobicContact CD1-CD1 3.77Å; F430-L436 HydrophobicContact CD1-CD2 3.58Å; F430-L436 HydrophobicContact CD1-CG 4.34Å; F430-L436 HydrophobicContact CE1-CD1 3.96Å; F430-L436 HydrophobicContact CE1-CD2 3.86Å; F430-L436 HydrophobicContact CG-CD1 4.28Å; D434-L436 HydrophobicContact CB-CD2 3.83Å; L436-C447 HydrophobicContact CB-CB 3.68Å; L436-C447 PolarHBondContact O-N 3.01Å; L436-R449 HydrophobicContact CD1-CB 4.25Å; L436-A455 HydrophobicContact CD1-CB 3.45Å; L436-A455 VanDerWaalsContact CD1-CB 3.45Å; L436-S475 WeakPolarHBondContact CA-O 3.19Å; L436-V476 HydrophobicContact CD2-CB 4.16Å; L436-V476 HydrophobicContact CD2-CG1 3.91Å
437	K	93.9	Very high	89.6	Confident	56 Å²	56	52.1 Å²	52.1	24%	0.243	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	133.9	174.4	-63	-70.5	-171.6	169.3	0	109	T444 L445 D446 S475	K437-T444 HydrophobicContact CB-CG2 4.21Å; K437-T444 HydrophobicContact CD-CG2 4.43Å; K437-L445 WeakPolarHBondContact CA-O 3.05Å; K437-D446 VanDerWaalsContact CD-OD1 3.24Å; K437-D446 WeakPolarHBondContact CD-OD1 3.49Å; K437-D446 VanDerWaalsContact CE-OD1 3.3Å; K437-D446 WeakPolarHBondContact CE-OD1 3.43Å; K437-D446 IonicContact NZ-OD1 3.74Å; K437-D446 PolarHBondContact NZ-OD1 3.1Å; K437-S475 PolarHBondContact N-O 2.66Å; K437-S475 WeakPolarHBondContact O-CB 3.42Å; K437-S475 PolarHBondContact O-N 3.3Å
438	M	93.8	Very high	89.6	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	133.7	174.8	-177.6	179	67.7	0	0	110	L423 V425 I440 T444 L445 C447 C457 V459 R473 L474	L423-M438 HydrophobicContact CD1-CE 4.11Å; V425-M438 HydrophobicContact CG1-SD 4.47Å; M438-I440 HydrophobicContact CE-CD1 3.72Å; M438-I440 HydrophobicContact CE-CG1 3.84Å; M438-I440 HydrophobicContact CG-CG1 4.49Å; M438-T444 CarbonylContact O-C 3.59Å; M438-T444 WeakPolarHBondContact O-CA 3.16Å; M438-L445 HydrophobicContact CE-CD1 4.26Å; M438-L445 PolarHBondContact N-O 3.04Å; M438-L445 PolarHBondContact O-N 2.85Å; M438-C447 WeakPolarHBondContact CB-SG 3.43Å; M438-C457 HydrophobicContact CB-CB 4.46Å; M438-C457 HydrophobicContact CE-CB 3.4Å; M438-C457 VanDerWaalsContact CE-CB 3.4Å; M438-C457 HydrophobicContact SD-CB 3.97Å; M438-V459 HydrophobicContact CE-CG2 4.18Å; M438-R473 CarbonylContact C-O 3.58Å; M438-R473 VanDerWaalsContact CA-O 3.29Å; M438-R473 WeakPolarHBondContact CA-O 3.11Å; M438-R473 WeakPolarHBondContact CG-O 3.22Å; M438-L474 HydrophobicContact CB-CD1 4.06Å
439	Q	93.2	Very high	89.6	Confident	47 Å²	47	59.2 Å²	59.2	22%	0.22	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	123	172.6	-174.7	178.2	-6.7	0	0	109.3	D441 N443 I472 R473 Y482	Q439-D441 WeakPolarHBondContact CG-O 3.41Å; Q439-D441 PolarHBondContact NE2-O 3.48Å; Q439-N443 CarbonylContact C-O 3.56Å; Q439-N443 VanDerWaalsContact CA-O 3.29Å; Q439-N443 WeakPolarHBondContact CA-O 3.4Å; Q439-I472 CarbonylContact O-C 3.54Å; Q439-I472 VanDerWaalsContact O-CA 3.28Å; Q439-I472 WeakPolarHBondContact O-CA 3.41Å; Q439-R473 PolarHBondContact N-O 2.58Å; Q439-R473 PolarHBondContact O-N 3.4Å; Q439-Y482 HydrophobicContact CB-CD1 4.12Å; Q439-Y482 HydrophobicContact CB-CE1 3.7Å
440	I	89.5	Confident	89.5	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.005	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	111.8	168.1	-54.1	-176.7	0	0	0	107.1	L423 M438 E442 N443 L445 V459 I464 V470 I472	L423-I440 HydrophobicContact CD1-CD1 4.45Å; M438-I440 HydrophobicContact CE-CD1 3.72Å; M438-I440 HydrophobicContact CE-CG1 3.84Å; M438-I440 HydrophobicContact CG-CG1 4.49Å; I440-E442 PolarHBondContact O-N 3.44Å; I440-N443 PolarHBondContact N-O 3.41Å; I440-N443 PolarHBondContact O-N 2.8Å; I440-L445 HydrophobicContact CD1-CD1 3.86Å; I440-L445 HydrophobicContact CG1-CD1 4.18Å; I440-V459 HydrophobicContact CD1-CG1 4.22Å; I440-V459 HydrophobicContact CD1-CG2 3.7Å; I440-I464 HydrophobicContact CD1-CD1 4.41Å; I440-I464 HydrophobicContact CG2-CD1 4.37Å; I440-V470 HydrophobicContact CG2-CG2 4.03Å; I440-I472 HydrophobicContact CB-CG2 4.28Å; I440-I472 HydrophobicContact CG1-CG2 3.91Å; I440-I472 HydrophobicContact CG2-CG2 4.07Å
441	D	81.6	Confident	89.3	Confident	39 Å²	39	61.5 Å²	61.5	21%	0.209	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.6	-107	-174.9	-158.7	42.3	0	0	0	110.7	Q439 K466 I471	Q439-D441 WeakPolarHBondContact CG-O 3.41Å; Q439-D441 PolarHBondContact NE2-O 3.48Å; D441-K466 VanDerWaalsContact CG-NZ 3.29Å; D441-K466 IonicContact OD1-NZ 3.17Å; D441-K466 PolarHBondContact OD1-NZ 2.81Å; D441-K466 WeakPolarHBondContact OD2-CD 3.24Å; D441-K466 IonicContact OD2-NZ 2.99Å; D441-K466 PolarHBondContact OD2-NZ 2.91Å; D441-I471 PolarHBondContact N-O 2.86Å
442	E	80.7	Confident	89.3	Confident	144 Å²	144	57 Å²	57	67%	0.673	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	-7.5	178.9	-63.5	168.2	161.9	0	0	113.3	I440 K760	I440-E442 PolarHBondContact O-N 3.44Å; E442-K760 IonicContact OE2-NZ 2.71Å; E442-K760 PolarHBondContact OE2-NZ 3.38Å
443	N	86.3	Confident	89.2	Confident	45 Å²	45	51.1 Å²	51.1	24%	0.241	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	127.8	-172.2	-61.6	-41.2	0	0	0	111.7	Q439 I440 S463	Q439-N443 CarbonylContact C-O 3.56Å; Q439-N443 VanDerWaalsContact CA-O 3.29Å; Q439-N443 WeakPolarHBondContact CA-O 3.4Å; I440-N443 PolarHBondContact N-O 3.41Å; I440-N443 PolarHBondContact O-N 2.8Å; N443-S463 PolarHBondContact ND2-O 2.94Å
444	T	90.6	Very high	89.2	Confident	76 Å²	76	45.7 Å²	45.7	47%	0.466	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	132.7	174	-55.1	0	0	0	0	110.6	K437 M438 Y482	K437-T444 HydrophobicContact CB-CG2 4.21Å; K437-T444 HydrophobicContact CD-CG2 4.43Å; M438-T444 CarbonylContact O-C 3.59Å; M438-T444 WeakPolarHBondContact O-CA 3.16Å; T444-Y482 WeakPolarHBondContact CG2-OH 3.22Å
445	L	88.9	Confident	89.3	Confident	18 Å²	18	43.6 Å²	43.6	9%	0.094	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	154.7	-173.5	-55.8	170.9	0	0	0	110.6	K437 M438 I440 V459 P460	K437-L445 WeakPolarHBondContact CA-O 3.05Å; M438-L445 HydrophobicContact CE-CD1 4.26Å; M438-L445 PolarHBondContact N-O 3.04Å; M438-L445 PolarHBondContact O-N 2.85Å; I440-L445 HydrophobicContact CD1-CD1 3.86Å; I440-L445 HydrophobicContact CG1-CD1 4.18Å; L445-V459 HydrophobicContact CD1-CB 4.35Å; L445-V459 HydrophobicContact CD1-CG1 4.22Å; L445-V459 HydrophobicContact CD1-CG2 4.06Å; L445-P460 HydrophobicContact CD2-CG 3.65Å
446	D	87.4	Confident	89.2	Confident	106 Å²	106	40.6 Å²	40.6	57%	0.567	20%	0.2	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-84.2	142.1	177	-68.8	-34.7	0	0	0	112	K437	K437-D446 VanDerWaalsContact CD-OD1 3.24Å; K437-D446 WeakPolarHBondContact CD-OD1 3.49Å; K437-D446 VanDerWaalsContact CE-OD1 3.3Å; K437-D446 WeakPolarHBondContact CE-OD1 3.43Å; K437-D446 IonicContact NZ-OD1 3.74Å; K437-D446 PolarHBondContact NZ-OD1 3.1Å
447	C	91.8	Very high	89	Confident	20 Å²	20	40.2 Å²	40.2	14%	0.135	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	149.1	174.5	-52.2	0	0	0	0	110.8	L436 M438 R456 C457	L436-C447 HydrophobicContact CB-CB 3.68Å; L436-C447 PolarHBondContact O-N 3.01Å; M438-C447 WeakPolarHBondContact CB-SG 3.43Å; C447-R456 CarbonylContact C-O 3.57Å; C447-R456 VanDerWaalsContact CA-O 3.27Å; C447-R456 WeakPolarHBondContact CA-O 3.43Å; C447-C457 HydrophobicContact CB-CB 3.99Å; C447-C457 WeakPolarHBondContact CB-SG 3.23Å; C447-C457 WeakPolarHBondContact SG-CB 3.47Å; C447-C457 CovalentContact SG-SG 2.03Å; C447-C457 PolarHBondContact SG-SG 2.91Å
448	E	88.5	Confident	88.6	Confident	70 Å²	70	39.7 Å²	39.7	33%	0.327	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	145.9	174.6	64.6	-179.5	-174.7	0	0	110.6	A455 R456	E448-A455 CarbonylContact O-C 3.46Å; E448-A455 VanDerWaalsContact O-CA 3.27Å; E448-A455 WeakPolarHBondContact O-CA 3.4Å; E448-A455 WeakPolarHBondContact O-CB 3.37Å; E448-R456 HydrophobicContact CG-CB 3.87Å; E448-R456 PolarHBondContact N-O 3.11Å; E448-R456 PolarHBondContact O-N 3.36Å; E448-R456 WeakPolarHBondContact OE1-CD 3.33Å; E448-R456 IonicContact OE1-NH1 3.98Å
449	R	90.1	Very high	88.4	Confident	96 Å²	96	39.7 Å²	39.7	36%	0.362	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	122.9	173.2	-170.2	-171.1	91.8	98.9	8.8	109.1	F430 R431 L436 D451 M452	F430-R449 HydrophobicContact CB-CG 3.79Å; F430-R449 PolarHBondContact O-NH1 3.22Å; R431-R449 WeakPolarHBondContact O-CD 3.11Å; L436-R449 HydrophobicContact CD1-CB 4.25Å; R449-D451 WeakPolarHBondContact CG-O 3.43Å; R449-D451 PolarHBondContact NH1-O 3.36Å; R449-M452 VanDerWaalsContact NH1-N 3.11Å
450	L	86.4	Confident	88.2	Confident	48 Å²	48	40.2 Å²	40.2	25%	0.251	21%	0.207	S	C	.	.			trans	-83.2	-49.2	169.8	-61.5	-179.7	0	0	0	109.8	M454 R456	L450-M454 HydrophobicContact CB-CB 4.5Å; L450-M454 WeakPolarHBondContact CB-O 3.2Å; L450-M454 HydrophobicContact CD1-CB 4.45Å; L450-M454 PolarHBondContact N-O 2.98Å; L450-R456 HydrophobicContact CD1-CB 4.08Å; L450-R456 HydrophobicContact CD2-CB 4.06Å; L450-R456 HydrophobicContact CG-CB 4Å
451	D	86.8	Confident	88.2	Confident	18 Å²	18	41.9 Å²	41.9	10%	0.096	22%	0.217	C	C	.	.	S	Bend	trans	-154.8	-165	177.8	58.9	49.8	0	0	0	110.4	Q382 R449 V453 M454	Q382-D451 PolarHBondContact NE2-OD1 2.94Å; Q382-D451 PolarHBondContact NE2-OD2 3.38Å; Q382-D451 VanDerWaalsContact NE2-OD2 3.11Å; R449-D451 WeakPolarHBondContact CG-O 3.43Å; R449-D451 PolarHBondContact NH1-O 3.36Å; D451-V453 VanDerWaalsContact C-N 3.26Å; D451-V453 PolarHBondContact O-N 2.88Å; D451-V453 WeakPolarHBondContact OD1-CA 3.37Å; D451-V453 WeakPolarHBondContact OD1-CB 3.33Å; D451-V453 PolarHBondContact OD1-N 3.05Å; D451-M454 PolarHBondContact N-O 3.09Å; D451-M454 VanDerWaalsContact N-O 3.12Å; D451-M454 PolarHBondContact OD1-N 3.34Å
452	M	88.2	Confident	88.4	Confident	35 Å²	35	43.2 Å²	43.2	17%	0.172	23%	0.225	C	C	.	.	S	Bend	trans	-71.9	-20.4	-179.3	64.5	174.6	-88	0	0	113.6	I50 Q382 C429 F430 R449	I50-M452 HydrophobicContact CD1-CE 4.27Å; I50-M452 HydrophobicContact CD1-SD 4.14Å; Q382-M452 HydrophobicContact CB-CG 4.36Å; Q382-M452 HydrophobicContact CB-SD 4.01Å; Q382-M452 HydrophobicContact CG-CG 3.71Å; Q382-M452 HydrophobicContact CG-SD 4.03Å; C429-M452 CarbonylContact C-O 3.6Å; C429-M452 WeakPolarHBondContact CA-O 3.12Å; F430-M452 PolarHBondContact N-O 3.32Å; F430-M452 WeakPolarHBondContact O-CA 3.19Å; R449-M452 VanDerWaalsContact NH1-N 3.11Å
453	V	88.5	Confident	88.6	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.2	C	C	.	.	S	Bend	trans	-98.7	-38.5	-176.6	179	0	0	0	0	111.3	Q382 C400 T426 F430 D451	Q382-V453 HydrophobicContact CG-CG2 4.13Å; C400-V453 HydrophobicContact CB-CB 4.48Å; C400-V453 HydrophobicContact CB-CG1 4.36Å; C400-V453 HydrophobicContact CB-CG2 4.43Å; T426-V453 VanDerWaalsContact CB-O 3.28Å; T426-V453 WeakPolarHBondContact CB-O 3.45Å; T426-V453 WeakPolarHBondContact OG1-CG1 3.39Å; T426-V453 PolarHBondContact OG1-O 2.94Å; F430-V453 WeakPolarHBondContact CE2-O 3.43Å; D451-V453 VanDerWaalsContact C-N 3.26Å; D451-V453 PolarHBondContact O-N 2.88Å; D451-V453 WeakPolarHBondContact OD1-CA 3.37Å; D451-V453 WeakPolarHBondContact OD1-CB 3.33Å; D451-V453 PolarHBondContact OD1-N 3.05Å
454	M	89.8	Confident	88.7	Confident	6 Å²	6	35.4 Å²	35.4	3%	0.03	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	141.2	-171.4	-71.8	-176.5	-74.2	0	0	113	H264 V425 L450 D451	H264-M454 VanDerWaalsContact O-CE 3.3Å; H264-M454 WeakPolarHBondContact O-CE 3.36Å; V425-M454 WeakPolarHBondContact O-CA 3.05Å; L450-M454 HydrophobicContact CB-CB 4.5Å; L450-M454 WeakPolarHBondContact CB-O 3.2Å; L450-M454 HydrophobicContact CD1-CB 4.45Å; L450-M454 PolarHBondContact N-O 2.98Å; D451-M454 PolarHBondContact N-O 3.09Å; D451-M454 VanDerWaalsContact N-O 3.12Å; D451-M454 PolarHBondContact OD1-N 3.34Å
455	A	91.6	Very high	88.6	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	156.6	166.8	0	0	0	0	0	109.9	N424 V425 F430 L436 E448	N424-A455 CarbonylContact C-O 3.53Å; N424-A455 VanDerWaalsContact CA-O 3.32Å; N424-A455 WeakPolarHBondContact CA-O 3.43Å; V425-A455 HydrophobicContact CG2-CB 4Å; V425-A455 PolarHBondContact N-O 3.3Å; V425-A455 PolarHBondContact O-N 3.47Å; F430-A455 HydrophobicContact CD2-CB 4.07Å; F430-A455 HydrophobicContact CE1-CB 4.11Å; F430-A455 HydrophobicContact CE2-CB 3.62Å; F430-A455 HydrophobicContact CZ-CB 3.63Å; L436-A455 HydrophobicContact CD1-CB 3.45Å; L436-A455 VanDerWaalsContact CD1-CB 3.45Å; E448-A455 CarbonylContact O-C 3.46Å; E448-A455 VanDerWaalsContact O-CA 3.27Å; E448-A455 WeakPolarHBondContact O-CA 3.4Å; E448-A455 WeakPolarHBondContact O-CB 3.37Å
456	R	90.5	Very high	88.6	Confident	19 Å²	19	33.5 Å²	33.5	7%	0.072	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	127.9	174.2	178.3	177.4	-64.5	164.3	4	109.6	T422 L423 N424 C447 E448 L450 Y611	T422-R456 HydrophobicContact CG2-CG 4.42Å; L423-R456 CarbonylContact O-C 3.54Å; L423-R456 WeakPolarHBondContact O-CA 3.29Å; N424-R456 PolarHBondContact OD1-NE 3.41Å; C447-R456 CarbonylContact C-O 3.57Å; C447-R456 VanDerWaalsContact CA-O 3.27Å; C447-R456 WeakPolarHBondContact CA-O 3.43Å; E448-R456 HydrophobicContact CG-CB 3.87Å; E448-R456 PolarHBondContact N-O 3.11Å; E448-R456 PolarHBondContact O-N 3.36Å; E448-R456 WeakPolarHBondContact OE1-CD 3.33Å; E448-R456 IonicContact OE1-NH1 3.98Å; L450-R456 HydrophobicContact CD1-CB 4.08Å; L450-R456 HydrophobicContact CD2-CB 4.06Å; L450-R456 HydrophobicContact CG-CB 4Å; R456-Y611 PolarHBondContact NH1-O 2.95Å; R456-Y611 VanDerWaalsContact NH1-O 3.16Å
457	C	90.9	Very high	88.7	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	131.8	174.6	-57.4	0	0	0	0	109.7	T422 L423 M438 C447	T422-C457 CarbonylContact C-O 3.54Å; T422-C457 WeakPolarHBondContact CA-O 3.4Å; L423-C457 PolarHBondContact N-O 3.46Å; L423-C457 PolarHBondContact O-N 2.96Å; M438-C457 HydrophobicContact CB-CB 4.46Å; M438-C457 HydrophobicContact CE-CB 3.4Å; M438-C457 VanDerWaalsContact CE-CB 3.4Å; M438-C457 HydrophobicContact SD-CB 3.97Å; C447-C457 HydrophobicContact CB-CB 3.99Å; C447-C457 WeakPolarHBondContact CB-SG 3.23Å; C447-C457 WeakPolarHBondContact SG-CB 3.47Å; C447-C457 CovalentContact SG-SG 2.03Å; C447-C457 PolarHBondContact SG-SG 2.91Å
458	V	85.5	Confident	88.6	Confident	45 Å²	45	28.6 Å²	28.6	27%	0.273	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	117.9	177.3	-176.8	0	0	0	0	108.3	T422 P460 H613	T422-V458 HydrophobicContact CG2-CG2 4.18Å; V458-P460 WeakPolarHBondContact O-CD 3.41Å; V458-H613 HydrophobicContact CG1-CB 3.91Å; V458-H613 HydrophobicContact CG2-CB 4.36Å
459	V	89.7	Confident	88.6	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	107.6	174.9	-176.5	0	0	0	0	108.2	G420 F421 L423 M438 I440 L445 I464	G420-V459 WeakPolarHBondContact CA-O 3.27Å; G420-V459 PolarHBondContact N-O 2.89Å; F421-V459 HydrophobicContact CD1-CB 4.4Å; F421-V459 HydrophobicContact CD2-CB 4.31Å; F421-V459 HydrophobicContact CD2-CG2 4.24Å; F421-V459 HydrophobicContact CE1-CB 4.07Å; F421-V459 HydrophobicContact CE1-CG1 3.92Å; F421-V459 HydrophobicContact CE2-CB 3.99Å; F421-V459 HydrophobicContact CE2-CG1 4.45Å; F421-V459 HydrophobicContact CE2-CG2 3.69Å; F421-V459 HydrophobicContact CG-CB 4.5Å; F421-V459 HydrophobicContact CZ-CB 3.83Å; F421-V459 HydrophobicContact CZ-CG1 3.81Å; F421-V459 HydrophobicContact CZ-CG2 3.86Å; F421-V459 PolarHBondContact N-O 3.18Å; F421-V459 WeakPolarHBondContact O-CB 3.44Å; F421-V459 PolarHBondContact O-N 3.42Å; L423-V459 HydrophobicContact CD1-CG2 4.03Å; L423-V459 HydrophobicContact CG-CG2 4.33Å; M438-V459 HydrophobicContact CE-CG2 4.18Å; I440-V459 HydrophobicContact CD1-CG1 4.22Å; I440-V459 HydrophobicContact CD1-CG2 3.7Å; L445-V459 HydrophobicContact CD1-CB 4.35Å; L445-V459 HydrophobicContact CD1-CG1 4.22Å; L445-V459 HydrophobicContact CD1-CG2 4.06Å; V459-I464 HydrophobicContact CG1-CD1 3.89Å; V459-I464 HydrophobicContact CG1-CG1 4.36Å
460	P	88.8	Confident	88.6	Confident	58 Å²	58	24.6 Å²	24.6	38%	0.377	13%	0.134	S	C	.	.			trans	-71.5	158.9	-176.3	30.6	-34.5	0	0	0	110.7	L445 V458 S463	L445-P460 HydrophobicContact CD2-CG 3.65Å; V458-P460 WeakPolarHBondContact O-CD 3.41Å; P460-S463 PolarHBondContact O-OG 3.1Å
461	V	89.2	Confident	88.8	Confident	36 Å²	36	25.5 Å²	25.5	22%	0.218	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	155.5	170.3	-56	0	0	0	0	110.6	L418 S463 W543 I615 W617	L418-V461 VanDerWaalsContact O-CA 3.25Å; L418-V461 WeakPolarHBondContact O-CA 3.34Å; V461-S463 VanDerWaalsContact C-N 3.26Å; V461-S463 PolarHBondContact O-N 3.28Å; V461-W543 HydrophobicContact CB-CH2 4.45Å; V461-W543 HydrophobicContact CG2-CH2 3.64Å; V461-W543 HydrophobicContact CG2-CZ3 4Å; V461-I615 HydrophobicContact CG1-CD1 3.62Å; V461-W617 HydrophobicContact CG1-CH2 4.24Å; V461-W617 HydrophobicContact CG1-CZ2 3.66Å
462	N	87.2	Confident	89.1	Confident	68 Å²	68	24.6 Å²	24.6	36%	0.364	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.6	15.7	-179.3	-66.2	-31.3	0	0	0	117.4	L418 F465 F554	L418-N462 PolarHBondContact O-N 2.88Å; N462-F465 VanDerWaalsContact CA-CE2 3.49Å; N462-F465 HydrophobicContact CB-CE2 3.99Å; N462-F465 VanDerWaalsContact OD1-CE2 3.25Å; N462-F465 WeakPolarHBondContact OD1-CE2 3.34Å; N462-F465 WeakPolarHBondContact OD1-CZ 3.31Å; N462-F554 PolarHBondContact ND2-O 2.88Å; N462-F554 WeakPolarHBondContact OD1-CB 3.4Å; N462-F554 VanDerWaalsContact OD1-CD1 3.23Å; N462-F554 WeakPolarHBondContact OD1-CD1 3.48Å; N462-F554 PolarHBondContact OD1-O 2.83Å
463	S	85	Confident	89.4	Confident	21 Å²	21	27 Å²	27	15%	0.147	14%	0.14	C	C	.	.	S	Bend	trans	-88.9	-49.7	-178.1	52.9	0	0	0	0	113.3	N443 P460 V461	N443-S463 PolarHBondContact ND2-O 2.94Å; P460-S463 PolarHBondContact O-OG 3.1Å; V461-S463 VanDerWaalsContact C-N 3.26Å; V461-S463 PolarHBondContact O-N 3.28Å
464	I	88.4	Confident	89.7	Confident	4 Å²	4	27 Å²	27	2%	0.021	14%	0.14	C	C	.	.			trans	-88.7	-57.7	-162.3	-54.2	174.8	0	0	0	113.6	F421 I440 V459 K466 V490 K760	F421-I464 HydrophobicContact CZ-CD1 4.34Å; I440-I464 HydrophobicContact CD1-CD1 4.41Å; I440-I464 HydrophobicContact CG2-CD1 4.37Å; V459-I464 HydrophobicContact CG1-CD1 3.89Å; V459-I464 HydrophobicContact CG1-CG1 4.36Å; I464-K466 VanDerWaalsContact C-N 3.26Å; I464-K466 HydrophobicContact CG2-CB 4.2Å; I464-K466 PolarHBondContact O-N 3.41Å; I464-K466 VanDerWaalsContact O-N 3.11Å; I464-V490 HydrophobicContact CG2-CG1 3.9Å; I464-V490 HydrophobicContact CG2-CG2 4.1Å; I464-K760 WeakPolarHBondContact O-CE 3.49Å
465	F	87.9	Confident	89.9	Confident	8 Å²	8	26.7 Å²	26.7	4%	0.035	14%	0.139	C	C	.	.			trans	40.2	45.7	-177	-74.8	-78.2	0	0	0	115.9	M417 L418 N462 H552 F554 K760 V765	M417-F465 VanDerWaalsContact CE-CA 3.49Å; M417-F465 HydrophobicContact CE-CB 4.05Å; M417-F465 HydrophobicContact CE-CD1 3.45Å; M417-F465 VanDerWaalsContact CE-CD1 3.45Å; M417-F465 HydrophobicContact CE-CE1 4.31Å; M417-F465 HydrophobicContact CE-CG 4.14Å; M417-F465 PolarHBondContact O-N 3.5Å; L418-F465 HydrophobicContact CD2-CE1 4.39Å; N462-F465 VanDerWaalsContact CA-CE2 3.49Å; N462-F465 HydrophobicContact CB-CE2 3.99Å; N462-F465 VanDerWaalsContact OD1-CE2 3.25Å; N462-F465 WeakPolarHBondContact OD1-CE2 3.34Å; N462-F465 WeakPolarHBondContact OD1-CZ 3.31Å; F465-H552 AromaticContact CD1-CE1 3.8Å; F465-H552 AromaticContact CD2-CE1 3.63Å; F465-H552 AromaticContact CE1-CE1 3.82Å; F465-H552 AromaticContact CE2-CE1 3.54Å; F465-H552 AromaticContact CG-CE1 3.76Å; F465-H552 AromaticContact CZ-CE1 3.7Å; F465-F554 HydrophobicContact CZ-CB 3.75Å; F465-F554 HydrophobicContact CZ-CD1 4.01Å; F465-F554 HydrophobicContact CZ-CG 4.16Å; F465-K760 HydrophobicContact CB-CG 4.4Å; F465-V765 HydrophobicContact CD1-CG1 3.83Å; F465-V765 HydrophobicContact CE1-CG1 4.44Å
466	K	88.4	Confident	89.9	Confident	46 Å²	46	28.6 Å²	28.6	20%	0.2	15%	0.151	C	C	.	.			trans	-144.5	156.2	179.9	-174.3	177.3	-174.8	179.3	0	109	M417 D441 I464 V470 V490 Y759	M417-K466 VanDerWaalsContact CB-O 3.24Å; M417-K466 WeakPolarHBondContact CB-O 3.43Å; D441-K466 VanDerWaalsContact CG-NZ 3.29Å; D441-K466 IonicContact OD1-NZ 3.17Å; D441-K466 PolarHBondContact OD1-NZ 2.81Å; D441-K466 WeakPolarHBondContact OD2-CD 3.24Å; D441-K466 IonicContact OD2-NZ 2.99Å; D441-K466 PolarHBondContact OD2-NZ 2.91Å; I464-K466 VanDerWaalsContact C-N 3.26Å; I464-K466 HydrophobicContact CG2-CB 4.2Å; I464-K466 PolarHBondContact O-N 3.41Å; I464-K466 VanDerWaalsContact O-N 3.11Å; K466-V470 HydrophobicContact CD-CG1 4.08Å; K466-V490 WeakPolarHBondContact O-CB 3.47Å; K466-V490 WeakPolarHBondContact O-CG1 3.38Å; K466-Y759 HydrophobicContact CG-CD2 3.81Å; K466-Y759 HydrophobicContact CG-CE2 4.41Å; K466-Y759 HydrophobicContact CG-CG 4.41Å
467	T	89.9	Confident	89.9	Confident	16 Å²	16	30.3 Å²	30.3	10%	0.098	16%	0.161	C	C	.	.			trans	-125.4	162.5	172.6	-165.2	0	0	0	0	111.3	V490 Y759 P766	T467-V490 VanDerWaalsContact CA-O 3.3Å; T467-V490 WeakPolarHBondContact CA-O 3.14Å; T467-V490 PolarHBondContact OG1-O 3.39Å; T467-Y759 HydrophobicContact CG2-CD1 4.33Å; T467-Y759 HydrophobicContact CG2-CE1 3.76Å; T467-P766 HydrophobicContact CG2-CB 4.25Å; T467-P766 HydrophobicContact CG2-CG 3.81Å
468	G	89.4	Confident	89.8	Confident	7 Å²	7	32 Å²	32	7%	0.072	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	94.8	-169.1	-176.7	0	0	0	0	0	112.8	V490	G468-V490 PolarHBondContact N-O 3.26Å; G468-V490 PolarHBondContact O-N 2.97Å
469	Q	89.3	Confident	90	Very high	77 Å²	77	31.1 Å²	31.1	36%	0.36	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	129.1	-178	-169	171.9	70.7	0	0	111.5	K487 F488 Y489	Q469-K487 HydrophobicContact CG-CB 3.92Å; Q469-K487 HydrophobicContact CG-CG 4.23Å; Q469-F488 WeakPolarHBondContact CA-O 3.33Å; Q469-Y489 HydrophobicContact CB-CD2 4.4Å
470	V	89.5	Confident	90.2	Very high	4 Å²	4	39.4 Å²	39.4	2%	0.024	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	154.9	174.1	-58	0	0	0	0	110	I440 K466 F488 V490	I440-V470 HydrophobicContact CG2-CG2 4.03Å; K466-V470 HydrophobicContact CD-CG1 4.08Å; V470-F488 HydrophobicContact CG2-CB 4.13Å; V470-F488 HydrophobicContact CG2-CD1 3.97Å; V470-F488 WeakPolarHBondContact CG2-O 3.13Å; V470-F488 PolarHBondContact N-O 2.54Å; V470-F488 PolarHBondContact O-N 2.96Å; V470-V490 HydrophobicContact CB-CG2 4.47Å; V470-V490 HydrophobicContact CG1-CG2 3.98Å; V470-V490 HydrophobicContact CG2-CG2 3.65Å
471	I	90.1	Very high	90.3	Very high	67 Å²	67	41.4 Å²	41.4	34%	0.344	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	128.3	173.9	-56.8	172.6	0	0	0	108	D441 R473 W485	D441-I471 PolarHBondContact N-O 2.86Å; I471-R473 HydrophobicContact CG2-CG 3.99Å; I471-W485 HydrophobicContact CG2-CB 4.42Å; I471-W485 HydrophobicContact CG2-CE3 4.5Å
472	I	93.2	Very high	90.4	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	143.3	168.9	58.9	165.9	0	0	0	109.2	L408 L410 Q439 I440 W485 N486 F488	L408-I472 HydrophobicContact CD2-CD1 3.92Å; L408-I472 HydrophobicContact CD2-CG1 4.4Å; L410-I472 HydrophobicContact CD1-CD1 3.26Å; L410-I472 HydrophobicContact CD1-CG1 4.41Å; L410-I472 HydrophobicContact CD2-CD1 3.22Å; L410-I472 HydrophobicContact CG-CD1 3.75Å; Q439-I472 CarbonylContact O-C 3.54Å; Q439-I472 VanDerWaalsContact O-CA 3.28Å; Q439-I472 WeakPolarHBondContact O-CA 3.41Å; I440-I472 HydrophobicContact CB-CG2 4.28Å; I440-I472 HydrophobicContact CG1-CG2 3.91Å; I440-I472 HydrophobicContact CG2-CG2 4.07Å; I472-W485 CarbonylContact O-C 3.54Å; I472-W485 WeakPolarHBondContact O-CA 3.42Å; I472-W485 WeakPolarHBondContact O-CB 3.32Å; I472-N486 HydrophobicContact CD1-CB 4.43Å; I472-N486 HydrophobicContact CG1-CB 4.25Å; I472-N486 VanDerWaalsContact CG1-O 3.26Å; I472-N486 WeakPolarHBondContact CG1-O 3.44Å; I472-N486 PolarHBondContact N-O 3.49Å; I472-N486 PolarHBondContact O-N 2.93Å; I472-F488 HydrophobicContact CD1-CB 4.25Å; I472-F488 HydrophobicContact CG1-CB 4.21Å; I472-F488 HydrophobicContact CG2-CB 3.66Å; I472-F488 HydrophobicContact CG2-CD1 4.42Å; I472-F488 HydrophobicContact CG2-CG 4.18Å
473	R	94.8	Very high	90.6	Very high	84 Å²	84	40.4 Å²	40.4	32%	0.317	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	144.7	177.3	-46.9	-175	163.5	80.2	-0.2	111.4	M438 Q439 I471 Y482 W484 W485	M438-R473 CarbonylContact C-O 3.58Å; M438-R473 VanDerWaalsContact CA-O 3.29Å; M438-R473 WeakPolarHBondContact CA-O 3.11Å; M438-R473 WeakPolarHBondContact CG-O 3.22Å; Q439-R473 PolarHBondContact N-O 2.58Å; Q439-R473 PolarHBondContact O-N 3.4Å; I471-R473 HydrophobicContact CG2-CG 3.99Å; R473-Y482 HydrophobicContact CB-CD1 3.79Å; R473-Y482 HydrophobicContact CB-CG 4.09Å; R473-W484 CarbonylContact C-O 3.58Å; R473-W484 WeakPolarHBondContact CA-O 3.41Å; R473-W485 HydrophobicContact CB-CB 4.42Å; R473-W485 HydrophobicContact CG-CB 3.92Å
474	L	94.6	Very high	91	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	133.5	179.1	-173.6	72.4	0	0	0	110.6	L408 V425 P428 F430 M438 W484	L408-L474 HydrophobicContact CD1-CB 3.9Å; L408-L474 HydrophobicContact CD1-CD2 3.59Å; L408-L474 HydrophobicContact CD1-CG 4.39Å; L408-L474 HydrophobicContact CD2-CB 3.94Å; V425-L474 HydrophobicContact CG2-CD1 4.45Å; V425-L474 HydrophobicContact CG2-CD2 3.98Å; P428-L474 HydrophobicContact CG-CD2 4.14Å; F430-L474 HydrophobicContact CE1-CD2 3.65Å; F430-L474 HydrophobicContact CZ-CD2 3.61Å; M438-L474 HydrophobicContact CB-CD1 4.06Å; L474-W484 HydrophobicContact CB-CB 4.19Å; L474-W484 PolarHBondContact N-O 2.93Å
475	S	94.3	Very high	91.2	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	138.4	173.4	156.7	0	0	0	0	109.4	L436 K437 D477 G479 N481	L436-S475 WeakPolarHBondContact CA-O 3.19Å; K437-S475 PolarHBondContact N-O 2.66Å; K437-S475 WeakPolarHBondContact O-CB 3.42Å; K437-S475 PolarHBondContact O-N 3.3Å; S475-D477 PolarHBondContact OG-N 3.39Å; S475-D477 PolarHBondContact OG-OD1 2.99Å; S475-G479 VanDerWaalsContact OG-CA 3.26Å; S475-G479 WeakPolarHBondContact OG-CA 3.29Å; S475-G479 PolarHBondContact OG-N 3.3Å; S475-N481 WeakPolarHBondContact CA-O 3.18Å; S475-N481 WeakPolarHBondContact CB-O 3.46Å; S475-N481 PolarHBondContact OG-O 2.92Å
476	V	91	Very high	91.3	Very high	41 Å²	41	45.8 Å²	45.8	25%	0.248	23%	0.234	C	C	.	.	S	Bend	trans	-104.6	-7.3	172.6	-62.1	0	0	0	0	113.4	P428 F430 V435 L436	P428-V476 HydrophobicContact CB-CG1 4.18Å; P428-V476 HydrophobicContact CG-CG1 3.84Å; F430-V476 HydrophobicContact CD1-CG1 4.19Å; F430-V476 HydrophobicContact CE1-CG1 4.11Å; V435-V476 PolarHBondContact N-O 3.33Å; V435-V476 CarbonylContact O-C 3.49Å; V435-V476 VanDerWaalsContact O-C 3.3Å; L436-V476 HydrophobicContact CD2-CB 4.16Å; L436-V476 HydrophobicContact CD2-CG1 3.91Å
477	D	90.9	Very high	91.4	Very high	55 Å²	55	46.7 Å²	46.7	29%	0.294	24%	0.238	S	C	.	.	B	Isolated β-bridge	trans	-111	24.2	-171.6	66.7	6.8	0	0	0	114.1	S475 K480 N481	S475-D477 PolarHBondContact OG-N 3.39Å; S475-D477 PolarHBondContact OG-OD1 2.99Å; D477-K480 WeakPolarHBondContact OD1-CB 3.34Å; D477-K480 PolarHBondContact OD1-N 2.96Å; D477-N481 PolarHBondContact OD1-N 2.98Å; D477-N481 PolarHBondContact OD2-N 2.83Å; D477-N481 PolarHBondContact OD2-ND2 3.49Å
478	G	89.9	Confident	91.4	Very high	35 Å²	35	46 Å²	46	36%	0.361	23%	0.234	S	C	.	.	S	Bend	trans	81.4	15.8	179.3	0	0	0	0	0	115.3	V435	V435-G478 WeakPolarHBondContact O-CA 3.37Å; V435-G478 PolarHBondContact O-N 3.39Å
479	G	89.7	Confident	91.5	Very high	27 Å²	27	46.6 Å²	46.6	28%	0.278	23%	0.234	S	C	.	.	S	Bend	trans	101.3	16.9	174.2	0	0	0	0	0	113.9	S475	S475-G479 VanDerWaalsContact OG-CA 3.26Å; S475-G479 WeakPolarHBondContact OG-CA 3.29Å; S475-G479 PolarHBondContact OG-N 3.3Å
480	K	91.9	Very high	91.7	Very high	173 Å²	173	42.9 Å²	42.9	75%	0.752	22%	0.217	S	C	*	.	S	Bend	trans	-81.6	-41.2	178.6	-59.6	174.1	179.9	174.7	0	110.8	D477	D477-K480 WeakPolarHBondContact OD1-CB 3.34Å; D477-K480 PolarHBondContact OD1-N 2.96Å
481	N	92	Very high	91.9	Very high	101 Å²	101	43 Å²	43	54%	0.54	22%	0.217	S	C	.	.			trans	-132.8	144.9	178.2	-58.9	-66	0	0	0	111.5	S475 D477 P483	S475-N481 WeakPolarHBondContact CA-O 3.18Å; S475-N481 WeakPolarHBondContact CB-O 3.46Å; S475-N481 PolarHBondContact OG-O 2.92Å; D477-N481 PolarHBondContact OD1-N 2.98Å; D477-N481 PolarHBondContact OD2-N 2.83Å; D477-N481 PolarHBondContact OD2-ND2 3.49Å; N481-P483 VanDerWaalsContact O-CD 3.25Å; N481-P483 WeakPolarHBondContact O-CD 3.22Å
482	Y	91.9	Very high	92	Very high	50 Å²	50	40.1 Å²	40.1	20%	0.196	20%	0.202	C	C	.	.			trans	-121.7	66.8	-179.4	-73.3	-85.2	0	0	0	111.7	Q439 T444 R473	Q439-Y482 HydrophobicContact CB-CD1 4.12Å; Q439-Y482 HydrophobicContact CB-CE1 3.7Å; T444-Y482 WeakPolarHBondContact CG2-OH 3.22Å; R473-Y482 HydrophobicContact CB-CD1 3.79Å; R473-Y482 HydrophobicContact CB-CG 4.09Å
483	P	91.1	Very high	92	Very high	33 Å²	33	40.6 Å²	40.6	21%	0.214	21%	0.205	C	C	.	.			trans	-77.2	-23.4	-173.7	28.1	-31.1	0	0	0	113.7	S404 I405 N481	S404-P483 WeakPolarHBondContact O-CB 3.33Å; I405-P483 HydrophobicContact CB-CB 4.37Å; I405-P483 HydrophobicContact CG1-CB 4.17Å; I405-P483 WeakPolarHBondContact CG1-O 3.28Å; N481-P483 VanDerWaalsContact O-CD 3.25Å; N481-P483 WeakPolarHBondContact O-CD 3.22Å
484	W	92.2	Very high	91.7	Very high	13 Å²	13	39.7 Å²	39.7	5%	0.049	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	127.5	-179.6	-65.2	87.3	0	0	0	110	N403 G406 L408 G427 P428 R473 L474	N403-W484 HydrophobicContact CB-CH2 4.09Å; N403-W484 HydrophobicContact CB-CZ2 4.15Å; N403-W484 VanDerWaalsContact O-CZ2 3.26Å; N403-W484 WeakPolarHBondContact O-CZ2 3.22Å; G406-W484 VanDerWaalsContact C-CE3 3.42Å; G406-W484 WeakPolarHBondContact O-CA 3.45Å; L408-W484 HydrophobicContact CB-CB 4.42Å; L408-W484 HydrophobicContact CD1-CB 4.28Å; G427-W484 VanDerWaalsContact C-CZ3 3.42Å; G427-W484 WeakPolarHBondContact O-CH2 3.48Å; P428-W484 HydrophobicContact CB-CD2 4.27Å; P428-W484 HydrophobicContact CB-CZ2 3.82Å; P428-W484 HydrophobicContact CG-CD2 4.09Å; P428-W484 HydrophobicContact CG-CG 4.02Å; R473-W484 CarbonylContact C-O 3.58Å; R473-W484 WeakPolarHBondContact CA-O 3.41Å; L474-W484 HydrophobicContact CB-CB 4.19Å; L474-W484 PolarHBondContact N-O 2.93Å
485	W	92.7	Very high	91.4	Very high	90 Å²	90	41.3 Å²	41.3	34%	0.341	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	157.9	-176	67.6	-88.5	0	0	0	112.8	G406 V407 L408 I471 I472 R473 K487	G406-W485 PolarHBondContact O-N 2.78Å; V407-W485 WeakPolarHBondContact CA-O 3.21Å; L408-W485 PolarHBondContact N-O 3.4Å; I471-W485 HydrophobicContact CG2-CB 4.42Å; I471-W485 HydrophobicContact CG2-CE3 4.5Å; I472-W485 CarbonylContact O-C 3.54Å; I472-W485 WeakPolarHBondContact O-CA 3.42Å; I472-W485 WeakPolarHBondContact O-CB 3.32Å; R473-W485 HydrophobicContact CB-CB 4.42Å; R473-W485 HydrophobicContact CG-CB 3.92Å; W485-K487 HydrophobicContact CZ3-CG 4.48Å
486	N	91.7	Very high	91.2	Very high	43 Å²	43	42.1 Å²	42.1	23%	0.23	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	167.3	168.1	-158.5	-9.5	0	0	0	110.3	V407 L408 I472	V407-N486 HydrophobicContact CG1-CB 4.45Å; L408-N486 HydrophobicContact CB-CB 4.16Å; L408-N486 WeakPolarHBondContact O-CB 3.42Å; L408-N486 VanDerWaalsContact O-CG 3.31Å; L408-N486 PolarHBondContact O-ND2 2.65Å; I472-N486 HydrophobicContact CD1-CB 4.43Å; I472-N486 HydrophobicContact CG1-CB 4.25Å; I472-N486 VanDerWaalsContact CG1-O 3.26Å; I472-N486 WeakPolarHBondContact CG1-O 3.44Å; I472-N486 PolarHBondContact N-O 3.49Å; I472-N486 PolarHBondContact O-N 2.93Å
487	K	89.1	Confident	91.1	Very high	65 Å²	65	48.4 Å²	48.4	28%	0.283	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	132.4	169.5	-70	170	170.3	-170.4	0	108.9	Q469 W485	Q469-K487 HydrophobicContact CG-CB 3.92Å; Q469-K487 HydrophobicContact CG-CG 4.23Å; W485-K487 HydrophobicContact CZ3-CG 4.48Å
488	F	90.9	Very high	91	Very high	2 Å²	2	51.6 Å²	51.6	1%	0.009	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	137.7	179.3	179.4	-107.7	0	0	0	109.5	L410 K412 P413 A415 F421 L423 Q469 V470 I472 V490	L410-F488 HydrophobicContact CD1-CB 4.39Å; L410-F488 HydrophobicContact CD1-CD2 3.75Å; K412-F488 WeakPolarHBondContact O-CE2 3.32Å; P413-F488 VanDerWaalsContact O-CD2 3.29Å; P413-F488 WeakPolarHBondContact O-CD2 3.45Å; A415-F488 HydrophobicContact CB-CE1 4.38Å; A415-F488 HydrophobicContact CB-CZ 3.62Å; F421-F488 HydrophobicContact CE2-CZ 4.14Å; F421-F488 HydrophobicContact CZ-CE1 4.43Å; F421-F488 HydrophobicContact CZ-CZ 4.15Å; L423-F488 HydrophobicContact CD1-CE2 4.26Å; L423-F488 HydrophobicContact CD1-CZ 4.27Å; L423-F488 HydrophobicContact CD2-CE2 3.97Å; L423-F488 HydrophobicContact CD2-CZ 4.3Å; Q469-F488 WeakPolarHBondContact CA-O 3.33Å; V470-F488 HydrophobicContact CG2-CB 4.13Å; V470-F488 HydrophobicContact CG2-CD1 3.97Å; V470-F488 WeakPolarHBondContact CG2-O 3.13Å; V470-F488 PolarHBondContact N-O 2.54Å; V470-F488 PolarHBondContact O-N 2.96Å; I472-F488 HydrophobicContact CD1-CB 4.25Å; I472-F488 HydrophobicContact CG1-CB 4.21Å; I472-F488 HydrophobicContact CG2-CB 3.66Å; I472-F488 HydrophobicContact CG2-CD1 4.42Å; I472-F488 HydrophobicContact CG2-CG 4.18Å; F488-V490 HydrophobicContact CD1-CG2 3.92Å; F488-V490 HydrophobicContact CE1-CG2 4.06Å
489	Y	92	Very high	91.1	Very high	18 Å²	18	53 Å²	53	7%	0.071	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	121.9	-177.8	-164	-82.8	0	0	0	111.7	P413 Q414 A415 Q469 L491 Q915 T916	P413-Y489 PolarHBondContact O-N 3Å; Q414-Y489 WeakPolarHBondContact CA-O 3.07Å; Q414-Y489 WeakPolarHBondContact CB-O 3.29Å; A415-Y489 PolarHBondContact N-O 3Å; Q469-Y489 HydrophobicContact CB-CD2 4.4Å; Y489-L491 HydrophobicContact CD1-CD2 3.88Å; Y489-L491 HydrophobicContact CD1-CG 4.26Å; Y489-L491 HydrophobicContact CE1-CD2 3.79Å; Y489-Q915 HydrophobicContact CE1-CG 4.38Å; Y489-Q915 HydrophobicContact CE2-CB 3.98Å; Y489-Q915 HydrophobicContact CE2-CG 4.15Å; Y489-Q915 VanDerWaalsContact OH-CA 3.29Å; Y489-Q915 WeakPolarHBondContact OH-CA 3.23Å; Y489-T916 PolarHBondContact OH-N 3.39Å
490	V	93	Very high	91.4	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	119.7	179.7	-167.6	0	0	0	0	110.4	M417 I464 K466 T467 G468 V470 F488	M417-V490 HydrophobicContact CB-CG1 3.6Å; I464-V490 HydrophobicContact CG2-CG1 3.9Å; I464-V490 HydrophobicContact CG2-CG2 4.1Å; K466-V490 WeakPolarHBondContact O-CB 3.47Å; K466-V490 WeakPolarHBondContact O-CG1 3.38Å; T467-V490 VanDerWaalsContact CA-O 3.3Å; T467-V490 WeakPolarHBondContact CA-O 3.14Å; T467-V490 PolarHBondContact OG1-O 3.39Å; G468-V490 PolarHBondContact N-O 3.26Å; G468-V490 PolarHBondContact O-N 2.97Å; V470-V490 HydrophobicContact CB-CG2 4.47Å; V470-V490 HydrophobicContact CG1-CG2 3.98Å; V470-V490 HydrophobicContact CG2-CG2 3.65Å; F488-V490 HydrophobicContact CD1-CG2 3.92Å; F488-V490 HydrophobicContact CE1-CG2 4.06Å
491	L	93.1	Very high	91.6	Very high	7 Å²	7	46.1 Å²	46.1	4%	0.037	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	138.4	179.8	-64.1	166.8	0	0	0	111	Q414 A415 T416 M417 Y489 A496 W911	Q414-L491 HydrophobicContact CB-CD1 4.31Å; Q414-L491 HydrophobicContact CB-CG 4.44Å; Q414-L491 HydrophobicContact CG-CD1 4Å; A415-L491 PolarHBondContact O-N 3.09Å; T416-L491 CarbonylContact C-O 3.54Å; T416-L491 WeakPolarHBondContact CA-O 3.31Å; M417-L491 PolarHBondContact N-O 3.26Å; Y489-L491 HydrophobicContact CD1-CD2 3.88Å; Y489-L491 HydrophobicContact CD1-CG 4.26Å; Y489-L491 HydrophobicContact CE1-CD2 3.79Å; L491-A496 HydrophobicContact CB-CB 4.11Å; L491-W911 HydrophobicContact CD1-CB 4.21Å; L491-W911 HydrophobicContact CD1-CG 4.35Å; L491-W911 VanDerWaalsContact CD2-O 3.29Å; L491-W911 WeakPolarHBondContact CD2-O 3.3Å
492	M	92.7	Very high	91.8	Very high	5 Å²	5	42.7 Å²	42.7	3%	0.025	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-72.1	153.1	166.7	64.4	176.1	178.2	0	0	111.4	M417 S494 L495 A496 W754 P766 S767	M417-M492 HydrophobicContact SD-CB 4.28Å; M492-S494 VanDerWaalsContact C-N 3.25Å; M492-S494 WeakPolarHBondContact CE-OG 3.4Å; M492-S494 PolarHBondContact O-N 2.65Å; M492-S494 VanDerWaalsContact O-N 3.16Å; M492-L495 HydrophobicContact CE-CB 4.39Å; M492-L495 HydrophobicContact CE-CD1 3.24Å; M492-L495 HydrophobicContact CE-CG 3.53Å; M492-L495 HydrophobicContact CG-CB 4.24Å; M492-L495 HydrophobicContact CG-CD1 4.19Å; M492-L495 HydrophobicContact CG-CG 4.35Å; M492-L495 PolarHBondContact O-N 3.41Å; M492-L495 VanDerWaalsContact O-N 3.09Å; M492-A496 WeakPolarHBondContact O-CB 3.14Å; M492-A496 PolarHBondContact O-N 2.9Å; M492-W754 HydrophobicContact CE-CG 4.1Å; M492-W754 HydrophobicContact SD-CB 4.31Å; M492-W754 HydrophobicContact SD-CG 4.45Å; M492-P766 HydrophobicContact CB-CB 3.67Å; M492-P766 HydrophobicContact SD-CB 4.42Å; M492-S767 PolarHBondContact SD-OG 3.11Å; M492-S767 VanDerWaalsContact SD-OG 3.39Å
493	P	92.3	Very high	91.9	Very high	10 Å²	10	44 Å²	44	7%	0.065	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-33.6	-172.9	-26.5	35	0	0	0	114.5	M417 L418 L495 M768	M417-P493 HydrophobicContact CG-CG 4.17Å; M417-P493 HydrophobicContact SD-CG 4.44Å; L418-P493 HydrophobicContact CD1-CB 4.28Å; L418-P493 HydrophobicContact CD1-CG 4.12Å; L418-P493 HydrophobicContact CD2-CG 3.92Å; L418-P493 HydrophobicContact CG-CG 3.91Å; P493-L495 VanDerWaalsContact C-N 3.34Å; P493-L495 PolarHBondContact O-N 3.07Å; P493-M768 HydrophobicContact CB-SD 4.49Å; P493-M768 HydrophobicContact CG-CG 4.42Å; P493-M768 HydrophobicContact CG-SD 3.93Å
494	S	89.4	Confident	91.9	Very high	66 Å²	66	46.2 Å²	46.2	46%	0.462	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-23.1	-179.8	59.1	0	0	0	0	114.6	M492 S767	M492-S494 VanDerWaalsContact C-N 3.25Å; M492-S494 WeakPolarHBondContact CE-OG 3.4Å; M492-S494 PolarHBondContact O-N 2.65Å; M492-S494 VanDerWaalsContact O-N 3.16Å; S494-S767 WeakPolarHBondContact CB-OG 3.4Å; S494-S767 PolarHBondContact N-OG 2.83Å; S494-S767 PolarHBondContact OG-OG 3.23Å
495	L	88.8	Confident	91.6	Very high	33 Å²	33	48.7 Å²	48.7	17%	0.173	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-24.7	174.4	-78.8	171.2	0	0	0	112.6	M492 P493 W911 L914	M492-L495 HydrophobicContact CE-CB 4.39Å; M492-L495 HydrophobicContact CE-CD1 3.24Å; M492-L495 HydrophobicContact CE-CG 3.53Å; M492-L495 HydrophobicContact CG-CB 4.24Å; M492-L495 HydrophobicContact CG-CD1 4.19Å; M492-L495 HydrophobicContact CG-CG 4.35Å; M492-L495 PolarHBondContact O-N 3.41Å; M492-L495 VanDerWaalsContact O-N 3.09Å; P493-L495 VanDerWaalsContact C-N 3.34Å; P493-L495 PolarHBondContact O-N 3.07Å; L495-W911 WeakPolarHBondContact O-CB 3.45Å; L495-L914 HydrophobicContact CD1-CB 4.42Å; L495-L914 HydrophobicContact CD1-CD2 4.2Å
496	A	89.8	Confident	91.1	Very high	17 Å²	17	49.8 Å²	49.8	14%	0.14	25%	0.251	C	S	.	.	S	Bend	trans	-59.8	143.4	-180	0	0	0	0	0	110.7	L491 M492 R498	L491-A496 HydrophobicContact CB-CB 4.11Å; M492-A496 WeakPolarHBondContact O-CB 3.14Å; M492-A496 PolarHBondContact O-N 2.9Å; A496-R498 PolarHBondContact O-N 2.77Å
497	R	88.6	Confident	90.9	Very high	174 Å²	174	54 Å²	54	66%	0.657	28%	0.278	S	S	*	.			trans	-61.1	114.1	175.8	-176.6	-176.7	-180	176.6	0.8	109.8	Q499 W911	R497-Q499 PolarHBondContact O-N 2.84Å; R497-W911 HydrophobicContact CB-CD2 4.25Å; R497-W911 HydrophobicContact CB-CE3 3.74Å; R497-W911 HydrophobicContact CB-CZ3 4Å; R497-W911 HydrophobicContact CG-CE3 4.15Å; R497-W911 HydrophobicContact CG-CZ3 3.93Å
498	R	89	Confident	90.6	Very high	121 Å²	121	52 Å²	52	46%	0.457	28%	0.275	S	S	.	.			trans	-63.5	132.1	168.1	73.2	-170.2	-172.1	-162.3	-6.1	110.6	A496 N501 D619	A496-R498 PolarHBondContact O-N 2.77Å; R498-N501 PolarHBondContact NE-OD1 2.83Å; R498-D619 WeakPolarHBondContact CB-OD1 3.23Å; R498-D619 VanDerWaalsContact CD-CG 3.44Å; R498-D619 WeakPolarHBondContact CD-OD1 3.5Å; R498-D619 WeakPolarHBondContact CD-OD2 3.21Å; R498-D619 IonicContact CZ-OD2 3.46Å; R498-D619 IonicContact NE-OD2 3.02Å; R498-D619 IonicContact NH1-OD2 2.76Å; R498-D619 PolarHBondContact NH1-OD2 2.95Å
499	Q	91.9	Very high	90.2	Very high	65 Å²	65	58.8 Å²	58.8	30%	0.304	31%	0.311	S	S	.	.	S	Bend	trans	-103.1	-25.4	176.8	-69.4	165.4	-50.1	0	0	111.1	R497 P526 I615 Y616 W617	R497-Q499 PolarHBondContact O-N 2.84Å; Q499-P526 VanDerWaalsContact O-CD 3.29Å; Q499-P526 WeakPolarHBondContact O-CD 3.4Å; Q499-I615 PolarHBondContact OE1-O 2.64Å; Q499-Y616 HydrophobicContact CB-CD1 4.05Å; Q499-Y616 HydrophobicContact CB-CD2 3.8Å; Q499-Y616 HydrophobicContact CB-CE2 4.43Å; Q499-Y616 HydrophobicContact CB-CG 3.58Å; Q499-Y616 HydrophobicContact CG-CD1 4.23Å; Q499-Y616 HydrophobicContact CG-CG 4.27Å; Q499-Y616 VanDerWaalsContact NE2-CE1 3.34Å; Q499-W617 PolarHBondContact N-O 2.85Å
500	V	95.7	Very high	89.9	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	33%	0.334	C	S	.	.	S	Bend	trans	-99.6	116.4	170.6	-174.7	0	0	0	0	108.3	L502 L523 T524 I597 W617 S618	V500-L502 HydrophobicContact CG1-CD2 4.05Å; V500-L523 HydrophobicContact CG1-CB 4.36Å; V500-L523 HydrophobicContact CG1-CD1 4.12Å; V500-T524 WeakPolarHBondContact CA-O 3.38Å; V500-I597 HydrophobicContact CB-CD1 4.39Å; V500-I597 HydrophobicContact CG1-CD1 3.88Å; V500-I597 HydrophobicContact CG1-CG1 4.38Å; V500-I597 HydrophobicContact CG2-CB 4.2Å; V500-I597 HydrophobicContact CG2-CD1 3.68Å; V500-I597 HydrophobicContact CG2-CG1 3.71Å; V500-W617 PolarHBondContact N-O 3.48Å; V500-S618 WeakPolarHBondContact O-CA 3.39Å
501	N	96	Very high	89.8	Confident	55 Å²	55	65.3 Å²	65.3	29%	0.294	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	116	173.9	-64.5	-54.6	0	0	0	109.1	R498 L503 L523 T524	R498-N501 PolarHBondContact NE-OD1 2.83Å; N501-L503 HydrophobicContact CB-CD2 4.19Å; N501-L523 CarbonylContact O-C 3.59Å; N501-L523 VanDerWaalsContact O-CA 3.31Å; N501-L523 WeakPolarHBondContact O-CA 3.13Å; N501-T524 PolarHBondContact N-O 3.35Å; N501-T524 PolarHBondContact O-N 3.42Å
502	L	95.5	Very high	89.7	Confident	29 Å²	29	66.9 Å²	66.9	15%	0.152	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	113.1	170.8	-53.2	-175.9	0	0	0	108	V500 W513 L523 V595 V621	V500-L502 HydrophobicContact CG1-CD2 4.05Å; L502-W513 HydrophobicContact CB-CB 4.42Å; L502-W513 HydrophobicContact CB-CD2 3.93Å; L502-W513 HydrophobicContact CB-CG 3.76Å; L502-W513 HydrophobicContact CD1-CD2 4.16Å; L502-W513 HydrophobicContact CD1-CE3 4.18Å; L502-W513 HydrophobicContact CD1-CG 4.34Å; L502-W513 HydrophobicContact CD2-CD2 4.11Å; L502-W513 HydrophobicContact CD2-CE3 4.22Å; L502-W513 HydrophobicContact CD2-CH2 4.13Å; L502-W513 HydrophobicContact CD2-CZ2 4.03Å; L502-W513 HydrophobicContact CD2-CZ3 4.22Å; L502-W513 HydrophobicContact CG-CD2 4.28Å; L502-L523 HydrophobicContact CD2-CB 4.05Å; L502-V595 HydrophobicContact CD1-CG2 4.38Å; L502-V595 HydrophobicContact CD2-CB 4.22Å; L502-V595 HydrophobicContact CD2-CG2 3.94Å; L502-V621 HydrophobicContact CD1-CB 3.84Å; L502-V621 HydrophobicContact CD1-CG1 4.11Å; L502-V621 HydrophobicContact CD1-CG2 3.93Å
503	L	94.1	Very high	89.8	Confident	78 Å²	78	66.9 Å²	66.9	41%	0.408	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	123.8	-175.5	-57	-173.4	0	0	0	110.2	N501 W513 T522 T524	N501-L503 HydrophobicContact CB-CD2 4.19Å; L503-W513 PolarHBondContact O-NE1 3.25Å; L503-T522 WeakPolarHBondContact CB-O 3.09Å; L503-T522 HydrophobicContact CD1-CG2 4.07Å; L503-T522 PolarHBondContact N-O 3.27Å; L503-T524 HydrophobicContact CD1-CG2 3.67Å; L503-T524 HydrophobicContact CG-CG2 4.34Å
504	N	90.7	Very high	89.9	Confident	80 Å²	80	68.7 Å²	68.7	43%	0.428	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-97.1	127.2	169.9	-66.8	-26.9	0	0	0	108.6	P506 N512 W513	N504-P506 WeakPolarHBondContact O-CD 3Å; N504-N512 PolarHBondContact ND2-OD1 3.03Å; N504-N512 WeakPolarHBondContact OD1-CA 3.32Å; N504-N512 PolarHBondContact OD1-OD1 3.18Å; N504-W513 PolarHBondContact OD1-N 2.92Å
505	D	86.3	Confident	90.1	Very high	64 Å²	64	67.4 Å²	67.4	34%	0.342	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-75.1	119.4	-179.1	-174.8	-13.4	0	0	0	110.2	V507 G508 N511	D505-V507 VanDerWaalsContact C-N 3.29Å; D505-V507 PolarHBondContact O-N 3Å; D505-V507 WeakPolarHBondContact OD1-CA 3.15Å; D505-V507 WeakPolarHBondContact OD1-CB 3.49Å; D505-V507 PolarHBondContact OD1-N 2.94Å; D505-G508 CarbonylContact O-C 3.58Å; D505-G508 PolarHBondContact OD1-N 3.01Å; D505-G508 PolarHBondContact OD2-N 2.89Å; D505-N511 HydrophobicContact CB-CB 3.78Å; D505-N511 PolarHBondContact N-O 2.82Å
506	P	83.2	Confident	90.3	Very high	114 Å²	114	68.5 Å²	68.5	74%	0.74	35%	0.346	S	S	*	.	S	Bend	trans	-73.1	-21.5	178.2	30.3	-34.6	0	0	0	113.1	N504	N504-P506 WeakPolarHBondContact O-CD 3Å
507	V	86.7	Confident	90.4	Very high	132 Å²	132	70 Å²	70	80%	0.8	35%	0.352	S	S	*	.	S	Bend	trans	-88.6	-54.1	179	-177.7	0	0	0	0	109.4	D505 L509	D505-V507 VanDerWaalsContact C-N 3.29Å; D505-V507 PolarHBondContact O-N 3Å; D505-V507 WeakPolarHBondContact OD1-CA 3.15Å; D505-V507 WeakPolarHBondContact OD1-CB 3.49Å; D505-V507 PolarHBondContact OD1-N 2.94Å; V507-L509 VanDerWaalsContact C-N 3.35Å; V507-L509 PolarHBondContact O-N 3.01Å
508	G	83.7	Confident	90.7	Very high	21 Å²	21	61.8 Å²	61.8	22%	0.216	32%	0.321	C	S	.	.	S	Bend	trans	-80.2	76.8	173.8	0	0	0	0	0	111.3	D505 K510 N511	D505-G508 CarbonylContact O-C 3.58Å; D505-G508 PolarHBondContact OD1-N 3.01Å; D505-G508 PolarHBondContact OD2-N 2.89Å; G508-K510 PolarHBondContact O-N 3.4Å; G508-N511 WeakPolarHBondContact O-CA 3.32Å; G508-N511 WeakPolarHBondContact O-CB 2.93Å; G508-N511 PolarHBondContact O-N 2.98Å
509	L	82.1	Confident	90.9	Very high	146 Å²	146	58.7 Å²	58.7	76%	0.764	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-24.9	-177.4	-68	171.8	0	0	0	114.6	V507	V507-L509 VanDerWaalsContact C-N 3.35Å; V507-L509 PolarHBondContact O-N 3.01Å
510	K	85.6	Confident	91	Very high	129 Å²	129	58.6 Å²	58.6	56%	0.561	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-30.5	173.6	-70.5	-170.5	177.9	-178.2	0	113.4	G508 N512 N515 P518	G508-K510 PolarHBondContact O-N 3.4Å; K510-N512 PolarHBondContact O-N 3.2Å; K510-N515 PolarHBondContact O-ND2 2.01Å; K510-P518 WeakPolarHBondContact O-CA 3.43Å; K510-P518 VanDerWaalsContact O-CB 3.29Å; K510-P518 WeakPolarHBondContact O-CB 2.94Å
511	N	91.2	Very high	91	Very high	25 Å²	25	58.6 Å²	58.6	13%	0.134	32%	0.315	C	S	.	.			trans	-80.6	65.7	-177.6	-66.5	-17.6	0	0	0	110.8	D505 G508 D519 N520	D505-N511 HydrophobicContact CB-CB 3.78Å; D505-N511 PolarHBondContact N-O 2.82Å; G508-N511 WeakPolarHBondContact O-CA 3.32Å; G508-N511 WeakPolarHBondContact O-CB 2.93Å; G508-N511 PolarHBondContact O-N 2.98Å; N511-D519 PolarHBondContact OD1-N 2.95Å; N511-D519 VanDerWaalsContact OD1-N 3.12Å; N511-N520 WeakPolarHBondContact CB-O 2.84Å; N511-N520 PolarHBondContact OD1-N 2.77Å; N511-N520 PolarHBondContact OD1-O 2.91Å
512	N	91.3	Very high	91	Very high	41 Å²	41	57.6 Å²	57.6	22%	0.219	31%	0.311	C	S	.	.			trans	-124.3	133.1	178.9	-179.2	-24.6	0	0	0	108.7	N504 K510 R514 N515	N504-N512 PolarHBondContact ND2-OD1 3.03Å; N504-N512 WeakPolarHBondContact OD1-CA 3.32Å; N504-N512 PolarHBondContact OD1-OD1 3.18Å; K510-N512 PolarHBondContact O-N 3.2Å; N512-R514 PolarHBondContact O-N 3.29Å; N512-R514 PolarHBondContact OD1-N 2.65Å; N512-N515 HydrophobicContact CB-CB 4.27Å; N512-N515 VanDerWaalsContact O-CB 3.29Å; N512-N515 WeakPolarHBondContact O-CB 3.37Å; N512-N515 PolarHBondContact O-N 2.97Å
513	W	94.7	Very high	91.1	Very high	4 Å²	4	56.2 Å²	56.2	2%	0.015	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-14.9	178.8	-77.4	87.9	0	0	0	114.5	L502 L503 N504 L521 T522 L523 I560 F572 V595 V621 W625	L502-W513 HydrophobicContact CB-CB 4.42Å; L502-W513 HydrophobicContact CB-CD2 3.93Å; L502-W513 HydrophobicContact CB-CG 3.76Å; L502-W513 HydrophobicContact CD1-CD2 4.16Å; L502-W513 HydrophobicContact CD1-CE3 4.18Å; L502-W513 HydrophobicContact CD1-CG 4.34Å; L502-W513 HydrophobicContact CD2-CD2 4.11Å; L502-W513 HydrophobicContact CD2-CE3 4.22Å; L502-W513 HydrophobicContact CD2-CH2 4.13Å; L502-W513 HydrophobicContact CD2-CZ2 4.03Å; L502-W513 HydrophobicContact CD2-CZ3 4.22Å; L502-W513 HydrophobicContact CG-CD2 4.28Å; L503-W513 PolarHBondContact O-NE1 3.25Å; N504-W513 PolarHBondContact OD1-N 2.92Å; W513-L521 HydrophobicContact CD2-CB 4.44Å; W513-L521 HydrophobicContact CD2-CD1 4Å; W513-L521 HydrophobicContact CD2-CD2 4.24Å; W513-L521 HydrophobicContact CD2-CG 4.48Å; W513-L521 HydrophobicContact CE3-CD1 3.87Å; W513-L521 HydrophobicContact CG-CD2 4.11Å; W513-L521 HydrophobicContact CH2-CB 4.26Å; W513-L521 HydrophobicContact CH2-CD1 4.37Å; W513-L521 HydrophobicContact CZ2-CB 3.81Å; W513-L521 HydrophobicContact CZ2-CD1 4.48Å; W513-L521 HydrophobicContact CZ3-CD1 4.07Å; W513-T522 PolarHBondContact NE1-O 2.77Å; W513-L523 HydrophobicContact CH2-CB 4.34Å; W513-L523 HydrophobicContact CH2-CD2 3.64Å; W513-L523 HydrophobicContact CZ2-CB 3.77Å; W513-L523 HydrophobicContact CZ2-CD2 3.86Å; W513-L523 HydrophobicContact CZ2-CG 4.34Å; W513-I560 HydrophobicContact CH2-CD1 4.12Å; W513-I560 HydrophobicContact CZ3-CD1 4.35Å; W513-F572 AromaticContact CH2-CE1 3.81Å; W513-F572 HydrophobicContact CH2-CE1 3.81Å; W513-F572 HydrophobicContact CH2-CZ 4.03Å; W513-F572 HydrophobicContact CZ2-CE1 4.26Å; W513-F572 HydrophobicContact CZ3-CZ 4.5Å; W513-V595 HydrophobicContact CZ3-CG2 4.05Å; W513-V621 HydrophobicContact CB-CG2 3.98Å; W513-V621 HydrophobicContact CE3-CG2 4.37Å; W513-V621 WeakPolarHBondContact O-CG2 3.19Å; W513-W625 AromaticContact CE3-CE2 3.94Å; W513-W625 HydrophobicContact CE3-CZ2 4.02Å; W513-W625 AromaticContact CE3-NE1 3.94Å; W513-W625 AromaticContact CZ3-CE2 3.92Å; W513-W625 AromaticContact CZ3-CH2 4Å; W513-W625 HydrophobicContact CZ3-CH2 4Å; W513-W625 AromaticContact CZ3-CZ2 3.57Å; W513-W625 HydrophobicContact CZ3-CZ2 3.57Å
514	R	93.1	Very high	91.2	Very high	49 Å²	49	54.1 Å²	54.1	19%	0.185	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-11.5	174.4	-62.7	-178	172.5	-84.7	-4.5	113.8	N512 L620 P622 Y696 Y697 E779 W784	N512-R514 PolarHBondContact O-N 3.29Å; N512-R514 PolarHBondContact OD1-N 2.65Å; R514-L620 PolarHBondContact NH2-O 3.35Å; R514-P622 HydrophobicContact CB-CG 4.16Å; R514-P622 HydrophobicContact CG-CG 4.06Å; R514-Y696 WeakPolarHBondContact CD-OH 3.34Å; R514-Y697 PolarHBondContact NH1-OH 3.17Å; R514-E779 WeakPolarHBondContact CD-OE1 3.13Å; R514-E779 IonicContact CZ-OE1 3.66Å; R514-E779 IonicContact NE-OE1 3.43Å; R514-E779 IonicContact NH1-OE1 3.72Å; R514-E779 PolarHBondContact NH1-OE1 3.15Å; R514-W784 PolarHBondContact O-NE1 3.15Å; R514-W784 VanDerWaalsContact O-NE1 3.1Å
515	N	93.3	Very high	91.3	Very high	38 Å²	38	50.8 Å²	50.8	20%	0.203	28%	0.276	C	S	.	.	S	Bend	trans	-71.7	141.6	172.7	-171.1	-8	0	0	0	109.4	K510 N512 N517 W625	K510-N515 PolarHBondContact O-ND2 2.01Å; N512-N515 HydrophobicContact CB-CB 4.27Å; N512-N515 VanDerWaalsContact O-CB 3.29Å; N512-N515 WeakPolarHBondContact O-CB 3.37Å; N512-N515 PolarHBondContact O-N 2.97Å; N515-N517 PolarHBondContact OD1-N 3.17Å; N515-N517 VanDerWaalsContact OD1-N 3.12Å; N515-W625 WeakPolarHBondContact O-CB 3.39Å
516	F	93.1	Very high	91.5	Very high	57 Å²	57	49.6 Å²	49.6	25%	0.25	27%	0.271	C	S	.	.	S	Bend	trans	-78.6	-18.4	177.8	69.5	-93.7	0	0	0	113.3	G624 W625 H628 W639 W784	F516-G624 CarbonylContact O-C 3.55Å; F516-W625 VanDerWaalsContact O-CA 3.28Å; F516-W625 WeakPolarHBondContact O-CA 3.27Å; F516-W625 PolarHBondContact O-N 3.23Å; F516-H628 HydrophobicContact CD2-CB 4.48Å; F516-H628 AromaticContact CD2-CE1 3.82Å; F516-H628 AromaticContact CD2-CG 3.84Å; F516-H628 AromaticContact CD2-ND1 3.65Å; F516-H628 AromaticContact CE2-CE1 3.81Å; F516-H628 VanDerWaalsContact O-CB 3.27Å; F516-H628 WeakPolarHBondContact O-CB 3.46Å; F516-W639 HydrophobicContact CB-CH2 4.07Å; F516-W639 HydrophobicContact CB-CZ2 4.39Å; F516-W639 HydrophobicContact CD2-CH2 4.34Å; F516-W639 AromaticContact CD2-CZ2 3.8Å; F516-W639 HydrophobicContact CD2-CZ2 3.8Å; F516-W639 HydrophobicContact CE2-CZ2 4.29Å; F516-W639 HydrophobicContact CG-CH2 4.18Å; F516-W639 HydrophobicContact CG-CZ2 4.08Å; F516-W784 HydrophobicContact CB-CD2 4.07Å; F516-W784 HydrophobicContact CB-CG 4.17Å; F516-W784 HydrophobicContact CD1-CB 3.99Å; F516-W784 AromaticContact CD1-CD1 3.61Å; F516-W784 AromaticContact CD1-CG 3.78Å; F516-W784 HydrophobicContact CD1-CG 3.78Å; F516-W784 HydrophobicContact CE1-CB 4.49Å; F516-W784 HydrophobicContact CG-CG 4.33Å
517	N	93.2	Very high	91.5	Very high	49 Å²	49	46.8 Å²	46.8	26%	0.262	25%	0.25	S	S	.	.	S	Bend	trans	-140.9	59.8	-179	-168.6	6.7	0	0	0	114	N515 R575 H628	N515-N517 PolarHBondContact OD1-N 3.17Å; N515-N517 VanDerWaalsContact OD1-N 3.12Å; N517-R575 PolarHBondContact O-NH2 3.02Å; N517-R575 PolarHBondContact OD1-NE 3.03Å; N517-R575 PolarHBondContact OD1-NH2 3.45Å; N517-R575 VanDerWaalsContact OD1-NH2 3.16Å; N517-H628 PolarHBondContact ND2-NE2 3.02Å
518	P	94.6	Very high	91.1	Very high	1 Å²	1	48 Å²	48	1%	0.006	24%	0.241	C	C	.	.			trans	-70.1	156	175.1	31.6	-35.5	0	0	0	112.2	K510 L521 P574 W625	K510-P518 WeakPolarHBondContact O-CA 3.43Å; K510-P518 VanDerWaalsContact O-CB 3.29Å; K510-P518 WeakPolarHBondContact O-CB 2.94Å; P518-L521 HydrophobicContact CB-CD2 3.8Å; P518-L521 HydrophobicContact CB-CG 4.05Å; P518-L521 HydrophobicContact CG-CD1 3.81Å; P518-L521 HydrophobicContact CG-CD2 3.83Å; P518-L521 HydrophobicContact CG-CG 3.71Å; P518-P574 HydrophobicContact CG-CG 4.08Å; P518-W625 HydrophobicContact CG-CB 3.7Å
519	D	92.5	Very high	90.8	Very high	56 Å²	56	51.4 Å²	51.4	30%	0.299	26%	0.255	S	S	.	.	S	Bend	trans	-85.8	-38.1	176.9	-62.9	-56.4	0	0	0	111.7	N511 N573 R575	N511-D519 PolarHBondContact OD1-N 2.95Å; N511-D519 VanDerWaalsContact OD1-N 3.12Å; D519-N573 WeakPolarHBondContact O-CA 3.31Å; D519-N573 WeakPolarHBondContact O-CB 3.48Å; D519-N573 PolarHBondContact O-ND2 3.39Å; D519-N573 PolarHBondContact O-OD1 2.83Å; D519-R575 IonicContact OD1-CZ 3.94Å; D519-R575 IonicContact OD1-NH1 2.8Å; D519-R575 PolarHBondContact OD1-NH1 2.74Å; D519-R575 IonicContact OD1-NH2 3.92Å; D519-R575 PolarHBondContact OD1-NH2 3.03Å
520	N	94.3	Very high	90.6	Very high	62 Å²	62	44.5 Å²	44.5	33%	0.332	22%	0.218	S	C	.	.			trans	-145.4	137.3	178.1	-171.8	32.6	0	0	0	109.9	N511 F572	N511-N520 WeakPolarHBondContact CB-O 2.84Å; N511-N520 PolarHBondContact OD1-N 2.77Å; N511-N520 PolarHBondContact OD1-O 2.91Å; N520-F572 VanDerWaalsContact OD1-C 3.29Å; N520-F572 PolarHBondContact OD1-N 3.33Å; N520-F572 PolarHBondContact OD1-O 2.94Å
521	L	96.5	Very high	90.2	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	139	174.8	-70.2	-179	0	0	0	110.1	W513 P518 S571 F572 P574 W625	W513-L521 HydrophobicContact CD2-CB 4.44Å; W513-L521 HydrophobicContact CD2-CD1 4Å; W513-L521 HydrophobicContact CD2-CD2 4.24Å; W513-L521 HydrophobicContact CD2-CG 4.48Å; W513-L521 HydrophobicContact CE3-CD1 3.87Å; W513-L521 HydrophobicContact CG-CD2 4.11Å; W513-L521 HydrophobicContact CH2-CB 4.26Å; W513-L521 HydrophobicContact CH2-CD1 4.37Å; W513-L521 HydrophobicContact CZ2-CB 3.81Å; W513-L521 HydrophobicContact CZ2-CD1 4.48Å; W513-L521 HydrophobicContact CZ3-CD1 4.07Å; P518-L521 HydrophobicContact CB-CD2 3.8Å; P518-L521 HydrophobicContact CB-CG 4.05Å; P518-L521 HydrophobicContact CG-CD1 3.81Å; P518-L521 HydrophobicContact CG-CD2 3.83Å; P518-L521 HydrophobicContact CG-CG 3.71Å; L521-S571 VanDerWaalsContact O-CA 3.3Å; L521-S571 WeakPolarHBondContact O-CA 3.37Å; L521-F572 HydrophobicContact CB-CE1 3.97Å; L521-F572 HydrophobicContact CB-CZ 4.11Å; L521-F572 HydrophobicContact CD1-CZ 4.33Å; L521-F572 PolarHBondContact N-O 3.19Å; L521-F572 PolarHBondContact O-N 2.89Å; L521-F572 VanDerWaalsContact O-N 3.08Å; L521-P574 HydrophobicContact CB-CG 4.41Å; L521-P574 HydrophobicContact CD1-CG 3.75Å; L521-P574 HydrophobicContact CG-CG 3.93Å; L521-W625 HydrophobicContact CD1-CB 4.07Å; L521-W625 HydrophobicContact CD1-CD2 3.73Å; L521-W625 HydrophobicContact CD1-CE3 3.96Å; L521-W625 HydrophobicContact CD1-CG 3.76Å
522	T	96	Very high	89.1	Confident	33 Å²	33	45 Å²	45	20%	0.202	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	137.6	-179.4	-56.3	0	0	0	0	110.8	L503 W513 V569 Y570 S571	L503-T522 WeakPolarHBondContact CB-O 3.09Å; L503-T522 HydrophobicContact CD1-CG2 4.07Å; L503-T522 PolarHBondContact N-O 3.27Å; W513-T522 PolarHBondContact NE1-O 2.77Å; T522-V569 HydrophobicContact CG2-CG2 3.9Å; T522-Y570 WeakPolarHBondContact CA-O 3.48Å; T522-S571 WeakPolarHBondContact CB-OG 3.42Å; T522-S571 VanDerWaalsContact CG2-OG 3.26Å; T522-S571 WeakPolarHBondContact CG2-OG 3.42Å; T522-S571 PolarHBondContact OG1-OG 3.16Å
523	L	96.6	Very high	88.4	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	152	172.7	64.5	98.3	0	0	0	110.9	V500 N501 L502 W513 W525 I540 I560 V569 Y570 F572 V595 I597	V500-L523 HydrophobicContact CG1-CB 4.36Å; V500-L523 HydrophobicContact CG1-CD1 4.12Å; N501-L523 CarbonylContact O-C 3.59Å; N501-L523 VanDerWaalsContact O-CA 3.31Å; N501-L523 WeakPolarHBondContact O-CA 3.13Å; L502-L523 HydrophobicContact CD2-CB 4.05Å; W513-L523 HydrophobicContact CH2-CB 4.34Å; W513-L523 HydrophobicContact CH2-CD2 3.64Å; W513-L523 HydrophobicContact CZ2-CB 3.77Å; W513-L523 HydrophobicContact CZ2-CD2 3.86Å; W513-L523 HydrophobicContact CZ2-CG 4.34Å; L523-W525 HydrophobicContact CD1-CE3 3.56Å; L523-W525 HydrophobicContact CD1-CZ3 3.49Å; L523-W525 VanDerWaalsContact CD1-CZ3 3.49Å; L523-I540 HydrophobicContact CD1-CD1 4.39Å; L523-I540 HydrophobicContact CD2-CG2 4.01Å; L523-I560 HydrophobicContact CD2-CD1 4.21Å; L523-V569 WeakPolarHBondContact O-CA 3.11Å; L523-Y570 PolarHBondContact N-O 3Å; L523-Y570 PolarHBondContact O-N 2.9Å; L523-F572 HydrophobicContact CD2-CE1 4.49Å; L523-V595 HydrophobicContact CD2-CG1 4.49Å; L523-I597 HydrophobicContact CD1-CD1 3.57Å
524	T	96.4	Very high	87.3	Confident	34 Å²	34	50.5 Å²	50.5	21%	0.209	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	152	179.7	58.4	0	0	0	0	112.3	V500 N501 L503 G568 V569	V500-T524 WeakPolarHBondContact CA-O 3.38Å; N501-T524 PolarHBondContact N-O 3.35Å; N501-T524 PolarHBondContact O-N 3.42Å; L503-T524 HydrophobicContact CD1-CG2 3.67Å; L503-T524 HydrophobicContact CG-CG2 4.34Å; T524-G568 CarbonylContact C-O 3.6Å; T524-G568 VanDerWaalsContact CA-O 3.25Å; T524-G568 WeakPolarHBondContact CA-O 3.41Å; T524-G568 WeakPolarHBondContact CB-O 3.49Å; T524-V569 HydrophobicContact CG2-CB 4.02Å; T524-V569 HydrophobicContact CG2-CG2 3.83Å
525	W	93.9	Very high	86.8	Confident	11 Å²	11	53.4 Å²	53.4	4%	0.042	29%	0.289	C	S	.	.			trans	-152.3	157.4	176.8	69.1	97.5	0	0	0	110.9	L523 N527 V538 I540 N566 G568 I597 Y616	L523-W525 HydrophobicContact CD1-CE3 3.56Å; L523-W525 HydrophobicContact CD1-CZ3 3.49Å; L523-W525 VanDerWaalsContact CD1-CZ3 3.49Å; W525-N527 PolarHBondContact O-N 3.43Å; W525-V538 HydrophobicContact CH2-CG2 4.43Å; W525-V538 HydrophobicContact CZ2-CG2 3.84Å; W525-I540 HydrophobicContact CH2-CD1 4.2Å; W525-I540 HydrophobicContact CZ3-CD1 4.32Å; W525-N566 PolarHBondContact NE1-OD1 3.35Å; W525-G568 PolarHBondContact N-O 2.86Å; W525-G568 WeakPolarHBondContact O-CA 3.23Å; W525-I597 HydrophobicContact CB-CD1 3.95Å; W525-I597 HydrophobicContact CD2-CD1 3.4Å; W525-I597 HydrophobicContact CD2-CG2 4.38Å; W525-I597 HydrophobicContact CE3-CD1 3.26Å; W525-I597 HydrophobicContact CG-CD1 3.72Å; W525-I597 HydrophobicContact CZ3-CD1 3.89Å; W525-Y616 HydrophobicContact CB-CD2 4.31Å
526	P	89.9	Confident	86.4	Confident	38 Å²	38	51.6 Å²	51.6	25%	0.247	28%	0.279	C	S	.	.			trans	-75	94	175.9	28.3	-30.5	0	0	0	110.8	Q499 Y528 N529 Y616	Q499-P526 VanDerWaalsContact O-CD 3.29Å; Q499-P526 WeakPolarHBondContact O-CD 3.4Å; P526-Y528 HydrophobicContact CB-CE1 4.12Å; P526-Y528 PolarHBondContact O-N 3.45Å; P526-N529 HydrophobicContact CB-CB 4.36Å; P526-N529 HydrophobicContact CG-CB 4.47Å; P526-N529 PolarHBondContact O-N 3.24Å; P526-Y616 HydrophobicContact CG-CE2 3.81Å
527	N	83.3	Confident	86.2	Confident	56 Å²	56	51.2 Å²	51.2	30%	0.299	28%	0.278	S	S	.	.	H	α-helix	trans	-59.6	-37.1	-174.9	61.4	-14.5	0	0	0	115	W525 N529 I530 S531 N566	W525-N527 PolarHBondContact O-N 3.43Å; N527-N529 VanDerWaalsContact C-N 3.28Å; N527-N529 PolarHBondContact O-N 2.81Å; N527-I530 VanDerWaalsContact O-CG2 3.23Å; N527-I530 WeakPolarHBondContact O-CG2 3.48Å; N527-I530 PolarHBondContact O-N 3.19Å; N527-S531 PolarHBondContact O-N 2.87Å; N527-N566 WeakPolarHBondContact CB-OD1 3.45Å; N527-N566 PolarHBondContact ND2-O 3.21Å; N527-N566 PolarHBondContact O-ND2 2.89Å
528	Y	77.6	Confident	86.1	Confident	158 Å²	158	48.9 Å²	48.9	62%	0.62	27%	0.265	S	S	*	.	H	α-helix	trans	-69.7	-25.3	-179.7	60.3	-87.6	0	0	0	113	P526 S531	P526-Y528 HydrophobicContact CB-CE1 4.12Å; P526-Y528 PolarHBondContact O-N 3.45Å; Y528-S531 CarbonylContact O-C 3.44Å
529	N	77.2	Confident	86.1	Confident	92 Å²	92	49 Å²	49	49%	0.492	27%	0.266	S	S	.	.	H	α-helix	trans	-82.5	-26.3	179.7	-72.7	-23.5	0	0	0	112.7	P526 N527 Y616	P526-N529 HydrophobicContact CB-CB 4.36Å; P526-N529 HydrophobicContact CG-CB 4.47Å; P526-N529 PolarHBondContact O-N 3.24Å; N527-N529 VanDerWaalsContact C-N 3.28Å; N527-N529 PolarHBondContact O-N 2.81Å; N529-Y616 WeakPolarHBondContact CB-OH 3.32Å; N529-Y616 PolarHBondContact O-OH 2.95Å
530	I	78.4	Confident	86.2	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-78.4	-38.9	178.3	-163.2	169.8	0	0	0	111	N527 V538 I597 V599 S612 Y616	N527-I530 VanDerWaalsContact O-CG2 3.23Å; N527-I530 WeakPolarHBondContact O-CG2 3.48Å; N527-I530 PolarHBondContact O-N 3.19Å; I530-V538 HydrophobicContact CD1-CG1 4.41Å; I530-V538 HydrophobicContact CG2-CG1 4.45Å; I530-I597 HydrophobicContact CD1-CG2 3.83Å; I530-V599 HydrophobicContact CG1-CG2 4.2Å; I530-S612 PolarHBondContact O-OG 3.18Å; I530-Y616 HydrophobicContact CB-CD2 4.42Å; I530-Y616 HydrophobicContact CB-CE2 3.88Å; I530-Y616 HydrophobicContact CD1-CD2 4.36Å; I530-Y616 HydrophobicContact CD1-CG 4.48Å; I530-Y616 HydrophobicContact CG1-CE2 4.49Å; I530-Y616 PolarHBondContact N-OH 2.9Å
531	S	77.6	Confident	86.3	Confident	24 Å²	24	43.3 Å²	43.3	17%	0.168	24%	0.236	C	C	.	.			trans	-152.2	132.4	172.1	-176.1	0	0	0	0	109.9	N527 Y528 N533 A536	N527-S531 PolarHBondContact O-N 2.87Å; Y528-S531 CarbonylContact O-C 3.44Å; S531-N533 PolarHBondContact O-N 3.37Å; S531-N533 PolarHBondContact OG-N 3.31Å; S531-A536 WeakPolarHBondContact OG-CB 3.4Å
532	V	67.7	Low	86.3	Confident	139 Å²	139	43.3 Å²	43.3	84%	0.842	24%	0.236	S	C	*	.	S	Bend	trans	-70.5	-19.9	173.7	-172.1	0	0	0	0	110.7	P534	V532-P534 WeakPolarHBondContact O-CD 3.38Å
533	N	76.3	Confident	86.3	Confident	52 Å²	52	42.5 Å²	42.5	28%	0.278	23%	0.229	S	C	.	.			trans	-76.5	116.7	-179.7	-167.2	-33.5	0	0	0	110.3	S531 N535 A536 R607	S531-N533 PolarHBondContact O-N 3.37Å; S531-N533 PolarHBondContact OG-N 3.31Å; N533-N535 PolarHBondContact O-N 3.43Å; N533-N535 PolarHBondContact OD1-N 3.43Å; N533-A536 HydrophobicContact CB-CB 4.31Å; N533-A536 WeakPolarHBondContact O-CB 3.41Å; N533-A536 PolarHBondContact O-N 3.16Å; N533-R607 PolarHBondContact ND2-NH1 3.15Å
534	P	72.8	Confident	86.4	Confident	110 Å²	110	42.5 Å²	42.5	71%	0.714	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-22.7	-177.7	27.7	-35.8	0	0	0	112.8	V532 A536	V532-P534 WeakPolarHBondContact O-CD 3.38Å; P534-A536 VanDerWaalsContact C-N 3.33Å
535	N	82.6	Confident	86.3	Confident	109 Å²	109	40.9 Å²	40.9	58%	0.583	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-1.3	178.4	-62.4	-41.7	0	0	0	112.8	N533 Q537 W603	N533-N535 PolarHBondContact O-N 3.43Å; N533-N535 PolarHBondContact OD1-N 3.43Å; N535-Q537 PolarHBondContact O-N 3.48Å; N535-W603 HydrophobicContact CB-CH2 3.8Å; N535-W603 HydrophobicContact CB-CZ2 4.13Å; N535-W603 WeakPolarHBondContact O-CH2 3.31Å; N535-W603 WeakPolarHBondContact O-CZ2 3.44Å; N535-W603 WeakPolarHBondContact O-CZ3 3.09Å
536	A	83.3	Confident	86.4	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.228	C	C	.	.			trans	-55.4	137.6	-178.4	0	0	0	0	0	111.8	S531 N533 P534 N566	S531-A536 WeakPolarHBondContact OG-CB 3.4Å; N533-A536 HydrophobicContact CB-CB 4.31Å; N533-A536 WeakPolarHBondContact O-CB 3.41Å; N533-A536 PolarHBondContact O-N 3.16Å; P534-A536 VanDerWaalsContact C-N 3.33Å; A536-N566 HydrophobicContact CB-CB 4.41Å; A536-N566 WeakPolarHBondContact O-CB 3.35Å; A536-N566 PolarHBondContact O-N 2.91Å
537	Q	89.6	Confident	86.6	Confident	49 Å²	49	41.6 Å²	41.6	23%	0.229	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	144.2	171.5	-68.8	178.2	-41	0	0	109.7	N535 N563 T564 S600 W603	N535-Q537 PolarHBondContact O-N 3.48Å; Q537-N563 PolarHBondContact NE2-O 3.08Å; Q537-N563 PolarHBondContact OE1-ND2 3.01Å; Q537-N563 PolarHBondContact OE1-OD1 2.93Å; Q537-T564 CarbonylContact C-O 3.58Å; Q537-T564 VanDerWaalsContact CA-O 3.31Å; Q537-T564 WeakPolarHBondContact CA-O 3.4Å; Q537-S600 WeakPolarHBondContact O-CB 3.38Å; Q537-S600 PolarHBondContact O-N 2.05Å; Q537-W603 HydrophobicContact CB-CB 4.19Å; Q537-W603 HydrophobicContact CB-CD2 4.25Å; Q537-W603 HydrophobicContact CB-CE3 4.03Å; Q537-W603 HydrophobicContact CB-CG 4.33Å; Q537-W603 HydrophobicContact CG-CD2 4.43Å; Q537-W603 HydrophobicContact CG-CE3 3.78Å; Q537-W603 HydrophobicContact CG-CZ3 4.11Å
538	V	91.6	Very high	86.8	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	151	-177.8	-65.8	0	0	0	0	110.9	W525 I530 N563 T564 N566 I597 R598	W525-V538 HydrophobicContact CH2-CG2 4.43Å; W525-V538 HydrophobicContact CZ2-CG2 3.84Å; I530-V538 HydrophobicContact CD1-CG1 4.41Å; I530-V538 HydrophobicContact CG2-CG1 4.45Å; V538-N563 PolarHBondContact O-N 3.21Å; V538-T564 WeakPolarHBondContact CG2-O 3.4Å; V538-T564 PolarHBondContact N-O 3.36Å; V538-T564 PolarHBondContact O-N 3.06Å; V538-N566 HydrophobicContact CG1-CB 3.97Å; V538-I597 HydrophobicContact CB-CG2 4.18Å; V538-I597 HydrophobicContact CG1-CG2 4.47Å; V538-I597 HydrophobicContact CG2-CG2 4.47Å; V538-R598 CarbonylContact C-O 3.58Å; V538-R598 WeakPolarHBondContact CA-O 3.36Å; V538-R598 VanDerWaalsContact CB-O 3.3Å; V538-R598 WeakPolarHBondContact CB-O 3.36Å
539	D	93.6	Very high	87	Confident	3 Å²	3	38.4 Å²	38.4	2%	0.016	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	133.6	168.4	-65.8	-24.4	0	0	0	109	T541 R562 N563 I597 R598	D539-T541 HydrophobicContact CB-CG2 4.15Å; D539-R562 VanDerWaalsContact OD1-CA 3.32Å; D539-R562 WeakPolarHBondContact OD1-CA 3.46Å; D539-N563 PolarHBondContact OD1-N 3.21Å; D539-I597 WeakPolarHBondContact O-CA 3.03Å; D539-R598 HydrophobicContact CB-CG 4.24Å; D539-R598 PolarHBondContact N-O 2.82Å; D539-R598 PolarHBondContact O-N 3.02Å; D539-R598 VanDerWaalsContact O-N 3.09Å
540	I	95.7	Very high	87.4	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	105.1	174.1	-52.5	175.8	0	0	0	106.8	L523 W525 I560 A561 Y570 V595 Q596 I597	L523-I540 HydrophobicContact CD1-CD1 4.39Å; L523-I540 HydrophobicContact CD2-CG2 4.01Å; W525-I540 HydrophobicContact CH2-CD1 4.2Å; W525-I540 HydrophobicContact CZ3-CD1 4.32Å; I540-I560 HydrophobicContact CB-CB 4.29Å; I540-I560 HydrophobicContact CG2-CB 3.95Å; I540-I560 HydrophobicContact CG2-CD1 3.88Å; I540-I560 HydrophobicContact CG2-CG1 4.3Å; I540-I560 PolarHBondContact O-N 3.04Å; I540-A561 PolarHBondContact N-O 2.68Å; I540-A561 PolarHBondContact O-N 3.08Å; I540-Y570 HydrophobicContact CD1-CD1 3.79Å; I540-Y570 HydrophobicContact CD1-CD2 4.12Å; I540-Y570 HydrophobicContact CD1-CE1 4.49Å; I540-Y570 HydrophobicContact CD1-CG 3.58Å; I540-V595 HydrophobicContact CG2-CG1 3.93Å; I540-Q596 WeakPolarHBondContact CA-O 3.45Å; I540-I597 HydrophobicContact CG1-CG1 4.36Å; I540-I597 HydrophobicContact CG2-CG1 4.38Å
541	T	95.7	Very high	87.9	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	158.1	-172.5	64.7	0	0	0	0	112.3	D539 W543 E556 Q596	D539-T541 HydrophobicContact CB-CG2 4.15Å; T541-W543 PolarHBondContact OG1-NE1 2.92Å; T541-E556 HydrophobicContact CG2-CG 4.44Å; T541-Q596 PolarHBondContact N-O 3.27Å; T541-Q596 PolarHBondContact O-N 3.4Å; T541-Q596 PolarHBondContact OG1-OE1 3.1Å; T541-Q596 VanDerWaalsContact OG1-OE1 3.14Å
542	L	96.2	Very high	88.6	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	131.4	177.3	-66.1	167.1	0	0	0	109.1	E556 V557 G558 I560 V595 F623 W625 Y626	L542-E556 CarbonylContact O-C 3.58Å; L542-E556 WeakPolarHBondContact O-CA 3.35Å; L542-V557 PolarHBondContact O-N 2.67Å; L542-G558 PolarHBondContact N-O 2.83Å; L542-I560 HydrophobicContact CD1-CG1 4.37Å; L542-I560 HydrophobicContact CD2-CD1 4.26Å; L542-I560 HydrophobicContact CD2-CG1 4.39Å; L542-I560 HydrophobicContact CG-CG1 4.22Å; L542-V595 HydrophobicContact CD2-CG2 3.93Å; L542-F623 HydrophobicContact CB-CE1 4.47Å; L542-F623 HydrophobicContact CB-CE2 4.39Å; L542-F623 HydrophobicContact CB-CZ 3.99Å; L542-F623 HydrophobicContact CD2-CD1 4.3Å; L542-F623 HydrophobicContact CD2-CE1 3.64Å; L542-F623 HydrophobicContact CD2-CZ 4Å; L542-W625 HydrophobicContact CD1-CH2 3.73Å; L542-W625 HydrophobicContact CD1-CZ2 4.35Å; L542-W625 HydrophobicContact CD1-CZ3 4.45Å; L542-W625 HydrophobicContact CD2-CH2 3.58Å; L542-W625 HydrophobicContact CD2-CZ2 3.61Å; L542-W625 HydrophobicContact CG-CH2 4.21Å; L542-Y626 HydrophobicContact CD1-CD1 3.81Å; L542-Y626 HydrophobicContact CD1-CD2 3.36Å; L542-Y626 HydrophobicContact CD1-CE1 3.93Å; L542-Y626 HydrophobicContact CD1-CE2 3.49Å; L542-Y626 VanDerWaalsContact CD1-CE2 3.49Å; L542-Y626 HydrophobicContact CD1-CG 3.52Å
543	W	97	Very high	89.8	Confident	16 Å²	16	42.2 Å²	42.2	6%	0.061	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	113.8	177.2	-78.6	66.6	0	0	0	109.5	V461 T541 F554 T555 E556 G593 L594 Q596 W617 F623	V461-W543 HydrophobicContact CB-CH2 4.45Å; V461-W543 HydrophobicContact CG2-CH2 3.64Å; V461-W543 HydrophobicContact CG2-CZ3 4Å; T541-W543 PolarHBondContact OG1-NE1 2.92Å; W543-F554 HydrophobicContact CB-CD2 4.44Å; W543-F554 HydrophobicContact CB-CE1 4.47Å; W543-F554 HydrophobicContact CB-CE2 3.57Å; W543-F554 HydrophobicContact CB-CZ 3.58Å; W543-F554 HydrophobicContact CD2-CE1 4.34Å; W543-F554 HydrophobicContact CD2-CZ 4.28Å; W543-F554 AromaticContact CE3-CD1 3.84Å; W543-F554 HydrophobicContact CE3-CD1 3.84Å; W543-F554 AromaticContact CE3-CE1 3.63Å; W543-F554 HydrophobicContact CE3-CE1 3.63Å; W543-F554 HydrophobicContact CE3-CE2 4.36Å; W543-F554 HydrophobicContact CE3-CG 4.29Å; W543-F554 AromaticContact CE3-CZ 3.91Å; W543-F554 HydrophobicContact CE3-CZ 3.91Å; W543-F554 HydrophobicContact CG-CZ 4.18Å; W543-F554 HydrophobicContact CZ3-CD1 4.28Å; W543-F554 HydrophobicContact CZ3-CE1 4.32Å; W543-T555 CarbonylContact C-O 3.3Å; W543-T555 VanDerWaalsContact CA-O 3.26Å; W543-T555 WeakPolarHBondContact CA-O 3.27Å; W543-T555 VanDerWaalsContact CE3-C 3.49Å; W543-E556 HydrophobicContact CD2-CB 4.37Å; W543-E556 HydrophobicContact CZ2-CB 3.99Å; W543-G593 CarbonylContact O-C 3.5Å; W543-G593 VanDerWaalsContact O-CA 3.23Å; W543-G593 WeakPolarHBondContact O-CA 3.39Å; W543-L594 PolarHBondContact N-O 3.42Å; W543-L594 PolarHBondContact O-N 2.98Å; W543-Q596 VanDerWaalsContact CD1-CB 3.47Å; W543-Q596 VanDerWaalsContact CE2-NE2 3.27Å; W543-Q596 HydrophobicContact CG-CB 4.45Å; W543-Q596 VanDerWaalsContact NE1-NE2 3.14Å; W543-W617 HydrophobicContact CB-CZ3 4.08Å; W543-W617 AromaticContact CD1-CZ3 3.96Å; W543-W617 AromaticContact CD2-CH2 3.88Å; W543-W617 HydrophobicContact CD2-CH2 3.88Å; W543-W617 HydrophobicContact CD2-CZ3 4.09Å; W543-W617 HydrophobicContact CE3-CH2 4.2Å; W543-W617 HydrophobicContact CG-CH2 4.06Å; W543-W617 AromaticContact CG-CZ3 3.75Å; W543-W617 HydrophobicContact CG-CZ3 3.75Å; W543-F623 WeakPolarHBondContact O-CZ 3.28Å
544	G	97	Very high	90.7	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	143.1	-179.6	0	0	0	0	0	111.8	F554 T555 F590	G544-F554 WeakPolarHBondContact O-CA 3.25Å; G544-F554 WeakPolarHBondContact O-CD2 3.49Å; G544-T555 PolarHBondContact N-O 2.86Å; G544-T555 PolarHBondContact O-N 3.09Å; G544-T555 VanDerWaalsContact O-N 3.15Å; G544-F590 WeakPolarHBondContact O-CE1 3.5Å
545	Y	96.4	Very high	91.7	Very high	1 Å²	1	36.5 Å²	36.5	0%	0.004	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	135.5	170.2	-176.7	-94.9	0	0	0	110.8	E547 H552 R553 F554 G592 V765 M768	Y545-E547 HydrophobicContact CE1-CB 4.3Å; Y545-E547 HydrophobicContact CE1-CG 4.11Å; Y545-E547 PolarHBondContact OH-OE2 3.18Å; Y545-H552 HydrophobicContact CE2-CB 3.9Å; Y545-H552 AromaticContact CE2-ND1 3.74Å; Y545-H552 WeakPolarHBondContact OH-CB 3.27Å; Y545-R553 WeakPolarHBondContact CA-O 3.4Å; Y545-F554 HydrophobicContact CD2-CB 4.11Å; Y545-F554 HydrophobicContact CD2-CD2 4.27Å; Y545-G592 PolarHBondContact N-O 3.37Å; Y545-G592 VanDerWaalsContact N-O 3.08Å; Y545-V765 WeakPolarHBondContact OH-CB 3.48Å; Y545-V765 VanDerWaalsContact OH-CG2 3.28Å; Y545-V765 WeakPolarHBondContact OH-CG2 3.32Å; Y545-M768 HydrophobicContact CD1-CB 3.94Å; Y545-M768 HydrophobicContact CD1-CE 4.11Å; Y545-M768 HydrophobicContact CD2-CB 3.97Å; Y545-M768 HydrophobicContact CD2-CE 3.41Å; Y545-M768 VanDerWaalsContact CD2-CE 3.41Å; Y545-M768 HydrophobicContact CD2-CG 4.31Å; Y545-M768 HydrophobicContact CE1-CB 3.61Å; Y545-M768 WeakPolarHBondContact CE1-O 3.32Å; Y545-M768 HydrophobicContact CE2-CB 3.64Å; Y545-M768 HydrophobicContact CE2-CE 4.22Å; Y545-M768 HydrophobicContact CE2-CG 4.18Å; Y545-M768 HydrophobicContact CG-CB 4.11Å; Y545-M768 HydrophobicContact CG-CE 3.33Å; Y545-M768 VanDerWaalsContact CZ-CB 3.44Å
546	W	95	Very high	92.3	Very high	63 Å²	63	33.3 Å²	33.3	24%	0.239	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	149.7	176.2	158.7	84.9	0	0	0	109.2	D548 H552 R553 Q589 F590 Y772	W546-D548 HydrophobicContact CH2-CB 4.37Å; W546-D548 HydrophobicContact CZ2-CB 3.83Å; W546-H552 CarbonylContact O-C 3.55Å; W546-H552 WeakPolarHBondContact O-CA 3.33Å; W546-R553 HydrophobicContact CE3-CB 3.55Å; W546-R553 HydrophobicContact CZ3-CB 3.96Å; W546-R553 PolarHBondContact N-O 3.33Å; W546-R553 PolarHBondContact O-N 2.9Å; W546-Q589 WeakPolarHBondContact CB-O 3.48Å; W546-Q589 VanDerWaalsContact CD1-O 3.29Å; W546-F590 HydrophobicContact CB-CD1 3.75Å; W546-F590 HydrophobicContact CB-CE1 3.69Å; W546-Y772 HydrophobicContact CB-CE2 4.4Å; W546-Y772 AromaticContact CD1-CE2 3.9Å; W546-Y772 AromaticContact CD1-CZ 3.76Å; W546-Y772 VanDerWaalsContact CD1-OH 3.23Å; W546-Y772 HydrophobicContact CG-CE2 4.49Å
547	E	93.8	Very high	92.9	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	157	173.1	59.6	168.9	-120.2	0	0	112.8	Y545 G551 H552 P762 S769 Y772 N773	Y545-E547 HydrophobicContact CE1-CB 4.3Å; Y545-E547 HydrophobicContact CE1-CG 4.11Å; Y545-E547 PolarHBondContact OH-OE2 3.18Å; E547-G551 WeakPolarHBondContact CA-O 3.3Å; E547-H552 HydrophobicContact CB-CB 3.92Å; E547-P762 HydrophobicContact CB-CB 4.07Å; E547-P762 HydrophobicContact CB-CG 3.73Å; E547-P762 HydrophobicContact CG-CB 4.4Å; E547-S769 VanDerWaalsContact OE2-CA 3.31Å; E547-S769 WeakPolarHBondContact OE2-CA 3.22Å; E547-S769 WeakPolarHBondContact OE2-CB 3.42Å; E547-S769 PolarHBondContact OE2-OG 3.33Å; E547-Y772 HydrophobicContact CG-CD1 3.35Å; E547-Y772 HydrophobicContact CG-CE1 3.77Å; E547-Y772 HydrophobicContact CG-CG 3.97Å; E547-Y772 VanDerWaalsContact O-CE1 3.24Å; E547-Y772 WeakPolarHBondContact O-CE1 3.24Å; E547-Y772 PolarHBondContact O-OH 2.9Å; E547-N773 PolarHBondContact OE1-ND2 3.45Å
548	D	88.2	Confident	93.1	Very high	41 Å²	41	31.1 Å²	31.1	22%	0.219	16%	0.16	C	C	.	.			trans	-129.7	-160.8	168.9	69	11.1	0	0	0	110.8	W546 L550 G551 P762	W546-D548 HydrophobicContact CH2-CB 4.37Å; W546-D548 HydrophobicContact CZ2-CB 3.83Å; D548-L550 VanDerWaalsContact C-N 3.32Å; D548-L550 WeakPolarHBondContact OD1-CA 3.26Å; D548-L550 PolarHBondContact OD1-N 3.45Å; D548-G551 PolarHBondContact N-O 2.99Å; D548-G551 PolarHBondContact OD1-N 3.48Å; D548-P762 WeakPolarHBondContact O-CB 3.29Å; D548-P762 WeakPolarHBondContact O-CG 3.43Å
549	V	81.2	Confident	93.2	Very high	106 Å²	106	31.6 Å²	31.6	64%	0.642	16%	0.163	S	C	*	.	S	Bend	trans	-75.6	-16.2	177.9	-81.1	0	0	0	0	114
550	L	85.1	Confident	93.3	Very high	156 Å²	156	31.7 Å²	31.7	82%	0.817	16%	0.164	S	C	*	.	S	Bend	trans	-101.3	-36.8	-175.9	-63.2	177.5	0	0	0	112.4	D548	D548-L550 VanDerWaalsContact C-N 3.32Å; D548-L550 WeakPolarHBondContact OD1-CA 3.26Å; D548-L550 PolarHBondContact OD1-N 3.45Å
551	G	90	Very high	93.2	Very high	25 Å²	25	32.1 Å²	32.1	26%	0.258	17%	0.167	S	C	.	.			trans	-170.5	178.5	-174.4	0	0	0	0	0	114.4	E547 D548 P762	E547-G551 WeakPolarHBondContact CA-O 3.3Å; D548-G551 PolarHBondContact N-O 2.99Å; D548-G551 PolarHBondContact OD1-N 3.48Å; G551-P762 VanDerWaalsContact C-CG 3.4Å; G551-P762 WeakPolarHBondContact O-CG 3.38Å
552	H	92.5	Very high	93.1	Very high	49 Å²	49	36.8 Å²	36.8	23%	0.227	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	158.4	176.9	72.2	88.3	0	0	0	111	F465 Y545 W546 E547 P762	F465-H552 AromaticContact CD1-CE1 3.8Å; F465-H552 AromaticContact CD2-CE1 3.63Å; F465-H552 AromaticContact CE1-CE1 3.82Å; F465-H552 AromaticContact CE2-CE1 3.54Å; F465-H552 AromaticContact CG-CE1 3.76Å; F465-H552 AromaticContact CZ-CE1 3.7Å; Y545-H552 HydrophobicContact CE2-CB 3.9Å; Y545-H552 AromaticContact CE2-ND1 3.74Å; Y545-H552 WeakPolarHBondContact OH-CB 3.27Å; W546-H552 CarbonylContact O-C 3.55Å; W546-H552 WeakPolarHBondContact O-CA 3.33Å; E547-H552 HydrophobicContact CB-CB 3.92Å; H552-P762 HydrophobicContact CB-CG 4.13Å
553	R	92.8	Very high	92.8	Very high	106 Å²	106	39.8 Å²	39.8	40%	0.4	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	131	174.3	-163.8	175.7	-180	-174.3	3.2	109.3	Y545 W546 T555 Q589 F590	Y545-R553 WeakPolarHBondContact CA-O 3.4Å; W546-R553 HydrophobicContact CE3-CB 3.55Å; W546-R553 HydrophobicContact CZ3-CB 3.96Å; W546-R553 PolarHBondContact N-O 3.33Å; W546-R553 PolarHBondContact O-N 2.9Å; R553-T555 HydrophobicContact CG-CG2 4.44Å; R553-Q589 VanDerWaalsContact NH1-OE1 3.15Å; R553-F590 HydrophobicContact CG-CZ 4.32Å
554	F	94.3	Very high	92.5	Very high	5 Å²	5	40.4 Å²	40.4	2%	0.022	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	115.7	170.8	-176.7	-122.9	0	0	0	108.3	L418 N462 F465 W543 G544 Y545 L594 W617 M768	L418-F554 HydrophobicContact CD2-CD1 4.44Å; L418-F554 HydrophobicContact CD2-CE1 4.02Å; L418-F554 HydrophobicContact CD2-CZ 4.31Å; N462-F554 PolarHBondContact ND2-O 2.88Å; N462-F554 WeakPolarHBondContact OD1-CB 3.4Å; N462-F554 VanDerWaalsContact OD1-CD1 3.23Å; N462-F554 WeakPolarHBondContact OD1-CD1 3.48Å; N462-F554 PolarHBondContact OD1-O 2.83Å; F465-F554 HydrophobicContact CZ-CB 3.75Å; F465-F554 HydrophobicContact CZ-CD1 4.01Å; F465-F554 HydrophobicContact CZ-CG 4.16Å; W543-F554 HydrophobicContact CB-CD2 4.44Å; W543-F554 HydrophobicContact CB-CE1 4.47Å; W543-F554 HydrophobicContact CB-CE2 3.57Å; W543-F554 HydrophobicContact CB-CZ 3.58Å; W543-F554 HydrophobicContact CD2-CE1 4.34Å; W543-F554 HydrophobicContact CD2-CZ 4.28Å; W543-F554 AromaticContact CE3-CD1 3.84Å; W543-F554 HydrophobicContact CE3-CD1 3.84Å; W543-F554 AromaticContact CE3-CE1 3.63Å; W543-F554 HydrophobicContact CE3-CE1 3.63Å; W543-F554 HydrophobicContact CE3-CE2 4.36Å; W543-F554 HydrophobicContact CE3-CG 4.29Å; W543-F554 AromaticContact CE3-CZ 3.91Å; W543-F554 HydrophobicContact CE3-CZ 3.91Å; W543-F554 HydrophobicContact CG-CZ 4.18Å; W543-F554 HydrophobicContact CZ3-CD1 4.28Å; W543-F554 HydrophobicContact CZ3-CE1 4.32Å; G544-F554 WeakPolarHBondContact O-CA 3.25Å; G544-F554 WeakPolarHBondContact O-CD2 3.49Å; Y545-F554 HydrophobicContact CD2-CB 4.11Å; Y545-F554 HydrophobicContact CD2-CD2 4.27Å; F554-L594 HydrophobicContact CE2-CD1 3.62Å; F554-L594 HydrophobicContact CZ-CD1 3.8Å; F554-W617 AromaticContact CE1-CH2 3.75Å; F554-W617 HydrophobicContact CE1-CH2 3.75Å; F554-W617 HydrophobicContact CE1-CZ2 4.38Å; F554-W617 HydrophobicContact CE1-CZ3 4.17Å; F554-W617 AromaticContact CZ-CH2 3.89Å; F554-W617 HydrophobicContact CZ-CH2 3.89Å; F554-W617 AromaticContact CZ-CZ3 3.81Å; F554-W617 HydrophobicContact CZ-CZ3 3.81Å; F554-M768 HydrophobicContact CD2-CE 4.23Å; F554-M768 HydrophobicContact CE2-CE 4.26Å
555	T	94.9	Very high	92.2	Very high	38 Å²	38	43.4 Å²	43.4	23%	0.233	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	160.8	-170.6	-159.9	0	0	0	0	112	W543 G544 R553 V557 L583 F590	W543-T555 CarbonylContact C-O 3.3Å; W543-T555 VanDerWaalsContact CA-O 3.26Å; W543-T555 WeakPolarHBondContact CA-O 3.27Å; W543-T555 VanDerWaalsContact CE3-C 3.49Å; G544-T555 PolarHBondContact N-O 2.86Å; G544-T555 PolarHBondContact O-N 3.09Å; G544-T555 VanDerWaalsContact O-N 3.15Å; R553-T555 HydrophobicContact CG-CG2 4.44Å; T555-V557 PolarHBondContact O-N 2.92Å; T555-L583 HydrophobicContact CG2-CD2 4.25Å; T555-F590 HydrophobicContact CG2-CE1 4.43Å; T555-F590 HydrophobicContact CG2-CE2 4.06Å; T555-F590 HydrophobicContact CG2-CZ 3.62Å
556	E	94.8	Very high	91.9	Very high	42 Å²	42	44 Å²	44	20%	0.196	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	121.5	174.7	-162.7	175.5	133.7	0	0	109.3	T541 L542 W543 R562 R598	T541-E556 HydrophobicContact CG2-CG 4.44Å; L542-E556 CarbonylContact O-C 3.58Å; L542-E556 WeakPolarHBondContact O-CA 3.35Å; W543-E556 HydrophobicContact CD2-CB 4.37Å; W543-E556 HydrophobicContact CZ2-CB 3.99Å; E556-R562 IonicContact OE1-CZ 3.47Å; E556-R562 IonicContact OE1-NH1 2.68Å; E556-R562 IonicContact OE1-NH2 3.86Å; E556-R562 PolarHBondContact OE1-NH2 2.7Å; E556-R598 IonicContact OE1-NH2 3.92Å; E556-R598 IonicContact OE2-CZ 3.32Å; E556-R598 IonicContact OE2-NH1 3.94Å; E556-R598 PolarHBondContact OE2-NH1 2.87Å; E556-R598 IonicContact OE2-NH2 2.64Å; E556-R598 PolarHBondContact OE2-NH2 2.79Å
557	V	94.9	Very high	91.7	Very high	1 Å²	1	50 Å²	50	1%	0.006	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	-30	-175	160.7	0	0	0	0	112	L542 T555 M582 L583 A586 F590 Y626 F627	L542-V557 PolarHBondContact O-N 2.67Å; T555-V557 PolarHBondContact O-N 2.92Å; V557-M582 CarbonylContact O-C 3.59Å; V557-M582 WeakPolarHBondContact O-CA 3.45Å; V557-L583 WeakPolarHBondContact O-CB 3.39Å; V557-L583 PolarHBondContact O-N 2.79Å; V557-A586 HydrophobicContact CG1-CB 3.93Å; V557-F590 HydrophobicContact CG2-CB 4.11Å; V557-F590 HydrophobicContact CG2-CD1 4.37Å; V557-F590 HydrophobicContact CG2-CD2 3.54Å; V557-F590 HydrophobicContact CG2-CE2 3.99Å; V557-F590 HydrophobicContact CG2-CG 3.74Å; V557-Y626 HydrophobicContact CG1-CE1 4.33Å; V557-F627 HydrophobicContact CG1-CE1 4.28Å; V557-F627 HydrophobicContact CG1-CE2 4.23Å; V557-F627 HydrophobicContact CG1-CZ 3.46Å; V557-F627 VanDerWaalsContact CG1-CZ 3.46Å
558	G	94.4	Very high	91.6	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.01	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.3	-175.9	179.9	0	0	0	0	0	110.7	L542	L542-G558 PolarHBondContact N-O 2.83Å
559	S	94.7	Very high	91.9	Very high	10 Å²	10	51.9 Å²	51.9	7%	0.07	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	152.9	176.9	71	0	0	0	0	113.6	D581	S559-D581 WeakPolarHBondContact CB-OD2 3.12Å; S559-D581 PolarHBondContact N-OD1 3.16Å; S559-D581 PolarHBondContact N-OD2 3.49Å; S559-D581 PolarHBondContact OG-OD1 3.45Å; S559-D581 PolarHBondContact OG-OD2 3.49Å
560	I	94.9	Very high	92.6	Very high	6 Å²	6	49.6 Å²	49.6	3%	0.031	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	-45	163.6	-61	177.7	0	0	0	108.7	W513 L523 I540 L542 Y570 F572 L577 V595 W625	W513-I560 HydrophobicContact CH2-CD1 4.12Å; W513-I560 HydrophobicContact CZ3-CD1 4.35Å; L523-I560 HydrophobicContact CD2-CD1 4.21Å; I540-I560 HydrophobicContact CB-CB 4.29Å; I540-I560 HydrophobicContact CG2-CB 3.95Å; I540-I560 HydrophobicContact CG2-CD1 3.88Å; I540-I560 HydrophobicContact CG2-CG1 4.3Å; I540-I560 PolarHBondContact O-N 3.04Å; L542-I560 HydrophobicContact CD1-CG1 4.37Å; L542-I560 HydrophobicContact CD2-CD1 4.26Å; L542-I560 HydrophobicContact CD2-CG1 4.39Å; L542-I560 HydrophobicContact CG-CG1 4.22Å; I560-Y570 HydrophobicContact CG2-CD1 4.11Å; I560-Y570 HydrophobicContact CG2-CE1 3.67Å; I560-F572 HydrophobicContact CD1-CE1 4.04Å; I560-F572 HydrophobicContact CD1-CZ 3.82Å; I560-F572 HydrophobicContact CG1-CZ 4.19Å; I560-F572 HydrophobicContact CG2-CD1 3.66Å; I560-F572 HydrophobicContact CG2-CD2 3.89Å; I560-F572 HydrophobicContact CG2-CE1 3.56Å; I560-F572 HydrophobicContact CG2-CE2 3.77Å; I560-F572 HydrophobicContact CG2-CG 3.84Å; I560-F572 HydrophobicContact CG2-CZ 3.62Å; I560-L577 WeakPolarHBondContact O-CD1 3.31Å; I560-V595 HydrophobicContact CD1-CG1 4.31Å; I560-W625 HydrophobicContact CD1-CH2 3.79Å; I560-W625 HydrophobicContact CD1-CZ3 4.46Å; I560-W625 HydrophobicContact CG1-CH2 4.01Å; I560-W625 HydrophobicContact CG1-CZ3 4.44Å
561	A	93.9	Very high	93.1	Very high	9 Å²	9	45 Å²	45	7%	0.074	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	139.2	177.1	0	0	0	0	0	109.5	I540 T564 Y570	I540-A561 PolarHBondContact N-O 2.68Å; I540-A561 PolarHBondContact O-N 3.08Å; A561-T564 WeakPolarHBondContact CB-OG1 3.44Å; A561-Y570 HydrophobicContact CB-CE1 4.01Å; A561-Y570 HydrophobicContact CB-CE2 4.08Å; A561-Y570 WeakPolarHBondContact CB-OH 3.33Å
562	R	92.3	Very high	93.4	Very high	97 Å²	97	44.7 Å²	44.7	37%	0.366	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	156.5	169.9	-68	-171.1	-176.9	-101.6	-0.8	110.4	D539 E556 T564 D581	D539-R562 VanDerWaalsContact OD1-CA 3.32Å; D539-R562 WeakPolarHBondContact OD1-CA 3.46Å; E556-R562 IonicContact OE1-CZ 3.47Å; E556-R562 IonicContact OE1-NH1 2.68Å; E556-R562 IonicContact OE1-NH2 3.86Å; E556-R562 PolarHBondContact OE1-NH2 2.7Å; R562-T564 PolarHBondContact O-N 3.09Å; R562-T564 VanDerWaalsContact O-N 3.09Å; R562-T564 PolarHBondContact O-OG1 2.81Å; R562-D581 IonicContact CZ-OD2 2.74Å; R562-D581 IonicContact NE-OD2 3.09Å; R562-D581 PolarHBondContact NE-OD2 3Å; R562-D581 IonicContact NH2-OD2 3.94Å; R562-D581 PolarHBondContact NH2-OD2 2.79Å
563	N	90.2	Very high	93.5	Very high	64 Å²	64	45 Å²	45	34%	0.342	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	51.2	37.3	173.7	-150	44.2	0	0	0	114.8	Q537 V538 D539 S600	Q537-N563 PolarHBondContact NE2-O 3.08Å; Q537-N563 PolarHBondContact OE1-ND2 3.01Å; Q537-N563 PolarHBondContact OE1-OD1 2.93Å; V538-N563 PolarHBondContact O-N 3.21Å; D539-N563 PolarHBondContact OD1-N 3.21Å; N563-S600 PolarHBondContact OD1-OG 3.42Å; N563-S600 VanDerWaalsContact OD1-OG 3.08Å
564	T	91.6	Very high	93.5	Very high	28 Å²	28	40.2 Å²	40.2	17%	0.172	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	143.6	-173.4	-64.7	0	0	0	0	110.7	Q537 V538 A561 R562 N566 Y570	Q537-T564 CarbonylContact C-O 3.58Å; Q537-T564 VanDerWaalsContact CA-O 3.31Å; Q537-T564 WeakPolarHBondContact CA-O 3.4Å; V538-T564 WeakPolarHBondContact CG2-O 3.4Å; V538-T564 PolarHBondContact N-O 3.36Å; V538-T564 PolarHBondContact O-N 3.06Å; A561-T564 WeakPolarHBondContact CB-OG1 3.44Å; R562-T564 PolarHBondContact O-N 3.09Å; R562-T564 VanDerWaalsContact O-N 3.09Å; R562-T564 PolarHBondContact O-OG1 2.81Å; T564-N566 PolarHBondContact O-N 3.49Å; T564-Y570 HydrophobicContact CG2-CD2 3.97Å; T564-Y570 HydrophobicContact CG2-CE2 3.79Å
565	P	91.4	Very high	93.2	Very high	64 Å²	64	46.1 Å²	46.1	42%	0.416	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	136.3	178.5	-25.7	34.9	0	0	0	113.4	R567	P565-R567 VanDerWaalsContact C-N 3.3Å; P565-R567 HydrophobicContact CB-CG 4.35Å; P565-R567 PolarHBondContact O-N 3.29Å
566	N	89.6	Confident	93.1	Very high	12 Å²	12	49.6 Å²	49.6	6%	0.064	25%	0.249	C	C	.	.			trans	-72.7	72.3	-179.2	-175.3	26.1	0	0	0	113.5	W525 N527 A536 V538 T564	W525-N566 PolarHBondContact NE1-OD1 3.35Å; N527-N566 WeakPolarHBondContact CB-OD1 3.45Å; N527-N566 PolarHBondContact ND2-O 3.21Å; N527-N566 PolarHBondContact O-ND2 2.89Å; A536-N566 HydrophobicContact CB-CB 4.41Å; A536-N566 WeakPolarHBondContact O-CB 3.35Å; A536-N566 PolarHBondContact O-N 2.91Å; V538-N566 HydrophobicContact CG1-CB 3.97Å; T564-N566 PolarHBondContact O-N 3.49Å
567	R	90.5	Very high	92.9	Very high	190 Å²	190	49 Å²	49	72%	0.717	25%	0.246	S	C	*	.			trans	-85.6	-11.6	-179.2	-64.9	-177.9	-179	176.8	0.9	114.7	P565 V569	P565-R567 VanDerWaalsContact C-N 3.3Å; P565-R567 HydrophobicContact CB-CG 4.35Å; P565-R567 PolarHBondContact O-N 3.29Å; R567-V569 PolarHBondContact O-N 3.03Å
568	G	90.5	Very high	92.4	Very high	10 Å²	10	52.1 Å²	52.1	10%	0.103	27%	0.273	C	S	.	.	S	Bend	trans	80	-2.9	-176.6	0	0	0	0	0	114.9	T524 W525	T524-G568 CarbonylContact C-O 3.6Å; T524-G568 VanDerWaalsContact CA-O 3.25Å; T524-G568 WeakPolarHBondContact CA-O 3.41Å; T524-G568 WeakPolarHBondContact CB-O 3.49Å; W525-G568 PolarHBondContact N-O 2.86Å; W525-G568 WeakPolarHBondContact O-CA 3.23Å
569	V	95.7	Very high	92.1	Very high	71 Å²	71	54 Å²	54	43%	0.43	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	142.1	174.5	59.7	0	0	0	0	109	T522 L523 T524 R567	T522-V569 HydrophobicContact CG2-CG2 3.9Å; L523-V569 WeakPolarHBondContact O-CA 3.11Å; T524-V569 HydrophobicContact CG2-CB 4.02Å; T524-V569 HydrophobicContact CG2-CG2 3.83Å; R567-V569 PolarHBondContact O-N 3.03Å
570	Y	96	Very high	91.7	Very high	58 Å²	58	59.6 Å²	59.6	23%	0.227	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	130.7	173.1	-168.5	-101.1	0	0	0	109.8	T522 L523 I540 I560 A561 T564 F572	T522-Y570 WeakPolarHBondContact CA-O 3.48Å; L523-Y570 PolarHBondContact N-O 3Å; L523-Y570 PolarHBondContact O-N 2.9Å; I540-Y570 HydrophobicContact CD1-CD1 3.79Å; I540-Y570 HydrophobicContact CD1-CD2 4.12Å; I540-Y570 HydrophobicContact CD1-CE1 4.49Å; I540-Y570 HydrophobicContact CD1-CG 3.58Å; I560-Y570 HydrophobicContact CG2-CD1 4.11Å; I560-Y570 HydrophobicContact CG2-CE1 3.67Å; A561-Y570 HydrophobicContact CB-CE1 4.01Å; A561-Y570 HydrophobicContact CB-CE2 4.08Å; A561-Y570 WeakPolarHBondContact CB-OH 3.33Å; T564-Y570 HydrophobicContact CG2-CD2 3.97Å; T564-Y570 HydrophobicContact CG2-CE2 3.79Å; Y570-F572 HydrophobicContact CD1-CB 4.39Å; Y570-F572 AromaticContact CD1-CD1 3.78Å; Y570-F572 HydrophobicContact CD1-CD1 3.78Å; Y570-F572 HydrophobicContact CD1-CG 4.4Å; Y570-F572 HydrophobicContact CE1-CB 3.7Å; Y570-F572 AromaticContact CE1-CD1 3.75Å; Y570-F572 HydrophobicContact CE1-CD1 3.75Å; Y570-F572 AromaticContact CE1-CG 3.92Å; Y570-F572 HydrophobicContact CE1-CG 3.92Å
571	S	95.4	Very high	91.3	Very high	60 Å²	60	61.5 Å²	61.5	42%	0.42	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	138.5	175.3	-60.8	0	0	0	0	109.4	L521 T522	L521-S571 VanDerWaalsContact O-CA 3.3Å; L521-S571 WeakPolarHBondContact O-CA 3.37Å; T522-S571 WeakPolarHBondContact CB-OG 3.42Å; T522-S571 VanDerWaalsContact CG2-OG 3.26Å; T522-S571 WeakPolarHBondContact CG2-OG 3.42Å; T522-S571 PolarHBondContact OG1-OG 3.16Å
572	F	95.4	Very high	91.2	Very high	17 Å²	17	63.4 Å²	63.4	8%	0.075	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	155.2	-177.4	68.1	-73.4	0	0	0	110.9	W513 N520 L521 L523 I560 Y570 P574 L577 W625	W513-F572 AromaticContact CH2-CE1 3.81Å; W513-F572 HydrophobicContact CH2-CE1 3.81Å; W513-F572 HydrophobicContact CH2-CZ 4.03Å; W513-F572 HydrophobicContact CZ2-CE1 4.26Å; W513-F572 HydrophobicContact CZ3-CZ 4.5Å; N520-F572 VanDerWaalsContact OD1-C 3.29Å; N520-F572 PolarHBondContact OD1-N 3.33Å; N520-F572 PolarHBondContact OD1-O 2.94Å; L521-F572 HydrophobicContact CB-CE1 3.97Å; L521-F572 HydrophobicContact CB-CZ 4.11Å; L521-F572 HydrophobicContact CD1-CZ 4.33Å; L521-F572 PolarHBondContact N-O 3.19Å; L521-F572 PolarHBondContact O-N 2.89Å; L521-F572 VanDerWaalsContact O-N 3.08Å; L523-F572 HydrophobicContact CD2-CE1 4.49Å; I560-F572 HydrophobicContact CD1-CE1 4.04Å; I560-F572 HydrophobicContact CD1-CZ 3.82Å; I560-F572 HydrophobicContact CG1-CZ 4.19Å; I560-F572 HydrophobicContact CG2-CD1 3.66Å; I560-F572 HydrophobicContact CG2-CD2 3.89Å; I560-F572 HydrophobicContact CG2-CE1 3.56Å; I560-F572 HydrophobicContact CG2-CE2 3.77Å; I560-F572 HydrophobicContact CG2-CG 3.84Å; I560-F572 HydrophobicContact CG2-CZ 3.62Å; Y570-F572 HydrophobicContact CD1-CB 4.39Å; Y570-F572 AromaticContact CD1-CD1 3.78Å; Y570-F572 HydrophobicContact CD1-CD1 3.78Å; Y570-F572 HydrophobicContact CD1-CG 4.4Å; Y570-F572 HydrophobicContact CE1-CB 3.7Å; Y570-F572 AromaticContact CE1-CD1 3.75Å; Y570-F572 HydrophobicContact CE1-CD1 3.75Å; Y570-F572 AromaticContact CE1-CG 3.92Å; Y570-F572 HydrophobicContact CE1-CG 3.92Å; F572-P574 HydrophobicContact CD2-CG 4.21Å; F572-P574 HydrophobicContact CE2-CB 4.23Å; F572-P574 HydrophobicContact CE2-CG 3.73Å; F572-P574 HydrophobicContact CZ-CG 4.32Å; F572-P574 WeakPolarHBondContact O-CD 3.31Å; F572-L577 HydrophobicContact CE2-CD2 4.16Å; F572-W625 HydrophobicContact CE2-CE3 4.4Å; F572-W625 AromaticContact CE2-CZ3 3.91Å; F572-W625 HydrophobicContact CE2-CZ3 3.91Å; F572-W625 HydrophobicContact CZ-CE3 4.36Å; F572-W625 HydrophobicContact CZ-CH2 4.27Å; F572-W625 AromaticContact CZ-CZ3 3.79Å; F572-W625 HydrophobicContact CZ-CZ3 3.79Å
573	N	94.9	Very high	91.2	Very high	56 Å²	56	61.8 Å²	61.8	30%	0.299	33%	0.331	S	S	.	.			trans	-92.2	114.3	171	-176.9	-25.9	0	0	0	109.4	D519 R575 T576 L577	D519-N573 WeakPolarHBondContact O-CA 3.31Å; D519-N573 WeakPolarHBondContact O-CB 3.48Å; D519-N573 PolarHBondContact O-ND2 3.39Å; D519-N573 PolarHBondContact O-OD1 2.83Å; N573-R575 PolarHBondContact O-N 3.16Å; N573-R575 VanDerWaalsContact OD1-CB 3.27Å; N573-R575 WeakPolarHBondContact OD1-CB 3.36Å; N573-R575 PolarHBondContact OD1-N 3.4Å; N573-T576 PolarHBondContact O-N 2.88Å; N573-T576 PolarHBondContact O-OG1 2.88Å; N573-L577 PolarHBondContact O-N 2.87Å
574	P	93	Very high	91	Very high	6 Å²	6	69 Å²	69	4%	0.039	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-61.5	-25.3	-179.5	-28.2	40	0	0	0	114.6	P518 L521 F572 T576 L577 W625	P518-P574 HydrophobicContact CG-CG 4.08Å; L521-P574 HydrophobicContact CB-CG 4.41Å; L521-P574 HydrophobicContact CD1-CG 3.75Å; L521-P574 HydrophobicContact CG-CG 3.93Å; F572-P574 HydrophobicContact CD2-CG 4.21Å; F572-P574 HydrophobicContact CE2-CB 4.23Å; F572-P574 HydrophobicContact CE2-CG 3.73Å; F572-P574 HydrophobicContact CZ-CG 4.32Å; F572-P574 WeakPolarHBondContact O-CD 3.31Å; P574-T576 VanDerWaalsContact C-N 3.3Å; P574-T576 PolarHBondContact O-N 3.15Å; P574-L577 WeakPolarHBondContact O-CB 3.36Å; P574-L577 PolarHBondContact O-N 3.44Å; P574-W625 HydrophobicContact CB-CE3 4.13Å; P574-W625 HydrophobicContact CG-CE3 4.21Å
575	R	89.5	Confident	90.8	Very high	129 Å²	129	70.7 Å²	70.7	49%	0.487	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-69.8	-27.2	179.9	-58.7	-174.6	179	142.1	15.6	113.3	N517 D519 N573	N517-R575 PolarHBondContact O-NH2 3.02Å; N517-R575 PolarHBondContact OD1-NE 3.03Å; N517-R575 PolarHBondContact OD1-NH2 3.45Å; N517-R575 VanDerWaalsContact OD1-NH2 3.16Å; D519-R575 IonicContact OD1-CZ 3.94Å; D519-R575 IonicContact OD1-NH1 2.8Å; D519-R575 PolarHBondContact OD1-NH1 2.74Å; D519-R575 IonicContact OD1-NH2 3.92Å; D519-R575 PolarHBondContact OD1-NH2 3.03Å; N573-R575 PolarHBondContact O-N 3.16Å; N573-R575 VanDerWaalsContact OD1-CB 3.27Å; N573-R575 WeakPolarHBondContact OD1-CB 3.36Å; N573-R575 PolarHBondContact OD1-N 3.4Å
576	T	91	Very high	90.8	Very high	110 Å²	110	67.7 Å²	67.7	68%	0.675	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-102.2	4.4	179.7	57.9	0	0	0	0	112.3	N573 P574 A578	N573-T576 PolarHBondContact O-N 2.88Å; N573-T576 PolarHBondContact O-OG1 2.88Å; P574-T576 VanDerWaalsContact C-N 3.3Å; P574-T576 PolarHBondContact O-N 3.15Å; T576-A578 PolarHBondContact O-N 3.23Å
577	L	92	Very high	90.9	Very high	29 Å²	29	68.5 Å²	68.5	15%	0.152	34%	0.344	C	S	.	.			trans	-69	120.1	-177.6	180	63.7	0	0	0	110.4	I560 F572 N573 P574 K579 Y626	I560-L577 WeakPolarHBondContact O-CD1 3.31Å; F572-L577 HydrophobicContact CE2-CD2 4.16Å; N573-L577 PolarHBondContact O-N 2.87Å; P574-L577 WeakPolarHBondContact O-CB 3.36Å; P574-L577 PolarHBondContact O-N 3.44Å; L577-K579 PolarHBondContact O-N 3.37Å; L577-Y626 HydrophobicContact CD2-CD2 3.89Å; L577-Y626 HydrophobicContact CD2-CE2 3.69Å
578	A	83.7	Confident	91	Very high	67 Å²	67	67.4 Å²	67.4	55%	0.554	34%	0.34	S	S	*	.			trans	-73.3	105.4	175.4	0	0	0	0	0	110.1	T576 T580	T576-A578 PolarHBondContact O-N 3.23Å; A578-T580 HydrophobicContact CB-CG2 4.16Å; A578-T580 PolarHBondContact O-N 3.16Å
579	K	88.3	Confident	91	Very high	41 Å²	41	70.5 Å²	70.5	18%	0.178	35%	0.352	C	S	.	.			trans	-81.5	45	-179.3	-64.5	170.4	-170.1	166.4	0	112.4	L577 D581 M582 Y626 D629	L577-K579 PolarHBondContact O-N 3.37Å; K579-D581 VanDerWaalsContact C-N 3.34Å; K579-D581 PolarHBondContact O-N 2.83Å; K579-M582 HydrophobicContact CB-CB 4.2Å; K579-M582 PolarHBondContact O-N 3.09Å; K579-Y626 WeakPolarHBondContact CE-O 3.25Å; K579-Y626 HydrophobicContact CG-CE2 4.09Å; K579-Y626 PolarHBondContact NZ-O 2.96Å; K579-D629 IonicContact NZ-OD1 2.89Å; K579-D629 PolarHBondContact NZ-OD1 3.26Å; K579-D629 IonicContact NZ-OD2 3.98Å; K579-D629 PolarHBondContact NZ-OD2 2.54Å
580	T	85.3	Confident	90.9	Very high	128 Å²	128	67.2 Å²	67.2	79%	0.785	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-30.7	-171.5	49.1	0	0	0	0	113.3	A578	A578-T580 HydrophobicContact CB-CG2 4.16Å; A578-T580 PolarHBondContact O-N 3.16Å
581	D	87.4	Confident	90.9	Very high	45 Å²	45	65 Å²	65	24%	0.241	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	15.1	-178.6	75.5	-32.3	0	0	0	113.7	S559 R562 K579 L583	S559-D581 WeakPolarHBondContact CB-OD2 3.12Å; S559-D581 PolarHBondContact N-OD1 3.16Å; S559-D581 PolarHBondContact N-OD2 3.49Å; S559-D581 PolarHBondContact OG-OD1 3.45Å; S559-D581 PolarHBondContact OG-OD2 3.49Å; R562-D581 IonicContact CZ-OD2 2.74Å; R562-D581 IonicContact NE-OD2 3.09Å; R562-D581 PolarHBondContact NE-OD2 3Å; R562-D581 IonicContact NH2-OD2 3.94Å; R562-D581 PolarHBondContact NH2-OD2 2.79Å; K579-D581 VanDerWaalsContact C-N 3.34Å; K579-D581 PolarHBondContact O-N 2.83Å; D581-L583 PolarHBondContact O-N 2.7Å
582	M	91.3	Very high	90.9	Very high	49 Å²	49	62.2 Å²	62.2	24%	0.241	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-62.6	128	176.2	-175	-175.7	72.3	0	0	110.3	V557 K579 R584 Y626 F627	V557-M582 CarbonylContact O-C 3.59Å; V557-M582 WeakPolarHBondContact O-CA 3.45Å; K579-M582 HydrophobicContact CB-CB 4.2Å; K579-M582 PolarHBondContact O-N 3.09Å; M582-R584 PolarHBondContact O-N 2.91Å; M582-Y626 HydrophobicContact CG-CE1 4.12Å; M582-Y626 HydrophobicContact SD-CE1 4.2Å; M582-F627 HydrophobicContact CG-CE1 4.29Å; M582-F627 HydrophobicContact SD-CD1 4.13Å; M582-F627 HydrophobicContact SD-CE1 3.69Å
583	L	92.3	Very high	91	Very high	64 Å²	64	61.4 Å²	61.4	34%	0.335	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-58.1	130.6	175.6	179.8	73	0	0	0	109.8	T555 V557 D581 D585 A586 F590	T555-L583 HydrophobicContact CG2-CD2 4.25Å; V557-L583 WeakPolarHBondContact O-CB 3.39Å; V557-L583 PolarHBondContact O-N 2.79Å; D581-L583 PolarHBondContact O-N 2.7Å; L583-D585 PolarHBondContact O-N 2.82Å; L583-A586 HydrophobicContact CB-CB 3.99Å; L583-A586 HydrophobicContact CD2-CB 4.48Å; L583-A586 HydrophobicContact CG-CB 4.45Å; L583-A586 WeakPolarHBondContact O-CB 3.45Å; L583-A586 PolarHBondContact O-N 3.24Å; L583-F590 HydrophobicContact CD2-CE2 4.34Å
584	R	87.6	Confident	91.1	Very high	214 Å²	214	58.8 Å²	58.8	81%	0.808	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	133.2	-178.4	-174.4	-179.6	174.2	172	3.7	110.7	M582 A586	M582-R584 PolarHBondContact O-N 2.91Å; R584-A586 PolarHBondContact O-N 3.47Å; R584-A586 VanDerWaalsContact O-N 3.09Å
585	D	86.5	Confident	91.3	Very high	65 Å²	65	58.5 Å²	58.5	35%	0.348	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	14.8	-179	-58	-46.7	0	0	0	115.1	L583 W587 R588	L583-D585 PolarHBondContact O-N 2.82Å; D585-W587 PolarHBondContact O-N 2.85Å; D585-R588 WeakPolarHBondContact O-CB 3.43Å; D585-R588 PolarHBondContact O-N 3.01Å
586	A	91.9	Very high	91.6	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.008	26%	0.263	C	S	.	.	H	α-helix	trans	-58.8	-35	179.8	0	0	0	0	0	113.1	V557 L583 R584 R588 Q589 F590 F627	V557-A586 HydrophobicContact CG1-CB 3.93Å; L583-A586 HydrophobicContact CB-CB 3.99Å; L583-A586 HydrophobicContact CD2-CB 4.48Å; L583-A586 HydrophobicContact CG-CB 4.45Å; L583-A586 WeakPolarHBondContact O-CB 3.45Å; L583-A586 PolarHBondContact O-N 3.24Å; R584-A586 PolarHBondContact O-N 3.47Å; R584-A586 VanDerWaalsContact O-N 3.09Å; A586-R588 PolarHBondContact O-N 2.96Å; A586-R588 VanDerWaalsContact O-N 3.1Å; A586-Q589 PolarHBondContact O-N 3.43Å; A586-F590 HydrophobicContact CB-CD2 4.06Å; A586-F590 PolarHBondContact O-N 2.81Å; A586-F627 HydrophobicContact CB-CE1 4.39Å; A586-F627 HydrophobicContact CB-CZ 4.03Å
587	W	91.6	Very high	91.7	Very high	28 Å²	28	47.1 Å²	47.1	11%	0.106	23%	0.231	C	C	.	.	H	α-helix	trans	-59.4	-19	176.5	64.9	-93.6	0	0	0	113.8	D585 F627 V630 W631 Q634	D585-W587 PolarHBondContact O-N 2.85Å; W587-F627 HydrophobicContact CB-CB 4.47Å; W587-F627 HydrophobicContact CB-CD1 3.62Å; W587-F627 HydrophobicContact CB-CE1 3.85Å; W587-F627 HydrophobicContact CB-CG 4.03Å; W587-F627 HydrophobicContact CB-CZ 4.43Å; W587-V630 HydrophobicContact CB-CG1 4.02Å; W587-V630 HydrophobicContact CD2-CG1 3.9Å; W587-V630 HydrophobicContact CG-CG1 3.57Å; W587-W631 AromaticContact CE3-CD1 3.66Å; W587-W631 AromaticContact CE3-NE1 3.91Å; W587-W631 PolarHBondContact O-NE1 2.97Å; W587-Q634 HydrophobicContact CH2-CB 3.6Å; W587-Q634 HydrophobicContact CH2-CG 3.69Å; W587-Q634 HydrophobicContact CZ2-CB 4.08Å; W587-Q634 HydrophobicContact CZ2-CG 3.6Å; W587-Q634 HydrophobicContact CZ3-CB 3.99Å; W587-Q634 HydrophobicContact CZ3-CG 4.3Å
588	R	91.8	Very high	91.7	Very high	168 Å²	168	47.2 Å²	47.2	63%	0.634	23%	0.229	S	C	*	.	H	α-helix	trans	-84.7	-29.7	175.3	-63	-175.7	177.8	-164.4	-1.7	113.1	D585 A586	D585-R588 WeakPolarHBondContact O-CB 3.43Å; D585-R588 PolarHBondContact O-N 3.01Å; A586-R588 PolarHBondContact O-N 2.96Å; A586-R588 VanDerWaalsContact O-N 3.1Å
589	Q	90.1	Very high	91.9	Very high	75 Å²	75	44.4 Å²	44.4	35%	0.35	21%	0.205	S	C	.	.	H	α-helix	trans	-100.6	-39.1	-173.5	-66.9	-177.8	5.2	0	0	112	W546 R553 A586	W546-Q589 WeakPolarHBondContact CB-O 3.48Å; W546-Q589 VanDerWaalsContact CD1-O 3.29Å; R553-Q589 VanDerWaalsContact NH1-OE1 3.15Å; A586-Q589 PolarHBondContact O-N 3.43Å
590	F	95.3	Very high	91.9	Very high	1 Å²	1	42.4 Å²	42.4	0%	0.004	20%	0.196	C	C	.	.			trans	-111.6	120.8	-171.2	-56.6	-73.6	0	0	0	110.8	G544 W546 R553 T555 V557 L583 A586 F627	G544-F590 WeakPolarHBondContact O-CE1 3.5Å; W546-F590 HydrophobicContact CB-CD1 3.75Å; W546-F590 HydrophobicContact CB-CE1 3.69Å; R553-F590 HydrophobicContact CG-CZ 4.32Å; T555-F590 HydrophobicContact CG2-CE1 4.43Å; T555-F590 HydrophobicContact CG2-CE2 4.06Å; T555-F590 HydrophobicContact CG2-CZ 3.62Å; V557-F590 HydrophobicContact CG2-CB 4.11Å; V557-F590 HydrophobicContact CG2-CD1 4.37Å; V557-F590 HydrophobicContact CG2-CD2 3.54Å; V557-F590 HydrophobicContact CG2-CE2 3.99Å; V557-F590 HydrophobicContact CG2-CG 3.74Å; L583-F590 HydrophobicContact CD2-CE2 4.34Å; A586-F590 HydrophobicContact CB-CD2 4.06Å; A586-F590 PolarHBondContact O-N 2.81Å; F590-F627 HydrophobicContact CB-CE2 4.39Å; F590-F627 WeakPolarHBondContact O-CD2 3.42Å; F590-F627 WeakPolarHBondContact O-CE2 3.5Å
591	S	94.6	Very high	91.6	Very high	13 Å²	13	40.6 Å²	40.6	9%	0.091	18%	0.179	C	C	.	.	S	Bend	trans	-109.1	-7	173.5	49.5	0	0	0	0	112.9	F623 L776	S591-F623 PolarHBondContact O-N 3.15Å; S591-L776 WeakPolarHBondContact OG-CD1 3.18Å
592	G	96.7	Very high	91	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.7	177.1	175.7	0	0	0	0	0	113	Y545 V621	Y545-G592 PolarHBondContact N-O 3.37Å; Y545-G592 VanDerWaalsContact N-O 3.08Å; G592-V621 WeakPolarHBondContact CA-O 3.3Å
593	G	96.6	Very high	90.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.8	-127.1	176.8	0	0	0	0	0	111.7	W543 L620 V621	W543-G593 CarbonylContact O-C 3.5Å; W543-G593 VanDerWaalsContact O-CA 3.23Å; W543-G593 WeakPolarHBondContact O-CA 3.39Å; G593-L620 CarbonylContact O-C 3.6Å; G593-L620 WeakPolarHBondContact O-CA 3.47Å; G593-V621 PolarHBondContact N-O 2.92Å; G593-V621 PolarHBondContact O-N 3.17Å
594	L	97	Very high	89.1	Confident	1 Å²	1	41 Å²	41	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	155.1	-177.1	-62	93.7	0	0	0	111.5	L418 W543 F554 W617 S618 L620 M768	L418-L594 HydrophobicContact CD1-CD1 4.34Å; L418-L594 HydrophobicContact CD1-CD2 3.55Å; W543-L594 PolarHBondContact N-O 3.42Å; W543-L594 PolarHBondContact O-N 2.98Å; F554-L594 HydrophobicContact CE2-CD1 3.62Å; F554-L594 HydrophobicContact CZ-CD1 3.8Å; L594-W617 HydrophobicContact CB-CE3 4.24Å; L594-W617 HydrophobicContact CD2-CB 4.35Å; L594-W617 HydrophobicContact CD2-CE3 4.47Å; L594-S618 WeakPolarHBondContact CD2-O 3.42Å; L594-L620 HydrophobicContact CD1-CD2 3.63Å; L594-L620 HydrophobicContact CD2-CD2 4.44Å; L594-L620 HydrophobicContact CG-CD2 3.93Å; L594-M768 HydrophobicContact CD1-CE 3.76Å; L594-M768 HydrophobicContact CD1-SD 4.2Å
595	V	97.3	Very high	88.1	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	133.6	164.4	-175.7	0	0	0	0	108.5	L502 W513 L523 I540 L542 I560 S618 V621	L502-V595 HydrophobicContact CD1-CG2 4.38Å; L502-V595 HydrophobicContact CD2-CB 4.22Å; L502-V595 HydrophobicContact CD2-CG2 3.94Å; W513-V595 HydrophobicContact CZ3-CG2 4.05Å; L523-V595 HydrophobicContact CD2-CG1 4.49Å; I540-V595 HydrophobicContact CG2-CG1 3.93Å; L542-V595 HydrophobicContact CD2-CG2 3.93Å; I560-V595 HydrophobicContact CD1-CG1 4.31Å; V595-S618 PolarHBondContact N-OG 2.87Å; V595-S618 PolarHBondContact O-N 3.32Å; V595-S618 PolarHBondContact O-OG 3.12Å; V595-V621 HydrophobicContact CG2-CG1 4.23Å
596	Q	95.3	Very high	86.9	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	138.9	177.8	-174.9	-172.4	80.5	0	0	109.8	I540 T541 W543 I615 Y616 W617	I540-Q596 WeakPolarHBondContact CA-O 3.45Å; T541-Q596 PolarHBondContact N-O 3.27Å; T541-Q596 PolarHBondContact O-N 3.4Å; T541-Q596 PolarHBondContact OG1-OE1 3.1Å; T541-Q596 VanDerWaalsContact OG1-OE1 3.14Å; W543-Q596 VanDerWaalsContact CD1-CB 3.47Å; W543-Q596 VanDerWaalsContact CE2-NE2 3.27Å; W543-Q596 HydrophobicContact CG-CB 4.45Å; W543-Q596 VanDerWaalsContact NE1-NE2 3.14Å; Q596-I615 HydrophobicContact CG-CG2 3.28Å; Q596-I615 VanDerWaalsContact NE2-CG2 3.33Å; Q596-Y616 CarbonylContact C-O 3.58Å; Q596-Y616 WeakPolarHBondContact CA-O 3.48Å; Q596-W617 HydrophobicContact CB-CE3 3.97Å; Q596-W617 HydrophobicContact CB-CH2 4.48Å; Q596-W617 HydrophobicContact CB-CZ3 3.7Å; Q596-W617 HydrophobicContact CG-CE3 4.12Å; Q596-W617 HydrophobicContact CG-CH2 4.2Å; Q596-W617 HydrophobicContact CG-CZ3 3.84Å
597	I	94.4	Very high	85.5	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	129.8	165.7	-54.8	-179.6	0	0	0	109	V500 L523 W525 I530 V538 D539 I540 Y616	V500-I597 HydrophobicContact CB-CD1 4.39Å; V500-I597 HydrophobicContact CG1-CD1 3.88Å; V500-I597 HydrophobicContact CG1-CG1 4.38Å; V500-I597 HydrophobicContact CG2-CB 4.2Å; V500-I597 HydrophobicContact CG2-CD1 3.68Å; V500-I597 HydrophobicContact CG2-CG1 3.71Å; L523-I597 HydrophobicContact CD1-CD1 3.57Å; W525-I597 HydrophobicContact CB-CD1 3.95Å; W525-I597 HydrophobicContact CD2-CD1 3.4Å; W525-I597 HydrophobicContact CD2-CG2 4.38Å; W525-I597 HydrophobicContact CE3-CD1 3.26Å; W525-I597 HydrophobicContact CG-CD1 3.72Å; W525-I597 HydrophobicContact CZ3-CD1 3.89Å; I530-I597 HydrophobicContact CD1-CG2 3.83Å; V538-I597 HydrophobicContact CB-CG2 4.18Å; V538-I597 HydrophobicContact CG1-CG2 4.47Å; V538-I597 HydrophobicContact CG2-CG2 4.47Å; D539-I597 WeakPolarHBondContact O-CA 3.03Å; I540-I597 HydrophobicContact CG1-CG1 4.36Å; I540-I597 HydrophobicContact CG2-CG1 4.38Å; I597-Y616 PolarHBondContact N-O 3.16Å; I597-Y616 PolarHBondContact O-N 2.81Å
598	R	90.5	Very high	83.5	Confident	32 Å²	32	48.8 Å²	48.8	12%	0.121	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	163.1	175.3	66.1	173.9	-178.9	-142.6	-11	110.9	V538 D539 E556 S600 I615	V538-R598 CarbonylContact C-O 3.58Å; V538-R598 WeakPolarHBondContact CA-O 3.36Å; V538-R598 VanDerWaalsContact CB-O 3.3Å; V538-R598 WeakPolarHBondContact CB-O 3.36Å; D539-R598 HydrophobicContact CB-CG 4.24Å; D539-R598 PolarHBondContact N-O 2.82Å; D539-R598 PolarHBondContact O-N 3.02Å; D539-R598 VanDerWaalsContact O-N 3.09Å; E556-R598 IonicContact OE1-NH2 3.92Å; E556-R598 IonicContact OE2-CZ 3.32Å; E556-R598 IonicContact OE2-NH1 3.94Å; E556-R598 PolarHBondContact OE2-NH1 2.87Å; E556-R598 IonicContact OE2-NH2 2.64Å; E556-R598 PolarHBondContact OE2-NH2 2.79Å; R598-S600 PolarHBondContact O-N 3.4Å; R598-I615 HydrophobicContact CB-CG1 4.29Å
599	V	88.3	Confident	81.3	Confident	7 Å²	7	45.6 Å²	45.6	4%	0.042	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	136	167.1	-176.5	0	0	0	0	109	I530 Q601 M604	I530-V599 HydrophobicContact CG1-CG2 4.2Å; V599-Q601 PolarHBondContact O-N 3.38Å; V599-M604 HydrophobicContact CB-CG 4.43Å; V599-M604 HydrophobicContact CB-SD 4.36Å; V599-M604 HydrophobicContact CG1-CG 3.83Å; V599-M604 HydrophobicContact CG1-SD 4.4Å
600	S	87.7	Confident	79.4	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.236	C	C	.	.			trans	-57.1	133.3	-179.2	163.7	0	0	0	0	110.5	Q537 N563 R598 D602 W603 M604	Q537-S600 WeakPolarHBondContact O-CB 3.38Å; Q537-S600 PolarHBondContact O-N 2.05Å; N563-S600 PolarHBondContact OD1-OG 3.42Å; N563-S600 VanDerWaalsContact OD1-OG 3.08Å; R598-S600 PolarHBondContact O-N 3.4Å; S600-D602 PolarHBondContact O-N 2.96Å; S600-D602 PolarHBondContact OG-N 2.56Å; S600-W603 WeakPolarHBondContact O-CB 3.47Å; S600-W603 PolarHBondContact O-N 3.22Å; S600-W603 PolarHBondContact OG-N 3.06Å; S600-M604 WeakPolarHBondContact O-CG 3.29Å; S600-M604 PolarHBondContact O-N 3.09Å
601	Q	79.3	Confident	77.3	Confident	89 Å²	89	50.5 Å²	50.5	42%	0.416	26%	0.263	S	S	.	.	H	α-helix	trans	-63.4	-35.2	177.6	-69.7	-173.1	-4.8	0	0	111.9	V599 M604 K605	V599-Q601 PolarHBondContact O-N 3.38Å; Q601-M604 HydrophobicContact CB-CE 4.47Å; Q601-M604 HydrophobicContact CG-CE 4.13Å; Q601-M604 PolarHBondContact O-N 3.1Å; Q601-K605 WeakPolarHBondContact O-CG 3.49Å; Q601-K605 PolarHBondContact O-N 2.76Å
602	D	75.5	Confident	75.4	Confident	81 Å²	81	51.5 Å²	51.5	43%	0.433	27%	0.27	S	S	.	.	H	α-helix	trans	-69.7	-40.4	179.2	-61.6	-31.9	0	0	0	110.4	S600 M604 K605 D606	S600-D602 PolarHBondContact O-N 2.96Å; S600-D602 PolarHBondContact OG-N 2.56Å; D602-M604 VanDerWaalsContact C-N 3.31Å; D602-M604 PolarHBondContact O-N 2.75Å; D602-K605 PolarHBondContact O-N 2.83Å; D602-K605 IonicContact OD1-NZ 3.77Å; D602-K605 PolarHBondContact OD1-NZ 3.03Å; D602-D606 PolarHBondContact O-N 3.42Å
603	W	71.9	Confident	73.8	Confident	35 Å²	35	55.4 Å²	55.4	13%	0.133	29%	0.288	C	S	.	.	H	α-helix	trans	-60.1	-38.6	172.1	-177.3	-91.8	0	0	0	113.2	N535 Q537 S600	N535-W603 HydrophobicContact CB-CH2 3.8Å; N535-W603 HydrophobicContact CB-CZ2 4.13Å; N535-W603 WeakPolarHBondContact O-CH2 3.31Å; N535-W603 WeakPolarHBondContact O-CZ2 3.44Å; N535-W603 WeakPolarHBondContact O-CZ3 3.09Å; Q537-W603 HydrophobicContact CB-CB 4.19Å; Q537-W603 HydrophobicContact CB-CD2 4.25Å; Q537-W603 HydrophobicContact CB-CE3 4.03Å; Q537-W603 HydrophobicContact CB-CG 4.33Å; Q537-W603 HydrophobicContact CG-CD2 4.43Å; Q537-W603 HydrophobicContact CG-CE3 3.78Å; Q537-W603 HydrophobicContact CG-CZ3 4.11Å; S600-W603 WeakPolarHBondContact O-CB 3.47Å; S600-W603 PolarHBondContact O-N 3.22Å; S600-W603 PolarHBondContact OG-N 3.06Å
604	M	70.4	Confident	72.8	Confident	50 Å²	50	56.9 Å²	56.9	25%	0.246	30%	0.298	C	S	.	.	H	α-helix	trans	-69.5	-39.8	177.3	-71.9	-172.6	-66.9	0	0	112.5	V599 S600 Q601 D602 D606 R607	V599-M604 HydrophobicContact CB-CG 4.43Å; V599-M604 HydrophobicContact CB-SD 4.36Å; V599-M604 HydrophobicContact CG1-CG 3.83Å; V599-M604 HydrophobicContact CG1-SD 4.4Å; S600-M604 WeakPolarHBondContact O-CG 3.29Å; S600-M604 PolarHBondContact O-N 3.09Å; Q601-M604 HydrophobicContact CB-CE 4.47Å; Q601-M604 HydrophobicContact CG-CE 4.13Å; Q601-M604 PolarHBondContact O-N 3.1Å; D602-M604 VanDerWaalsContact C-N 3.31Å; D602-M604 PolarHBondContact O-N 2.75Å; M604-D606 VanDerWaalsContact C-N 3.29Å; M604-D606 PolarHBondContact O-N 2.94Å; M604-R607 PolarHBondContact O-N 2.94Å
605	K	67.5	Low	72.4	Confident	147 Å²	147	58 Å²	58	64%	0.639	30%	0.304	S	S	*	.	H	α-helix	trans	-60.3	-39.6	177.9	-73.7	170.4	-169.5	161.4	0	112	Q601 D602 R607	Q601-K605 WeakPolarHBondContact O-CG 3.49Å; Q601-K605 PolarHBondContact O-N 2.76Å; D602-K605 PolarHBondContact O-N 2.83Å; D602-K605 IonicContact OD1-NZ 3.77Å; D602-K605 PolarHBondContact OD1-NZ 3.03Å; K605-R607 VanDerWaalsContact C-N 3.32Å; K605-R607 PolarHBondContact O-N 3.15Å
606	D	62	Low	72.2	Confident	137 Å²	137	58.5 Å²	58.5	73%	0.733	31%	0.306	S	S	*	.	H	α-helix	trans	-72.7	-19.8	-173.8	-71.6	-16.2	0	0	0	114.3	D602 M604	D602-D606 PolarHBondContact O-N 3.42Å; M604-D606 VanDerWaalsContact C-N 3.29Å; M604-D606 PolarHBondContact O-N 2.94Å
607	R	62	Low	72.2	Confident	117 Å²	117	59.1 Å²	59.1	44%	0.442	31%	0.308	S	S	.	.	H	α-helix	trans	-118.3	-0.3	-171.3	-67.7	-168.5	178.3	-175.2	0.5	116.2	N533 M604 K605 D609	N533-R607 PolarHBondContact ND2-NH1 3.15Å; M604-R607 PolarHBondContact O-N 2.94Å; K605-R607 VanDerWaalsContact C-N 3.32Å; K605-R607 PolarHBondContact O-N 3.15Å; R607-D609 PolarHBondContact O-N 2.77Å
608	G	48.8	Very low	72.3	Confident	72 Å²	72	59.4 Å²	59.4	74%	0.742	31%	0.31	S	S	*	.			trans	64.1	-7.2	176.9	0	0	0	0	0	115.6	G610	G608-G610 PolarHBondContact O-N 2.79Å; G608-G610 VanDerWaalsContact O-N 3.14Å
609	D	46.6	Very low	72.4	Confident	100 Å²	100	60.5 Å²	60.5	54%	0.535	32%	0.318	S	S	.	.			trans	-80.9	89.2	179.5	-73.4	-30.1	0	0	0	110.2	R607 Y611	R607-D609 PolarHBondContact O-N 2.77Å; D609-Y611 HydrophobicContact CB-CD2 4.14Å; D609-Y611 PolarHBondContact O-N 3.36Å
610	G	48.8	Very low	72.8	Confident	37 Å²	37	61.2 Å²	61.2	38%	0.381	32%	0.322	S	S	.	.			trans	-66.6	24.2	176.7	0	0	0	0	0	116	G608 H613	G608-G610 PolarHBondContact O-N 2.79Å; G608-G610 VanDerWaalsContact O-N 3.14Å; G610-H613 PolarHBondContact O-CE1 3.35Å; G610-H613 PolarHBondContact O-ND1 3.08Å
611	Y	51.6	Low	73.2	Confident	143 Å²	143	61.3 Å²	61.3	56%	0.561	32%	0.322	S	S	*	.			trans	-98.9	-12.1	-153.6	-75.3	-68.9	0	0	0	117.9	R456 D609	R456-Y611 PolarHBondContact NH1-O 2.95Å; R456-Y611 VanDerWaalsContact NH1-O 3.16Å; D609-Y611 HydrophobicContact CB-CD2 4.14Å; D609-Y611 PolarHBondContact O-N 3.36Å
612	S	55.1	Low	74	Confident	34 Å²	34	57.1 Å²	57.1	24%	0.238	30%	0.303	C	S	.	.			trans	-122.2	87.1	177.2	-161.9	0	0	0	0	113.1	I530 S614	I530-S612 PolarHBondContact O-OG 3.18Å; S612-S614 VanDerWaalsContact C-N 3.25Å
613	H	62.5	Low	75	Confident	82 Å²	82	53.2 Å²	53.2	38%	0.38	28%	0.282	S	S	.	.			trans	-89.1	14	170.3	-66.6	93.5	0	0	0	112.6	T422 V458 G610 I615	T422-H613 HydrophobicContact CG2-CB 3.87Å; V458-H613 HydrophobicContact CG1-CB 3.91Å; V458-H613 HydrophobicContact CG2-CB 4.36Å; G610-H613 PolarHBondContact O-CE1 3.35Å; G610-H613 PolarHBondContact O-ND1 3.08Å; H613-I615 PolarHBondContact O-N 3.1Å
614	S	76.9	Confident	76.1	Confident	30 Å²	30	51.6 Å²	51.6	21%	0.21	28%	0.276	C	S	.	.			trans	-80.4	114.9	-178.7	-69.8	0	0	0	0	110.4	S612	S612-S614 VanDerWaalsContact C-N 3.25Å
615	I	88	Confident	77.2	Confident	24 Å²	24	49.6 Å²	49.6	12%	0.123	27%	0.265	C	S	.	.			trans	-96	133.3	177.4	-64.8	176.6	0	0	0	108.7	G420 V461 Q499 Q596 R598 H613 W617	G420-I615 WeakPolarHBondContact O-CA 3.27Å; G420-I615 VanDerWaalsContact O-CB 3.22Å; G420-I615 WeakPolarHBondContact O-CB 3.3Å; G420-I615 PolarHBondContact O-N 3.34Å; V461-I615 HydrophobicContact CG1-CD1 3.62Å; Q499-I615 PolarHBondContact OE1-O 2.64Å; Q596-I615 HydrophobicContact CG-CG2 3.28Å; Q596-I615 VanDerWaalsContact NE2-CG2 3.33Å; R598-I615 HydrophobicContact CB-CG1 4.29Å; H613-I615 PolarHBondContact O-N 3.1Å; I615-W617 HydrophobicContact CG2-CD2 4.06Å; I615-W617 HydrophobicContact CG2-CH2 4.29Å; I615-W617 HydrophobicContact CG2-CZ2 3.75Å
616	Y	92.7	Very high	78.5	Confident	12 Å²	12	42.6 Å²	42.6	5%	0.047	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	131.4	175.3	-71.8	4.4	0	0	0	110.7	Q499 W525 P526 N529 I530 Q596 I597	Q499-Y616 HydrophobicContact CB-CD1 4.05Å; Q499-Y616 HydrophobicContact CB-CD2 3.8Å; Q499-Y616 HydrophobicContact CB-CE2 4.43Å; Q499-Y616 HydrophobicContact CB-CG 3.58Å; Q499-Y616 HydrophobicContact CG-CD1 4.23Å; Q499-Y616 HydrophobicContact CG-CG 4.27Å; Q499-Y616 VanDerWaalsContact NE2-CE1 3.34Å; W525-Y616 HydrophobicContact CB-CD2 4.31Å; P526-Y616 HydrophobicContact CG-CE2 3.81Å; N529-Y616 WeakPolarHBondContact CB-OH 3.32Å; N529-Y616 PolarHBondContact O-OH 2.95Å; I530-Y616 HydrophobicContact CB-CD2 4.42Å; I530-Y616 HydrophobicContact CB-CE2 3.88Å; I530-Y616 HydrophobicContact CD1-CD2 4.36Å; I530-Y616 HydrophobicContact CD1-CG 4.48Å; I530-Y616 HydrophobicContact CG1-CE2 4.49Å; I530-Y616 PolarHBondContact N-OH 2.9Å; Q596-Y616 CarbonylContact C-O 3.58Å; Q596-Y616 WeakPolarHBondContact CA-O 3.48Å; I597-Y616 PolarHBondContact N-O 3.16Å; I597-Y616 PolarHBondContact O-N 2.81Å
617	W	95	Very high	80.1	Confident	13 Å²	13	36.1 Å²	36.1	5%	0.049	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	145.7	-179.6	-60.3	109.5	0	0	0	111.3	L418 G419 V461 Q499 V500 W543 F554 L594 Q596 I615	L418-W617 HydrophobicContact CB-CZ2 4.33Å; L418-W617 HydrophobicContact CD1-CD2 4.06Å; L418-W617 HydrophobicContact CD1-CE3 4.49Å; L418-W617 HydrophobicContact CD1-CG 4.09Å; G419-W617 PolarHBondContact O-NE1 3.07Å; V461-W617 HydrophobicContact CG1-CH2 4.24Å; V461-W617 HydrophobicContact CG1-CZ2 3.66Å; Q499-W617 PolarHBondContact N-O 2.85Å; V500-W617 PolarHBondContact N-O 3.48Å; W543-W617 HydrophobicContact CB-CZ3 4.08Å; W543-W617 AromaticContact CD1-CZ3 3.96Å; W543-W617 AromaticContact CD2-CH2 3.88Å; W543-W617 HydrophobicContact CD2-CH2 3.88Å; W543-W617 HydrophobicContact CD2-CZ3 4.09Å; W543-W617 HydrophobicContact CE3-CH2 4.2Å; W543-W617 HydrophobicContact CG-CH2 4.06Å; W543-W617 AromaticContact CG-CZ3 3.75Å; W543-W617 HydrophobicContact CG-CZ3 3.75Å; F554-W617 AromaticContact CE1-CH2 3.75Å; F554-W617 HydrophobicContact CE1-CH2 3.75Å; F554-W617 HydrophobicContact CE1-CZ2 4.38Å; F554-W617 HydrophobicContact CE1-CZ3 4.17Å; F554-W617 AromaticContact CZ-CH2 3.89Å; F554-W617 HydrophobicContact CZ-CH2 3.89Å; F554-W617 AromaticContact CZ-CZ3 3.81Å; F554-W617 HydrophobicContact CZ-CZ3 3.81Å; L594-W617 HydrophobicContact CB-CE3 4.24Å; L594-W617 HydrophobicContact CD2-CB 4.35Å; L594-W617 HydrophobicContact CD2-CE3 4.47Å; Q596-W617 HydrophobicContact CB-CE3 3.97Å; Q596-W617 HydrophobicContact CB-CH2 4.48Å; Q596-W617 HydrophobicContact CB-CZ3 3.7Å; Q596-W617 HydrophobicContact CG-CE3 4.12Å; Q596-W617 HydrophobicContact CG-CH2 4.2Å; Q596-W617 HydrophobicContact CG-CZ3 3.84Å; I615-W617 HydrophobicContact CG2-CD2 4.06Å; I615-W617 HydrophobicContact CG2-CH2 4.29Å; I615-W617 HydrophobicContact CG2-CZ2 3.75Å
618	S	96.5	Very high	81.6	Confident	6 Å²	6	31.6 Å²	31.6	4%	0.042	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	-176	167	71.7	0	0	0	0	112.2	V500 L594 V595	V500-S618 WeakPolarHBondContact O-CA 3.39Å; L594-S618 WeakPolarHBondContact CD2-O 3.42Å; V595-S618 PolarHBondContact N-OG 2.87Å; V595-S618 PolarHBondContact O-N 3.32Å; V595-S618 PolarHBondContact O-OG 3.12Å
619	D	93.6	Very high	83.6	Confident	54 Å²	54	31.8 Å²	31.8	29%	0.289	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	170.3	159.1	-64.6	-32.4	0	0	0	111.2	R498 V621	R498-D619 WeakPolarHBondContact CB-OD1 3.23Å; R498-D619 VanDerWaalsContact CD-CG 3.44Å; R498-D619 WeakPolarHBondContact CD-OD1 3.5Å; R498-D619 WeakPolarHBondContact CD-OD2 3.21Å; R498-D619 IonicContact CZ-OD2 3.46Å; R498-D619 IonicContact NE-OD2 3.02Å; R498-D619 IonicContact NH1-OD2 2.76Å; R498-D619 PolarHBondContact NH1-OD2 2.95Å; D619-V621 PolarHBondContact O-N 3.45Å
620	L	95.5	Very high	85.8	Confident	22 Å²	22	28.1 Å²	28.1	12%	0.115	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	127.6	173.1	-64.3	164	0	0	0	111	R514 G593 L594 M768 F771	R514-L620 PolarHBondContact NH2-O 3.35Å; G593-L620 CarbonylContact O-C 3.6Å; G593-L620 WeakPolarHBondContact O-CA 3.47Å; L594-L620 HydrophobicContact CD1-CD2 3.63Å; L594-L620 HydrophobicContact CD2-CD2 4.44Å; L594-L620 HydrophobicContact CG-CD2 3.93Å; L620-M768 HydrophobicContact CD2-CE 3.98Å; L620-M768 HydrophobicContact CD2-SD 3.54Å; L620-M768 VanDerWaalsContact CD2-SD 3.54Å; L620-F771 HydrophobicContact CB-CD1 4.34Å; L620-F771 HydrophobicContact CB-CD2 3.91Å; L620-F771 HydrophobicContact CB-CE1 4.35Å; L620-F771 HydrophobicContact CB-CE2 3.94Å; L620-F771 HydrophobicContact CB-CG 4.12Å; L620-F771 HydrophobicContact CB-CZ 4.14Å; L620-F771 HydrophobicContact CD1-CB 3.96Å; L620-F771 HydrophobicContact CD1-CD2 4.42Å; L620-F771 HydrophobicContact CD1-CG 4.11Å; L620-F771 HydrophobicContact CD2-CD1 4.02Å; L620-F771 HydrophobicContact CD2-CE1 4.37Å; L620-F771 HydrophobicContact CD2-CG 4.3Å; L620-F771 HydrophobicContact CG-CG 4.41Å
621	V	96.3	Very high	88	Confident	3 Å²	3	26.5 Å²	26.5	2%	0.018	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	135.5	-173.2	69.1	0	0	0	0	111.2	L502 W513 G592 G593 V595 D619 F623	L502-V621 HydrophobicContact CD1-CB 3.84Å; L502-V621 HydrophobicContact CD1-CG1 4.11Å; L502-V621 HydrophobicContact CD1-CG2 3.93Å; W513-V621 HydrophobicContact CB-CG2 3.98Å; W513-V621 HydrophobicContact CE3-CG2 4.37Å; W513-V621 WeakPolarHBondContact O-CG2 3.19Å; G592-V621 WeakPolarHBondContact CA-O 3.3Å; G593-V621 PolarHBondContact N-O 2.92Å; G593-V621 PolarHBondContact O-N 3.17Å; V595-V621 HydrophobicContact CG2-CG1 4.23Å; D619-V621 PolarHBondContact O-N 3.45Å; V621-F623 HydrophobicContact CG1-CD1 4.26Å; V621-F623 HydrophobicContact CG1-CE1 3.84Å
622	P	97	Very high	90	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	150.7	172.3	32.3	-36.4	0	0	0	110.8	R514 W625 L776 E779 W784	R514-P622 HydrophobicContact CB-CG 4.16Å; R514-P622 HydrophobicContact CG-CG 4.06Å; P622-W625 PolarHBondContact O-NE1 2.97Å; P622-W625 VanDerWaalsContact O-NE1 3.09Å; P622-L776 HydrophobicContact CB-CD2 3.76Å; P622-E779 HydrophobicContact CB-CG 4.25Å; P622-E779 HydrophobicContact CG-CG 4.16Å; P622-W784 HydrophobicContact CB-CH2 3.84Å; P622-W784 HydrophobicContact CB-CZ2 3.72Å; P622-W784 HydrophobicContact CG-CZ2 4.09Å
623	F	96.1	Very high	91.8	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.15	C	C	.	.			trans	-99.3	24.9	-177.4	-68.2	-19.8	0	0	0	113.5	L542 W543 S591 V621 W625 Y626 F627	L542-F623 HydrophobicContact CB-CE1 4.47Å; L542-F623 HydrophobicContact CB-CE2 4.39Å; L542-F623 HydrophobicContact CB-CZ 3.99Å; L542-F623 HydrophobicContact CD2-CD1 4.3Å; L542-F623 HydrophobicContact CD2-CE1 3.64Å; L542-F623 HydrophobicContact CD2-CZ 4Å; W543-F623 WeakPolarHBondContact O-CZ 3.28Å; S591-F623 PolarHBondContact O-N 3.15Å; V621-F623 HydrophobicContact CG1-CD1 4.26Å; V621-F623 HydrophobicContact CG1-CE1 3.84Å; F623-W625 VanDerWaalsContact C-N 3.34Å; F623-W625 HydrophobicContact CD1-CZ2 4.34Å; F623-W625 PolarHBondContact O-N 2.69Å; F623-Y626 PolarHBondContact O-N 2.87Å; F623-F627 HydrophobicContact CB-CD2 3.74Å; F623-F627 HydrophobicContact CB-CE2 3.98Å; F623-F627 AromaticContact CD2-CE2 3.98Å; F623-F627 HydrophobicContact CD2-CE2 3.98Å; F623-F627 HydrophobicContact CG-CE2 4.47Å; F623-F627 PolarHBondContact O-N 3.29Å
624	G	94.4	Very high	93.3	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-52.9	-51	175	0	0	0	0	0	112.2	F516 Y626 F627 H628 W784	F516-G624 CarbonylContact O-C 3.55Å; G624-Y626 PolarHBondContact O-N 2.99Å; G624-Y626 VanDerWaalsContact O-N 3.1Å; G624-F627 PolarHBondContact O-N 2.88Å; G624-H628 WeakPolarHBondContact O-CA 3.35Å; G624-H628 WeakPolarHBondContact O-CB 3.34Å; G624-H628 PolarHBondContact O-N 3.43Å; G624-W784 VanDerWaalsContact CA-CH2 3.49Å
625	W	95.1	Very high	94	Very high	8 Å²	8	34 Å²	34	3%	0.03	16%	0.16	C	C	.	.	H	α-helix	trans	-60	-21.1	177.3	60.7	-92.3	0	0	0	114.5	W513 N515 F516 P518 L521 L542 I560 F572 P574 P622 F623	W513-W625 AromaticContact CE3-CE2 3.94Å; W513-W625 HydrophobicContact CE3-CZ2 4.02Å; W513-W625 AromaticContact CE3-NE1 3.94Å; W513-W625 AromaticContact CZ3-CE2 3.92Å; W513-W625 AromaticContact CZ3-CH2 4Å; W513-W625 HydrophobicContact CZ3-CH2 4Å; W513-W625 AromaticContact CZ3-CZ2 3.57Å; W513-W625 HydrophobicContact CZ3-CZ2 3.57Å; N515-W625 WeakPolarHBondContact O-CB 3.39Å; F516-W625 VanDerWaalsContact O-CA 3.28Å; F516-W625 WeakPolarHBondContact O-CA 3.27Å; F516-W625 PolarHBondContact O-N 3.23Å; P518-W625 HydrophobicContact CG-CB 3.7Å; L521-W625 HydrophobicContact CD1-CB 4.07Å; L521-W625 HydrophobicContact CD1-CD2 3.73Å; L521-W625 HydrophobicContact CD1-CE3 3.96Å; L521-W625 HydrophobicContact CD1-CG 3.76Å; L542-W625 HydrophobicContact CD1-CH2 3.73Å; L542-W625 HydrophobicContact CD1-CZ2 4.35Å; L542-W625 HydrophobicContact CD1-CZ3 4.45Å; L542-W625 HydrophobicContact CD2-CH2 3.58Å; L542-W625 HydrophobicContact CD2-CZ2 3.61Å; L542-W625 HydrophobicContact CG-CH2 4.21Å; I560-W625 HydrophobicContact CD1-CH2 3.79Å; I560-W625 HydrophobicContact CD1-CZ3 4.46Å; I560-W625 HydrophobicContact CG1-CH2 4.01Å; I560-W625 HydrophobicContact CG1-CZ3 4.44Å; F572-W625 HydrophobicContact CE2-CE3 4.4Å; F572-W625 AromaticContact CE2-CZ3 3.91Å; F572-W625 HydrophobicContact CE2-CZ3 3.91Å; F572-W625 HydrophobicContact CZ-CE3 4.36Å; F572-W625 HydrophobicContact CZ-CH2 4.27Å; F572-W625 AromaticContact CZ-CZ3 3.79Å; F572-W625 HydrophobicContact CZ-CZ3 3.79Å; P574-W625 HydrophobicContact CB-CE3 4.13Å; P574-W625 HydrophobicContact CG-CE3 4.21Å; P622-W625 PolarHBondContact O-NE1 2.97Å; P622-W625 VanDerWaalsContact O-NE1 3.09Å; F623-W625 VanDerWaalsContact C-N 3.34Å; F623-W625 HydrophobicContact CD1-CZ2 4.34Å; F623-W625 PolarHBondContact O-N 2.69Å
626	Y	95.1	Very high	94.4	Very high	1 Å²	1	34.3 Å²	34.3	0%	0.004	17%	0.169	C	C	.	.	H	α-helix	trans	-95.5	-38.9	-179.2	-171.8	-106.5	0	0	0	112.6	L542 V557 L577 K579 M582 F623 G624	L542-Y626 HydrophobicContact CD1-CD1 3.81Å; L542-Y626 HydrophobicContact CD1-CD2 3.36Å; L542-Y626 HydrophobicContact CD1-CE1 3.93Å; L542-Y626 HydrophobicContact CD1-CE2 3.49Å; L542-Y626 VanDerWaalsContact CD1-CE2 3.49Å; L542-Y626 HydrophobicContact CD1-CG 3.52Å; V557-Y626 HydrophobicContact CG1-CE1 4.33Å; L577-Y626 HydrophobicContact CD2-CD2 3.89Å; L577-Y626 HydrophobicContact CD2-CE2 3.69Å; K579-Y626 WeakPolarHBondContact CE-O 3.25Å; K579-Y626 HydrophobicContact CG-CE2 4.09Å; K579-Y626 PolarHBondContact NZ-O 2.96Å; M582-Y626 HydrophobicContact CG-CE1 4.12Å; M582-Y626 HydrophobicContact SD-CE1 4.2Å; F623-Y626 PolarHBondContact O-N 2.87Å; G624-Y626 PolarHBondContact O-N 2.99Å; G624-Y626 VanDerWaalsContact O-N 3.1Å
627	F	94.6	Very high	94.4	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-102.2	-5.2	-175.5	-68.5	-51.6	0	0	0	115.1	V557 M582 A586 W587 F590 F623 G624 D629 V630 W631	V557-F627 HydrophobicContact CG1-CE1 4.28Å; V557-F627 HydrophobicContact CG1-CE2 4.23Å; V557-F627 HydrophobicContact CG1-CZ 3.46Å; V557-F627 VanDerWaalsContact CG1-CZ 3.46Å; M582-F627 HydrophobicContact CG-CE1 4.29Å; M582-F627 HydrophobicContact SD-CD1 4.13Å; M582-F627 HydrophobicContact SD-CE1 3.69Å; A586-F627 HydrophobicContact CB-CE1 4.39Å; A586-F627 HydrophobicContact CB-CZ 4.03Å; W587-F627 HydrophobicContact CB-CB 4.47Å; W587-F627 HydrophobicContact CB-CD1 3.62Å; W587-F627 HydrophobicContact CB-CE1 3.85Å; W587-F627 HydrophobicContact CB-CG 4.03Å; W587-F627 HydrophobicContact CB-CZ 4.43Å; F590-F627 HydrophobicContact CB-CE2 4.39Å; F590-F627 WeakPolarHBondContact O-CD2 3.42Å; F590-F627 WeakPolarHBondContact O-CE2 3.5Å; F623-F627 HydrophobicContact CB-CD2 3.74Å; F623-F627 HydrophobicContact CB-CE2 3.98Å; F623-F627 AromaticContact CD2-CE2 3.98Å; F623-F627 HydrophobicContact CD2-CE2 3.98Å; F623-F627 HydrophobicContact CG-CE2 4.47Å; F623-F627 PolarHBondContact O-N 3.29Å; G624-F627 PolarHBondContact O-N 2.88Å; F627-D629 PolarHBondContact O-N 3.44Å; F627-V630 PolarHBondContact O-N 3.34Å; F627-W631 HydrophobicContact CB-CD2 3.69Å; F627-W631 VanDerWaalsContact CB-CE2 3.48Å; F627-W631 HydrophobicContact CB-CE3 3.92Å; F627-W631 HydrophobicContact CB-CG 4.38Å; F627-W631 HydrophobicContact CB-CH2 3.8Å; F627-W631 HydrophobicContact CB-CZ2 3.53Å; F627-W631 HydrophobicContact CB-CZ3 4.01Å; F627-W631 HydrophobicContact CD2-CH2 4.17Å; F627-W631 AromaticContact CD2-CZ2 3.77Å; F627-W631 HydrophobicContact CD2-CZ2 3.77Å; F627-W631 HydrophobicContact CG-CH2 4.49Å; F627-W631 HydrophobicContact CG-CZ2 4.03Å; F627-W631 PolarHBondContact O-N 3.04Å
628	H	93.3	Very high	94.3	Very high	23 Å²	23	42.7 Å²	42.7	11%	0.106	22%	0.223	C	C	.	.	H	α-helix	trans	-50.5	-49.4	-174.1	165.6	48.8	0	0	0	114.9	F516 N517 G624 W631 Q632 W639	F516-H628 HydrophobicContact CD2-CB 4.48Å; F516-H628 AromaticContact CD2-CE1 3.82Å; F516-H628 AromaticContact CD2-CG 3.84Å; F516-H628 AromaticContact CD2-ND1 3.65Å; F516-H628 AromaticContact CE2-CE1 3.81Å; F516-H628 VanDerWaalsContact O-CB 3.27Å; F516-H628 WeakPolarHBondContact O-CB 3.46Å; N517-H628 PolarHBondContact ND2-NE2 3.02Å; G624-H628 WeakPolarHBondContact O-CA 3.35Å; G624-H628 WeakPolarHBondContact O-CB 3.34Å; G624-H628 PolarHBondContact O-N 3.43Å; H628-W631 PolarHBondContact O-N 3.35Å; H628-Q632 PolarHBondContact CE1-OE1 2.86Å; H628-Q632 VanDerWaalsContact CE1-OE1 3.3Å; H628-Q632 VanDerWaalsContact O-CB 3.29Å; H628-Q632 WeakPolarHBondContact O-CB 3.23Å; H628-Q632 PolarHBondContact O-N 2.86Å; H628-W639 AromaticContact CE1-NE1 3.88Å; H628-W639 AromaticContact ND1-CE2 3.65Å; H628-W639 AromaticContact ND1-CZ2 3.46Å; H628-W639 WeakPolarHBondContact ND1-CZ2 3.37Å; H628-W639 AromaticContact ND1-NE1 3.67Å
629	D	92	Very high	94.3	Very high	76 Å²	76	43 Å²	43	41%	0.406	22%	0.224	S	C	.	.	H	α-helix	trans	-63.5	-39	178.1	60.1	-24	0	0	0	112.7	K579 F627 Y633	K579-D629 IonicContact NZ-OD1 2.89Å; K579-D629 PolarHBondContact NZ-OD1 3.26Å; K579-D629 IonicContact NZ-OD2 3.98Å; K579-D629 PolarHBondContact NZ-OD2 2.54Å; F627-D629 PolarHBondContact O-N 3.44Å; D629-Y633 VanDerWaalsContact O-CB 3.27Å; D629-Y633 WeakPolarHBondContact O-CB 3.36Å; D629-Y633 PolarHBondContact O-N 2.84Å
630	V	92.1	Very high	94.4	Very high	23 Å²	23	40.8 Å²	40.8	14%	0.139	21%	0.213	C	C	.	.	H	α-helix	trans	-68.1	-45.3	177	-176.8	0	0	0	0	110.2	W587 F627 Y633 Q634	W587-V630 HydrophobicContact CB-CG1 4.02Å; W587-V630 HydrophobicContact CD2-CG1 3.9Å; W587-V630 HydrophobicContact CG-CG1 3.57Å; F627-V630 PolarHBondContact O-N 3.34Å; V630-Y633 PolarHBondContact O-N 2.81Å; V630-Q634 HydrophobicContact CG1-CG 4.16Å; V630-Q634 WeakPolarHBondContact O-CB 3.36Å; V630-Q634 WeakPolarHBondContact O-CG 3.42Å; V630-Q634 PolarHBondContact O-N 3.01Å
631	W	94.2	Very high	94.3	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.008	22%	0.216	C	C	.	.	H	α-helix	trans	-64	-43.8	176.2	-68.6	-32.7	0	0	0	111.9	W587 F627 H628 Y633 Q634 L635 W639 M643 W784	W587-W631 AromaticContact CE3-CD1 3.66Å; W587-W631 AromaticContact CE3-NE1 3.91Å; W587-W631 PolarHBondContact O-NE1 2.97Å; F627-W631 HydrophobicContact CB-CD2 3.69Å; F627-W631 VanDerWaalsContact CB-CE2 3.48Å; F627-W631 HydrophobicContact CB-CE3 3.92Å; F627-W631 HydrophobicContact CB-CG 4.38Å; F627-W631 HydrophobicContact CB-CH2 3.8Å; F627-W631 HydrophobicContact CB-CZ2 3.53Å; F627-W631 HydrophobicContact CB-CZ3 4.01Å; F627-W631 HydrophobicContact CD2-CH2 4.17Å; F627-W631 AromaticContact CD2-CZ2 3.77Å; F627-W631 HydrophobicContact CD2-CZ2 3.77Å; F627-W631 HydrophobicContact CG-CH2 4.49Å; F627-W631 HydrophobicContact CG-CZ2 4.03Å; F627-W631 PolarHBondContact O-N 3.04Å; H628-W631 PolarHBondContact O-N 3.35Å; W631-Y633 VanDerWaalsContact C-N 3.29Å; W631-Y633 PolarHBondContact O-N 2.81Å; W631-Q634 PolarHBondContact O-N 2.97Å; W631-L635 WeakPolarHBondContact O-CB 3.46Å; W631-L635 PolarHBondContact O-N 2.99Å; W631-W639 HydrophobicContact CB-CB 4.07Å; W631-W639 HydrophobicContact CB-CD2 3.93Å; W631-W639 HydrophobicContact CB-CE3 3.83Å; W631-W639 HydrophobicContact CB-CG 4.05Å; W631-W639 HydrophobicContact CD2-CE3 4.12Å; W631-W639 HydrophobicContact CD2-CZ3 4.25Å; W631-W639 AromaticContact CE3-CE3 3.61Å; W631-W639 HydrophobicContact CE3-CE3 3.61Å; W631-W639 HydrophobicContact CE3-CH2 4.04Å; W631-W639 AromaticContact CE3-CZ3 3.31Å; W631-W639 HydrophobicContact CE3-CZ3 3.31Å; W631-W639 HydrophobicContact CG-CE3 4.26Å; W631-W639 HydrophobicContact CZ3-CE3 4.42Å; W631-W639 HydrophobicContact CZ3-CH2 4.36Å; W631-W639 AromaticContact CZ3-CZ3 3.74Å; W631-W639 HydrophobicContact CZ3-CZ3 3.74Å; W631-M643 HydrophobicContact CD2-CE 4.39Å; W631-M643 HydrophobicContact CD2-SD 3.74Å; W631-M643 HydrophobicContact CE3-SD 3.95Å; W631-M643 HydrophobicContact CG-SD 4.17Å; W631-M643 HydrophobicContact CH2-CE 3.87Å; W631-M643 HydrophobicContact CH2-SD 4.31Å; W631-M643 HydrophobicContact CZ2-CE 3.66Å; W631-M643 HydrophobicContact CZ2-SD 4.14Å; W631-M643 HydrophobicContact CZ3-CE 4.29Å; W631-M643 HydrophobicContact CZ3-SD 4.2Å; W631-W784 HydrophobicContact CH2-CZ3 4.2Å; W631-W784 HydrophobicContact CZ3-CH2 4.4Å; W631-W784 AromaticContact CZ3-CZ3 3.78Å; W631-W784 HydrophobicContact CZ3-CZ3 3.78Å
632	Q	94.1	Very high	94.3	Very high	95 Å²	95	43.9 Å²	43.9	44%	0.444	23%	0.231	S	C	.	.	H	α-helix	trans	-62.9	-37	176.6	-173.7	174.5	1.3	0	0	112	H628 G636	H628-Q632 PolarHBondContact CE1-OE1 2.86Å; H628-Q632 VanDerWaalsContact CE1-OE1 3.3Å; H628-Q632 VanDerWaalsContact O-CB 3.29Å; H628-Q632 WeakPolarHBondContact O-CB 3.23Å; H628-Q632 PolarHBondContact O-N 2.86Å; Q632-G636 WeakPolarHBondContact CA-O 2.92Å; Q632-G636 CarbonylContact O-C 3.6Å; Q632-G636 WeakPolarHBondContact O-CA 3.37Å; Q632-G636 PolarHBondContact O-N 3.4Å; Q632-G636 VanDerWaalsContact O-N 3.12Å
633	Y	93.4	Very high	94.2	Very high	190 Å²	190	45.4 Å²	45.4	75%	0.745	24%	0.238	S	C	*	.	H	α-helix	trans	-70.4	-40.5	175.9	179.8	-96.7	0	0	0	112.9	D629 V630 W631	D629-Y633 VanDerWaalsContact O-CB 3.27Å; D629-Y633 WeakPolarHBondContact O-CB 3.36Å; D629-Y633 PolarHBondContact O-N 2.84Å; V630-Y633 PolarHBondContact O-N 2.81Å; W631-Y633 VanDerWaalsContact C-N 3.29Å; W631-Y633 PolarHBondContact O-N 2.81Å
634	Q	93.6	Very high	94.1	Very high	95 Å²	95	45.4 Å²	45.4	44%	0.444	24%	0.238	S	C	.	.	H	α-helix	trans	-87.5	-37.6	-173	-64.3	-72.2	-18.5	0	0	113.9	W587 V630 W631	W587-Q634 HydrophobicContact CH2-CB 3.6Å; W587-Q634 HydrophobicContact CH2-CG 3.69Å; W587-Q634 HydrophobicContact CZ2-CB 4.08Å; W587-Q634 HydrophobicContact CZ2-CG 3.6Å; W587-Q634 HydrophobicContact CZ3-CB 3.99Å; W587-Q634 HydrophobicContact CZ3-CG 4.3Å; V630-Q634 HydrophobicContact CG1-CG 4.16Å; V630-Q634 WeakPolarHBondContact O-CB 3.36Å; V630-Q634 WeakPolarHBondContact O-CG 3.42Å; V630-Q634 PolarHBondContact O-N 3.01Å; W631-Q634 PolarHBondContact O-N 2.97Å
635	L	92.5	Very high	94.2	Very high	66 Å²	66	47.8 Å²	47.8	35%	0.346	25%	0.25	S	S	.	.	H	α-helix	trans	-104.6	-15.4	-176.3	-57.2	174.6	0	0	0	112.4	W631 W639 M643	W631-L635 WeakPolarHBondContact O-CB 3.46Å; W631-L635 PolarHBondContact O-N 2.99Å; L635-W639 HydrophobicContact CB-CB 3.69Å; L635-W639 HydrophobicContact CD1-CB 4.08Å; L635-W639 HydrophobicContact CG-CB 4.47Å; L635-M643 HydrophobicContact CD1-CG 4.06Å
636	G	94.5	Very high	94.2	Very high	31 Å²	31	52.1 Å²	52.1	32%	0.32	27%	0.274	S	S	.	.			trans	93.1	-165.7	-179	0	0	0	0	0	113.6	Q632 N638 W639	Q632-G636 WeakPolarHBondContact CA-O 2.92Å; Q632-G636 CarbonylContact O-C 3.6Å; Q632-G636 WeakPolarHBondContact O-CA 3.37Å; Q632-G636 PolarHBondContact O-N 3.4Å; Q632-G636 VanDerWaalsContact O-N 3.12Å; G636-N638 VanDerWaalsContact C-N 3.27Å; G636-N638 PolarHBondContact O-N 3.34Å; G636-W639 WeakPolarHBondContact O-CB 3.23Å; G636-W639 PolarHBondContact O-N 3.36Å
637	S	93.1	Very high	94.1	Very high	97 Å²	97	52.9 Å²	52.9	68%	0.678	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-28.1	-174.2	58.7	0	0	0	0	114
638	N	94.2	Very high	94.2	Very high	104 Å²	104	55.3 Å²	55.3	56%	0.556	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	18.3	-175.4	-64.4	-5.7	0	0	0	113.2	G636 A640 T641 D642	G636-N638 VanDerWaalsContact C-N 3.27Å; G636-N638 PolarHBondContact O-N 3.34Å; N638-A640 PolarHBondContact O-N 3.4Å; N638-T641 WeakPolarHBondContact O-CA 3.33Å; N638-T641 WeakPolarHBondContact O-CB 3.19Å; N638-T641 PolarHBondContact O-N 3.02Å; N638-D642 PolarHBondContact O-N 2.96Å; N638-D642 VanDerWaalsContact O-N 3.12Å
639	W	95.5	Very high	94.3	Very high	13 Å²	13	59.2 Å²	59.2	5%	0.049	31%	0.306	C	S	.	.	H	α-helix	trans	-45.4	-40.9	-175.7	64.5	-90.9	0	0	0	114.7	F516 H628 W631 L635 G636 T641 D642 M643 W784	F516-W639 HydrophobicContact CB-CH2 4.07Å; F516-W639 HydrophobicContact CB-CZ2 4.39Å; F516-W639 HydrophobicContact CD2-CH2 4.34Å; F516-W639 AromaticContact CD2-CZ2 3.8Å; F516-W639 HydrophobicContact CD2-CZ2 3.8Å; F516-W639 HydrophobicContact CE2-CZ2 4.29Å; F516-W639 HydrophobicContact CG-CH2 4.18Å; F516-W639 HydrophobicContact CG-CZ2 4.08Å; H628-W639 AromaticContact CE1-NE1 3.88Å; H628-W639 AromaticContact ND1-CE2 3.65Å; H628-W639 AromaticContact ND1-CZ2 3.46Å; H628-W639 WeakPolarHBondContact ND1-CZ2 3.37Å; H628-W639 AromaticContact ND1-NE1 3.67Å; W631-W639 HydrophobicContact CB-CB 4.07Å; W631-W639 HydrophobicContact CB-CD2 3.93Å; W631-W639 HydrophobicContact CB-CE3 3.83Å; W631-W639 HydrophobicContact CB-CG 4.05Å; W631-W639 HydrophobicContact CD2-CE3 4.12Å; W631-W639 HydrophobicContact CD2-CZ3 4.25Å; W631-W639 AromaticContact CE3-CE3 3.61Å; W631-W639 HydrophobicContact CE3-CE3 3.61Å; W631-W639 HydrophobicContact CE3-CH2 4.04Å; W631-W639 AromaticContact CE3-CZ3 3.31Å; W631-W639 HydrophobicContact CE3-CZ3 3.31Å; W631-W639 HydrophobicContact CG-CE3 4.26Å; W631-W639 HydrophobicContact CZ3-CE3 4.42Å; W631-W639 HydrophobicContact CZ3-CH2 4.36Å; W631-W639 AromaticContact CZ3-CZ3 3.74Å; W631-W639 HydrophobicContact CZ3-CZ3 3.74Å; L635-W639 HydrophobicContact CB-CB 3.69Å; L635-W639 HydrophobicContact CD1-CB 4.08Å; L635-W639 HydrophobicContact CG-CB 4.47Å; G636-W639 WeakPolarHBondContact O-CB 3.23Å; G636-W639 PolarHBondContact O-N 3.36Å; W639-T641 VanDerWaalsContact C-N 3.35Å; W639-T641 PolarHBondContact O-N 3.31Å; W639-D642 PolarHBondContact O-N 3.24Å; W639-M643 HydrophobicContact CE3-SD 3.8Å; W639-M643 HydrophobicContact CZ3-SD 4.06Å; W639-M643 VanDerWaalsContact O-CG 3.31Å; W639-M643 WeakPolarHBondContact O-CG 3Å; W639-M643 PolarHBondContact O-N 3.28Å; W639-W784 HydrophobicContact CH2-CB 4.34Å; W639-W784 HydrophobicContact CH2-CD2 4.32Å; W639-W784 AromaticContact CH2-CE3 3.81Å; W639-W784 HydrophobicContact CH2-CE3 3.81Å; W639-W784 AromaticContact CZ3-CE3 3.84Å; W639-W784 HydrophobicContact CZ3-CE3 3.84Å; W639-W784 HydrophobicContact CZ3-CZ3 4.36Å
640	A	94.9	Very high	94.3	Very high	7 Å²	7	58.7 Å²	58.7	6%	0.058	30%	0.299	C	S	.	.	H	α-helix	trans	-67.6	-37.5	-178.2	0	0	0	0	0	111.9	N638 C644 W784 A785	N638-A640 PolarHBondContact O-N 3.4Å; A640-C644 WeakPolarHBondContact O-CB 3.31Å; A640-C644 PolarHBondContact O-N 3.49Å; A640-W784 HydrophobicContact CB-CB 4.06Å; A640-A785 HydrophobicContact CB-CB 3.92Å
641	T	95	Very high	94.3	Very high	29 Å²	29	57.8 Å²	57.8	18%	0.178	29%	0.293	C	S	.	.	H	α-helix	trans	-69.4	-42.4	177	-53.7	0	0	0	0	110.4	N638 W639 M643 C644 I645	N638-T641 WeakPolarHBondContact O-CA 3.33Å; N638-T641 WeakPolarHBondContact O-CB 3.19Å; N638-T641 PolarHBondContact O-N 3.02Å; W639-T641 VanDerWaalsContact C-N 3.35Å; W639-T641 PolarHBondContact O-N 3.31Å; T641-M643 PolarHBondContact O-N 3.37Å; T641-C644 WeakPolarHBondContact O-CB 3.21Å; T641-C644 PolarHBondContact O-N 3.25Å; T641-C644 VanDerWaalsContact O-N 3.16Å; T641-I645 HydrophobicContact CG2-CD1 4.04Å; T641-I645 WeakPolarHBondContact O-CG1 3.43Å; T641-I645 PolarHBondContact O-N 2.82Å
642	D	95.2	Very high	94.2	Very high	62 Å²	62	59.4 Å²	59.4	33%	0.332	31%	0.31	S	S	.	.	H	α-helix	trans	-62.2	-44.6	176.5	-64.1	-29.3	0	0	0	111.2	N638 W639 C644 I645 D646	N638-D642 PolarHBondContact O-N 2.96Å; N638-D642 VanDerWaalsContact O-N 3.12Å; W639-D642 PolarHBondContact O-N 3.24Å; D642-C644 VanDerWaalsContact C-N 3.3Å; D642-C644 PolarHBondContact O-N 3.07Å; D642-I645 PolarHBondContact O-N 2.77Å; D642-D646 WeakPolarHBondContact O-CB 3.08Å; D642-D646 PolarHBondContact O-N 3.49Å
643	M	94.4	Very high	94.2	Very high	31 Å²	31	64 Å²	64	15%	0.153	32%	0.323	C	S	.	.	H	α-helix	trans	-59.5	-40.4	173.3	-72.3	-179.7	70	0	0	112.6	W631 L635 W639 T641 D646 W647	W631-M643 HydrophobicContact CD2-CE 4.39Å; W631-M643 HydrophobicContact CD2-SD 3.74Å; W631-M643 HydrophobicContact CE3-SD 3.95Å; W631-M643 HydrophobicContact CG-SD 4.17Å; W631-M643 HydrophobicContact CH2-CE 3.87Å; W631-M643 HydrophobicContact CH2-SD 4.31Å; W631-M643 HydrophobicContact CZ2-CE 3.66Å; W631-M643 HydrophobicContact CZ2-SD 4.14Å; W631-M643 HydrophobicContact CZ3-CE 4.29Å; W631-M643 HydrophobicContact CZ3-SD 4.2Å; L635-M643 HydrophobicContact CD1-CG 4.06Å; W639-M643 HydrophobicContact CE3-SD 3.8Å; W639-M643 HydrophobicContact CZ3-SD 4.06Å; W639-M643 VanDerWaalsContact O-CG 3.31Å; W639-M643 WeakPolarHBondContact O-CG 3Å; W639-M643 PolarHBondContact O-N 3.28Å; T641-M643 PolarHBondContact O-N 3.37Å; M643-D646 PolarHBondContact O-N 2.87Å; M643-W647 PolarHBondContact O-N 3.32Å
644	C	95.9	Very high	94	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-63.3	-44.9	175.8	-179.3	0	0	0	0	112	A640 T641 D642 W647 F648 Y780 C781	A640-C644 WeakPolarHBondContact O-CB 3.31Å; A640-C644 PolarHBondContact O-N 3.49Å; T641-C644 WeakPolarHBondContact O-CB 3.21Å; T641-C644 PolarHBondContact O-N 3.25Å; T641-C644 VanDerWaalsContact O-N 3.16Å; D642-C644 VanDerWaalsContact C-N 3.3Å; D642-C644 PolarHBondContact O-N 3.07Å; C644-W647 PolarHBondContact O-N 2.88Å; C644-F648 WeakPolarHBondContact O-CB 3.25Å; C644-F648 PolarHBondContact O-N 2.77Å; C644-Y780 HydrophobicContact CB-CD2 4.2Å; C644-C781 WeakPolarHBondContact CA-SG 3.24Å; C644-C781 HydrophobicContact CB-CB 3.98Å; C644-C781 WeakPolarHBondContact CB-SG 3.36Å; C644-C781 VanDerWaalsContact SG-CA 3.55Å; C644-C781 WeakPolarHBondContact SG-CB 3.45Å; C644-C781 CovalentContact SG-SG 2.04Å; C644-C781 PolarHBondContact SG-SG 2.87Å
645	I	96	Very high	93.8	Very high	50 Å²	50	57 Å²	57	26%	0.256	30%	0.296	S	S	.	.	H	α-helix	trans	-64.9	-41.7	178	-69.2	169	0	0	0	110.7	T641 D642 F648 Q649 F790	T641-I645 HydrophobicContact CG2-CD1 4.04Å; T641-I645 WeakPolarHBondContact O-CG1 3.43Å; T641-I645 PolarHBondContact O-N 2.82Å; D642-I645 PolarHBondContact O-N 2.77Å; I645-F648 WeakPolarHBondContact O-CB 3.38Å; I645-F648 PolarHBondContact O-N 3.16Å; I645-Q649 HydrophobicContact CG2-CG 4.33Å; I645-Q649 WeakPolarHBondContact O-CB 3.38Å; I645-Q649 WeakPolarHBondContact O-CG 3.45Å; I645-Q649 PolarHBondContact O-N 2.89Å; I645-F790 HydrophobicContact CG1-CZ 4.43Å
646	D	93.9	Very high	93.6	Very high	99 Å²	99	58.6 Å²	58.6	53%	0.529	31%	0.305	S	S	.	.	H	α-helix	trans	-60.5	-47.4	177.1	-80.5	-11.9	0	0	0	111.5	D642 M643 F648 Q649 Y650	D642-D646 WeakPolarHBondContact O-CB 3.08Å; D642-D646 PolarHBondContact O-N 3.49Å; M643-D646 PolarHBondContact O-N 2.87Å; D646-F648 VanDerWaalsContact C-N 3.35Å; D646-Q649 PolarHBondContact O-N 3.37Å; D646-Y650 VanDerWaalsContact O-CB 3.26Å; D646-Y650 WeakPolarHBondContact O-CB 3.4Å; D646-Y650 PolarHBondContact O-N 3.47Å
647	W	94.1	Very high	93.5	Very high	17 Å²	17	57.4 Å²	57.4	6%	0.064	29%	0.291	C	S	.	.	H	α-helix	trans	-60.1	-46.2	172.5	166.9	80.6	0	0	0	111.3	M643 C644 Q649 Y650 D651 P777 Y780 Y791 R794	M643-W647 PolarHBondContact O-N 3.32Å; C644-W647 PolarHBondContact O-N 2.88Å; W647-Q649 VanDerWaalsContact C-N 3.31Å; W647-Q649 PolarHBondContact O-N 2.76Å; W647-Y650 PolarHBondContact O-N 3.09Å; W647-Y650 VanDerWaalsContact O-N 3.16Å; W647-D651 WeakPolarHBondContact O-CB 3.23Å; W647-D651 PolarHBondContact O-N 3.16Å; W647-P777 HydrophobicContact CD2-CB 3.56Å; W647-P777 HydrophobicContact CD2-CG 3.96Å; W647-P777 VanDerWaalsContact CE2-CG 3.4Å; W647-P777 HydrophobicContact CE3-CB 4Å; W647-P777 HydrophobicContact CG-CB 4Å; W647-P777 HydrophobicContact CG-CG 4.07Å; W647-P777 HydrophobicContact CH2-CB 4.03Å; W647-P777 HydrophobicContact CZ2-CB 3.6Å; W647-P777 HydrophobicContact CZ2-CG 3.85Å; W647-P777 HydrophobicContact CZ3-CB 4.23Å; W647-Y780 HydrophobicContact CB-CE2 3.71Å; W647-Y780 VanDerWaalsContact CB-OH 3.31Å; W647-Y780 WeakPolarHBondContact CB-OH 3.49Å; W647-Y780 VanDerWaalsContact CD1-OH 3.27Å; W647-Y780 HydrophobicContact CG-CE2 4.08Å; W647-Y780 VanDerWaalsContact CG-OH 3.25Å; W647-Y791 AromaticContact CH2-CD2 3.63Å; W647-Y791 HydrophobicContact CH2-CD2 3.63Å; W647-Y791 HydrophobicContact CH2-CE2 4.27Å; W647-Y791 HydrophobicContact CH2-CG 4.4Å; W647-Y791 HydrophobicContact CZ2-CD2 4.22Å; W647-Y791 HydrophobicContact CZ2-CE2 4.47Å; W647-Y791 HydrophobicContact CZ3-CD2 4.19Å; W647-R794 HydrophobicContact CH2-CB 3.82Å; W647-R794 HydrophobicContact CH2-CG 4.14Å; W647-R794 HydrophobicContact CZ2-CG 4.4Å; W647-R794 HydrophobicContact CZ3-CB 4.33Å
648	F	95.8	Very high	93.3	Very high	52 Å²	52	54.6 Å²	54.6	23%	0.228	27%	0.266	C	S	.	.	H	α-helix	trans	-57.8	-45.9	-179.3	179.5	-97.6	0	0	0	110.7	C644 I645 D646 G652 F790 W793 R794	C644-F648 WeakPolarHBondContact O-CB 3.25Å; C644-F648 PolarHBondContact O-N 2.77Å; I645-F648 WeakPolarHBondContact O-CB 3.38Å; I645-F648 PolarHBondContact O-N 3.16Å; D646-F648 VanDerWaalsContact C-N 3.35Å; F648-G652 PolarHBondContact O-N 3.4Å; F648-G652 VanDerWaalsContact O-N 3.12Å; F648-F790 HydrophobicContact CB-CB 4.47Å; F648-F790 HydrophobicContact CD1-CD1 4.32Å; F648-F790 HydrophobicContact CD2-CB 3.91Å; F648-F790 HydrophobicContact CD2-CD1 4.13Å; F648-F790 VanDerWaalsContact CD2-O 3.31Å; F648-F790 WeakPolarHBondContact CD2-O 3.41Å; F648-F790 HydrophobicContact CE1-CD1 4.5Å; F648-F790 HydrophobicContact CE2-CB 4.49Å; F648-F790 HydrophobicContact CE2-CD1 4.31Å; F648-F790 WeakPolarHBondContact CE2-O 3.32Å; F648-F790 HydrophobicContact CG-CB 4.35Å; F648-F790 HydrophobicContact CG-CD1 4.12Å; F648-F790 HydrophobicContact CZ-CD1 4.49Å; F648-W793 HydrophobicContact CE2-CB 4.17Å; F648-R794 HydrophobicContact CD2-CB 4.32Å; F648-R794 HydrophobicContact CE2-CB 4.35Å; F648-R794 PolarHBondContact O-NE 2.99Å; F648-R794 PolarHBondContact O-NH2 2.95Å
649	Q	95.8	Very high	93	Very high	105 Å²	105	55.2 Å²	55.2	49%	0.491	27%	0.267	S	S	.	.	H	α-helix	trans	-68.3	-38.9	176.6	-68.7	179.6	14.4	0	0	112.6	I645 D646 W647 R653	I645-Q649 HydrophobicContact CG2-CG 4.33Å; I645-Q649 WeakPolarHBondContact O-CB 3.38Å; I645-Q649 WeakPolarHBondContact O-CG 3.45Å; I645-Q649 PolarHBondContact O-N 2.89Å; D646-Q649 PolarHBondContact O-N 3.37Å; W647-Q649 VanDerWaalsContact C-N 3.31Å; W647-Q649 PolarHBondContact O-N 2.76Å; Q649-R653 WeakPolarHBondContact O-CG 3.27Å; Q649-R653 PolarHBondContact O-N 3.19Å; Q649-R653 PolarHBondContact O-NE 2.87Å
650	Y	92.2	Very high	92.6	Very high	65 Å²	65	56.9 Å²	56.9	26%	0.255	28%	0.275	S	S	.	.	H	α-helix	trans	-64.6	-50.3	177.3	178	-107.5	0	0	0	111.8	D646 W647 G652 R653	D646-Y650 VanDerWaalsContact O-CB 3.26Å; D646-Y650 WeakPolarHBondContact O-CB 3.4Å; D646-Y650 PolarHBondContact O-N 3.47Å; W647-Y650 PolarHBondContact O-N 3.09Å; W647-Y650 VanDerWaalsContact O-N 3.16Å; Y650-G652 VanDerWaalsContact C-N 3.27Å; Y650-G652 PolarHBondContact O-N 2.82Å; Y650-R653 PolarHBondContact O-N 2.98Å; Y650-R653 VanDerWaalsContact O-N 3.16Å
651	D	93.1	Very high	92.2	Very high	4 Å²	4	56.6 Å²	56.6	2%	0.021	27%	0.272	C	S	.	.	H	α-helix	trans	-63	-35.4	179.5	-163.1	83.4	0	0	0	111.4	W647 R653 R654 R750 R794 R795	W647-D651 WeakPolarHBondContact O-CB 3.23Å; W647-D651 PolarHBondContact O-N 3.16Å; D651-R653 VanDerWaalsContact C-N 3.33Å; D651-R653 PolarHBondContact O-N 2.89Å; D651-R654 PolarHBondContact O-N 2.8Å; D651-R750 PolarHBondContact O-NH2 2.86Å; D651-R750 VanDerWaalsContact O-NH2 3.12Å; D651-R750 IonicContact OD1-CZ 3.72Å; D651-R750 IonicContact OD1-NE 3.32Å; D651-R750 PolarHBondContact OD1-NE 3.46Å; D651-R750 IonicContact OD1-NH2 3.17Å; D651-R750 PolarHBondContact OD1-NH2 2.86Å; D651-R750 VanDerWaalsContact OD1-NH2 3.09Å; D651-R750 IonicContact OD2-CZ 3.35Å; D651-R750 IonicContact OD2-NE 3.49Å; D651-R750 IonicContact OD2-NH2 3.73Å; D651-R750 PolarHBondContact OD2-NH2 2.8Å; D651-R794 HydrophobicContact CB-CG 4.04Å; D651-R794 VanDerWaalsContact OD2-CD 3.25Å; D651-R794 WeakPolarHBondContact OD2-CD 2.87Å; D651-R794 WeakPolarHBondContact OD2-CG 3.1Å; D651-R795 IonicContact OD1-CZ 3.9Å; D651-R795 IonicContact OD1-NH1 2.8Å; D651-R795 IonicContact OD1-NH2 3.01Å; D651-R795 PolarHBondContact OD1-NH2 3.4Å; D651-R795 IonicContact OD2-CZ 3.5Å; D651-R795 IonicContact OD2-NH1 2.7Å; D651-R795 PolarHBondContact OD2-NH1 2.86Å; D651-R795 IonicContact OD2-NH2 3.72Å
652	G	92	Very high	91.4	Very high	36 Å²	36	59.1 Å²	59.1	37%	0.371	28%	0.282	S	S	.	.	H	α-helix	trans	-70	-21.3	176.3	0	0	0	0	0	116	F648 Y650 R794	F648-G652 PolarHBondContact O-N 3.4Å; F648-G652 VanDerWaalsContact O-N 3.12Å; Y650-G652 VanDerWaalsContact C-N 3.27Å; Y650-G652 PolarHBondContact O-N 2.82Å; G652-R794 VanDerWaalsContact CA-NH1 3.33Å
653	R	92.7	Very high	90.5	Very high	190 Å²	190	61.9 Å²	61.9	72%	0.717	30%	0.296	S	S	*	.	H	α-helix	trans	-83.6	-14.7	173.8	-74.2	-178.7	-68.7	168.4	-3.2	112.8	Q649 Y650 D651	Q649-R653 WeakPolarHBondContact O-CG 3.27Å; Q649-R653 PolarHBondContact O-N 3.19Å; Q649-R653 PolarHBondContact O-NE 2.87Å; Y650-R653 PolarHBondContact O-N 2.98Å; Y650-R653 VanDerWaalsContact O-N 3.16Å; D651-R653 VanDerWaalsContact C-N 3.33Å; D651-R653 PolarHBondContact O-N 2.89Å
654	R	90.6	Very high	90	Very high	38 Å²	38	67.7 Å²	67.7	14%	0.143	32%	0.321	C	S	.	.	S	Bend	trans	-83.6	166	178.5	-63.9	175.4	76	168.4	3.4	110.2	D651 N656 N773	D651-R654 PolarHBondContact O-N 2.8Å; R654-N656 PolarHBondContact O-N 2.8Å; R654-N773 PolarHBondContact NH1-OD1 3.39Å
655	E	88.3	Confident	89.7	Confident	102 Å²	102	68.4 Å²	68.4	48%	0.477	32%	0.324	S	S	.	.			trans	-52.9	135.3	174.1	-175	173.3	-163.7	0	0	111.2	F657 F660 W712 R750	E655-F657 PolarHBondContact O-N 2.86Å; E655-F660 HydrophobicContact CG-CE2 4.24Å; E655-F660 VanDerWaalsContact OE1-CE2 3.25Å; E655-F660 WeakPolarHBondContact OE1-CE2 3.38Å; E655-F660 WeakPolarHBondContact OE1-CZ 3.48Å; E655-W712 WeakPolarHBondContact OE1-CH2 3.22Å; E655-W712 WeakPolarHBondContact OE1-CZ2 3.26Å; E655-R750 PolarHBondContact O-NH1 3.06Å
656	N	89.4	Confident	89.5	Confident	99 Å²	99	66.7 Å²	66.7	53%	0.529	32%	0.316	S	S	.	.			trans	-75.2	87.9	177.8	-176.1	8	0	0	0	109.9	R654 Y658 M659	R654-N656 PolarHBondContact O-N 2.8Å; N656-Y658 PolarHBondContact O-N 2.94Å; N656-Y658 WeakPolarHBondContact OD1-CB 3.48Å; N656-Y658 PolarHBondContact OD1-N 2.81Å; N656-M659 PolarHBondContact O-N 2.79Å
657	F	91	Very high	89.4	Confident	6 Å²	6	62.1 Å²	62.1	3%	0.026	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-64.1	-26.3	-178.8	74.4	-88.7	0	0	0	113.1	E655 M659 F660 L661 A715 P748 R750	E655-F657 PolarHBondContact O-N 2.86Å; F657-M659 PolarHBondContact O-N 3.05Å; F657-F660 PolarHBondContact O-N 2.69Å; F657-L661 HydrophobicContact CD2-CD1 3.81Å; F657-L661 HydrophobicContact CE2-CD1 3.84Å; F657-A715 HydrophobicContact CB-CB 4.04Å; F657-A715 HydrophobicContact CD2-CB 3.33Å; F657-A715 HydrophobicContact CE2-CB 4.07Å; F657-A715 HydrophobicContact CG-CB 3.99Å; F657-P748 HydrophobicContact CE2-CB 4.2Å; F657-R750 HydrophobicContact CD1-CB 3.88Å; F657-R750 HydrophobicContact CD1-CG 3.92Å; F657-R750 HydrophobicContact CE1-CB 3.65Å; F657-R750 HydrophobicContact CE1-CG 4.19Å; F657-R750 HydrophobicContact CE2-CB 4.4Å; F657-R750 HydrophobicContact CG-CB 4.36Å; F657-R750 HydrophobicContact CG-CG 4.35Å; F657-R750 HydrophobicContact CZ-CB 3.92Å
658	Y	88.8	Confident	89.5	Confident	37 Å²	37	61.3 Å²	61.3	15%	0.145	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-58.7	-37.8	-178	-176.6	-95.5	0	0	0	112.1	N656 F660 L661 E662 P748 I796 S798	N656-Y658 PolarHBondContact O-N 2.94Å; N656-Y658 WeakPolarHBondContact OD1-CB 3.48Å; N656-Y658 PolarHBondContact OD1-N 2.81Å; Y658-F660 PolarHBondContact O-N 2.79Å; Y658-F660 VanDerWaalsContact O-N 3.07Å; Y658-L661 PolarHBondContact O-N 3.39Å; Y658-E662 HydrophobicContact CE1-CB 4.1Å; Y658-E662 HydrophobicContact CE1-CG 4.19Å; Y658-E662 WeakPolarHBondContact CE1-OE2 3.3Å; Y658-E662 PolarHBondContact O-N 3.01Å; Y658-P748 HydrophobicContact CD2-CB 4.47Å; Y658-P748 HydrophobicContact CD2-CG 3.79Å; Y658-P748 HydrophobicContact CE2-CG 3.97Å; Y658-I796 HydrophobicContact CD2-CG2 4.12Å; Y658-I796 HydrophobicContact CE1-CG2 4.17Å; Y658-I796 HydrophobicContact CE2-CG2 3.63Å; Y658-I796 VanDerWaalsContact CE2-O 3.28Å; Y658-I796 WeakPolarHBondContact CE2-O 3.32Å; Y658-S798 WeakPolarHBondContact CE2-OG 3.34Å
659	M	88.1	Confident	89.3	Confident	118 Å²	118	59 Å²	59	58%	0.581	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-56.4	-26.4	176.8	-175.2	-179.5	66.3	0	0	112.9	N656 F657	N656-M659 PolarHBondContact O-N 2.79Å; F657-M659 PolarHBondContact O-N 3.05Å
660	F	87.4	Confident	89.2	Confident	48 Å²	48	54.9 Å²	54.9	21%	0.211	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-89.6	-12.7	178.6	-61	-77.5	0	0	0	113.7	E655 F657 Y658 V711 W712 T713	E655-F660 HydrophobicContact CG-CE2 4.24Å; E655-F660 VanDerWaalsContact OE1-CE2 3.25Å; E655-F660 WeakPolarHBondContact OE1-CE2 3.38Å; E655-F660 WeakPolarHBondContact OE1-CZ 3.48Å; F657-F660 PolarHBondContact O-N 2.69Å; Y658-F660 PolarHBondContact O-N 2.79Å; Y658-F660 VanDerWaalsContact O-N 3.07Å; F660-V711 HydrophobicContact CB-CG2 4.3Å; F660-W712 HydrophobicContact CD1-CZ2 4.47Å; F660-W712 AromaticContact CD1-NE1 3.18Å; F660-W712 AromaticContact CE1-CE2 3.9Å; F660-W712 AromaticContact CE1-CZ2 3.85Å; F660-W712 HydrophobicContact CE1-CZ2 3.85Å; F660-W712 AromaticContact CE1-NE1 3.33Å; F660-W712 VanDerWaalsContact CE1-NE1 3.33Å; F660-W712 AromaticContact CE2-CZ2 3.9Å; F660-W712 HydrophobicContact CE2-CZ2 3.9Å; F660-W712 AromaticContact CG-NE1 3.57Å; F660-W712 AromaticContact CZ-CZ2 3.53Å; F660-W712 HydrophobicContact CZ-CZ2 3.53Å; F660-W712 AromaticContact CZ-NE1 3.85Å; F660-T713 HydrophobicContact CD2-CG2 3.73Å; F660-T713 HydrophobicContact CE2-CG2 4.06Å; F660-T713 HydrophobicContact CG-CG2 4.29Å
661	L	87.4	Confident	89.3	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-48.4	-180	-71.9	174.9	0	0	0	112.4	F657 Y658 N663 K664 Q665 V711 A715 P748	F657-L661 HydrophobicContact CD2-CD1 3.81Å; F657-L661 HydrophobicContact CE2-CD1 3.84Å; Y658-L661 PolarHBondContact O-N 3.39Å; L661-N663 VanDerWaalsContact C-N 3.31Å; L661-N663 PolarHBondContact O-N 2.94Å; L661-N663 VanDerWaalsContact O-N 3.11Å; L661-K664 PolarHBondContact O-N 3.43Å; L661-Q665 PolarHBondContact O-N 3.5Å; L661-V711 HydrophobicContact CD2-CB 4.47Å; L661-V711 HydrophobicContact CD2-CG1 3.79Å; L661-V711 HydrophobicContact CD2-CG2 3.84Å; L661-V711 HydrophobicContact CG-CG2 4.29Å; L661-A715 HydrophobicContact CD1-CB 4.04Å; L661-A715 HydrophobicContact CD2-CB 4.44Å; L661-A715 HydrophobicContact CG-CB 4.34Å; L661-P748 HydrophobicContact CD1-CB 3.64Å
662	E	76.7	Confident	89.3	Confident	83 Å²	83	55.6 Å²	55.6	39%	0.388	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.3	-48.4	-166.3	-167.7	173.8	-166.5	0	0	113.3	Y658	Y658-E662 HydrophobicContact CE1-CB 4.1Å; Y658-E662 HydrophobicContact CE1-CG 4.19Å; Y658-E662 WeakPolarHBondContact CE1-OE2 3.3Å; Y658-E662 PolarHBondContact O-N 3.01Å
663	N	76.3	Confident	89.5	Confident	119 Å²	119	54 Å²	54	64%	0.636	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-16.7	-178.4	-62.7	-8.4	0	0	0	114.1	L661	L661-N663 VanDerWaalsContact C-N 3.31Å; L661-N663 PolarHBondContact O-N 2.94Å; L661-N663 VanDerWaalsContact O-N 3.11Å
664	K	83.8	Confident	89.6	Confident	154 Å²	154	45.1 Å²	45.1	67%	0.67	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.3	-30.4	-173.2	-68.3	-154.3	176.8	-167.4	0	113.4	L661	L661-K664 PolarHBondContact O-N 3.43Å
665	Q	90.1	Very high	89.8	Confident	15 Å²	15	45.9 Å²	45.9	7%	0.07	23%	0.228	C	C	.	.	S	Bend	trans	-139.2	62.9	-176.7	-61.8	-175.3	-48	0	0	110.2	L661 R709 Q717	L661-Q665 PolarHBondContact O-N 3.5Å; Q665-R709 PolarHBondContact NE2-O 3.27Å; Q665-Q717 HydrophobicContact CB-CB 4.07Å; Q665-Q717 VanDerWaalsContact O-CG 3.28Å; Q665-Q717 WeakPolarHBondContact O-CG 3.39Å
666	P	91.5	Very high	90.1	Very high	14 Å²	14	41.1 Å²	41.1	9%	0.091	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-71.8	144.7	178.3	30.9	-36.1	0	0	0	111.3	Y681 D802 Y803	P666-Y681 PolarHBondContact O-OH 2.81Å; P666-D802 HydrophobicContact CB-CB 4.36Å; P666-D802 HydrophobicContact CG-CB 4.38Å; P666-Y803 HydrophobicContact CG-CD2 4.42Å; P666-Y803 WeakPolarHBondContact O-CD2 3.25Å
667	C	93.3	Very high	90.4	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.014	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-67.6	140.9	-179.4	-77.3	0	0	0	0	111.8	Q717 C719 L727 G799 C800 Y803	C667-Q717 PolarHBondContact SG-NE2 3.19Å; C667-C719 WeakPolarHBondContact CA-SG 3.34Å; C667-C719 HydrophobicContact CB-CB 3.76Å; C667-C719 WeakPolarHBondContact CB-SG 3.49Å; C667-C719 WeakPolarHBondContact SG-CB 3.37Å; C667-C719 CovalentContact SG-SG 2.03Å; C667-C719 PolarHBondContact SG-SG 3.06Å; C667-L727 HydrophobicContact CB-CD1 3.94Å; C667-L727 HydrophobicContact CB-CD2 3.64Å; C667-L727 HydrophobicContact CB-CG 4.48Å; C667-G799 PolarHBondContact N-O 3.35Å; C667-C800 VanDerWaalsContact O-CA 3.28Å; C667-C800 WeakPolarHBondContact O-CA 3.34Å; C667-C800 WeakPolarHBondContact O-CB 3.25Å; C667-Y803 VanDerWaalsContact O-CB 3.27Å; C667-Y803 WeakPolarHBondContact O-CB 3.49Å
668	P	94.8	Very high	90.5	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.183	C	C	.	.	P	Polyproline II helix	trans	-57.1	142.6	164.3	-17.6	27.3	0	0	0	111	T670 Q673 A674 Y681 Y721 Y803	P668-T670 VanDerWaalsContact C-N 3.31Å; P668-T670 PolarHBondContact O-N 3.32Å; P668-Q673 HydrophobicContact CB-CB 3.91Å; P668-A674 HydrophobicContact CB-CB 4.06Å; P668-A674 HydrophobicContact CG-CB 3.95Å; P668-Y681 HydrophobicContact CG-CD2 3.92Å; P668-Y681 HydrophobicContact CG-CE2 3.89Å; P668-Y721 VanDerWaalsContact CB-OH 3.31Å; P668-Y721 WeakPolarHBondContact CB-OH 3.45Å; P668-Y721 VanDerWaalsContact CD-OH 3.3Å; P668-Y721 WeakPolarHBondContact CD-OH 3.45Å; P668-Y721 WeakPolarHBondContact CG-OH 3.43Å; P668-Y721 WeakPolarHBondContact O-CE1 3.32Å; P668-Y721 PolarHBondContact O-OH 2.8Å; P668-Y803 HydrophobicContact CB-CD1 4.34Å; P668-Y803 HydrophobicContact CB-CD2 4.39Å; P668-Y803 HydrophobicContact CB-CE1 3.87Å; P668-Y803 HydrophobicContact CB-CE2 3.94Å; P668-Y803 HydrophobicContact CG-CD2 4.28Å; P668-Y803 HydrophobicContact CG-CE2 3.69Å
669	C	92.2	Very high	90.7	Very high	4 Å²	4	34.9 Å²	34.9	3%	0.027	18%	0.176	C	C	.	.	S	Bend	trans	-72.3	-28.7	-177.9	-62.6	0	0	0	0	112.5	L727 C800 T1138 L1160	C669-L727 PolarHBondContact O-N 3.01Å; C669-C800 WeakPolarHBondContact CA-SG 3.28Å; C669-C800 HydrophobicContact CB-CB 3.87Å; C669-C800 WeakPolarHBondContact CB-SG 3.08Å; C669-C800 WeakPolarHBondContact SG-CB 3.31Å; C669-C800 CovalentContact SG-SG 2.04Å; C669-C800 PolarHBondContact SG-SG 3.01Å; C669-T1138 HydrophobicContact CB-CG2 4.34Å; C669-L1160 HydrophobicContact CB-CD2 4.21Å
670	T	93.4	Very high	91	Very high	19 Å²	19	31.5 Å²	31.5	12%	0.117	16%	0.157	C	C	.	.	B	Isolated β-bridge	trans	-134.8	155.9	-174	59	0	0	0	0	111.3	P668 D672 Q673 A674 Y721 G725 W726	P668-T670 VanDerWaalsContact C-N 3.31Å; P668-T670 PolarHBondContact O-N 3.32Å; T670-D672 VanDerWaalsContact C-N 3.3Å; T670-D672 PolarHBondContact O-N 2.81Å; T670-Q673 WeakPolarHBondContact O-CB 3.45Å; T670-Q673 PolarHBondContact O-N 2.93Å; T670-Q673 VanDerWaalsContact OG1-CD 3.26Å; T670-Q673 VanDerWaalsContact OG1-CG 3.26Å; T670-Q673 WeakPolarHBondContact OG1-CG 3Å; T670-Q673 PolarHBondContact OG1-OE1 2.98Å; T670-A674 PolarHBondContact O-N 3.44Å; T670-Y721 VanDerWaalsContact C-CE1 3.46Å; T670-G725 CarbonylContact C-O 3.55Å; T670-G725 WeakPolarHBondContact CA-O 3.44Å; T670-W726 HydrophobicContact CG2-CE3 4.16Å; T670-W726 HydrophobicContact CG2-CZ3 3.93Å
671	L	94	Very high	91.4	Very high	18 Å²	18	29.7 Å²	29.7	9%	0.094	15%	0.149	C	C	.	.	H	α-helix	trans	-59.2	-40.6	176.5	177.9	58	0	0	0	112.1	Q673 A674 V675 H703 Y721 G725	L671-Q673 VanDerWaalsContact C-N 3.32Å; L671-Q673 PolarHBondContact O-N 3.06Å; L671-A674 WeakPolarHBondContact O-CB 3.12Å; L671-A674 PolarHBondContact O-N 2.77Å; L671-V675 HydrophobicContact CD1-CG2 3.93Å; L671-V675 HydrophobicContact CG-CG2 4.29Å; L671-V675 WeakPolarHBondContact O-CG2 3.43Å; L671-V675 PolarHBondContact O-N 2.84Å; L671-H703 HydrophobicContact CD1-CB 3.75Å; L671-H703 VanDerWaalsContact CD1-CD2 3.48Å; L671-H703 WeakPolarHBondContact CD1-CD2 3.38Å; L671-Y721 HydrophobicContact CB-CD1 4.2Å; L671-Y721 HydrophobicContact CB-CD2 4.38Å; L671-Y721 HydrophobicContact CB-CG 3.93Å; L671-Y721 HydrophobicContact CD1-CD2 3.81Å; L671-Y721 HydrophobicContact CD1-CE2 4.46Å; L671-Y721 HydrophobicContact CD1-CG 4.16Å; L671-G725 PolarHBondContact N-O 3.37Å
672	D	94.4	Very high	91.7	Very high	66 Å²	66	29.9 Å²	29.9	35%	0.353	15%	0.15	S	C	.	.	H	α-helix	trans	-61.5	-40.4	-179.9	-62.1	-53.1	0	0	0	112.1	T670 A674 V676 L1133	T670-D672 VanDerWaalsContact C-N 3.3Å; T670-D672 PolarHBondContact O-N 2.81Å; D672-A674 VanDerWaalsContact C-N 3.34Å; D672-V676 WeakPolarHBondContact O-CG2 3.14Å; D672-V676 PolarHBondContact O-N 3.41Å; D672-L1133 HydrophobicContact CB-CB 3.7Å
673	Q	95.3	Very high	92.5	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.005	13%	0.134	C	C	.	.	H	α-helix	trans	-61.9	-42.8	172.3	-71.5	167.6	-25.5	0	0	111.4	P668 T670 L671 V675 V676 D677 Y803 G1134 K1136 T1138	P668-Q673 HydrophobicContact CB-CB 3.91Å; T670-Q673 WeakPolarHBondContact O-CB 3.45Å; T670-Q673 PolarHBondContact O-N 2.93Å; T670-Q673 VanDerWaalsContact OG1-CD 3.26Å; T670-Q673 VanDerWaalsContact OG1-CG 3.26Å; T670-Q673 WeakPolarHBondContact OG1-CG 3Å; T670-Q673 PolarHBondContact OG1-OE1 2.98Å; L671-Q673 VanDerWaalsContact C-N 3.32Å; L671-Q673 PolarHBondContact O-N 3.06Å; Q673-V675 PolarHBondContact O-N 2.87Å; Q673-V676 PolarHBondContact O-N 3.25Å; Q673-D677 WeakPolarHBondContact O-CB 3.22Å; Q673-D677 PolarHBondContact O-N 3.2Å; Q673-D677 VanDerWaalsContact O-N 3.16Å; Q673-Y803 HydrophobicContact CB-CE1 4.04Å; Q673-Y803 HydrophobicContact CG-CE1 4.29Å; Q673-G1134 WeakPolarHBondContact CG-O 3.35Å; Q673-K1136 PolarHBondContact NE2-O 3.32Å; Q673-T1138 PolarHBondContact NE2-OG1 3.18Å
674	A	95.2	Very high	93.2	Very high	4 Å²	4	21.3 Å²	21.3	3%	0.033	11%	0.108	C	C	.	.	H	α-helix	trans	-65.5	-38.4	-178.7	0	0	0	0	0	113.1	P668 T670 L671 D672 V676 D677 V705 Y721	P668-A674 HydrophobicContact CB-CB 4.06Å; P668-A674 HydrophobicContact CG-CB 3.95Å; T670-A674 PolarHBondContact O-N 3.44Å; L671-A674 WeakPolarHBondContact O-CB 3.12Å; L671-A674 PolarHBondContact O-N 2.77Å; D672-A674 VanDerWaalsContact C-N 3.34Å; A674-V676 VanDerWaalsContact C-N 3.34Å; A674-D677 PolarHBondContact O-N 3.21Å; A674-V705 HydrophobicContact CB-CG1 4.1Å; A674-V705 HydrophobicContact CB-CG2 4.28Å; A674-Y721 HydrophobicContact CB-CE2 3.62Å; A674-Y721 WeakPolarHBondContact CB-OH 3.43Å
675	V	93.4	Very high	93.2	Very high	54 Å²	54	17.2 Å²	17.2	33%	0.327	10%	0.099	S	C	.	.	H	α-helix	trans	-71.4	-30.1	-179.6	173.3	0	0	0	0	112	L671 Q673	L671-V675 HydrophobicContact CD1-CG2 3.93Å; L671-V675 HydrophobicContact CG-CG2 4.29Å; L671-V675 WeakPolarHBondContact O-CG2 3.43Å; L671-V675 PolarHBondContact O-N 2.84Å; Q673-V675 PolarHBondContact O-N 2.87Å
676	V	94.7	Very high	93	Very high	3 Å²	3	19.1 Å²	19.1	2%	0.018	11%	0.109	C	C	.	.	H	α-helix	trans	-80	-26.4	177.5	174.1	0	0	0	0	111.9	D672 Q673 A674 V678 P806 V808 S958 L1130	D672-V676 WeakPolarHBondContact O-CG2 3.14Å; D672-V676 PolarHBondContact O-N 3.41Å; Q673-V676 PolarHBondContact O-N 3.25Å; A674-V676 VanDerWaalsContact C-N 3.34Å; V676-V678 PolarHBondContact O-N 2.99Å; V676-P806 HydrophobicContact CG1-CG 4.36Å; V676-V808 HydrophobicContact CG1-CB 4.45Å; V676-V808 HydrophobicContact CG1-CG1 3.41Å; V676-V808 VanDerWaalsContact CG1-CG1 3.41Å; V676-V808 HydrophobicContact CG1-CG2 4.17Å; V676-S958 PolarHBondContact O-OG 3.03Å; V676-L1130 HydrophobicContact CG2-CB 4.2Å; V676-L1130 HydrophobicContact CG2-CD2 4.23Å
677	D	96	Very high	93.1	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.105	C	C	.	.			trans	-82.3	50.8	-178.3	-155	-11.2	0	0	0	113.9	Q673 A674 G679 R680 Y681 Y803 P806	Q673-D677 WeakPolarHBondContact O-CB 3.22Å; Q673-D677 PolarHBondContact O-N 3.2Å; Q673-D677 VanDerWaalsContact O-N 3.16Å; A674-D677 PolarHBondContact O-N 3.21Å; D677-G679 PolarHBondContact O-N 3.08Å; D677-R680 PolarHBondContact O-N 3.24Å; D677-R680 WeakPolarHBondContact OD1-CB 3.36Å; D677-R680 IonicContact OD1-CZ 3.35Å; D677-R680 IonicContact OD1-NE 3.09Å; D677-R680 PolarHBondContact OD1-NE 2.79Å; D677-R680 IonicContact OD1-NH2 3.01Å; D677-R680 IonicContact OD2-CZ 2.72Å; D677-R680 IonicContact OD2-NE 3.95Å; D677-R680 PolarHBondContact OD2-NE 3.48Å; D677-R680 IonicContact OD2-NH2 2.98Å; D677-R680 PolarHBondContact OD2-NH2 3.2Å; D677-Y681 HydrophobicContact CB-CD2 4.26Å; D677-Y681 PolarHBondContact O-N 3.42Å; D677-Y681 VanDerWaalsContact O-N 3.09Å; D677-Y803 WeakPolarHBondContact OD2-CE2 3.15Å; D677-Y803 PolarHBondContact OD2-OH 2.95Å; D677-P806 HydrophobicContact CB-CG 3.95Å
678	V	92.6	Very high	93	Very high	9 Å²	9	18.5 Å²	18.5	6%	0.055	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-26.7	-173.5	-178.5	0	0	0	0	112.5	V676 E935 M937	V676-V678 PolarHBondContact O-N 2.99Å; V678-E935 HydrophobicContact CG1-CB 3.76Å; V678-E935 HydrophobicContact CG1-CG 3.84Å; V678-M937 WeakPolarHBondContact O-CG 3.49Å
679	G	93.3	Very high	92.8	Very high	1 Å²	1	21.2 Å²	21.2	1%	0.01	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-39.3	-176.8	0	0	0	0	0	114.5	D677 G941 G943	D677-G679 PolarHBondContact O-N 3.08Å; G679-G941 CarbonylContact C-O 3.16Å; G679-G941 WeakPolarHBondContact CA-O 3.28Å; G679-G943 VanDerWaalsContact CA-CA 3.41Å
680	R	95	Very high	92.5	Very high	48 Å²	48	23.6 Å²	23.6	18%	0.181	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-27	-176.2	-62.4	-174.7	-67	-178.7	-1.8	113.1	D677 A707 T708 R804	D677-R680 PolarHBondContact O-N 3.24Å; D677-R680 WeakPolarHBondContact OD1-CB 3.36Å; D677-R680 IonicContact OD1-CZ 3.35Å; D677-R680 IonicContact OD1-NE 3.09Å; D677-R680 PolarHBondContact OD1-NE 2.79Å; D677-R680 IonicContact OD1-NH2 3.01Å; D677-R680 IonicContact OD2-CZ 2.72Å; D677-R680 IonicContact OD2-NE 3.95Å; D677-R680 PolarHBondContact OD2-NE 3.48Å; D677-R680 IonicContact OD2-NH2 2.98Å; D677-R680 PolarHBondContact OD2-NH2 3.2Å; R680-A707 WeakPolarHBondContact O-CA 3.22Å; R680-T708 PolarHBondContact O-N 2.84Å; R680-T708 PolarHBondContact O-OG1 3.28Å; R680-R804 PolarHBondContact NH1-O 3.45Å; R680-R804 PolarHBondContact NH2-O 2.65Å
681	Y	95.3	Very high	92.1	Very high	9 Å²	9	23.4 Å²	23.4	4%	0.035	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	148.6	-174.2	-68.7	-73.3	0	0	0	111.7	P666 P668 D677 V705 V706 A707 Y803	P666-Y681 PolarHBondContact O-OH 2.81Å; P668-Y681 HydrophobicContact CG-CD2 3.92Å; P668-Y681 HydrophobicContact CG-CE2 3.89Å; D677-Y681 HydrophobicContact CB-CD2 4.26Å; D677-Y681 PolarHBondContact O-N 3.42Å; D677-Y681 VanDerWaalsContact O-N 3.09Å; Y681-V705 HydrophobicContact CD1-CB 4.46Å; Y681-V705 HydrophobicContact CD1-CG2 3.88Å; Y681-V705 HydrophobicContact CG-CG2 4.15Å; Y681-V706 WeakPolarHBondContact CA-O 3.29Å; Y681-A707 HydrophobicContact CD1-CB 4.31Å; Y681-A707 HydrophobicContact CE1-CB 3.97Å; Y681-Y803 HydrophobicContact CE2-CE2 4.16Å
682	V	94.6	Very high	91.4	Very high	5 Å²	5	25.7 Å²	25.7	3%	0.03	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	148.6	-178.3	62.4	0	0	0	0	109.8	L684 V705 V706 W754 R923 M937	V682-L684 PolarHBondContact O-N 3.12Å; V682-V705 CarbonylContact O-C 3.53Å; V682-V705 WeakPolarHBondContact O-CA 3.11Å; V682-V706 HydrophobicContact CG1-CG1 3.64Å; V682-V706 PolarHBondContact N-O 3.02Å; V682-V706 PolarHBondContact O-N 3.11Å; V682-W754 HydrophobicContact CB-CH2 4.16Å; V682-W754 HydrophobicContact CG1-CH2 3.14Å; V682-W754 HydrophobicContact CG1-CZ2 3.56Å; V682-W754 HydrophobicContact CG1-CZ3 4.08Å; V682-W754 HydrophobicContact CG2-CH2 4.17Å; V682-R923 VanDerWaalsContact CG2-CD 3.45Å; V682-M937 HydrophobicContact CB-CE 4.26Å; V682-M937 HydrophobicContact CB-SD 3.69Å; V682-M937 HydrophobicContact CG2-CE 3.81Å; V682-M937 HydrophobicContact CG2-SD 3.79Å
683	A	93.2	Very high	90.6	Very high	7 Å²	7	26 Å²	26	6%	0.058	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	138.5	-179.9	0	0	0	0	0	112.5	D688 H703 C704	A683-D688 HydrophobicContact CB-CB 4.06Å; A683-H703 VanDerWaalsContact CB-CE1 3.41Å; A683-H703 WeakPolarHBondContact CB-CE1 3.26Å; A683-C704 WeakPolarHBondContact CA-O 3.16Å
684	L	92.1	Very high	90	Very high	14 Å²	14	33.2 Å²	33.2	7%	0.073	18%	0.176	C	C	.	.			trans	-77.1	128	170.5	-166.2	72.7	0	0	0	109.7	V682 D686 C687 D688 C704 V706 V718 P753	V682-L684 PolarHBondContact O-N 3.12Å; L684-D686 VanDerWaalsContact C-N 3.27Å; L684-D686 WeakPolarHBondContact CD2-OD1 3.48Å; L684-D686 WeakPolarHBondContact CG-OD1 3.31Å; L684-D686 PolarHBondContact O-N 2.97Å; L684-D686 VanDerWaalsContact O-N 3.11Å; L684-C687 CarbonylContact O-C 3.54Å; L684-C687 VanDerWaalsContact O-C 3.28Å; L684-C687 PolarHBondContact O-N 2.86Å; L684-D688 PolarHBondContact O-N 3.06Å; L684-C704 HydrophobicContact CB-CB 3.99Å; L684-C704 HydrophobicContact CD2-CB 4.29Å; L684-C704 PolarHBondContact N-O 3.22Å; L684-V706 HydrophobicContact CD1-CB 4.13Å; L684-V706 HydrophobicContact CD1-CG1 4.18Å; L684-V718 HydrophobicContact CD2-CG1 4.25Å; L684-P753 HydrophobicContact CD1-CG 4.45Å
685	S	83.8	Confident	89.8	Confident	69 Å²	69	33.1 Å²	33.1	48%	0.483	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-28.9	-167.8	-55.7	0	0	0	0	115.8
686	D	85	Confident	89.5	Confident	55 Å²	55	33.7 Å²	33.7	29%	0.294	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-3	-179.4	65.5	-31.1	0	0	0	114	L684 C695	L684-D686 VanDerWaalsContact C-N 3.27Å; L684-D686 WeakPolarHBondContact CD2-OD1 3.48Å; L684-D686 WeakPolarHBondContact CG-OD1 3.31Å; L684-D686 PolarHBondContact O-N 2.97Å; L684-D686 VanDerWaalsContact O-N 3.11Å; D686-C695 PolarHBondContact O-N 3.28Å; D686-C695 VanDerWaalsContact O-N 3.15Å
687	C	92.6	Very high	89.3	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.174	C	C	.	.	S	Bend	trans	-146.3	63.9	177.8	-165.8	0	0	0	0	111.2	L684 C695 C704	L684-C687 CarbonylContact O-C 3.54Å; L684-C687 VanDerWaalsContact O-C 3.28Å; L684-C687 PolarHBondContact O-N 2.86Å; C687-C695 WeakPolarHBondContact CA-SG 3.49Å; C687-C695 HydrophobicContact CB-CB 3.78Å; C687-C695 WeakPolarHBondContact CB-SG 3.41Å; C687-C695 WeakPolarHBondContact SG-CB 3.27Å; C687-C695 CovalentContact SG-SG 2.04Å; C687-C695 PolarHBondContact SG-SG 2.59Å; C687-C704 HydrophobicContact CB-CB 4.02Å; C687-C704 PolarHBondContact O-N 2.64Å; C687-C704 PolarHBondContact SG-SG 2.84Å
688	D	91.9	Very high	89.1	Confident	3 Å²	3	34.6 Å²	34.6	2%	0.016	18%	0.175	C	C	.	.			trans	-117	123.8	-176.7	174.2	8	0	0	0	109.9	A683 L684 N690 G691 D692 H693 H703 R923 P926	A683-D688 HydrophobicContact CB-CB 4.06Å; L684-D688 PolarHBondContact O-N 3.06Å; D688-N690 PolarHBondContact O-N 3.21Å; D688-N690 VanDerWaalsContact O-N 3.1Å; D688-N690 PolarHBondContact OD1-N 3.06Å; D688-G691 CarbonylContact O-C 3.55Å; D688-G691 WeakPolarHBondContact O-CA 3.38Å; D688-G691 PolarHBondContact O-N 3.33Å; D688-D692 PolarHBondContact N-O 2.9Å; D688-H693 PolarHBondContact O-CE1 3.42Å; D688-H693 PolarHBondContact O-ND1 2.97Å; D688-H703 IonicContact OD1-CE1 2.86Å; D688-H703 PolarHBondContact OD1-CE1 2.79Å; D688-H703 IonicContact OD1-ND1 3.33Å; D688-R923 IonicContact OD1-NH2 3.73Å; D688-R923 IonicContact OD2-CZ 3.99Å; D688-R923 IonicContact OD2-NH2 3.61Å; D688-R923 PolarHBondContact OD2-NH2 3.27Å; D688-P926 VanDerWaalsContact OD2-CD 3.27Å; D688-P926 WeakPolarHBondContact OD2-CD 3.44Å; D688-P926 WeakPolarHBondContact OD2-CG 3.36Å
689	I	90.9	Very high	89	Confident	56 Å²	56	36.9 Å²	36.9	29%	0.287	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-15.4	179.6	-164.5	174.7	0	0	0	113.5	H693 Q702 H703	I689-H693 WeakPolarHBondContact CA-CE1 3.46Å; I689-H693 WeakPolarHBondContact CA-ND1 3.41Å; I689-H693 PolarHBondContact O-CE1 2.82Å; I689-H693 PolarHBondContact O-NE2 3.5Å; I689-Q702 HydrophobicContact CD1-CG 4Å; I689-Q702 HydrophobicContact CG1-CG 4.12Å; I689-H703 HydrophobicContact CB-CB 4.35Å; I689-H703 PolarHBondContact N-ND1 2.85Å; I689-H703 VanDerWaalsContact N-ND1 3.13Å
690	N	86.4	Confident	88.8	Confident	55 Å²	55	38.1 Å²	38.1	29%	0.294	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-3.5	172	-56.3	136.8	0	0	0	113.8	D688 R925 R927	D688-N690 PolarHBondContact O-N 3.21Å; D688-N690 VanDerWaalsContact O-N 3.1Å; D688-N690 PolarHBondContact OD1-N 3.06Å; N690-R925 HydrophobicContact CB-CB 4.46Å; N690-R927 VanDerWaalsContact O-CD 3.27Å; N690-R927 WeakPolarHBondContact O-CD 3.39Å; N690-R927 VanDerWaalsContact O-CG 3.25Å; N690-R927 WeakPolarHBondContact O-CG 3.2Å; N690-R927 PolarHBondContact O-NE 3.45Å; N690-R927 VanDerWaalsContact O-NE 3.16Å
691	G	85.1	Confident	88.7	Confident	15 Å²	15	36 Å²	36	16%	0.155	19%	0.191	C	C	.	.	S	Bend	trans	-125.9	-124.7	-173.3	0	0	0	0	0	113.6	D688 H693 R927	D688-G691 CarbonylContact O-C 3.55Å; D688-G691 WeakPolarHBondContact O-CA 3.38Å; D688-G691 PolarHBondContact O-N 3.33Å; G691-H693 PolarHBondContact O-CE1 3.16Å; G691-R927 PolarHBondContact O-NH2 3.41Å
692	D	78.5	Confident	88.5	Confident	65 Å²	65	37.4 Å²	37.4	35%	0.348	20%	0.198	S	C	.	.			trans	-84.3	127.4	172.7	-164.5	-16.7	0	0	0	109.3	D688 K694	D688-D692 PolarHBondContact N-O 2.9Å; D692-K694 WeakPolarHBondContact OD1-CB 3.23Å; D692-K694 WeakPolarHBondContact OD1-CD 3.46Å; D692-K694 WeakPolarHBondContact OD1-CG 3.12Å; D692-K694 PolarHBondContact OD1-N 3.12Å; D692-K694 IonicContact OD1-NZ 3.07Å; D692-K694 WeakPolarHBondContact OD2-CD 3.42Å; D692-K694 WeakPolarHBondContact OD2-CE 3.4Å; D692-K694 IonicContact OD2-NZ 2.74Å; D692-K694 PolarHBondContact OD2-NZ 3.2Å
693	H	77.7	Confident	88.5	Confident	73 Å²	73	37.7 Å²	37.7	34%	0.338	20%	0.199	S	C	.	.			trans	-107.5	18.8	-179.9	-48.5	-37.2	0	0	0	112.4	D688 I689 G691 C695 R927	D688-H693 PolarHBondContact O-CE1 3.42Å; D688-H693 PolarHBondContact O-ND1 2.97Å; I689-H693 WeakPolarHBondContact CA-CE1 3.46Å; I689-H693 WeakPolarHBondContact CA-ND1 3.41Å; I689-H693 PolarHBondContact O-CE1 2.82Å; I689-H693 PolarHBondContact O-NE2 3.5Å; G691-H693 PolarHBondContact O-CE1 3.16Å; H693-C695 VanDerWaalsContact C-N 3.32Å; H693-R927 PolarHBondContact NE2-NH2 3.48Å
694	K	83.1	Confident	88.7	Confident	152 Å²	152	37.4 Å²	37.4	66%	0.661	20%	0.196	S	C	*	.			trans	-67.4	-32.6	178.6	-76.1	167.5	-156.1	144.3	0	113	D692 Y696	D692-K694 WeakPolarHBondContact OD1-CB 3.23Å; D692-K694 WeakPolarHBondContact OD1-CD 3.46Å; D692-K694 WeakPolarHBondContact OD1-CG 3.12Å; D692-K694 PolarHBondContact OD1-N 3.12Å; D692-K694 IonicContact OD1-NZ 3.07Å; D692-K694 WeakPolarHBondContact OD2-CD 3.42Å; D692-K694 WeakPolarHBondContact OD2-CE 3.4Å; D692-K694 IonicContact OD2-NZ 2.74Å; D692-K694 PolarHBondContact OD2-NZ 3.2Å; K694-Y696 VanDerWaalsContact C-N 3.32Å; K694-Y696 PolarHBondContact O-N 3.37Å
695	C	90.1	Very high	88.8	Confident	2 Å²	2	36.9 Å²	36.9	1%	0.014	19%	0.194	C	C	.	.			trans	46	53	175.2	-56.7	0	0	0	0	112.4	D686 C687 H693 Y697 T698 Q699 A701	D686-C695 PolarHBondContact O-N 3.28Å; D686-C695 VanDerWaalsContact O-N 3.15Å; C687-C695 WeakPolarHBondContact CA-SG 3.49Å; C687-C695 HydrophobicContact CB-CB 3.78Å; C687-C695 WeakPolarHBondContact CB-SG 3.41Å; C687-C695 WeakPolarHBondContact SG-CB 3.27Å; C687-C695 CovalentContact SG-SG 2.04Å; C687-C695 PolarHBondContact SG-SG 2.59Å; H693-C695 VanDerWaalsContact C-N 3.32Å; C695-Y697 PolarHBondContact O-N 3.44Å; C695-T698 CarbonylContact O-C 3.52Å; C695-T698 PolarHBondContact O-N 3.48Å; C695-Q699 PolarHBondContact O-N 3.06Å; C695-Q699 VanDerWaalsContact O-N 3.07Å; C695-A701 PolarHBondContact SG-O 3.31Å; C695-A701 VanDerWaalsContact SG-O 3.34Å
696	Y	88.4	Confident	89.3	Confident	67 Å²	67	33.6 Å²	33.6	26%	0.263	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-44.1	-166.4	174.7	-95.3	0	0	0	113.5	R514 K694 E779	R514-Y696 WeakPolarHBondContact CD-OH 3.34Å; K694-Y696 VanDerWaalsContact C-N 3.32Å; K694-Y696 PolarHBondContact O-N 3.37Å; Y696-E779 WeakPolarHBondContact CE1-OE1 3.36Å; Y696-E779 PolarHBondContact OH-OE1 3.43Å; Y696-E779 PolarHBondContact OH-OE2 3.48Å
697	Y	90.4	Very high	89.8	Confident	17 Å²	17	31 Å²	31	7%	0.067	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-14.3	178	-62.9	-72.2	0	0	0	113.1	R514 C695 S744 L775 Y778	R514-Y697 PolarHBondContact NH1-OH 3.17Å; C695-Y697 PolarHBondContact O-N 3.44Å; Y697-S744 WeakPolarHBondContact O-CB 3.37Å; Y697-S744 PolarHBondContact O-OG 2.91Å; Y697-L775 HydrophobicContact CD1-CD2 4.39Å; Y697-L775 HydrophobicContact CD2-CD2 4Å; Y697-L775 HydrophobicContact CE1-CB 4.28Å; Y697-L775 HydrophobicContact CE1-CD2 4.32Å; Y697-L775 HydrophobicContact CE2-CD1 3.95Å; Y697-L775 HydrophobicContact CE2-CD2 3.9Å; Y697-L775 HydrophobicContact CE2-CG 4.36Å; Y697-L775 HydrophobicContact CG-CD2 4.23Å; Y697-Y778 AromaticContact CD1-CD1 3.5Å; Y697-Y778 HydrophobicContact CD1-CD1 3.5Å; Y697-Y778 VanDerWaalsContact CD1-CD1 3.5Å; Y697-Y778 AromaticContact CD1-CE1 3.82Å; Y697-Y778 HydrophobicContact CD1-CE1 3.82Å; Y697-Y778 HydrophobicContact CD1-CG 4.09Å; Y697-Y778 HydrophobicContact CE1-CD1 4.02Å; Y697-Y778 PolarHBondContact O-OH 2.94Å
698	T	91.9	Very high	89.8	Confident	4 Å²	4	31.6 Å²	31.6	3%	0.025	16%	0.161	C	C	.	.	S	Bend	trans	-130.5	47.6	-169.7	52.5	0	0	0	0	111.1	C695 G700 A701 C704 C720 S744	C695-T698 CarbonylContact O-C 3.52Å; C695-T698 PolarHBondContact O-N 3.48Å; T698-G700 PolarHBondContact O-N 3.47Å; T698-A701 WeakPolarHBondContact O-CB 3.5Å; T698-A701 PolarHBondContact O-N 2.82Å; T698-C704 PolarHBondContact OG1-SG 2.97Å; T698-C720 VanDerWaalsContact CG2-SG 3.54Å; T698-S744 CarbonylContact C-O 3.57Å; T698-S744 VanDerWaalsContact CA-O 3.23Å; T698-S744 WeakPolarHBondContact CA-O 3.32Å
699	Q	89.8	Confident	89.6	Confident	58 Å²	58	37.8 Å²	37.8	27%	0.271	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	140	-177.2	-61.7	-162.2	-61.7	0	0	111.1	C695 A701 L740 R741 Y743 S744	C695-Q699 PolarHBondContact O-N 3.06Å; C695-Q699 VanDerWaalsContact O-N 3.07Å; Q699-A701 VanDerWaalsContact C-N 3.32Å; Q699-L740 WeakPolarHBondContact CB-O 3.42Å; Q699-L740 PolarHBondContact OE1-O 3.01Å; Q699-R741 VanDerWaalsContact OE1-CA 3.25Å; Q699-Y743 CarbonylContact O-C 3.58Å; Q699-Y743 WeakPolarHBondContact O-CA 3.42Å; Q699-S744 PolarHBondContact O-N 2.99Å
700	G	88.4	Confident	89.6	Confident	26 Å²	26	36 Å²	36	27%	0.268	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	92	-19.1	-172.1	0	0	0	0	0	114.2	T698 F742	T698-G700 PolarHBondContact O-N 3.47Å; G700-F742 WeakPolarHBondContact CA-O 3.29Å
701	A	92.7	Very high	89.9	Confident	4 Å²	4	34 Å²	34	3%	0.033	17%	0.166	C	C	.	.			trans	-76.1	143.2	171.2	0	0	0	0	0	111.3	C695 T698 Q699 C720 Y721 M728	C695-A701 PolarHBondContact SG-O 3.31Å; C695-A701 VanDerWaalsContact SG-O 3.34Å; T698-A701 WeakPolarHBondContact O-CB 3.5Å; T698-A701 PolarHBondContact O-N 2.82Å; Q699-A701 VanDerWaalsContact C-N 3.32Å; A701-C720 HydrophobicContact CB-CB 3.92Å; A701-Y721 CarbonylContact C-O 3.56Å; A701-Y721 VanDerWaalsContact CA-O 3.25Å; A701-Y721 WeakPolarHBondContact CA-O 3.22Å; A701-M728 HydrophobicContact CB-SD 3.66Å
702	Q	91.9	Very high	90	Very high	39 Å²	39	40.6 Å²	40.6	18%	0.182	19%	0.187	C	C	.	.	S	Bend	trans	-92.8	-33.3	167.2	-175.4	-178.3	31.4	0	0	111.3	I689 Y721 W723	I689-Q702 HydrophobicContact CD1-CG 4Å; I689-Q702 HydrophobicContact CG1-CG 4.12Å; Q702-Y721 PolarHBondContact N-O 2.81Å; Q702-W723 HydrophobicContact CB-CD2 3.97Å; Q702-W723 HydrophobicContact CB-CE3 4.01Å; Q702-W723 HydrophobicContact CB-CG 4.4Å; Q702-W723 HydrophobicContact CB-CZ3 4.34Å; Q702-W723 HydrophobicContact CG-CD2 4.24Å; Q702-W723 HydrophobicContact CG-CE3 3.75Å; Q702-W723 HydrophobicContact CG-CH2 4.18Å; Q702-W723 HydrophobicContact CG-CZ3 3.73Å
703	H	95.3	Very high	90.5	Very high	11 Å²	11	38.1 Å²	38.1	5%	0.051	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	137.3	-177.6	-165.3	55.1	0	0	0	110.9	L671 A683 D688 I689 C720 Y721	L671-H703 HydrophobicContact CD1-CB 3.75Å; L671-H703 VanDerWaalsContact CD1-CD2 3.48Å; L671-H703 WeakPolarHBondContact CD1-CD2 3.38Å; A683-H703 VanDerWaalsContact CB-CE1 3.41Å; A683-H703 WeakPolarHBondContact CB-CE1 3.26Å; D688-H703 IonicContact OD1-CE1 2.86Å; D688-H703 PolarHBondContact OD1-CE1 2.79Å; D688-H703 IonicContact OD1-ND1 3.33Å; I689-H703 HydrophobicContact CB-CB 4.35Å; I689-H703 PolarHBondContact N-ND1 2.85Å; I689-H703 VanDerWaalsContact N-ND1 3.13Å; H703-C720 WeakPolarHBondContact O-CA 3.4Å; H703-Y721 WeakPolarHBondContact O-CD2 3.25Å; H703-Y721 PolarHBondContact O-N 3.41Å
704	C	96	Very high	91.1	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	143.8	169	-61.5	0	0	0	0	110.2	A683 L684 C687 T698 C719 C720	A683-C704 WeakPolarHBondContact CA-O 3.16Å; L684-C704 HydrophobicContact CB-CB 3.99Å; L684-C704 HydrophobicContact CD2-CB 4.29Å; L684-C704 PolarHBondContact N-O 3.22Å; C687-C704 HydrophobicContact CB-CB 4.02Å; C687-C704 PolarHBondContact O-N 2.64Å; C687-C704 PolarHBondContact SG-SG 2.84Å; T698-C704 PolarHBondContact OG1-SG 2.97Å; C704-C719 CarbonylContact C-O 3.35Å; C704-C719 VanDerWaalsContact CA-O 3.25Å; C704-C719 WeakPolarHBondContact CA-O 3.42Å; C704-C720 HydrophobicContact CB-CB 4.1Å; C704-C720 WeakPolarHBondContact CB-SG 3.48Å; C704-C720 WeakPolarHBondContact SG-CB 3.47Å; C704-C720 CovalentContact SG-SG 2.03Å; C704-C720 PolarHBondContact SG-SG 2.77Å
705	V	95.5	Very high	91.6	Very high	3 Å²	3	27.4 Å²	27.4	2%	0.018	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	145.6	170.6	-58.1	0	0	0	0	110.2	A674 Y681 V682 V718 C719 Y721	A674-V705 HydrophobicContact CB-CG1 4.1Å; A674-V705 HydrophobicContact CB-CG2 4.28Å; Y681-V705 HydrophobicContact CD1-CB 4.46Å; Y681-V705 HydrophobicContact CD1-CG2 3.88Å; Y681-V705 HydrophobicContact CG-CG2 4.15Å; V682-V705 CarbonylContact O-C 3.53Å; V682-V705 WeakPolarHBondContact O-CA 3.11Å; V705-V718 CarbonylContact O-C 3.22Å; V705-V718 WeakPolarHBondContact O-CA 3.42Å; V705-C719 HydrophobicContact CG2-CB 3.9Å; V705-C719 PolarHBondContact N-O 3.31Å; V705-C719 PolarHBondContact O-N 3.34Å; V705-Y721 HydrophobicContact CG2-CE2 4.04Å
706	V	94.8	Very high	91.8	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	146.4	169.4	62.1	0	0	0	0	108.4	Y681 V682 L684 T708 Q717 V718 W754	Y681-V706 WeakPolarHBondContact CA-O 3.29Å; V682-V706 HydrophobicContact CG1-CG1 3.64Å; V682-V706 PolarHBondContact N-O 3.02Å; V682-V706 PolarHBondContact O-N 3.11Å; L684-V706 HydrophobicContact CD1-CB 4.13Å; L684-V706 HydrophobicContact CD1-CG1 4.18Å; V706-T708 PolarHBondContact O-N 2.9Å; V706-Q717 CarbonylContact C-O 3.56Å; V706-Q717 VanDerWaalsContact CA-O 3.32Å; V706-Q717 WeakPolarHBondContact CA-O 3.49Å; V706-V718 HydrophobicContact CB-CG2 4.15Å; V706-V718 HydrophobicContact CG2-CG2 3.88Å; V706-W754 HydrophobicContact CG1-CZ2 4.16Å
707	A	94.4	Very high	92	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	132.1	171	0	0	0	0	0	109.2	R680 Y681 R709 Q717 H752	R680-A707 WeakPolarHBondContact O-CA 3.22Å; Y681-A707 HydrophobicContact CD1-CB 4.31Å; Y681-A707 HydrophobicContact CE1-CB 3.97Å; A707-R709 PolarHBondContact O-N 3.31Å; A707-R709 VanDerWaalsContact O-N 3.11Å; A707-Q717 HydrophobicContact CB-CB 4.23Å; A707-Q717 PolarHBondContact N-O 3.22Å; A707-H752 PolarHBondContact O-NE2 3.2Å
708	T	92.2	Very high	92.2	Very high	14 Å²	14	23.3 Å²	23.3	9%	0.086	11%	0.11	C	C	.	.	S	Bend	trans	-61.3	-25.8	-177.1	-52.3	0	0	0	0	112.5	R680 V706 W754 M937	R680-T708 PolarHBondContact O-N 2.84Å; R680-T708 PolarHBondContact O-OG1 3.28Å; V706-T708 PolarHBondContact O-N 2.9Å; T708-W754 HydrophobicContact CG2-CZ3 4.04Å; T708-M937 HydrophobicContact CG2-CB 3.9Å; T708-M937 HydrophobicContact CG2-CE 4.4Å; T708-M937 HydrophobicContact CG2-SD 4Å
709	R	88.6	Confident	92.3	Very high	132 Å²	132	23.2 Å²	23.2	50%	0.498	11%	0.109	S	C	.	.	S	Bend	trans	-118.7	146.2	-176.1	-175.2	-179.5	65.2	-162.2	-2.7	110.9	Q665 A707 D939	Q665-R709 PolarHBondContact NE2-O 3.27Å; A707-R709 PolarHBondContact O-N 3.31Å; A707-R709 VanDerWaalsContact O-N 3.11Å; R709-D939 PolarHBondContact NH1-O 2.79Å
710	S	91.3	Very high	92.6	Very high	19 Å²	19	20.4 Å²	20.4	13%	0.133	10%	0.096	C	C	.	.			trans	-87.8	153.6	167.9	67	0	0	0	0	112.7	A715 S756	S710-A715 CarbonylContact C-O 3.33Å; S710-A715 WeakPolarHBondContact CA-O 3.35Å; S710-A715 VanDerWaalsContact CB-O 3.29Å; S710-A715 WeakPolarHBondContact CB-O 3.35Å; S710-S756 WeakPolarHBondContact OG-CB 3.14Å; S710-S756 PolarHBondContact OG-OG 3.06Å
711	V	91.2	Very high	92.9	Very high	14 Å²	14	19.2 Å²	19.2	9%	0.085	8%	0.084	C	C	.	.			trans	-72.7	169	164.3	-66.2	0	0	0	0	111	F660 L661 T713 G714 A715	F660-V711 HydrophobicContact CB-CG2 4.3Å; L661-V711 HydrophobicContact CD2-CB 4.47Å; L661-V711 HydrophobicContact CD2-CG1 3.79Å; L661-V711 HydrophobicContact CD2-CG2 3.84Å; L661-V711 HydrophobicContact CG-CG2 4.29Å; V711-T713 WeakPolarHBondContact CG2-OG1 3.46Å; V711-T713 PolarHBondContact O-N 2.73Å; V711-G714 WeakPolarHBondContact O-CA 3.49Å; V711-G714 PolarHBondContact O-N 2.95Å; V711-A715 HydrophobicContact CG2-CB 3.76Å; V711-A715 WeakPolarHBondContact CG2-O 3.45Å; V711-A715 PolarHBondContact N-O 3.16Å
712	W	87.4	Confident	92.8	Very high	153 Å²	153	19.9 Å²	19.9	58%	0.58	9%	0.087	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-23.6	-175.5	74.6	-80.8	0	0	0	114.2	E655 F660 G714 Y764	E655-W712 WeakPolarHBondContact OE1-CH2 3.22Å; E655-W712 WeakPolarHBondContact OE1-CZ2 3.26Å; F660-W712 HydrophobicContact CD1-CZ2 4.47Å; F660-W712 AromaticContact CD1-NE1 3.18Å; F660-W712 AromaticContact CE1-CE2 3.9Å; F660-W712 AromaticContact CE1-CZ2 3.85Å; F660-W712 HydrophobicContact CE1-CZ2 3.85Å; F660-W712 AromaticContact CE1-NE1 3.33Å; F660-W712 VanDerWaalsContact CE1-NE1 3.33Å; F660-W712 AromaticContact CE2-CZ2 3.9Å; F660-W712 HydrophobicContact CE2-CZ2 3.9Å; F660-W712 AromaticContact CG-NE1 3.57Å; F660-W712 AromaticContact CZ-CZ2 3.53Å; F660-W712 HydrophobicContact CZ-CZ2 3.53Å; F660-W712 AromaticContact CZ-NE1 3.85Å; W712-G714 PolarHBondContact O-N 2.88Å; W712-Y764 PolarHBondContact O-OH 2.92Å; W712-Y764 VanDerWaalsContact O-OH 3.07Å
713	T	89.7	Confident	92.7	Very high	12 Å²	12	25.5 Å²	25.5	7%	0.074	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-4.4	174.4	64.4	0	0	0	0	113.6	F660 V711	F660-T713 HydrophobicContact CD2-CG2 3.73Å; F660-T713 HydrophobicContact CE2-CG2 4.06Å; F660-T713 HydrophobicContact CG-CG2 4.29Å; V711-T713 WeakPolarHBondContact CG2-OG1 3.46Å; V711-T713 PolarHBondContact O-N 2.73Å
714	G	90.6	Very high	92.4	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.01	13%	0.134	C	C	.	.	S	Bend	trans	87.9	0.3	-175	0	0	0	0	0	114.4	V711 W712 R750 H752 Y764	V711-G714 WeakPolarHBondContact O-CA 3.49Å; V711-G714 PolarHBondContact O-N 2.95Å; W712-G714 PolarHBondContact O-N 2.88Å; G714-R750 CarbonylContact C-O 3.46Å; G714-H752 WeakPolarHBondContact O-CB 3.42Å; G714-H752 PolarHBondContact O-N 3.2Å; G714-Y764 VanDerWaalsContact CA-CE1 3.47Å
715	A	93.4	Very high	92.2	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	14%	0.139	C	C	.	.			trans	-82	158.8	-176.3	0	0	0	0	0	113.2	F657 L661 S710 V711 Y749 R750	F657-A715 HydrophobicContact CB-CB 4.04Å; F657-A715 HydrophobicContact CD2-CB 3.33Å; F657-A715 HydrophobicContact CE2-CB 4.07Å; F657-A715 HydrophobicContact CG-CB 3.99Å; L661-A715 HydrophobicContact CD1-CB 4.04Å; L661-A715 HydrophobicContact CD2-CB 4.44Å; L661-A715 HydrophobicContact CG-CB 4.34Å; S710-A715 CarbonylContact C-O 3.33Å; S710-A715 WeakPolarHBondContact CA-O 3.35Å; S710-A715 VanDerWaalsContact CB-O 3.29Å; S710-A715 WeakPolarHBondContact CB-O 3.35Å; V711-A715 HydrophobicContact CG2-CB 3.76Å; V711-A715 WeakPolarHBondContact CG2-O 3.45Å; V711-A715 PolarHBondContact N-O 3.16Å; A715-Y749 VanDerWaalsContact CA-O 3.27Å; A715-Y749 WeakPolarHBondContact CA-O 3.32Å; A715-Y749 VanDerWaalsContact CB-O 3.27Å; A715-Y749 WeakPolarHBondContact CB-O 3.43Å; A715-R750 WeakPolarHBondContact CA-O 3.49Å; A715-R750 WeakPolarHBondContact CB-O 3.46Å; A715-R750 PolarHBondContact N-O 2.83Å
716	G	93.2	Very high	92	Very high	0 Å²	0	35 Å²	35	0%	0	15%	0.15	C	C	.	.	B	Isolated β-bridge	trans	-144.5	147.1	-179.6	0	0	0	0	0	113.1	Y749	G716-Y749 PolarHBondContact N-O 2.96Å; G716-Y749 PolarHBondContact O-N 3.15Å
717	Q	93.6	Very high	91.9	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	15%	0.151	C	C	.	.			trans	-82.7	133.8	175.8	-167.6	64.6	37.9	0	0	111	Q665 C667 V706 A707 S798	Q665-Q717 HydrophobicContact CB-CB 4.07Å; Q665-Q717 VanDerWaalsContact O-CG 3.28Å; Q665-Q717 WeakPolarHBondContact O-CG 3.39Å; C667-Q717 PolarHBondContact SG-NE2 3.19Å; V706-Q717 CarbonylContact C-O 3.56Å; V706-Q717 VanDerWaalsContact CA-O 3.32Å; V706-Q717 WeakPolarHBondContact CA-O 3.49Å; A707-Q717 HydrophobicContact CB-CB 4.23Å; A707-Q717 PolarHBondContact N-O 3.22Å; Q717-S798 PolarHBondContact NE2-OG 2.86Å; Q717-S798 PolarHBondContact OE1-OG 2.81Å
718	V	95.2	Very high	91.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	132.7	166.7	-177.9	0	0	0	0	109.2	L684 V705 V706 V747 Y749	L684-V718 HydrophobicContact CD2-CG1 4.25Å; V705-V718 CarbonylContact O-C 3.22Å; V705-V718 WeakPolarHBondContact O-CA 3.42Å; V706-V718 HydrophobicContact CB-CG2 4.15Å; V706-V718 HydrophobicContact CG2-CG2 3.88Å; V718-V747 WeakPolarHBondContact CB-O 3.23Å; V718-Y749 HydrophobicContact CG2-CD2 3.53Å; V718-Y749 HydrophobicContact CG2-CE2 3.56Å; V718-Y749 HydrophobicContact CG2-CG 4.27Å
719	C	94.4	Very high	91.7	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.007	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	129.5	-177.1	-46.7	0	0	0	0	108.3	C667 C704 V705 Y721 L727	C667-C719 WeakPolarHBondContact CA-SG 3.34Å; C667-C719 HydrophobicContact CB-CB 3.76Å; C667-C719 WeakPolarHBondContact CB-SG 3.49Å; C667-C719 WeakPolarHBondContact SG-CB 3.37Å; C667-C719 CovalentContact SG-SG 2.03Å; C667-C719 PolarHBondContact SG-SG 3.06Å; C704-C719 CarbonylContact C-O 3.35Å; C704-C719 VanDerWaalsContact CA-O 3.25Å; C704-C719 WeakPolarHBondContact CA-O 3.42Å; V705-C719 HydrophobicContact CG2-CB 3.9Å; V705-C719 PolarHBondContact N-O 3.31Å; V705-C719 PolarHBondContact O-N 3.34Å; C719-Y721 HydrophobicContact CB-CE2 4.4Å; C719-L727 HydrophobicContact CB-CD1 3.86Å
720	C	94.9	Very high	91.7	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	145.8	-178.3	-66.2	0	0	0	0	110.9	T698 A701 H703 C704 M728 G746	T698-C720 VanDerWaalsContact CG2-SG 3.54Å; A701-C720 HydrophobicContact CB-CB 3.92Å; H703-C720 WeakPolarHBondContact O-CA 3.4Å; C704-C720 HydrophobicContact CB-CB 4.1Å; C704-C720 WeakPolarHBondContact CB-SG 3.48Å; C704-C720 WeakPolarHBondContact SG-CB 3.47Å; C704-C720 CovalentContact SG-SG 2.03Å; C704-C720 PolarHBondContact SG-SG 2.77Å; C720-M728 HydrophobicContact CB-SD 4.27Å; C720-M728 PolarHBondContact O-N 3.2Å; C720-G746 WeakPolarHBondContact SG-CA 3.47Å
721	Y	93.9	Very high	91.4	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	137.6	-175.3	-51.9	-86.2	0	0	0	110.6	P668 T670 L671 A674 A701 Q702 H703 V705 C719 W726 L727	P668-Y721 VanDerWaalsContact CB-OH 3.31Å; P668-Y721 WeakPolarHBondContact CB-OH 3.45Å; P668-Y721 VanDerWaalsContact CD-OH 3.3Å; P668-Y721 WeakPolarHBondContact CD-OH 3.45Å; P668-Y721 WeakPolarHBondContact CG-OH 3.43Å; P668-Y721 WeakPolarHBondContact O-CE1 3.32Å; P668-Y721 PolarHBondContact O-OH 2.8Å; T670-Y721 VanDerWaalsContact C-CE1 3.46Å; L671-Y721 HydrophobicContact CB-CD1 4.2Å; L671-Y721 HydrophobicContact CB-CD2 4.38Å; L671-Y721 HydrophobicContact CB-CG 3.93Å; L671-Y721 HydrophobicContact CD1-CD2 3.81Å; L671-Y721 HydrophobicContact CD1-CE2 4.46Å; L671-Y721 HydrophobicContact CD1-CG 4.16Å; A674-Y721 HydrophobicContact CB-CE2 3.62Å; A674-Y721 WeakPolarHBondContact CB-OH 3.43Å; A701-Y721 CarbonylContact C-O 3.56Å; A701-Y721 VanDerWaalsContact CA-O 3.25Å; A701-Y721 WeakPolarHBondContact CA-O 3.22Å; Q702-Y721 PolarHBondContact N-O 2.81Å; H703-Y721 WeakPolarHBondContact O-CD2 3.25Å; H703-Y721 PolarHBondContact O-N 3.41Å; V705-Y721 HydrophobicContact CG2-CE2 4.04Å; C719-Y721 HydrophobicContact CB-CE2 4.4Å; Y721-W726 VanDerWaalsContact CA-O 3.26Å; Y721-W726 WeakPolarHBondContact CA-O 3.3Å; Y721-L727 HydrophobicContact CD1-CB 4.24Å; Y721-L727 HydrophobicContact CE1-CB 4.03Å; Y721-L727 HydrophobicContact CE1-CD1 4.01Å
722	D	91.1	Very high	91.1	Very high	18 Å²	18	28.9 Å²	28.9	10%	0.096	12%	0.124	C	C	.	.			trans	-70.7	179.7	174.4	70.3	13.2	0	0	0	112.1	Q724 G725 W726 M728	D722-Q724 PolarHBondContact O-N 3.13Å; D722-Q724 VanDerWaalsContact O-N 3.16Å; D722-Q724 WeakPolarHBondContact OD1-CA 3.35Å; D722-Q724 WeakPolarHBondContact OD1-CB 3.11Å; D722-Q724 PolarHBondContact OD1-N 3.34Å; D722-G725 PolarHBondContact O-N 2.7Å; D722-G725 PolarHBondContact OD1-N 2.74Å; D722-W726 PolarHBondContact N-O 2.96Å; D722-W726 PolarHBondContact OD1-N 2.8Å; D722-M728 HydrophobicContact CB-CG 4.26Å; D722-M728 HydrophobicContact CB-SD 4.4Å
723	W	89.5	Confident	90.9	Very high	157 Å²	157	22.6 Å²	22.6	60%	0.595	10%	0.101	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-10.9	179.8	-66.5	89.4	0	0	0	114.3	Q702	Q702-W723 HydrophobicContact CB-CD2 3.97Å; Q702-W723 HydrophobicContact CB-CE3 4.01Å; Q702-W723 HydrophobicContact CB-CG 4.4Å; Q702-W723 HydrophobicContact CB-CZ3 4.34Å; Q702-W723 HydrophobicContact CG-CD2 4.24Å; Q702-W723 HydrophobicContact CG-CE3 3.75Å; Q702-W723 HydrophobicContact CG-CH2 4.18Å; Q702-W723 HydrophobicContact CG-CZ3 3.73Å
724	Q	90.8	Very high	90.3	Very high	135 Å²	135	24 Å²	24	63%	0.631	11%	0.106	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-1.7	174.9	-62	97	-56.7	0	0	111.9	D722	D722-Q724 PolarHBondContact O-N 3.13Å; D722-Q724 VanDerWaalsContact O-N 3.16Å; D722-Q724 WeakPolarHBondContact OD1-CA 3.35Å; D722-Q724 WeakPolarHBondContact OD1-CB 3.11Å; D722-Q724 PolarHBondContact OD1-N 3.34Å
725	G	91.5	Very high	89.5	Confident	10 Å²	10	28.1 Å²	28.1	10%	0.103	12%	0.124	C	C	.	.	S	Bend	trans	85.7	15.1	177.6	0	0	0	0	0	114.9	T670 L671 D722	T670-G725 CarbonylContact C-O 3.55Å; T670-G725 WeakPolarHBondContact CA-O 3.44Å; L671-G725 PolarHBondContact N-O 3.37Å; D722-G725 PolarHBondContact O-N 2.7Å; D722-G725 PolarHBondContact OD1-N 2.74Å
726	W	91.2	Very high	88.4	Confident	68 Å²	68	31.7 Å²	31.7	26%	0.258	14%	0.143	S	C	.	.	B	Isolated β-bridge	trans	-91.3	138.7	179.3	-56.1	113.2	0	0	0	112.3	T670 Y721 D722 M728 N1157 L1160	T670-W726 HydrophobicContact CG2-CE3 4.16Å; T670-W726 HydrophobicContact CG2-CZ3 3.93Å; Y721-W726 VanDerWaalsContact CA-O 3.26Å; Y721-W726 WeakPolarHBondContact CA-O 3.3Å; D722-W726 PolarHBondContact N-O 2.96Å; D722-W726 PolarHBondContact OD1-N 2.8Å; W726-M728 PolarHBondContact O-N 3.26Å; W726-N1157 VanDerWaalsContact CD1-N 3.34Å; W726-N1157 HydrophobicContact CD2-CB 4.39Å; W726-N1157 HydrophobicContact CZ2-CB 4.3Å; W726-L1160 HydrophobicContact CE3-CD1 4.15Å; W726-L1160 HydrophobicContact CH2-CD1 4.4Å; W726-L1160 HydrophobicContact CZ3-CD1 3.54Å
727	L	92.4	Very high	86.9	Confident	5 Å²	5	38.4 Å²	38.4	3%	0.026	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-60.3	125.4	175.1	178.7	64.7	0	0	0	111.1	C667 C669 C719 Y721 F729 C800 N1158	C667-L727 HydrophobicContact CB-CD1 3.94Å; C667-L727 HydrophobicContact CB-CD2 3.64Å; C667-L727 HydrophobicContact CB-CG 4.48Å; C669-L727 PolarHBondContact O-N 3.01Å; C719-L727 HydrophobicContact CB-CD1 3.86Å; Y721-L727 HydrophobicContact CD1-CB 4.24Å; Y721-L727 HydrophobicContact CE1-CB 4.03Å; Y721-L727 HydrophobicContact CE1-CD1 4.01Å; L727-F729 HydrophobicContact CB-CE2 4.24Å; L727-F729 HydrophobicContact CD2-CE1 4.23Å; L727-F729 HydrophobicContact CD2-CE2 4.08Å; L727-F729 HydrophobicContact CD2-CZ 3.63Å; L727-F729 HydrophobicContact CG-CE2 4.02Å; L727-F729 HydrophobicContact CG-CZ 4.07Å; L727-F729 VanDerWaalsContact O-CD2 3.31Å; L727-F729 WeakPolarHBondContact O-CD2 3.41Å; L727-F729 VanDerWaalsContact O-CE2 3.32Å; L727-F729 WeakPolarHBondContact O-CE2 3.27Å; L727-C800 HydrophobicContact CD2-CB 4.31Å; L727-N1158 PolarHBondContact O-ND2 3.11Å
728	M	92	Very high	85.9	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.01	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-86.7	140.6	179.2	-60.2	170.6	71.6	0	0	111.6	A701 C720 D722 W726 Y743 S744 A745	A701-M728 HydrophobicContact CB-SD 3.66Å; C720-M728 HydrophobicContact CB-SD 4.27Å; C720-M728 PolarHBondContact O-N 3.2Å; D722-M728 HydrophobicContact CB-CG 4.26Å; D722-M728 HydrophobicContact CB-SD 4.4Å; W726-M728 PolarHBondContact O-N 3.26Å; M728-Y743 HydrophobicContact CB-CE2 4.31Å; M728-Y743 HydrophobicContact CE-CD2 3.61Å; M728-Y743 HydrophobicContact CE-CE2 3.6Å; M728-Y743 HydrophobicContact CE-CG 4.12Å; M728-Y743 HydrophobicContact CG-CE2 4.25Å; M728-S744 WeakPolarHBondContact CE-O 3.4Å; M728-A745 HydrophobicContact CB-CB 3.86Å
729	F	90.2	Very high	85	Confident	3 Å²	3	44.7 Å²	44.7	1%	0.013	21%	0.207	C	C	.	.			trans	-118.6	135.3	-177	-71.6	-86.8	0	0	0	112.6	L727 Q731 D732 Y743 P1143 N1158 Y1159	L727-F729 HydrophobicContact CB-CE2 4.24Å; L727-F729 HydrophobicContact CD2-CE1 4.23Å; L727-F729 HydrophobicContact CD2-CE2 4.08Å; L727-F729 HydrophobicContact CD2-CZ 3.63Å; L727-F729 HydrophobicContact CG-CE2 4.02Å; L727-F729 HydrophobicContact CG-CZ 4.07Å; L727-F729 VanDerWaalsContact O-CD2 3.31Å; L727-F729 WeakPolarHBondContact O-CD2 3.41Å; L727-F729 VanDerWaalsContact O-CE2 3.32Å; L727-F729 WeakPolarHBondContact O-CE2 3.27Å; F729-Q731 PolarHBondContact O-N 2.99Å; F729-D732 WeakPolarHBondContact O-CB 3.5Å; F729-D732 PolarHBondContact O-N 3.29Å; F729-Y743 PolarHBondContact N-OH 3.04Å; F729-Y743 WeakPolarHBondContact O-CE1 3.03Å; F729-Y743 PolarHBondContact O-OH 3.35Å; F729-P1143 HydrophobicContact CD1-CB 3.74Å; F729-P1143 HydrophobicContact CD1-CG 3.81Å; F729-P1143 HydrophobicContact CE1-CB 4.08Å; F729-P1143 HydrophobicContact CE1-CG 3.87Å; F729-P1143 HydrophobicContact CG-CB 4.23Å; F729-N1158 HydrophobicContact CD2-CB 3.88Å; F729-N1158 HydrophobicContact CE2-CB 3.6Å; F729-Y1159 HydrophobicContact CB-CE2 4.29Å; F729-Y1159 HydrophobicContact CD1-CE2 4.4Å; F729-Y1159 AromaticContact CD2-CD2 3.77Å; F729-Y1159 HydrophobicContact CD2-CD2 3.77Å; F729-Y1159 AromaticContact CD2-CE2 3.65Å; F729-Y1159 HydrophobicContact CD2-CE2 3.65Å; F729-Y1159 HydrophobicContact CE1-CD2 4.45Å; F729-Y1159 AromaticContact CE2-CD2 3.65Å; F729-Y1159 HydrophobicContact CE2-CD2 3.65Å; F729-Y1159 HydrophobicContact CE2-CE2 4.06Å; F729-Y1159 HydrophobicContact CG-CD2 4.24Å; F729-Y1159 AromaticContact CG-CE2 3.85Å; F729-Y1159 HydrophobicContact CG-CE2 3.85Å; F729-Y1159 HydrophobicContact CZ-CD2 4Å
730	S	88.4	Confident	84.4	Confident	6 Å²	6	45.2 Å²	45.2	4%	0.042	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-67.3	-23.3	175.4	63.9	0	0	0	0	113.1	D732 Y733 I796 S797	S730-D732 PolarHBondContact O-N 2.75Å; S730-Y733 WeakPolarHBondContact O-CB 3.25Å; S730-Y733 PolarHBondContact O-N 2.67Å; S730-Y733 VanDerWaalsContact O-N 3.12Å; S730-I796 WeakPolarHBondContact OG-CA 3.5Å; S730-S797 WeakPolarHBondContact CB-OG 3.49Å; S730-S797 PolarHBondContact N-OG 3Å; S730-S797 PolarHBondContact OG-N 2.9Å; S730-S797 PolarHBondContact OG-OG 2.81Å
731	Q	85.7	Confident	83.7	Confident	29 Å²	29	52.6 Å²	52.6	14%	0.136	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-65.3	-20.7	174.2	-59.6	89.1	-29.2	0	0	112.8	F729 Y733 I796 S797 P1143 K1146	F729-Q731 PolarHBondContact O-N 2.99Å; Q731-Y733 VanDerWaalsContact C-N 3.25Å; Q731-Y733 PolarHBondContact O-N 2.9Å; Q731-I796 HydrophobicContact CG-CD1 4.02Å; Q731-I796 HydrophobicContact CG-CG1 4.11Å; Q731-S797 PolarHBondContact NE2-O 3.14Å; Q731-P1143 HydrophobicContact CB-CB 4.36Å; Q731-P1143 HydrophobicContact CG-CB 4.2Å; Q731-P1143 HydrophobicContact CG-CG 4.5Å; Q731-K1146 WeakPolarHBondContact O-CE 3.2Å
732	D	84.4	Confident	83.2	Confident	6 Å²	6	59.7 Å²	59.7	3%	0.032	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-82.6	-2.7	176.3	-67	-29.2	0	0	0	112.6	F729 S730 E734 Y739 Y743 K1146 K1152 Y1159	F729-D732 WeakPolarHBondContact O-CB 3.5Å; F729-D732 PolarHBondContact O-N 3.29Å; S730-D732 PolarHBondContact O-N 2.75Å; D732-E734 PolarHBondContact O-N 2.86Å; D732-Y739 PolarHBondContact O-OH 2.96Å; D732-Y743 HydrophobicContact CB-CE1 4.18Å; D732-K1146 PolarHBondContact O-NZ 3.15Å; D732-K1152 WeakPolarHBondContact OD1-CD 3.26Å; D732-K1152 IonicContact OD1-NZ 3.53Å; D732-K1152 PolarHBondContact OD1-NZ 2.96Å; D732-K1152 IonicContact OD2-NZ 2.94Å; D732-K1152 PolarHBondContact OD2-NZ 3.3Å; D732-Y1159 PolarHBondContact OD1-OH 2.79Å
733	Y	82.4	Confident	83	Confident	22 Å²	22	60.3 Å²	60.3	9%	0.086	27%	0.27	C	S	.	.			trans	-53.6	135.8	175.3	171.1	-106.3	0	0	0	112.7	S730 Q731 F735 Y739 L740 C788 F792 K1146	S730-Y733 WeakPolarHBondContact O-CB 3.25Å; S730-Y733 PolarHBondContact O-N 2.67Å; S730-Y733 VanDerWaalsContact O-N 3.12Å; Q731-Y733 VanDerWaalsContact C-N 3.25Å; Q731-Y733 PolarHBondContact O-N 2.9Å; Y733-F735 HydrophobicContact CE1-CD1 4.37Å; Y733-F735 HydrophobicContact CE1-CE1 4.46Å; Y733-F735 HydrophobicContact CE1-CG 4.49Å; Y733-Y739 AromaticContact CD2-CD1 3.87Å; Y733-Y739 HydrophobicContact CD2-CD1 3.87Å; Y733-Y739 HydrophobicContact CD2-CE1 4.31Å; Y733-Y739 HydrophobicContact CE2-CD1 4.28Å; Y733-L740 HydrophobicContact CD2-CD2 4.29Å; Y733-L740 HydrophobicContact CE2-CD2 4Å; Y733-L740 HydrophobicContact CE2-CG 4.45Å; Y733-C788 HydrophobicContact CD2-CB 4.49Å; Y733-C788 HydrophobicContact CE1-CB 3.96Å; Y733-C788 HydrophobicContact CE2-CB 3.79Å; Y733-C788 VanDerWaalsContact CZ-CB 3.5Å; Y733-F792 HydrophobicContact CD1-CD2 4.06Å; Y733-F792 HydrophobicContact CD1-CE2 4.46Å; Y733-F792 HydrophobicContact CD2-CD2 4Å; Y733-F792 AromaticContact CD2-CE2 3.57Å; Y733-F792 HydrophobicContact CD2-CE2 3.57Å; Y733-F792 HydrophobicContact CE2-CE2 4.21Å; Y733-F792 AromaticContact CG-CD2 3.67Å; Y733-F792 HydrophobicContact CG-CD2 3.67Å; Y733-F792 AromaticContact CG-CE2 3.72Å; Y733-F792 HydrophobicContact CG-CE2 3.72Å; Y733-K1146 WeakPolarHBondContact O-CE 3.35Å; Y733-K1146 PolarHBondContact O-NZ 3.46Å
734	E	78.8	Confident	83	Confident	40 Å²	40	52.9 Å²	52.9	19%	0.187	24%	0.242	C	C	.	.			trans	-113.7	141.4	176.4	-68.5	-178.7	-179.7	0	0	111.3	D732 N736 Y739 K1146 L1151	D732-E734 PolarHBondContact O-N 2.86Å; E734-N736 VanDerWaalsContact C-N 3.31Å; E734-N736 PolarHBondContact O-N 3.36Å; E734-Y739 HydrophobicContact CB-CD1 4.34Å; E734-Y739 HydrophobicContact CB-CD2 3.77Å; E734-Y739 HydrophobicContact CB-CE1 4.36Å; E734-Y739 HydrophobicContact CB-CE2 3.81Å; E734-Y739 HydrophobicContact CB-CG 4.05Å; E734-Y739 HydrophobicContact CG-CD2 4.37Å; E734-Y739 HydrophobicContact CG-CE2 3.91Å; E734-K1146 IonicContact OE1-NZ 3.02Å; E734-L1151 HydrophobicContact CG-CD2 4.3Å; E734-L1151 VanDerWaalsContact OE1-CD2 3.29Å; E734-L1151 WeakPolarHBondContact OE1-CD2 3.47Å; E734-L1151 VanDerWaalsContact OE2-CD2 3.26Å; E734-L1151 WeakPolarHBondContact OE2-CD2 3.39Å
735	F	72	Confident	82.9	Confident	89 Å²	89	46.6 Å²	46.6	39%	0.39	21%	0.213	S	C	.	.	S	Bend	trans	-71.7	86.2	174.9	-69.2	-91.1	0	0	0	109.9	Y733 E789 I1148	Y733-F735 HydrophobicContact CE1-CD1 4.37Å; Y733-F735 HydrophobicContact CE1-CE1 4.46Å; Y733-F735 HydrophobicContact CE1-CG 4.49Å; F735-E789 HydrophobicContact CE1-CB 3.84Å; F735-E789 HydrophobicContact CE1-CG 3.86Å; F735-E789 WeakPolarHBondContact CE1-OE2 3.47Å; F735-E789 HydrophobicContact CZ-CB 3.76Å; F735-E789 HydrophobicContact CZ-CG 4.12Å; F735-I1148 HydrophobicContact CD2-CG1 4.24Å; F735-I1148 HydrophobicContact CD2-CG2 4.3Å; F735-I1148 HydrophobicContact CE2-CD1 4.37Å; F735-I1148 HydrophobicContact CE2-CG1 3.72Å; F735-I1148 HydrophobicContact CZ-CD1 4.34Å; F735-I1148 HydrophobicContact CZ-CG1 4.16Å
736	N	70.2	Confident	82.9	Confident	75 Å²	75	46.2 Å²	46.2	40%	0.401	21%	0.209	S	C	.	.			trans	-154	132.2	172.4	177.4	-24.5	0	0	0	108.5	E734 Q738 Y739	E734-N736 VanDerWaalsContact C-N 3.31Å; E734-N736 PolarHBondContact O-N 3.36Å; N736-Q738 PolarHBondContact O-N 3.41Å; N736-Q738 VanDerWaalsContact O-N 3.14Å; N736-Q738 PolarHBondContact OD1-N 3.23Å; N736-Y739 VanDerWaalsContact O-CB 3.31Å; N736-Y739 WeakPolarHBondContact O-CB 3.41Å; N736-Y739 PolarHBondContact O-N 3.13Å
737	D	63	Low	83.1	Confident	141 Å²	141	43.2 Å²	43.2	75%	0.754	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-22.3	-177.6	66.1	-33.8	0	0	0	113.3
738	Q	72	Confident	83.2	Confident	92 Å²	92	43 Å²	43	43%	0.43	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-11.7	176.7	-58	-174.7	12.5	0	0	113.7	N736 L740 R741	N736-Q738 PolarHBondContact O-N 3.41Å; N736-Q738 VanDerWaalsContact O-N 3.14Å; N736-Q738 PolarHBondContact OD1-N 3.23Å; Q738-L740 VanDerWaalsContact C-N 3.34Å; Q738-L740 PolarHBondContact O-N 3.04Å; Q738-R741 WeakPolarHBondContact O-CB 3.31Å; Q738-R741 WeakPolarHBondContact O-CG 2.99Å; Q738-R741 PolarHBondContact O-N 2.51Å
739	Y	75.8	Confident	83.3	Confident	39 Å²	39	43.3 Å²	43.3	15%	0.153	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-61.8	-42.1	-170.9	-167.2	-103.9	0	0	0	112.6	D732 Y733 E734 N736 R741 F742 Y743	D732-Y739 PolarHBondContact O-OH 2.96Å; Y733-Y739 AromaticContact CD2-CD1 3.87Å; Y733-Y739 HydrophobicContact CD2-CD1 3.87Å; Y733-Y739 HydrophobicContact CD2-CE1 4.31Å; Y733-Y739 HydrophobicContact CE2-CD1 4.28Å; E734-Y739 HydrophobicContact CB-CD1 4.34Å; E734-Y739 HydrophobicContact CB-CD2 3.77Å; E734-Y739 HydrophobicContact CB-CE1 4.36Å; E734-Y739 HydrophobicContact CB-CE2 3.81Å; E734-Y739 HydrophobicContact CB-CG 4.05Å; E734-Y739 HydrophobicContact CG-CD2 4.37Å; E734-Y739 HydrophobicContact CG-CE2 3.91Å; N736-Y739 VanDerWaalsContact O-CB 3.31Å; N736-Y739 WeakPolarHBondContact O-CB 3.41Å; N736-Y739 PolarHBondContact O-N 3.13Å; Y739-R741 PolarHBondContact O-N 2.84Å; Y739-F742 PolarHBondContact O-N 2.73Å; Y739-Y743 HydrophobicContact CD1-CD1 4.44Å; Y739-Y743 AromaticContact CE1-CD1 3.45Å; Y739-Y743 HydrophobicContact CE1-CD1 3.45Å; Y739-Y743 VanDerWaalsContact CE1-CD1 3.45Å; Y739-Y743 HydrophobicContact CE1-CE1 4.37Å; Y739-Y743 AromaticContact CE1-CG 3.82Å; Y739-Y743 HydrophobicContact CE1-CG 3.82Å; Y739-Y743 AromaticContact CZ-CD1 3.93Å; Y739-Y743 AromaticContact CZ-CG 3.94Å; Y739-Y743 PolarHBondContact O-N 2.68Å
740	L	82.6	Confident	83.5	Confident	12 Å²	12	43.9 Å²	43.9	6%	0.063	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-61.5	-14.8	178	-62.4	176.3	0	0	0	113.9	Q699 Y733 Q738 C782 K783 C788 F792	Q699-L740 WeakPolarHBondContact CB-O 3.42Å; Q699-L740 PolarHBondContact OE1-O 3.01Å; Y733-L740 HydrophobicContact CD2-CD2 4.29Å; Y733-L740 HydrophobicContact CE2-CD2 4Å; Y733-L740 HydrophobicContact CE2-CG 4.45Å; Q738-L740 VanDerWaalsContact C-N 3.34Å; Q738-L740 PolarHBondContact O-N 3.04Å; L740-C782 HydrophobicContact CD1-CB 3.89Å; L740-K783 HydrophobicContact CD1-CD 4.24Å; L740-C788 WeakPolarHBondContact CD1-SG 3.45Å; L740-C788 VanDerWaalsContact CD2-SG 3.59Å; L740-F792 HydrophobicContact CD2-CE2 4.39Å
741	R	80.7	Confident	83.8	Confident	156 Å²	156	43.6 Å²	43.6	59%	0.589	20%	0.198	S	C	*	.	G	3₁₀ helix	trans	-70.1	-24.7	174.2	-62	-177.9	177.8	179.1	0.8	112.5	Q699 Q738 Y739	Q699-R741 VanDerWaalsContact OE1-CA 3.25Å; Q738-R741 WeakPolarHBondContact O-CB 3.31Å; Q738-R741 WeakPolarHBondContact O-CG 2.99Å; Q738-R741 PolarHBondContact O-N 2.51Å; Y739-R741 PolarHBondContact O-N 2.84Å
742	F	82.7	Confident	84.3	Confident	148 Å²	148	42.3 Å²	42.3	65%	0.649	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-120.9	-23.7	-171.9	-54.3	-69.8	0	0	0	113	G700 Y739	G700-F742 WeakPolarHBondContact CA-O 3.29Å; Y739-F742 PolarHBondContact O-N 2.73Å
743	Y	86.5	Confident	84.7	Confident	31 Å²	31	42.6 Å²	42.6	12%	0.122	20%	0.195	C	C	.	.			trans	-147.5	120.3	-177.8	-172.6	-81.4	0	0	0	112.3	Q699 M728 F729 D732 Y739 A745	Q699-Y743 CarbonylContact O-C 3.58Å; Q699-Y743 WeakPolarHBondContact O-CA 3.42Å; M728-Y743 HydrophobicContact CB-CE2 4.31Å; M728-Y743 HydrophobicContact CE-CD2 3.61Å; M728-Y743 HydrophobicContact CE-CE2 3.6Å; M728-Y743 HydrophobicContact CE-CG 4.12Å; M728-Y743 HydrophobicContact CG-CE2 4.25Å; F729-Y743 PolarHBondContact N-OH 3.04Å; F729-Y743 WeakPolarHBondContact O-CE1 3.03Å; F729-Y743 PolarHBondContact O-OH 3.35Å; D732-Y743 HydrophobicContact CB-CE1 4.18Å; Y739-Y743 HydrophobicContact CD1-CD1 4.44Å; Y739-Y743 AromaticContact CE1-CD1 3.45Å; Y739-Y743 HydrophobicContact CE1-CD1 3.45Å; Y739-Y743 VanDerWaalsContact CE1-CD1 3.45Å; Y739-Y743 HydrophobicContact CE1-CE1 4.37Å; Y739-Y743 AromaticContact CE1-CG 3.82Å; Y739-Y743 HydrophobicContact CE1-CG 3.82Å; Y739-Y743 AromaticContact CZ-CD1 3.93Å; Y739-Y743 AromaticContact CZ-CG 3.94Å; Y739-Y743 PolarHBondContact O-N 2.68Å; Y743-A745 HydrophobicContact CE1-CB 4.24Å
744	S	89.5	Confident	85.1	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.007	20%	0.195	C	C	.	.			trans	-146.6	120.5	165.4	-178.1	0	0	0	0	108.5	Y697 T698 Q699 M728 Y778	Y697-S744 WeakPolarHBondContact O-CB 3.37Å; Y697-S744 PolarHBondContact O-OG 2.91Å; T698-S744 CarbonylContact C-O 3.57Å; T698-S744 VanDerWaalsContact CA-O 3.23Å; T698-S744 WeakPolarHBondContact CA-O 3.32Å; Q699-S744 PolarHBondContact O-N 2.99Å; M728-S744 WeakPolarHBondContact CE-O 3.4Å; S744-Y778 PolarHBondContact OG-OH 2.9Å
745	A	89.6	Confident	85.7	Confident	3 Å²	3	41 Å²	41	3%	0.025	19%	0.189	C	C	.	.			trans	-79	160.7	-174.4	0	0	0	0	0	112.7	M728 Y743	M728-A745 HydrophobicContact CB-CB 3.86Å; Y743-A745 HydrophobicContact CE1-CB 4.24Å
746	G	92	Very high	86.5	Confident	2 Å²	2	38 Å²	38	2%	0.021	18%	0.179	C	C	.	.			trans	-69.7	138.1	167.2	0	0	0	0	0	110.8	C720 S797	C720-G746 WeakPolarHBondContact SG-CA 3.47Å; G746-S797 WeakPolarHBondContact O-CB 3.37Å; G746-S797 PolarHBondContact O-OG 3.43Å
747	V	94	Very high	87.2	Confident	5 Å²	5	42 Å²	42	3%	0.03	19%	0.193	C	C	.	.			trans	-130.9	150.3	-176.5	-61.4	0	0	0	0	111.2	V718 Y749 Y791 F792 R795	V718-V747 WeakPolarHBondContact CB-O 3.23Å; V747-Y749 HydrophobicContact CG2-CD1 4.22Å; V747-Y749 HydrophobicContact CG2-CE1 3.83Å; V747-Y791 HydrophobicContact CG2-CE1 4.01Å; V747-F792 HydrophobicContact CG1-CD1 3.96Å; V747-F792 HydrophobicContact CG1-CE1 3.99Å; V747-R795 HydrophobicContact CB-CB 3.93Å; V747-R795 WeakPolarHBondContact CB-O 3.29Å; V747-R795 HydrophobicContact CG1-CB 4.34Å; V747-R795 WeakPolarHBondContact CG1-O 3.4Å; V747-R795 HydrophobicContact CG2-CB 4.05Å
748	P	94.8	Very high	88.3	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	17%	0.171	C	C	.	.			trans	-66	137.9	175.4	29.2	-36	0	0	0	110.6	F657 Y658 L661 R795 I796	F657-P748 HydrophobicContact CE2-CB 4.2Å; Y658-P748 HydrophobicContact CD2-CB 4.47Å; Y658-P748 HydrophobicContact CD2-CG 3.79Å; Y658-P748 HydrophobicContact CE2-CG 3.97Å; L661-P748 HydrophobicContact CD1-CB 3.64Å; P748-R795 WeakPolarHBondContact O-CD 3.48Å; P748-I796 WeakPolarHBondContact CD-O 3.39Å; P748-I796 VanDerWaalsContact CG-O 3.23Å; P748-I796 WeakPolarHBondContact CG-O 3.3Å
749	Y	94.9	Very high	89.1	Confident	9 Å²	9	34.9 Å²	34.9	4%	0.035	16%	0.158	C	C	.	.	B	Isolated β-bridge	trans	-100.3	134.5	178	-66.9	-31.7	0	0	0	111.2	A715 G716 V718 V747 A751 P753 N770 D774 L775	A715-Y749 VanDerWaalsContact CA-O 3.27Å; A715-Y749 WeakPolarHBondContact CA-O 3.32Å; A715-Y749 VanDerWaalsContact CB-O 3.27Å; A715-Y749 WeakPolarHBondContact CB-O 3.43Å; G716-Y749 PolarHBondContact N-O 2.96Å; G716-Y749 PolarHBondContact O-N 3.15Å; V718-Y749 HydrophobicContact CG2-CD2 3.53Å; V718-Y749 HydrophobicContact CG2-CE2 3.56Å; V718-Y749 HydrophobicContact CG2-CG 4.27Å; V747-Y749 HydrophobicContact CG2-CD1 4.22Å; V747-Y749 HydrophobicContact CG2-CE1 3.83Å; Y749-A751 WeakPolarHBondContact CB-O 3.45Å; Y749-A751 PolarHBondContact O-N 2.99Å; Y749-P753 HydrophobicContact CD2-CG 3.86Å; Y749-P753 HydrophobicContact CE2-CG 4.16Å; Y749-N770 WeakPolarHBondContact CB-ND2 2.91Å; Y749-N770 WeakPolarHBondContact CD2-ND2 3.33Å; Y749-N770 VanDerWaalsContact CG-ND2 3.26Å; Y749-D774 HydrophobicContact CD1-CB 3.6Å; Y749-D774 HydrophobicContact CE1-CB 4.15Å; Y749-D774 HydrophobicContact CG-CB 4.15Å; Y749-L775 HydrophobicContact CE1-CD2 4.36Å
750	R	94.1	Very high	89.6	Confident	15 Å²	15	36 Å²	36	6%	0.057	16%	0.164	C	C	.	.	S	Bend	trans	-62.3	-38	174.6	178.3	-177.7	-74.3	-82.1	-0.4	110.7	D651 E655 F657 G714 A715 N773 D774	D651-R750 PolarHBondContact O-NH2 2.86Å; D651-R750 VanDerWaalsContact O-NH2 3.12Å; D651-R750 IonicContact OD1-CZ 3.72Å; D651-R750 IonicContact OD1-NE 3.32Å; D651-R750 PolarHBondContact OD1-NE 3.46Å; D651-R750 IonicContact OD1-NH2 3.17Å; D651-R750 PolarHBondContact OD1-NH2 2.86Å; D651-R750 VanDerWaalsContact OD1-NH2 3.09Å; D651-R750 IonicContact OD2-CZ 3.35Å; D651-R750 IonicContact OD2-NE 3.49Å; D651-R750 IonicContact OD2-NH2 3.73Å; D651-R750 PolarHBondContact OD2-NH2 2.8Å; E655-R750 PolarHBondContact O-NH1 3.06Å; F657-R750 HydrophobicContact CD1-CB 3.88Å; F657-R750 HydrophobicContact CD1-CG 3.92Å; F657-R750 HydrophobicContact CE1-CB 3.65Å; F657-R750 HydrophobicContact CE1-CG 4.19Å; F657-R750 HydrophobicContact CE2-CB 4.4Å; F657-R750 HydrophobicContact CG-CB 4.36Å; F657-R750 HydrophobicContact CG-CG 4.35Å; F657-R750 HydrophobicContact CZ-CB 3.92Å; G714-R750 CarbonylContact C-O 3.46Å; A715-R750 WeakPolarHBondContact CA-O 3.49Å; A715-R750 WeakPolarHBondContact CB-O 3.46Å; A715-R750 PolarHBondContact N-O 2.83Å; R750-N773 HydrophobicContact CB-CB 4.41Å; R750-D774 PolarHBondContact N-OD1 3.43Å; R750-D774 PolarHBondContact N-OD2 2.86Å; R750-D774 VanDerWaalsContact N-OD2 3.15Å
751	A	94.8	Very high	89.9	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	19%	0.192	C	C	.	.	S	Bend	trans	-115.2	123.1	176.4	0	0	0	0	0	109.6	Y749 P763 S769 N770 D774	Y749-A751 WeakPolarHBondContact CB-O 3.45Å; Y749-A751 PolarHBondContact O-N 2.99Å; A751-P763 HydrophobicContact CB-CB 4.22Å; A751-P763 WeakPolarHBondContact CB-O 3.23Å; A751-S769 VanDerWaalsContact CB-C 3.46Å; A751-N770 HydrophobicContact CB-CB 4.28Å; A751-N770 WeakPolarHBondContact O-CB 3.01Å; A751-N770 PolarHBondContact O-ND2 3.05Å; A751-D774 PolarHBondContact N-OD2 2.75Å
752	H	94.7	Very high	90.4	Very high	3 Å²	3	36.8 Å²	36.8	1%	0.014	17%	0.167	C	C	.	.			trans	-60.4	135.4	176.7	-169.9	-94.3	0	0	0	110.3	A707 G714 W754 G755	A707-H752 PolarHBondContact O-NE2 3.2Å; G714-H752 WeakPolarHBondContact O-CB 3.42Å; G714-H752 PolarHBondContact O-N 3.2Å; H752-W754 AromaticContact CE1-CD2 3.52Å; H752-W754 AromaticContact CE1-CE3 3.6Å; H752-W754 AromaticContact CE1-CG 3.54Å; H752-W754 WeakPolarHBondContact ND1-CB 3.08Å; H752-W754 AromaticContact ND1-CG 3.82Å; H752-W754 PolarHBondContact ND1-N 3.29Å; H752-W754 VanDerWaalsContact ND1-N 3.16Å; H752-W754 PolarHBondContact O-N 3.32Å; H752-W754 VanDerWaalsContact O-N 3.1Å; H752-G755 WeakPolarHBondContact O-CA 3.48Å; H752-G755 PolarHBondContact O-N 3.4Å
753	P	93.2	Very high	90.8	Very high	12 Å²	12	30.5 Å²	30.5	8%	0.078	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-32.1	-178.2	-27.9	35.8	0	0	0	113.7	L684 Y749 G755 S767	L684-P753 HydrophobicContact CD1-CG 4.45Å; Y749-P753 HydrophobicContact CD2-CG 3.86Å; Y749-P753 HydrophobicContact CE2-CG 4.16Å; P753-G755 VanDerWaalsContact C-N 3.29Å; P753-S767 WeakPolarHBondContact O-CA 3.36Å; P753-S767 PolarHBondContact O-N 2.83Å
754	W	90.9	Very high	91.2	Very high	22 Å²	22	31.2 Å²	31.2	8%	0.083	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	0.8	179.9	-48.3	-15.3	0	0	0	113.4	M492 V682 V706 T708 H752 L914 T921	M492-W754 HydrophobicContact CE-CG 4.1Å; M492-W754 HydrophobicContact SD-CB 4.31Å; M492-W754 HydrophobicContact SD-CG 4.45Å; V682-W754 HydrophobicContact CB-CH2 4.16Å; V682-W754 HydrophobicContact CG1-CH2 3.14Å; V682-W754 HydrophobicContact CG1-CZ2 3.56Å; V682-W754 HydrophobicContact CG1-CZ3 4.08Å; V682-W754 HydrophobicContact CG2-CH2 4.17Å; V706-W754 HydrophobicContact CG1-CZ2 4.16Å; T708-W754 HydrophobicContact CG2-CZ3 4.04Å; H752-W754 AromaticContact CE1-CD2 3.52Å; H752-W754 AromaticContact CE1-CE3 3.6Å; H752-W754 AromaticContact CE1-CG 3.54Å; H752-W754 WeakPolarHBondContact ND1-CB 3.08Å; H752-W754 AromaticContact ND1-CG 3.82Å; H752-W754 PolarHBondContact ND1-N 3.29Å; H752-W754 VanDerWaalsContact ND1-N 3.16Å; H752-W754 PolarHBondContact O-N 3.32Å; H752-W754 VanDerWaalsContact O-N 3.1Å; W754-L914 HydrophobicContact CD2-CD2 4.3Å; W754-L914 HydrophobicContact CH2-CD1 4.09Å; W754-L914 HydrophobicContact CH2-CD2 3.78Å; W754-L914 HydrophobicContact CZ2-CD1 4.4Å; W754-L914 HydrophobicContact CZ2-CD2 3.35Å; W754-L914 HydrophobicContact CZ3-CD2 4.49Å; W754-T921 HydrophobicContact CZ3-CG2 4.32Å
755	G	91.1	Very high	91.4	Very high	7 Å²	7	31.1 Å²	31.1	7%	0.072	14%	0.144	C	C	.	.			trans	66.8	-168.2	-168.9	0	0	0	0	0	111.7	H752 P753 Y764	H752-G755 WeakPolarHBondContact O-CA 3.48Å; H752-G755 PolarHBondContact O-N 3.4Å; P753-G755 VanDerWaalsContact C-N 3.29Å; G755-Y764 VanDerWaalsContact CA-O 3.23Å; G755-Y764 WeakPolarHBondContact CA-O 3.28Å
756	S	88.9	Confident	91.6	Very high	26 Å²	26	31 Å²	31	18%	0.182	14%	0.143	C	C	.	.			trans	-154.6	157.1	171.7	164.7	0	0	0	0	109.6	S710 Y759 Y764	S710-S756 WeakPolarHBondContact OG-CB 3.14Å; S710-S756 PolarHBondContact OG-OG 3.06Å; S756-Y759 VanDerWaalsContact C-CE1 3.49Å; S756-Y759 VanDerWaalsContact O-CA 3.31Å; S756-Y759 WeakPolarHBondContact O-CA 3.45Å; S756-Y759 VanDerWaalsContact O-CD1 3.25Å; S756-Y759 WeakPolarHBondContact O-CD1 3.44Å; S756-Y759 PolarHBondContact O-N 2.66Å; S756-Y764 PolarHBondContact N-O 3.37Å; S756-Y764 WeakPolarHBondContact O-CB 3.24Å
757	F	86.5	Confident	91.8	Very high	157 Å²	157	31.1 Å²	31.1	69%	0.689	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.9	132.8	171.9	-178.7	-93.3	0	0	0	109.9	Y759	F757-Y759 HydrophobicContact CB-CE2 4.42Å
758	P	86	Confident	91.8	Very high	46 Å²	46	30.9 Å²	30.9	30%	0.299	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	cis	-91.6	9.2	13.8	36.7	-37.1	0	0	0	116.7	K760 R761	P758-K760 PolarHBondContact O-N 2.73Å; P758-R761 HydrophobicContact CG-CB 4.48Å
759	Y	89.1	Confident	91.8	Very high	39 Å²	39	30.9 Å²	30.9	15%	0.153	14%	0.141	C	C	.	.			trans	64	-49.1	179.7	-55.8	-70.8	0	0	0	116.6	K466 T467 S756 F757 R761 Y764 V765 P766	K466-Y759 HydrophobicContact CG-CD2 3.81Å; K466-Y759 HydrophobicContact CG-CE2 4.41Å; K466-Y759 HydrophobicContact CG-CG 4.41Å; T467-Y759 HydrophobicContact CG2-CD1 4.33Å; T467-Y759 HydrophobicContact CG2-CE1 3.76Å; S756-Y759 VanDerWaalsContact C-CE1 3.49Å; S756-Y759 VanDerWaalsContact O-CA 3.31Å; S756-Y759 WeakPolarHBondContact O-CA 3.45Å; S756-Y759 VanDerWaalsContact O-CD1 3.25Å; S756-Y759 WeakPolarHBondContact O-CD1 3.44Å; S756-Y759 PolarHBondContact O-N 2.66Å; F757-Y759 HydrophobicContact CB-CE2 4.42Å; Y759-R761 PolarHBondContact O-N 3.5Å; Y759-Y764 WeakPolarHBondContact CA-O 3.4Å; Y759-Y764 CarbonylContact O-C 3.56Å; Y759-V765 VanDerWaalsContact O-CA 3.25Å; Y759-V765 WeakPolarHBondContact O-CA 3.44Å; Y759-V765 VanDerWaalsContact O-CG2 3.3Å; Y759-V765 WeakPolarHBondContact O-CG2 3.43Å; Y759-V765 PolarHBondContact O-N 2.88Å; Y759-P766 HydrophobicContact CD1-CG 3.49Å; Y759-P766 VanDerWaalsContact CD1-CG 3.49Å; Y759-P766 HydrophobicContact CE1-CG 4.08Å; Y759-P766 HydrophobicContact CG-CG 4.27Å
760	K	85.1	Confident	91.9	Very high	63 Å²	63	30.9 Å²	30.9	27%	0.274	14%	0.142	S	C	.	.	S	Bend	trans	-72.3	6.3	-174.7	-61.2	-179.8	-176.1	174.1	0	114.5	E442 I464 F465 P758	E442-K760 IonicContact OE2-NZ 2.71Å; E442-K760 PolarHBondContact OE2-NZ 3.38Å; I464-K760 WeakPolarHBondContact O-CE 3.49Å; F465-K760 HydrophobicContact CB-CG 4.4Å; P758-K760 PolarHBondContact O-N 2.73Å
761	R	89.2	Confident	92	Very high	172 Å²	172	30.2 Å²	30.2	65%	0.649	14%	0.14	S	C	*	.	S	Bend	trans	-127.7	141.7	-178.1	-69	-174.9	179.6	161	1.1	109.9	P758 Y759 Y764	P758-R761 HydrophobicContact CG-CB 4.48Å; Y759-R761 PolarHBondContact O-N 3.5Å; R761-Y764 HydrophobicContact CB-CD2 4.42Å; R761-Y764 WeakPolarHBondContact O-CA 3.49Å; R761-Y764 WeakPolarHBondContact O-CB 3.32Å; R761-Y764 VanDerWaalsContact O-CD2 3.31Å; R761-Y764 WeakPolarHBondContact O-CD2 3.29Å; R761-Y764 PolarHBondContact O-N 2.96Å
762	P	90.9	Very high	92.1	Very high	12 Å²	12	32 Å²	32	8%	0.078	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	151.6	169.1	-24.4	35.5	0	0	0	112.6	E547 D548 G551 H552 Y764	E547-P762 HydrophobicContact CB-CB 4.07Å; E547-P762 HydrophobicContact CB-CG 3.73Å; E547-P762 HydrophobicContact CG-CB 4.4Å; D548-P762 WeakPolarHBondContact O-CB 3.29Å; D548-P762 WeakPolarHBondContact O-CG 3.43Å; G551-P762 VanDerWaalsContact C-CG 3.4Å; G551-P762 WeakPolarHBondContact O-CG 3.38Å; H552-P762 HydrophobicContact CB-CG 4.13Å; P762-Y764 WeakPolarHBondContact O-CD2 3.11Å
763	P	92.1	Very high	92	Very high	16 Å²	16	32.1 Å²	32.1	10%	0.104	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	cis	-88.8	35.5	-10.2	38.7	-35.9	0	0	0	111.7	A751 S769	A751-P763 HydrophobicContact CB-CB 4.22Å; A751-P763 WeakPolarHBondContact CB-O 3.23Å; P763-S769 VanDerWaalsContact C-CB 3.48Å; P763-S769 VanDerWaalsContact C-OG 3.28Å; P763-S769 WeakPolarHBondContact O-CB 3.33Å; P763-S769 PolarHBondContact O-OG 2.82Å
764	Y	93.5	Very high	92.1	Very high	45 Å²	45	31.5 Å²	31.5	18%	0.176	14%	0.144	C	C	.	.			trans	-98.2	3.3	-170.3	-50.1	-82.7	0	0	0	114.3	W712 G714 G755 S756 Y759 R761 P762 P766	W712-Y764 PolarHBondContact O-OH 2.92Å; W712-Y764 VanDerWaalsContact O-OH 3.07Å; G714-Y764 VanDerWaalsContact CA-CE1 3.47Å; G755-Y764 VanDerWaalsContact CA-O 3.23Å; G755-Y764 WeakPolarHBondContact CA-O 3.28Å; S756-Y764 PolarHBondContact N-O 3.37Å; S756-Y764 WeakPolarHBondContact O-CB 3.24Å; Y759-Y764 WeakPolarHBondContact CA-O 3.4Å; Y759-Y764 CarbonylContact O-C 3.56Å; R761-Y764 HydrophobicContact CB-CD2 4.42Å; R761-Y764 WeakPolarHBondContact O-CA 3.49Å; R761-Y764 WeakPolarHBondContact O-CB 3.32Å; R761-Y764 VanDerWaalsContact O-CD2 3.31Å; R761-Y764 WeakPolarHBondContact O-CD2 3.29Å; R761-Y764 PolarHBondContact O-N 2.96Å; P762-Y764 WeakPolarHBondContact O-CD2 3.11Å; Y764-P766 WeakPolarHBondContact O-CD 3.04Å
765	V	94.7	Very high	92.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.145	C	C	.	.	S	Bend	trans	-73.7	120.1	-174.9	-171.6	0	0	0	0	110.2	M417 F465 Y545 Y759 S767 M768 S769	M417-V765 HydrophobicContact CE-CG1 3.7Å; F465-V765 HydrophobicContact CD1-CG1 3.83Å; F465-V765 HydrophobicContact CE1-CG1 4.44Å; Y545-V765 WeakPolarHBondContact OH-CB 3.48Å; Y545-V765 VanDerWaalsContact OH-CG2 3.28Å; Y545-V765 WeakPolarHBondContact OH-CG2 3.32Å; Y759-V765 VanDerWaalsContact O-CA 3.25Å; Y759-V765 WeakPolarHBondContact O-CA 3.44Å; Y759-V765 VanDerWaalsContact O-CG2 3.3Å; Y759-V765 WeakPolarHBondContact O-CG2 3.43Å; Y759-V765 PolarHBondContact O-N 2.88Å; V765-S767 PolarHBondContact O-N 2.91Å; V765-M768 HydrophobicContact CB-CB 4.36Å; V765-M768 HydrophobicContact CG1-CB 3.88Å; V765-M768 HydrophobicContact CG1-CG 4.1Å; V765-M768 PolarHBondContact O-N 2.67Å; V765-S769 WeakPolarHBondContact CA-OG 3.29Å; V765-S769 WeakPolarHBondContact CB-OG 3.41Å; V765-S769 PolarHBondContact N-OG 2.93Å; V765-S769 WeakPolarHBondContact O-CB 3.49Å; V765-S769 PolarHBondContact O-N 2.75Å; V765-S769 PolarHBondContact O-OG 3.28Å
766	P	94.2	Very high	92.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	133.2	-176	-24.7	31.5	0	0	0	113.3	M417 T467 M492 Y759 Y764 M768	M417-P766 HydrophobicContact CE-CB 4.39Å; M417-P766 HydrophobicContact CE-CG 4.26Å; M417-P766 HydrophobicContact SD-CB 3.78Å; M417-P766 HydrophobicContact SD-CG 3.96Å; T467-P766 HydrophobicContact CG2-CB 4.25Å; T467-P766 HydrophobicContact CG2-CG 3.81Å; M492-P766 HydrophobicContact CB-CB 3.67Å; M492-P766 HydrophobicContact SD-CB 4.42Å; Y759-P766 HydrophobicContact CD1-CG 3.49Å; Y759-P766 VanDerWaalsContact CD1-CG 3.49Å; Y759-P766 HydrophobicContact CE1-CG 4.08Å; Y759-P766 HydrophobicContact CG-CG 4.27Å; Y764-P766 WeakPolarHBondContact O-CD 3.04Å; P766-M768 PolarHBondContact O-N 3.28Å
767	S	94.2	Very high	93	Very high	4 Å²	4	29.9 Å²	29.9	3%	0.028	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	-39	-173.6	-47.3	0	0	0	0	116	M492 S494 P753 V765 F771	M492-S767 PolarHBondContact SD-OG 3.11Å; M492-S767 VanDerWaalsContact SD-OG 3.39Å; S494-S767 WeakPolarHBondContact CB-OG 3.4Å; S494-S767 PolarHBondContact N-OG 2.83Å; S494-S767 PolarHBondContact OG-OG 3.23Å; P753-S767 WeakPolarHBondContact O-CA 3.36Å; P753-S767 PolarHBondContact O-N 2.83Å; V765-S767 PolarHBondContact O-N 2.91Å; S767-F771 WeakPolarHBondContact O-CB 3.3Å; S767-F771 PolarHBondContact O-N 2.9Å
768	M	95.1	Very high	93.4	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-74.5	-45.7	-172.6	-53.9	-60.8	-64.6	0	0	112.4	L418 P493 Y545 F554 L594 L620 V765 P766 F771 Y772	L418-M768 HydrophobicContact CD2-SD 4.38Å; P493-M768 HydrophobicContact CB-SD 4.49Å; P493-M768 HydrophobicContact CG-CG 4.42Å; P493-M768 HydrophobicContact CG-SD 3.93Å; Y545-M768 HydrophobicContact CD1-CB 3.94Å; Y545-M768 HydrophobicContact CD1-CE 4.11Å; Y545-M768 HydrophobicContact CD2-CB 3.97Å; Y545-M768 HydrophobicContact CD2-CE 3.41Å; Y545-M768 VanDerWaalsContact CD2-CE 3.41Å; Y545-M768 HydrophobicContact CD2-CG 4.31Å; Y545-M768 HydrophobicContact CE1-CB 3.61Å; Y545-M768 WeakPolarHBondContact CE1-O 3.32Å; Y545-M768 HydrophobicContact CE2-CB 3.64Å; Y545-M768 HydrophobicContact CE2-CE 4.22Å; Y545-M768 HydrophobicContact CE2-CG 4.18Å; Y545-M768 HydrophobicContact CG-CB 4.11Å; Y545-M768 HydrophobicContact CG-CE 3.33Å; Y545-M768 VanDerWaalsContact CZ-CB 3.44Å; F554-M768 HydrophobicContact CD2-CE 4.23Å; F554-M768 HydrophobicContact CE2-CE 4.26Å; L594-M768 HydrophobicContact CD1-CE 3.76Å; L594-M768 HydrophobicContact CD1-SD 4.2Å; L620-M768 HydrophobicContact CD2-CE 3.98Å; L620-M768 HydrophobicContact CD2-SD 3.54Å; L620-M768 VanDerWaalsContact CD2-SD 3.54Å; V765-M768 HydrophobicContact CB-CB 4.36Å; V765-M768 HydrophobicContact CG1-CB 3.88Å; V765-M768 HydrophobicContact CG1-CG 4.1Å; V765-M768 PolarHBondContact O-N 2.67Å; P766-M768 PolarHBondContact O-N 3.28Å; M768-F771 PolarHBondContact O-N 3.02Å; M768-Y772 PolarHBondContact O-N 2.91Å
769	S	95.7	Very high	93.7	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-65.2	-40.8	177.2	-66	0	0	0	0	111.2	E547 A751 P763 V765 Y772 N773	E547-S769 VanDerWaalsContact OE2-CA 3.31Å; E547-S769 WeakPolarHBondContact OE2-CA 3.22Å; E547-S769 WeakPolarHBondContact OE2-CB 3.42Å; E547-S769 PolarHBondContact OE2-OG 3.33Å; A751-S769 VanDerWaalsContact CB-C 3.46Å; P763-S769 VanDerWaalsContact C-CB 3.48Å; P763-S769 VanDerWaalsContact C-OG 3.28Å; P763-S769 WeakPolarHBondContact O-CB 3.33Å; P763-S769 PolarHBondContact O-OG 2.82Å; V765-S769 WeakPolarHBondContact CA-OG 3.29Å; V765-S769 WeakPolarHBondContact CB-OG 3.41Å; V765-S769 PolarHBondContact N-OG 2.93Å; V765-S769 WeakPolarHBondContact O-CB 3.49Å; V765-S769 PolarHBondContact O-N 2.75Å; V765-S769 PolarHBondContact O-OG 3.28Å; S769-Y772 PolarHBondContact O-N 3.12Å; S769-N773 WeakPolarHBondContact O-CB 3.25Å; S769-N773 PolarHBondContact O-N 2.55Å; S769-N773 PolarHBondContact O-ND2 3.15Å
770	N	95.8	Very high	93.9	Very high	9 Å²	9	19.3 Å²	19.3	5%	0.048	8%	0.082	C	C	.	.	H	α-helix	trans	-62	-45	173.9	178.2	-107.7	0	0	0	111.3	Y749 A751 Y772 D774 L775	Y749-N770 WeakPolarHBondContact CB-ND2 2.91Å; Y749-N770 WeakPolarHBondContact CD2-ND2 3.33Å; Y749-N770 VanDerWaalsContact CG-ND2 3.26Å; A751-N770 HydrophobicContact CB-CB 4.28Å; A751-N770 WeakPolarHBondContact O-CB 3.01Å; A751-N770 PolarHBondContact O-ND2 3.05Å; N770-Y772 PolarHBondContact O-N 2.8Å; N770-D774 PolarHBondContact ND2-OD2 3.45Å; N770-D774 WeakPolarHBondContact O-CA 3.25Å; N770-D774 VanDerWaalsContact O-CB 3.31Å; N770-D774 WeakPolarHBondContact O-CB 3.47Å; N770-D774 PolarHBondContact O-N 3.47Å; N770-L775 PolarHBondContact O-N 2.76Å; N770-L775 VanDerWaalsContact O-N 3.13Å
771	F	96.3	Very high	94.3	Very high	1 Å²	1	16.3 Å²	16.3	0%	0.004	7%	0.069	C	C	.	.	I	π-helix	trans	-58.9	-46.1	176.7	178.8	-114.8	0	0	0	112.3	L620 S767 M768 L775 L776	L620-F771 HydrophobicContact CB-CD1 4.34Å; L620-F771 HydrophobicContact CB-CD2 3.91Å; L620-F771 HydrophobicContact CB-CE1 4.35Å; L620-F771 HydrophobicContact CB-CE2 3.94Å; L620-F771 HydrophobicContact CB-CG 4.12Å; L620-F771 HydrophobicContact CB-CZ 4.14Å; L620-F771 HydrophobicContact CD1-CB 3.96Å; L620-F771 HydrophobicContact CD1-CD2 4.42Å; L620-F771 HydrophobicContact CD1-CG 4.11Å; L620-F771 HydrophobicContact CD2-CD1 4.02Å; L620-F771 HydrophobicContact CD2-CE1 4.37Å; L620-F771 HydrophobicContact CD2-CG 4.3Å; L620-F771 HydrophobicContact CG-CG 4.41Å; S767-F771 WeakPolarHBondContact O-CB 3.3Å; S767-F771 PolarHBondContact O-N 2.9Å; M768-F771 PolarHBondContact O-N 3.02Å; F771-L775 HydrophobicContact CD2-CB 4.08Å; F771-L775 HydrophobicContact CD2-CD1 4.3Å; F771-L775 PolarHBondContact O-N 3.16Å; F771-L776 HydrophobicContact CD1-CD1 4.09Å; F771-L776 HydrophobicContact CD1-CG 4.18Å; F771-L776 HydrophobicContact CD2-CG 4.3Å; F771-L776 HydrophobicContact CE1-CD1 3.78Å; F771-L776 HydrophobicContact CE1-CD2 3.91Å; F771-L776 HydrophobicContact CE1-CG 3.85Å; F771-L776 HydrophobicContact CE2-CD2 3.78Å; F771-L776 HydrophobicContact CE2-CG 3.97Å; F771-L776 HydrophobicContact CG-CG 4.4Å; F771-L776 HydrophobicContact CZ-CD1 4.15Å; F771-L776 HydrophobicContact CZ-CD2 3.4Å; F771-L776 HydrophobicContact CZ-CG 3.74Å; F771-L776 WeakPolarHBondContact O-CB 3.25Å; F771-L776 WeakPolarHBondContact O-CG 3.09Å; F771-L776 PolarHBondContact O-N 2.95Å
772	Y	96	Very high	94.5	Very high	39 Å²	39	8.4 Å²	8.4	15%	0.153	4%	0.04	C	C	.	.	I	π-helix	trans	-71.2	-47.4	-179.2	-179.7	-97.5	0	0	0	114	W546 E547 M768 S769 N770 L776 P777	W546-Y772 HydrophobicContact CB-CE2 4.4Å; W546-Y772 AromaticContact CD1-CE2 3.9Å; W546-Y772 AromaticContact CD1-CZ 3.76Å; W546-Y772 VanDerWaalsContact CD1-OH 3.23Å; W546-Y772 HydrophobicContact CG-CE2 4.49Å; E547-Y772 HydrophobicContact CG-CD1 3.35Å; E547-Y772 HydrophobicContact CG-CE1 3.77Å; E547-Y772 HydrophobicContact CG-CG 3.97Å; E547-Y772 VanDerWaalsContact O-CE1 3.24Å; E547-Y772 WeakPolarHBondContact O-CE1 3.24Å; E547-Y772 PolarHBondContact O-OH 2.9Å; M768-Y772 PolarHBondContact O-N 2.91Å; S769-Y772 PolarHBondContact O-N 3.12Å; N770-Y772 PolarHBondContact O-N 2.8Å; Y772-L776 HydrophobicContact CD2-CD1 4.31Å; Y772-P777 WeakPolarHBondContact O-CD 3.41Å
773	N	94.6	Very high	94.5	Very high	4 Å²	4	11 Å²	11	2%	0.021	5%	0.05	C	C	.	.	I	π-helix	trans	-85.6	-22.4	-173.1	-65.8	-86.1	0	0	0	114.3	E547 R654 R750 S769 P777 R795	E547-N773 PolarHBondContact OE1-ND2 3.45Å; R654-N773 PolarHBondContact NH1-OD1 3.39Å; R750-N773 HydrophobicContact CB-CB 4.41Å; S769-N773 WeakPolarHBondContact O-CB 3.25Å; S769-N773 PolarHBondContact O-N 2.55Å; S769-N773 PolarHBondContact O-ND2 3.15Å; N773-P777 WeakPolarHBondContact O-CG 3.35Å; N773-R795 PolarHBondContact O-NH2 3.26Å
774	D	95.3	Very high	94.5	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	5%	0.05	C	C	.	.	I	π-helix	trans	-126.6	-41.1	-167.8	-57.9	-63.2	0	0	0	113.4	Y749 R750 A751 N770 Y791 R795	Y749-D774 HydrophobicContact CD1-CB 3.6Å; Y749-D774 HydrophobicContact CE1-CB 4.15Å; Y749-D774 HydrophobicContact CG-CB 4.15Å; R750-D774 PolarHBondContact N-OD1 3.43Å; R750-D774 PolarHBondContact N-OD2 2.86Å; R750-D774 VanDerWaalsContact N-OD2 3.15Å; A751-D774 PolarHBondContact N-OD2 2.75Å; N770-D774 PolarHBondContact ND2-OD2 3.45Å; N770-D774 WeakPolarHBondContact O-CA 3.25Å; N770-D774 VanDerWaalsContact O-CB 3.31Å; N770-D774 WeakPolarHBondContact O-CB 3.47Å; N770-D774 PolarHBondContact O-N 3.47Å; D774-Y791 WeakPolarHBondContact O-CE2 3.14Å; D774-Y791 PolarHBondContact O-OH 3.25Å; D774-R795 IonicContact OD1-CZ 2.79Å; D774-R795 IonicContact OD1-NE 3.96Å; D774-R795 PolarHBondContact OD1-NE 3.46Å; D774-R795 IonicContact OD1-NH2 3.32Å; D774-R795 PolarHBondContact OD1-NH2 3.25Å; D774-R795 VanDerWaalsContact OD1-NH2 3.17Å
775	L	95.5	Very high	94.4	Very high	20 Å²	20	10.2 Å²	10.2	11%	0.105	5%	0.049	C	C	.	.	I	π-helix	trans	-89.8	-43.2	-176.8	-55.2	-178.4	0	0	0	114.1	Y697 Y749 N770 F771 Y778 E779	Y697-L775 HydrophobicContact CD1-CD2 4.39Å; Y697-L775 HydrophobicContact CD2-CD2 4Å; Y697-L775 HydrophobicContact CE1-CB 4.28Å; Y697-L775 HydrophobicContact CE1-CD2 4.32Å; Y697-L775 HydrophobicContact CE2-CD1 3.95Å; Y697-L775 HydrophobicContact CE2-CD2 3.9Å; Y697-L775 HydrophobicContact CE2-CG 4.36Å; Y697-L775 HydrophobicContact CG-CD2 4.23Å; Y749-L775 HydrophobicContact CE1-CD2 4.36Å; N770-L775 PolarHBondContact O-N 2.76Å; N770-L775 VanDerWaalsContact O-N 3.13Å; F771-L775 HydrophobicContact CD2-CB 4.08Å; F771-L775 HydrophobicContact CD2-CD1 4.3Å; F771-L775 PolarHBondContact O-N 3.16Å; L775-Y778 WeakPolarHBondContact O-CB 3.39Å; L775-Y778 PolarHBondContact O-N 3.11Å; L775-Y778 VanDerWaalsContact O-N 3.14Å; L775-E779 PolarHBondContact O-N 2.96Å
776	L	96.4	Very high	94.1	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-58.6	-42	175.1	-75.2	178	0	0	0	112.6	S591 P622 F771 Y772 Y778 E779 Y780	S591-L776 WeakPolarHBondContact OG-CD1 3.18Å; P622-L776 HydrophobicContact CB-CD2 3.76Å; F771-L776 HydrophobicContact CD1-CD1 4.09Å; F771-L776 HydrophobicContact CD1-CG 4.18Å; F771-L776 HydrophobicContact CD2-CG 4.3Å; F771-L776 HydrophobicContact CE1-CD1 3.78Å; F771-L776 HydrophobicContact CE1-CD2 3.91Å; F771-L776 HydrophobicContact CE1-CG 3.85Å; F771-L776 HydrophobicContact CE2-CD2 3.78Å; F771-L776 HydrophobicContact CE2-CG 3.97Å; F771-L776 HydrophobicContact CG-CG 4.4Å; F771-L776 HydrophobicContact CZ-CD1 4.15Å; F771-L776 HydrophobicContact CZ-CD2 3.4Å; F771-L776 HydrophobicContact CZ-CG 3.74Å; F771-L776 WeakPolarHBondContact O-CB 3.25Å; F771-L776 WeakPolarHBondContact O-CG 3.09Å; F771-L776 PolarHBondContact O-N 2.95Å; Y772-L776 HydrophobicContact CD2-CD1 4.31Å; L776-Y778 VanDerWaalsContact C-N 3.26Å; L776-Y778 PolarHBondContact O-N 3.38Å; L776-E779 WeakPolarHBondContact O-CA 3.3Å; L776-E779 WeakPolarHBondContact O-CB 3.25Å; L776-E779 PolarHBondContact O-N 3.01Å; L776-Y780 HydrophobicContact CB-CE1 3.97Å; L776-Y780 WeakPolarHBondContact O-CD1 3.31Å; L776-Y780 WeakPolarHBondContact O-CE1 3.26Å; L776-Y780 PolarHBondContact O-N 2.83Å; L776-Y780 VanDerWaalsContact O-N 3.12Å
777	P	96.2	Very high	93.8	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-60.6	-33.5	173.9	-16.5	26.3	0	0	0	114.5	W647 Y772 N773 E779 Y780 C781 Y791	W647-P777 HydrophobicContact CD2-CB 3.56Å; W647-P777 HydrophobicContact CD2-CG 3.96Å; W647-P777 VanDerWaalsContact CE2-CG 3.4Å; W647-P777 HydrophobicContact CE3-CB 4Å; W647-P777 HydrophobicContact CG-CB 4Å; W647-P777 HydrophobicContact CG-CG 4.07Å; W647-P777 HydrophobicContact CH2-CB 4.03Å; W647-P777 HydrophobicContact CZ2-CB 3.6Å; W647-P777 HydrophobicContact CZ2-CG 3.85Å; W647-P777 HydrophobicContact CZ3-CB 4.23Å; Y772-P777 WeakPolarHBondContact O-CD 3.41Å; N773-P777 WeakPolarHBondContact O-CG 3.35Å; P777-E779 VanDerWaalsContact C-N 3.31Å; P777-E779 PolarHBondContact O-N 2.84Å; P777-Y780 VanDerWaalsContact CA-CE2 3.47Å; P777-Y780 HydrophobicContact CB-CE1 4.48Å; P777-Y780 HydrophobicContact CB-CE2 3.91Å; P777-Y780 VanDerWaalsContact CG-OH 3.3Å; P777-Y780 WeakPolarHBondContact CG-OH 3.41Å; P777-C781 WeakPolarHBondContact O-CB 3.46Å; P777-C781 PolarHBondContact O-N 3.46Å; P777-Y791 HydrophobicContact CB-CD2 3.95Å; P777-Y791 HydrophobicContact CB-CE2 4.05Å
778	Y	94.7	Very high	93.6	Very high	4 Å²	4	15.7 Å²	15.7	2%	0.016	9%	0.087	C	C	.	.	I	π-helix	trans	-62.6	-40.6	170.9	-172.2	-89.1	0	0	0	110.8	Y697 S744 L775 L776 C782 K783 Y791 F792	Y697-Y778 AromaticContact CD1-CD1 3.5Å; Y697-Y778 HydrophobicContact CD1-CD1 3.5Å; Y697-Y778 VanDerWaalsContact CD1-CD1 3.5Å; Y697-Y778 AromaticContact CD1-CE1 3.82Å; Y697-Y778 HydrophobicContact CD1-CE1 3.82Å; Y697-Y778 HydrophobicContact CD1-CG 4.09Å; Y697-Y778 HydrophobicContact CE1-CD1 4.02Å; Y697-Y778 PolarHBondContact O-OH 2.94Å; S744-Y778 PolarHBondContact OG-OH 2.9Å; L775-Y778 WeakPolarHBondContact O-CB 3.39Å; L775-Y778 PolarHBondContact O-N 3.11Å; L775-Y778 VanDerWaalsContact O-N 3.14Å; L776-Y778 VanDerWaalsContact C-N 3.26Å; L776-Y778 PolarHBondContact O-N 3.38Å; Y778-C782 HydrophobicContact CD1-CB 4.35Å; Y778-C782 HydrophobicContact CD2-CB 4.12Å; Y778-C782 HydrophobicContact CE1-CB 4.4Å; Y778-C782 HydrophobicContact CE2-CB 4.12Å; Y778-C782 HydrophobicContact CG-CB 4.25Å; Y778-C782 WeakPolarHBondContact O-CA 3.24Å; Y778-C782 WeakPolarHBondContact O-CB 3.47Å; Y778-C782 PolarHBondContact O-N 3Å; Y778-K783 HydrophobicContact CD1-CG 4.47Å; Y778-K783 HydrophobicContact CE1-CD 4.49Å; Y778-K783 HydrophobicContact CE1-CG 4.27Å; Y778-K783 PolarHBondContact O-N 3.09Å; Y778-Y791 AromaticContact CD2-CD1 3.92Å; Y778-Y791 HydrophobicContact CD2-CD1 3.92Å; Y778-Y791 AromaticContact CD2-CE1 3.71Å; Y778-Y791 HydrophobicContact CD2-CE1 3.71Å; Y778-Y791 HydrophobicContact CD2-CG 4.48Å; Y778-F792 HydrophobicContact CE2-CZ 4.47Å
779	E	94.1	Very high	93.3	Very high	1 Å²	1	17.1 Å²	17.1	1%	0.005	9%	0.093	C	C	.	.	I	π-helix	trans	-61.8	-55.6	177.2	-61.4	-69.1	-177.2	0	0	112.3	R514 P622 Y696 L775 L776 P777 K783 W784	R514-E779 WeakPolarHBondContact CD-OE1 3.13Å; R514-E779 IonicContact CZ-OE1 3.66Å; R514-E779 IonicContact NE-OE1 3.43Å; R514-E779 IonicContact NH1-OE1 3.72Å; R514-E779 PolarHBondContact NH1-OE1 3.15Å; P622-E779 HydrophobicContact CB-CG 4.25Å; P622-E779 HydrophobicContact CG-CG 4.16Å; Y696-E779 WeakPolarHBondContact CE1-OE1 3.36Å; Y696-E779 PolarHBondContact OH-OE1 3.43Å; Y696-E779 PolarHBondContact OH-OE2 3.48Å; L775-E779 PolarHBondContact O-N 2.96Å; L776-E779 WeakPolarHBondContact O-CA 3.3Å; L776-E779 WeakPolarHBondContact O-CB 3.25Å; L776-E779 PolarHBondContact O-N 3.01Å; P777-E779 VanDerWaalsContact C-N 3.31Å; P777-E779 PolarHBondContact O-N 2.84Å; E779-K783 WeakPolarHBondContact O-CA 3.44Å; E779-K783 WeakPolarHBondContact O-CB 3.17Å; E779-K783 PolarHBondContact O-N 3.43Å; E779-K783 VanDerWaalsContact O-N 3.07Å; E779-W784 HydrophobicContact CB-CH2 4.44Å; E779-W784 HydrophobicContact CB-CZ2 4.01Å; E779-W784 PolarHBondContact O-N 2.72Å
780	Y	93	Very high	93	Very high	16 Å²	16	19.8 Å²	19.8	6%	0.063	11%	0.105	C	C	.	.	I	π-helix	trans	-76.8	-34.3	-175.3	50	-104.4	0	0	0	114.4	C644 W647 L776 P777 W784 A785	C644-Y780 HydrophobicContact CB-CD2 4.2Å; W647-Y780 HydrophobicContact CB-CE2 3.71Å; W647-Y780 VanDerWaalsContact CB-OH 3.31Å; W647-Y780 WeakPolarHBondContact CB-OH 3.49Å; W647-Y780 VanDerWaalsContact CD1-OH 3.27Å; W647-Y780 HydrophobicContact CG-CE2 4.08Å; W647-Y780 VanDerWaalsContact CG-OH 3.25Å; L776-Y780 HydrophobicContact CB-CE1 3.97Å; L776-Y780 WeakPolarHBondContact O-CD1 3.31Å; L776-Y780 WeakPolarHBondContact O-CE1 3.26Å; L776-Y780 PolarHBondContact O-N 2.83Å; L776-Y780 VanDerWaalsContact O-N 3.12Å; P777-Y780 VanDerWaalsContact CA-CE2 3.47Å; P777-Y780 HydrophobicContact CB-CE1 4.48Å; P777-Y780 HydrophobicContact CB-CE2 3.91Å; P777-Y780 VanDerWaalsContact CG-OH 3.3Å; P777-Y780 WeakPolarHBondContact CG-OH 3.41Å; Y780-W784 VanDerWaalsContact CB-CE3 3.47Å; Y780-A785 WeakPolarHBondContact O-CB 3.46Å; Y780-A785 PolarHBondContact O-N 3.35Å
781	C	93.8	Very high	92.9	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.103	C	C	.	.	I	π-helix	trans	-76.2	-53.5	175.7	-68	0	0	0	0	111.8	C644 P777 G786 H787	C644-C781 WeakPolarHBondContact CA-SG 3.24Å; C644-C781 HydrophobicContact CB-CB 3.98Å; C644-C781 WeakPolarHBondContact CB-SG 3.36Å; C644-C781 VanDerWaalsContact SG-CA 3.55Å; C644-C781 WeakPolarHBondContact SG-CB 3.45Å; C644-C781 CovalentContact SG-SG 2.04Å; C644-C781 PolarHBondContact SG-SG 2.87Å; P777-C781 WeakPolarHBondContact O-CB 3.46Å; P777-C781 PolarHBondContact O-N 3.46Å; C781-G786 PolarHBondContact O-N 3.02Å; C781-H787 CarbonylContact O-C 3.58Å; C781-H787 PolarHBondContact O-N 3.49Å
782	C	92.1	Very high	92.6	Very high	5 Å²	5	20 Å²	20	3%	0.034	11%	0.106	C	C	.	.	I	π-helix	trans	-82.9	-43.2	-171.1	-84.1	0	0	0	0	113.9	L740 Y778 C788	L740-C782 HydrophobicContact CD1-CB 3.89Å; Y778-C782 HydrophobicContact CD1-CB 4.35Å; Y778-C782 HydrophobicContact CD2-CB 4.12Å; Y778-C782 HydrophobicContact CE1-CB 4.4Å; Y778-C782 HydrophobicContact CE2-CB 4.12Å; Y778-C782 HydrophobicContact CG-CB 4.25Å; Y778-C782 WeakPolarHBondContact O-CA 3.24Å; Y778-C782 WeakPolarHBondContact O-CB 3.47Å; Y778-C782 PolarHBondContact O-N 3Å; C782-C788 WeakPolarHBondContact CA-SG 3.15Å; C782-C788 HydrophobicContact CB-CB 4.16Å; C782-C788 WeakPolarHBondContact CB-SG 3.39Å; C782-C788 WeakPolarHBondContact SG-CA 3.14Å; C782-C788 WeakPolarHBondContact SG-CB 3.35Å; C782-C788 CovalentContact SG-SG 2.02Å; C782-C788 PolarHBondContact SG-SG 3.49Å
783	K	90.8	Very high	92.3	Very high	67 Å²	67	26.6 Å²	26.6	29%	0.291	13%	0.13	S	C	.	.	I	π-helix	trans	-95.3	-37.8	-171.3	-59.7	-62.7	-175.9	-179.6	0	113	L740 Y778 E779	L740-K783 HydrophobicContact CD1-CD 4.24Å; Y778-K783 HydrophobicContact CD1-CG 4.47Å; Y778-K783 HydrophobicContact CE1-CD 4.49Å; Y778-K783 HydrophobicContact CE1-CG 4.27Å; Y778-K783 PolarHBondContact O-N 3.09Å; E779-K783 WeakPolarHBondContact O-CA 3.44Å; E779-K783 WeakPolarHBondContact O-CB 3.17Å; E779-K783 PolarHBondContact O-N 3.43Å; E779-K783 VanDerWaalsContact O-N 3.07Å
784	W	92.4	Very high	92.1	Very high	26 Å²	26	30 Å²	30	10%	0.098	14%	0.143	C	C	.	.	I	π-helix	trans	-93.5	-49	-176.5	-52.5	-16	0	0	0	113.1	R514 F516 P622 G624 W631 W639 A640 E779 Y780	R514-W784 PolarHBondContact O-NE1 3.15Å; R514-W784 VanDerWaalsContact O-NE1 3.1Å; F516-W784 HydrophobicContact CB-CD2 4.07Å; F516-W784 HydrophobicContact CB-CG 4.17Å; F516-W784 HydrophobicContact CD1-CB 3.99Å; F516-W784 AromaticContact CD1-CD1 3.61Å; F516-W784 AromaticContact CD1-CG 3.78Å; F516-W784 HydrophobicContact CD1-CG 3.78Å; F516-W784 HydrophobicContact CE1-CB 4.49Å; F516-W784 HydrophobicContact CG-CG 4.33Å; P622-W784 HydrophobicContact CB-CH2 3.84Å; P622-W784 HydrophobicContact CB-CZ2 3.72Å; P622-W784 HydrophobicContact CG-CZ2 4.09Å; G624-W784 VanDerWaalsContact CA-CH2 3.49Å; W631-W784 HydrophobicContact CH2-CZ3 4.2Å; W631-W784 HydrophobicContact CZ3-CH2 4.4Å; W631-W784 AromaticContact CZ3-CZ3 3.78Å; W631-W784 HydrophobicContact CZ3-CZ3 3.78Å; W639-W784 HydrophobicContact CH2-CB 4.34Å; W639-W784 HydrophobicContact CH2-CD2 4.32Å; W639-W784 AromaticContact CH2-CE3 3.81Å; W639-W784 HydrophobicContact CH2-CE3 3.81Å; W639-W784 AromaticContact CZ3-CE3 3.84Å; W639-W784 HydrophobicContact CZ3-CE3 3.84Å; W639-W784 HydrophobicContact CZ3-CZ3 4.36Å; A640-W784 HydrophobicContact CB-CB 4.06Å; E779-W784 HydrophobicContact CB-CH2 4.44Å; E779-W784 HydrophobicContact CB-CZ2 4.01Å; E779-W784 PolarHBondContact O-N 2.72Å; Y780-W784 VanDerWaalsContact CB-CE3 3.47Å
785	A	92	Very high	92	Very high	19 Å²	19	30 Å²	30	16%	0.157	14%	0.143	C	C	.	.	S	Bend	trans	-78.6	-27.2	178	0	0	0	0	0	113	A640 Y780 H787	A640-A785 HydrophobicContact CB-CB 3.92Å; Y780-A785 WeakPolarHBondContact O-CB 3.46Å; Y780-A785 PolarHBondContact O-N 3.35Å; A785-H787 VanDerWaalsContact C-N 3.26Å; A785-H787 HydrophobicContact CB-CB 4.42Å; A785-H787 PolarHBondContact O-CD2 3.37Å
786	G	88.3	Confident	91.7	Very high	49 Å²	49	31.1 Å²	31.1	51%	0.505	15%	0.148	S	C	.	.	S	Bend	trans	74.6	15.5	-173.9	0	0	0	0	0	113.9	C781	C781-G786 PolarHBondContact O-N 3.02Å
787	H	88.8	Confident	91.4	Very high	69 Å²	69	31.2 Å²	31.2	32%	0.319	15%	0.149	S	C	.	.			trans	-112.7	62.8	-177.4	-72.8	-68.4	0	0	0	111.3	C781 A785 E789 F790	C781-H787 CarbonylContact O-C 3.58Å; C781-H787 PolarHBondContact O-N 3.49Å; A785-H787 VanDerWaalsContact C-N 3.26Å; A785-H787 HydrophobicContact CB-CB 4.42Å; A785-H787 PolarHBondContact O-CD2 3.37Å; H787-E789 WeakPolarHBondContact CA-OE2 3.21Å; H787-E789 WeakPolarHBondContact CB-OE1 3.3Å; H787-E789 IonicContact CE1-OE1 3.29Å; H787-E789 IonicContact CG-OE1 2.9Å; H787-E789 IonicContact ND1-OE1 2.91Å; H787-E789 PolarHBondContact ND1-OE1 3.09Å; H787-E789 PolarHBondContact O-N 2.86Å; H787-F790 HydrophobicContact CB-CD2 3.82Å; H787-F790 HydrophobicContact CB-CE2 3.98Å
788	C	89.2	Confident	91	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61.7	-22.5	179.7	-89.2	0	0	0	0	115.1	Y733 L740 C782 F790 Y791 F792	Y733-C788 HydrophobicContact CD2-CB 4.49Å; Y733-C788 HydrophobicContact CE1-CB 3.96Å; Y733-C788 HydrophobicContact CE2-CB 3.79Å; Y733-C788 VanDerWaalsContact CZ-CB 3.5Å; L740-C788 WeakPolarHBondContact CD1-SG 3.45Å; L740-C788 VanDerWaalsContact CD2-SG 3.59Å; C782-C788 WeakPolarHBondContact CA-SG 3.15Å; C782-C788 HydrophobicContact CB-CB 4.16Å; C782-C788 WeakPolarHBondContact CB-SG 3.39Å; C782-C788 WeakPolarHBondContact SG-CA 3.14Å; C782-C788 WeakPolarHBondContact SG-CB 3.35Å; C782-C788 CovalentContact SG-SG 2.02Å; C782-C788 PolarHBondContact SG-SG 3.49Å; C788-F790 VanDerWaalsContact C-N 3.28Å; C788-F790 PolarHBondContact O-N 3Å; C788-Y791 WeakPolarHBondContact O-CA 3.31Å; C788-Y791 WeakPolarHBondContact O-CB 3.49Å; C788-Y791 PolarHBondContact O-N 3.29Å; C788-F792 HydrophobicContact CB-CD2 4.08Å; C788-F792 HydrophobicContact CB-CE2 4.02Å; C788-F792 PolarHBondContact O-N 2.77Å
789	E	88.1	Confident	90.5	Very high	30 Å²	30	31.4 Å²	31.4	14%	0.14	15%	0.152	C	C	.	.	H	α-helix	trans	-54.7	-46.4	-178.1	61.6	-80.3	-166.1	0	0	110.6	F735 H787 Y791 F792 W793	F735-E789 HydrophobicContact CE1-CB 3.84Å; F735-E789 HydrophobicContact CE1-CG 3.86Å; F735-E789 WeakPolarHBondContact CE1-OE2 3.47Å; F735-E789 HydrophobicContact CZ-CB 3.76Å; F735-E789 HydrophobicContact CZ-CG 4.12Å; H787-E789 WeakPolarHBondContact CA-OE2 3.21Å; H787-E789 WeakPolarHBondContact CB-OE1 3.3Å; H787-E789 IonicContact CE1-OE1 3.29Å; H787-E789 IonicContact CG-OE1 2.9Å; H787-E789 IonicContact ND1-OE1 2.91Å; H787-E789 PolarHBondContact ND1-OE1 3.09Å; H787-E789 PolarHBondContact O-N 2.86Å; E789-Y791 PolarHBondContact O-N 3.41Å; E789-F792 PolarHBondContact O-N 3.29Å; E789-W793 WeakPolarHBondContact O-CB 3.03Å; E789-W793 PolarHBondContact O-N 2.68Å
790	F	90.2	Very high	90.4	Very high	56 Å²	56	31.5 Å²	31.5	25%	0.246	15%	0.153	C	C	.	.	H	α-helix	trans	-57.8	-38.8	178.9	-65.2	-66.2	0	0	0	112	I645 F648 H787 C788 R794	I645-F790 HydrophobicContact CG1-CZ 4.43Å; F648-F790 HydrophobicContact CB-CB 4.47Å; F648-F790 HydrophobicContact CD1-CD1 4.32Å; F648-F790 HydrophobicContact CD2-CB 3.91Å; F648-F790 HydrophobicContact CD2-CD1 4.13Å; F648-F790 VanDerWaalsContact CD2-O 3.31Å; F648-F790 WeakPolarHBondContact CD2-O 3.41Å; F648-F790 HydrophobicContact CE1-CD1 4.5Å; F648-F790 HydrophobicContact CE2-CB 4.49Å; F648-F790 HydrophobicContact CE2-CD1 4.31Å; F648-F790 WeakPolarHBondContact CE2-O 3.32Å; F648-F790 HydrophobicContact CG-CB 4.35Å; F648-F790 HydrophobicContact CG-CD1 4.12Å; F648-F790 HydrophobicContact CZ-CD1 4.49Å; H787-F790 HydrophobicContact CB-CD2 3.82Å; H787-F790 HydrophobicContact CB-CE2 3.98Å; C788-F790 VanDerWaalsContact C-N 3.28Å; C788-F790 PolarHBondContact O-N 3Å; F790-R794 PolarHBondContact O-N 2.89Å
791	Y	92.9	Very high	90.2	Very high	4 Å²	4	34.8 Å²	34.8	2%	0.016	17%	0.169	C	C	.	.	H	α-helix	trans	-65.1	-55.7	176.6	-176.2	-96	0	0	0	111.5	W647 V747 D774 P777 Y778 C788 E789 W793 R794 R795	W647-Y791 AromaticContact CH2-CD2 3.63Å; W647-Y791 HydrophobicContact CH2-CD2 3.63Å; W647-Y791 HydrophobicContact CH2-CE2 4.27Å; W647-Y791 HydrophobicContact CH2-CG 4.4Å; W647-Y791 HydrophobicContact CZ2-CD2 4.22Å; W647-Y791 HydrophobicContact CZ2-CE2 4.47Å; W647-Y791 HydrophobicContact CZ3-CD2 4.19Å; V747-Y791 HydrophobicContact CG2-CE1 4.01Å; D774-Y791 WeakPolarHBondContact O-CE2 3.14Å; D774-Y791 PolarHBondContact O-OH 3.25Å; P777-Y791 HydrophobicContact CB-CD2 3.95Å; P777-Y791 HydrophobicContact CB-CE2 4.05Å; Y778-Y791 AromaticContact CD2-CD1 3.92Å; Y778-Y791 HydrophobicContact CD2-CD1 3.92Å; Y778-Y791 AromaticContact CD2-CE1 3.71Å; Y778-Y791 HydrophobicContact CD2-CE1 3.71Å; Y778-Y791 HydrophobicContact CD2-CG 4.48Å; C788-Y791 WeakPolarHBondContact O-CA 3.31Å; C788-Y791 WeakPolarHBondContact O-CB 3.49Å; C788-Y791 PolarHBondContact O-N 3.29Å; E789-Y791 PolarHBondContact O-N 3.41Å; Y791-W793 VanDerWaalsContact C-N 3.31Å; Y791-W793 PolarHBondContact O-N 3.08Å; Y791-R794 CarbonylContact O-C 3.56Å; Y791-R794 PolarHBondContact O-N 2.77Å; Y791-R795 HydrophobicContact CD1-CB 4.42Å; Y791-R795 HydrophobicContact CD2-CG 4.43Å; Y791-R795 HydrophobicContact CE1-CB 4.06Å; Y791-R795 HydrophobicContact CE1-CG 4.2Å; Y791-R795 HydrophobicContact CE2-CG 4.02Å; Y791-R795 WeakPolarHBondContact O-CB 3.21Å; Y791-R795 PolarHBondContact O-N 2.74Å
792	F	91	Very high	89.9	Confident	12 Å²	12	39.3 Å²	39.3	5%	0.053	19%	0.193	C	C	.	.	H	α-helix	trans	-66.8	-29.1	-177.5	-70.5	-45.3	0	0	0	113.7	Y733 L740 V747 Y778 C788 E789 R794 R795 I796	Y733-F792 HydrophobicContact CD1-CD2 4.06Å; Y733-F792 HydrophobicContact CD1-CE2 4.46Å; Y733-F792 HydrophobicContact CD2-CD2 4Å; Y733-F792 AromaticContact CD2-CE2 3.57Å; Y733-F792 HydrophobicContact CD2-CE2 3.57Å; Y733-F792 HydrophobicContact CE2-CE2 4.21Å; Y733-F792 AromaticContact CG-CD2 3.67Å; Y733-F792 HydrophobicContact CG-CD2 3.67Å; Y733-F792 AromaticContact CG-CE2 3.72Å; Y733-F792 HydrophobicContact CG-CE2 3.72Å; L740-F792 HydrophobicContact CD2-CE2 4.39Å; V747-F792 HydrophobicContact CG1-CD1 3.96Å; V747-F792 HydrophobicContact CG1-CE1 3.99Å; Y778-F792 HydrophobicContact CE2-CZ 4.47Å; C788-F792 HydrophobicContact CB-CD2 4.08Å; C788-F792 HydrophobicContact CB-CE2 4.02Å; C788-F792 PolarHBondContact O-N 2.77Å; E789-F792 PolarHBondContact O-N 3.29Å; F792-R794 VanDerWaalsContact C-N 3.29Å; F792-R794 PolarHBondContact O-N 3.24Å; F792-R795 CarbonylContact O-C 3.53Å; F792-R795 PolarHBondContact O-N 2.67Å; F792-I796 WeakPolarHBondContact O-CA 3.4Å; F792-I796 PolarHBondContact O-N 2.76Å; F792-I796 VanDerWaalsContact O-N 3.16Å
793	W	88.6	Confident	89.9	Confident	177 Å²	177	39.6 Å²	39.6	67%	0.67	19%	0.194	S	C	*	.	H	α-helix	trans	-62.4	-36.2	170.7	-89.5	98.7	0	0	0	112.3	F648 E789 Y791	F648-W793 HydrophobicContact CE2-CB 4.17Å; E789-W793 WeakPolarHBondContact O-CB 3.03Å; E789-W793 PolarHBondContact O-N 2.68Å; Y791-W793 VanDerWaalsContact C-N 3.31Å; Y791-W793 PolarHBondContact O-N 3.08Å
794	R	91.6	Very high	90	Very high	74 Å²	74	42.8 Å²	42.8	28%	0.279	20%	0.204	S	C	.	.	H	α-helix	trans	-90.6	-15.2	179.6	-162	68.9	77.6	-162.8	-0.3	112.9	W647 F648 D651 G652 F790 Y791 F792	W647-R794 HydrophobicContact CH2-CB 3.82Å; W647-R794 HydrophobicContact CH2-CG 4.14Å; W647-R794 HydrophobicContact CZ2-CG 4.4Å; W647-R794 HydrophobicContact CZ3-CB 4.33Å; F648-R794 HydrophobicContact CD2-CB 4.32Å; F648-R794 HydrophobicContact CE2-CB 4.35Å; F648-R794 PolarHBondContact O-NE 2.99Å; F648-R794 PolarHBondContact O-NH2 2.95Å; D651-R794 HydrophobicContact CB-CG 4.04Å; D651-R794 VanDerWaalsContact OD2-CD 3.25Å; D651-R794 WeakPolarHBondContact OD2-CD 2.87Å; D651-R794 WeakPolarHBondContact OD2-CG 3.1Å; G652-R794 VanDerWaalsContact CA-NH1 3.33Å; F790-R794 PolarHBondContact O-N 2.89Å; Y791-R794 CarbonylContact O-C 3.56Å; Y791-R794 PolarHBondContact O-N 2.77Å; F792-R794 VanDerWaalsContact C-N 3.29Å; F792-R794 PolarHBondContact O-N 3.24Å
795	R	92.8	Very high	90.1	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.205	C	C	.	.	S	Bend	trans	-130.3	59.8	-178.3	-61.2	-70.3	-178.7	-80.5	-3.6	109.3	D651 V747 P748 N773 D774 Y791 F792	D651-R795 IonicContact OD1-CZ 3.9Å; D651-R795 IonicContact OD1-NH1 2.8Å; D651-R795 IonicContact OD1-NH2 3.01Å; D651-R795 PolarHBondContact OD1-NH2 3.4Å; D651-R795 IonicContact OD2-CZ 3.5Å; D651-R795 IonicContact OD2-NH1 2.7Å; D651-R795 PolarHBondContact OD2-NH1 2.86Å; D651-R795 IonicContact OD2-NH2 3.72Å; V747-R795 HydrophobicContact CB-CB 3.93Å; V747-R795 WeakPolarHBondContact CB-O 3.29Å; V747-R795 HydrophobicContact CG1-CB 4.34Å; V747-R795 WeakPolarHBondContact CG1-O 3.4Å; V747-R795 HydrophobicContact CG2-CB 4.05Å; P748-R795 WeakPolarHBondContact O-CD 3.48Å; N773-R795 PolarHBondContact O-NH2 3.26Å; D774-R795 IonicContact OD1-CZ 2.79Å; D774-R795 IonicContact OD1-NE 3.96Å; D774-R795 PolarHBondContact OD1-NE 3.46Å; D774-R795 IonicContact OD1-NH2 3.32Å; D774-R795 PolarHBondContact OD1-NH2 3.25Å; D774-R795 VanDerWaalsContact OD1-NH2 3.17Å; Y791-R795 HydrophobicContact CD1-CB 4.42Å; Y791-R795 HydrophobicContact CD2-CG 4.43Å; Y791-R795 HydrophobicContact CE1-CB 4.06Å; Y791-R795 HydrophobicContact CE1-CG 4.2Å; Y791-R795 HydrophobicContact CE2-CG 4.02Å; Y791-R795 WeakPolarHBondContact O-CB 3.21Å; Y791-R795 PolarHBondContact O-N 2.74Å; F792-R795 CarbonylContact O-C 3.53Å; F792-R795 PolarHBondContact O-N 2.67Å
796	I	89.9	Confident	90.2	Very high	44 Å²	44	41.7 Å²	41.7	23%	0.226	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-72.5	130.5	-178.1	-164.6	166.8	0	0	0	110.3	Y658 S730 Q731 P748 F792 S798	Y658-I796 HydrophobicContact CD2-CG2 4.12Å; Y658-I796 HydrophobicContact CE1-CG2 4.17Å; Y658-I796 HydrophobicContact CE2-CG2 3.63Å; Y658-I796 VanDerWaalsContact CE2-O 3.28Å; Y658-I796 WeakPolarHBondContact CE2-O 3.32Å; S730-I796 WeakPolarHBondContact OG-CA 3.5Å; Q731-I796 HydrophobicContact CG-CD1 4.02Å; Q731-I796 HydrophobicContact CG-CG1 4.11Å; P748-I796 WeakPolarHBondContact CD-O 3.39Å; P748-I796 VanDerWaalsContact CG-O 3.23Å; P748-I796 WeakPolarHBondContact CG-O 3.3Å; F792-I796 WeakPolarHBondContact O-CA 3.4Å; F792-I796 PolarHBondContact O-N 2.76Å; F792-I796 VanDerWaalsContact O-N 3.16Å; I796-S798 PolarHBondContact O-N 2.97Å
797	S	90.1	Very high	90.5	Very high	3 Å²	3	39.6 Å²	39.6	2%	0.021	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-62.2	132.1	178.9	-57.7	0	0	0	0	110.2	S730 Q731 G746	S730-S797 WeakPolarHBondContact CB-OG 3.49Å; S730-S797 PolarHBondContact N-OG 3Å; S730-S797 PolarHBondContact OG-N 2.9Å; S730-S797 PolarHBondContact OG-OG 2.81Å; Q731-S797 PolarHBondContact NE2-O 3.14Å; G746-S797 WeakPolarHBondContact O-CB 3.37Å; G746-S797 PolarHBondContact O-OG 3.43Å
798	S	86.6	Confident	90.9	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.007	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-73.1	140.8	174.4	-50.9	0	0	0	0	109.9	Y658 Q717 I796	Y658-S798 WeakPolarHBondContact CE2-OG 3.34Å; Q717-S798 PolarHBondContact NE2-OG 2.86Å; Q717-S798 PolarHBondContact OE1-OG 2.81Å; I796-S798 PolarHBondContact O-N 2.97Å
799	G	85.2	Confident	91.3	Very high	7 Å²	7	36.3 Å²	36.3	7%	0.072	16%	0.161	C	C	.	.			trans	-82.2	-172.5	174.2	0	0	0	0	0	113.3	C667	C667-G799 PolarHBondContact N-O 3.35Å
800	C	90.5	Very high	91.7	Very high	3 Å²	3	35.2 Å²	35.2	2%	0.02	16%	0.156	C	C	.	.	S	Bend	trans	-116.9	14.7	-177.2	76.4	0	0	0	0	113.5	C667 C669 L727 D802 Y803 S1140	C667-C800 VanDerWaalsContact O-CA 3.28Å; C667-C800 WeakPolarHBondContact O-CA 3.34Å; C667-C800 WeakPolarHBondContact O-CB 3.25Å; C669-C800 WeakPolarHBondContact CA-SG 3.28Å; C669-C800 HydrophobicContact CB-CB 3.87Å; C669-C800 WeakPolarHBondContact CB-SG 3.08Å; C669-C800 WeakPolarHBondContact SG-CB 3.31Å; C669-C800 CovalentContact SG-SG 2.04Å; C669-C800 PolarHBondContact SG-SG 3.01Å; L727-C800 HydrophobicContact CD2-CB 4.31Å; C800-D802 VanDerWaalsContact C-N 3.3Å; C800-D802 PolarHBondContact O-N 3.29Å; C800-Y803 WeakPolarHBondContact O-CB 3.4Å; C800-Y803 PolarHBondContact O-N 3.14Å; C800-Y803 VanDerWaalsContact O-N 3.07Å; C800-S1140 VanDerWaalsContact SG-CB 3.5Å
801	Q	88.5	Confident	92.1	Very high	84 Å²	84	32.5 Å²	32.5	39%	0.393	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-38.5	-175.8	-56.4	92.7	-50.4	0	0	112.1	S1140	Q801-S1140 WeakPolarHBondContact CG-O 3.3Å
802	D	88.5	Confident	92.2	Very high	95 Å²	95	32.5 Å²	32.5	51%	0.508	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-0.9	176.5	-67.2	-50.5	0	0	0	113.2	P666 C800 R804	P666-D802 HydrophobicContact CB-CB 4.36Å; P666-D802 HydrophobicContact CG-CB 4.38Å; C800-D802 VanDerWaalsContact C-N 3.3Å; C800-D802 PolarHBondContact O-N 3.29Å; D802-R804 PolarHBondContact O-N 2.8Å
803	Y	92.3	Very high	92.3	Very high	11 Å²	11	32.3 Å²	32.3	4%	0.043	15%	0.145	C	C	.	.			trans	-68.8	130.7	178.4	179.1	-100.9	0	0	0	110.6	P666 C667 P668 Q673 D677 Y681 C800 P805 P806	P666-Y803 HydrophobicContact CG-CD2 4.42Å; P666-Y803 WeakPolarHBondContact O-CD2 3.25Å; C667-Y803 VanDerWaalsContact O-CB 3.27Å; C667-Y803 WeakPolarHBondContact O-CB 3.49Å; P668-Y803 HydrophobicContact CB-CD1 4.34Å; P668-Y803 HydrophobicContact CB-CD2 4.39Å; P668-Y803 HydrophobicContact CB-CE1 3.87Å; P668-Y803 HydrophobicContact CB-CE2 3.94Å; P668-Y803 HydrophobicContact CG-CD2 4.28Å; P668-Y803 HydrophobicContact CG-CE2 3.69Å; Q673-Y803 HydrophobicContact CB-CE1 4.04Å; Q673-Y803 HydrophobicContact CG-CE1 4.29Å; D677-Y803 WeakPolarHBondContact OD2-CE2 3.15Å; D677-Y803 PolarHBondContact OD2-OH 2.95Å; Y681-Y803 HydrophobicContact CE2-CE2 4.16Å; C800-Y803 WeakPolarHBondContact O-CB 3.4Å; C800-Y803 PolarHBondContact O-N 3.14Å; C800-Y803 VanDerWaalsContact O-N 3.07Å; Y803-P805 HydrophobicContact CE1-CB 4.33Å; Y803-P805 HydrophobicContact CE1-CG 3.97Å; Y803-P806 WeakPolarHBondContact OH-CD 3.49Å
804	R	92.3	Very high	92.4	Very high	134 Å²	134	24 Å²	24	51%	0.506	11%	0.114	S	C	.	.			trans	-121.9	124.4	172.2	-69.9	-175.8	-177.2	165.8	5.1	108.6	R680 D802 P961	R680-R804 PolarHBondContact NH1-O 3.45Å; R680-R804 PolarHBondContact NH2-O 2.65Å; D802-R804 PolarHBondContact O-N 2.8Å; R804-P961 HydrophobicContact CB-CB 4.08Å; R804-P961 HydrophobicContact CB-CG 3.65Å
805	P	94.6	Very high	92.4	Very high	19 Å²	19	20.4 Å²	20.4	12%	0.123	10%	0.101	C	C	.	.	P	Polyproline II helix	trans	-56.9	150.4	176.6	-25.6	33.8	0	0	0	112.6	Y803 G1134	Y803-P805 HydrophobicContact CE1-CB 4.33Å; Y803-P805 HydrophobicContact CE1-CG 3.97Å; P805-G1134 WeakPolarHBondContact CB-O 3.33Å
806	P	94.9	Very high	92.6	Very high	4 Å²	4	20.5 Å²	20.5	3%	0.026	10%	0.101	C	C	.	.	P	Polyproline II helix	trans	-69.5	165.9	167	35.3	-37.8	0	0	0	110.4	V676 D677 Y803 S958 V959	V676-P806 HydrophobicContact CG1-CG 4.36Å; D677-P806 HydrophobicContact CB-CG 3.95Å; Y803-P806 WeakPolarHBondContact OH-CD 3.49Å; P806-S958 VanDerWaalsContact CB-OG 3.3Å; P806-S958 WeakPolarHBondContact CB-OG 3.14Å; P806-V959 VanDerWaalsContact CA-O 3.28Å; P806-V959 WeakPolarHBondContact CA-O 3.39Å; P806-V959 WeakPolarHBondContact CB-O 3.37Å
807	A	94.5	Very high	92.9	Very high	5 Å²	5	18.5 Å²	18.5	4%	0.041	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	138	163.8	0	0	0	0	0	109.8	Y820 V959 F1004 E1135	A807-Y820 HydrophobicContact CB-CD1 4.26Å; A807-V959 PolarHBondContact N-O 3.18Å; A807-V959 PolarHBondContact O-N 3.27Å; A807-F1004 HydrophobicContact CB-CD1 4.48Å; A807-F1004 HydrophobicContact CB-CD2 3.99Å; A807-F1004 HydrophobicContact CB-CE1 3.88Å; A807-F1004 HydrophobicContact CB-CE2 3.33Å; A807-F1004 HydrophobicContact CB-CZ 3.27Å; A807-E1135 WeakPolarHBondContact CA-OE1 3.43Å
808	V	96.6	Very high	93.3	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	132.2	179.4	-69.7	0	0	0	0	112.8	V676 M956 V957 F1127 K1131 E1135	V676-V808 HydrophobicContact CG1-CB 4.45Å; V676-V808 HydrophobicContact CG1-CG1 3.41Å; V676-V808 VanDerWaalsContact CG1-CG1 3.41Å; V676-V808 HydrophobicContact CG1-CG2 4.17Å; V808-M956 HydrophobicContact CB-CG 4.25Å; V808-M956 HydrophobicContact CG1-CG 4.25Å; V808-M956 HydrophobicContact CG1-SD 4.15Å; V808-V957 VanDerWaalsContact CA-O 3.23Å; V808-V957 WeakPolarHBondContact CA-O 3.22Å; V808-F1127 HydrophobicContact CB-CE2 4.16Å; V808-F1127 HydrophobicContact CB-CZ 4.24Å; V808-F1127 HydrophobicContact CG2-CE2 3.86Å; V808-F1127 HydrophobicContact CG2-CZ 3.79Å; V808-K1131 HydrophobicContact CG2-CB 4.06Å; V808-K1131 HydrophobicContact CG2-CD 4.34Å; V808-K1131 HydrophobicContact CG2-CG 3.85Å; V808-K1131 PolarHBondContact O-NZ 3.14Å; V808-E1135 HydrophobicContact CG2-CG 4.38Å; V808-E1135 VanDerWaalsContact CG2-OE1 3.3Å; V808-E1135 WeakPolarHBondContact CG2-OE1 3.39Å; V808-E1135 PolarHBondContact N-OE1 3.23Å
809	G	96.6	Very high	93.7	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	154.6	168.7	0	0	0	0	0	110.1	I818 Y820 M956 V957	G809-I818 CarbonylContact C-O 3.6Å; G809-I818 WeakPolarHBondContact CA-O 3.38Å; G809-Y820 VanDerWaalsContact N-CD1 3.29Å; G809-Y820 VanDerWaalsContact N-CE1 3.34Å; G809-M956 WeakPolarHBondContact O-CA 3.35Å; G809-V957 PolarHBondContact N-O 3.4Å; G809-V957 PolarHBondContact O-N 2.87Å
810	Y	98	Very high	94.2	Very high	6 Å²	6	18.6 Å²	18.6	2%	0.024	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	136.5	-173.3	-166.3	-137	0	0	0	112.6	Y812 F817 I818 N954 V955 M956 F1127	Y810-Y812 AromaticContact CD1-CD1 3.26Å; Y810-Y812 HydrophobicContact CD1-CD1 3.26Å; Y810-Y812 AromaticContact CD1-CE1 3.95Å; Y810-Y812 HydrophobicContact CD1-CE1 3.95Å; Y810-Y812 AromaticContact CD1-CG 3.81Å; Y810-Y812 HydrophobicContact CD1-CG 3.81Å; Y810-Y812 VanDerWaalsContact CE1-CB 3.48Å; Y810-Y812 AromaticContact CE1-CD1 3.51Å; Y810-Y812 HydrophobicContact CE1-CD1 3.51Å; Y810-Y812 HydrophobicContact CE1-CD2 4.37Å; Y810-Y812 HydrophobicContact CE1-CE1 4.37Å; Y810-Y812 AromaticContact CE1-CG 3.52Å; Y810-Y812 HydrophobicContact CE1-CG 3.52Å; Y810-Y812 HydrophobicContact CG-CD1 4.11Å; Y810-F817 CarbonylContact O-C 3.44Å; Y810-F817 WeakPolarHBondContact O-CA 3.08Å; Y810-I818 PolarHBondContact N-O 2.64Å; Y810-I818 PolarHBondContact O-N 2.88Å; Y810-N954 HydrophobicContact CE2-CB 3.98Å; Y810-N954 WeakPolarHBondContact OH-CB 2.93Å; Y810-V955 WeakPolarHBondContact CA-O 3.1Å; Y810-V955 VanDerWaalsContact CD2-O 3.31Å; Y810-V955 WeakPolarHBondContact CD2-O 3.48Å; Y810-M956 HydrophobicContact CD2-CB 3.76Å; Y810-M956 HydrophobicContact CE2-CB 4.17Å; Y810-F1127 VanDerWaalsContact CB-CZ 3.45Å; Y810-F1127 HydrophobicContact CD1-CB 3.59Å; Y810-F1127 AromaticContact CD1-CD1 3.76Å; Y810-F1127 HydrophobicContact CD1-CD1 3.76Å; Y810-F1127 AromaticContact CD1-CD2 3.72Å; Y810-F1127 HydrophobicContact CD1-CD2 3.72Å; Y810-F1127 HydrophobicContact CD1-CE1 4.4Å; Y810-F1127 HydrophobicContact CD1-CE2 4.41Å; Y810-F1127 AromaticContact CD1-CG 3.36Å; Y810-F1127 HydrophobicContact CD1-CG 3.36Å; Y810-F1127 AromaticContact CD2-CD2 4Å; Y810-F1127 HydrophobicContact CD2-CD2 4Å; Y810-F1127 HydrophobicContact CD2-CE2 4.34Å; Y810-F1127 HydrophobicContact CD2-CG 4.48Å; Y810-F1127 HydrophobicContact CE1-CB 3.59Å; Y810-F1127 HydrophobicContact CE1-CD2 4.27Å; Y810-F1127 AromaticContact CE1-CG 3.9Å; Y810-F1127 HydrophobicContact CE1-CG 3.9Å; Y810-F1127 HydrophobicContact CG-CB 4.33Å; Y810-F1127 HydrophobicContact CG-CD1 4.11Å; Y810-F1127 AromaticContact CG-CD2 3.57Å; Y810-F1127 HydrophobicContact CG-CD2 3.57Å; Y810-F1127 HydrophobicContact CG-CE1 4.34Å; Y810-F1127 AromaticContact CG-CE2 3.89Å; Y810-F1127 HydrophobicContact CG-CE2 3.89Å; Y810-F1127 AromaticContact CG-CG 3.71Å; Y810-F1127 HydrophobicContact CG-CG 3.71Å; Y810-F1127 HydrophobicContact CG-CZ 4.26Å
811	I	97.7	Very high	94.3	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	131.2	166.7	-178.5	177.9	0	0	0	108.6	H816 F817 L835 M851 V868 N954 V955	I811-H816 VanDerWaalsContact CA-O 3.31Å; I811-H816 WeakPolarHBondContact CA-O 3.46Å; I811-F817 HydrophobicContact CB-CD1 4.06Å; I811-F817 HydrophobicContact CB-CE1 3.97Å; I811-F817 HydrophobicContact CB-CZ 4.5Å; I811-F817 HydrophobicContact CD1-CD1 4.29Å; I811-F817 HydrophobicContact CD1-CE1 3.42Å; I811-F817 VanDerWaalsContact CD1-CE1 3.42Å; I811-F817 HydrophobicContact CD1-CE2 3.98Å; I811-F817 HydrophobicContact CD1-CZ 3.23Å; I811-F817 HydrophobicContact CG1-CD1 4.19Å; I811-F817 HydrophobicContact CG1-CE1 3.81Å; I811-F817 HydrophobicContact CG1-CE2 4.23Å; I811-F817 HydrophobicContact CG1-CZ 3.82Å; I811-L835 HydrophobicContact CB-CD1 4.26Å; I811-L835 HydrophobicContact CD1-CD1 4.45Å; I811-L835 HydrophobicContact CG2-CD1 3.91Å; I811-L835 HydrophobicContact CG2-CD2 4.12Å; I811-M851 HydrophobicContact CD1-CE 4.11Å; I811-M851 HydrophobicContact CD1-SD 4.37Å; I811-V868 HydrophobicContact CD1-CG2 3.3Å; I811-V868 HydrophobicContact CG1-CG2 3.8Å; I811-V868 HydrophobicContact CG2-CG2 4.37Å; I811-N954 WeakPolarHBondContact O-CA 3.06Å; I811-V955 HydrophobicContact CG2-CB 3.61Å; I811-V955 HydrophobicContact CG2-CG2 4.13Å; I811-V955 PolarHBondContact N-O 3.27Å; I811-V955 PolarHBondContact O-N 2.68Å
812	Y	96.2	Very high	94.5	Very high	3 Å²	3	16.1 Å²	16.1	1%	0.012	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	163.2	-174.8	67	-75.4	0	0	0	111.4	Y810 H816 I818 N954 P1103 T1120 N1123 E1124	Y810-Y812 AromaticContact CD1-CD1 3.26Å; Y810-Y812 HydrophobicContact CD1-CD1 3.26Å; Y810-Y812 AromaticContact CD1-CE1 3.95Å; Y810-Y812 HydrophobicContact CD1-CE1 3.95Å; Y810-Y812 AromaticContact CD1-CG 3.81Å; Y810-Y812 HydrophobicContact CD1-CG 3.81Å; Y810-Y812 VanDerWaalsContact CE1-CB 3.48Å; Y810-Y812 AromaticContact CE1-CD1 3.51Å; Y810-Y812 HydrophobicContact CE1-CD1 3.51Å; Y810-Y812 HydrophobicContact CE1-CD2 4.37Å; Y810-Y812 HydrophobicContact CE1-CE1 4.37Å; Y810-Y812 AromaticContact CE1-CG 3.52Å; Y810-Y812 HydrophobicContact CE1-CG 3.52Å; Y810-Y812 HydrophobicContact CG-CD1 4.11Å; Y812-H816 HydrophobicContact CD1-CB 4.29Å; Y812-H816 HydrophobicContact CE1-CB 3.87Å; Y812-H816 HydrophobicContact CE2-CB 4.11Å; Y812-H816 PolarHBondContact N-O 2.81Å; Y812-H816 WeakPolarHBondContact O-CB 3.36Å; Y812-H816 PolarHBondContact O-N 2.94Å; Y812-H816 VanDerWaalsContact O-N 3.07Å; Y812-I818 HydrophobicContact CE1-CD1 3.88Å; Y812-I818 HydrophobicContact CE1-CG1 4.07Å; Y812-N954 VanDerWaalsContact CA-OD1 3.27Å; Y812-N954 WeakPolarHBondContact CA-OD1 3.32Å; Y812-N954 WeakPolarHBondContact CB-OD1 3.36Å; Y812-P1103 HydrophobicContact CE2-CB 4.28Å; Y812-T1120 HydrophobicContact CD2-CG2 3.9Å; Y812-T1120 HydrophobicContact CE2-CG2 3.73Å; Y812-N1123 HydrophobicContact CD2-CB 4.45Å; Y812-E1124 HydrophobicContact CE2-CB 3.72Å; Y812-E1124 HydrophobicContact CE2-CG 4.31Å; Y812-E1124 PolarHBondContact OH-OE1 3.09Å; Y812-E1124 VanDerWaalsContact OH-OE1 3.04Å
813	G	91.7	Very high	94.8	Very high	8 Å²	8	12.4 Å²	12.4	8%	0.082	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	-145.6	179.1	0	0	0	0	0	112.9	G815 N954 D1107	G813-G815 VanDerWaalsContact C-N 3.34Å; G813-G815 PolarHBondContact O-N 2.81Å; G813-G815 VanDerWaalsContact O-N 3.13Å; G813-N954 PolarHBondContact N-OD1 2.82Å; G813-D1107 WeakPolarHBondContact CA-OD2 3.19Å
814	E	91	Very high	95	Very high	2 Å²	2	14.7 Å²	14.7	1%	0.009	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86	73.1	175	-53.1	-168	148.1	0	0	112.2	H816 N828 A865 T866 V867 F1106 D1107 T1110 T1111	E814-H816 PolarHBondContact O-N 2.73Å; E814-N828 PolarHBondContact O-OD1 2.88Å; E814-A865 HydrophobicContact CB-CB 4.2Å; E814-A865 VanDerWaalsContact OE2-CB 3.29Å; E814-A865 WeakPolarHBondContact OE2-CB 3.2Å; E814-T866 CarbonylContact C-O 3.59Å; E814-T866 VanDerWaalsContact CA-O 3.23Å; E814-T866 WeakPolarHBondContact CA-O 3.45Å; E814-V867 HydrophobicContact CB-CG1 4.4Å; E814-V867 HydrophobicContact CG-CG1 3.81Å; E814-F1106 HydrophobicContact CB-CE1 4.33Å; E814-D1107 WeakPolarHBondContact CB-OD1 3.47Å; E814-D1107 HydrophobicContact CG-CB 4.48Å; E814-D1107 VanDerWaalsContact CG-OD1 3.23Å; E814-D1107 WeakPolarHBondContact CG-OD1 3.42Å; E814-D1107 PolarHBondContact N-OD1 2.79Å; E814-D1107 PolarHBondContact N-OD2 2.79Å; E814-T1110 VanDerWaalsContact OE2-CB 3.24Å; E814-T1110 WeakPolarHBondContact OE2-CB 3.4Å; E814-T1110 PolarHBondContact OE2-OG1 3Å; E814-T1111 WeakPolarHBondContact OE1-CG2 3.34Å
815	G	92	Very high	95.1	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	5%	0.048	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.7	33.1	171.7	0	0	0	0	0	113.6	G813 F817 T826 F827 T866	G813-G815 VanDerWaalsContact C-N 3.34Å; G813-G815 PolarHBondContact O-N 2.81Å; G813-G815 VanDerWaalsContact O-N 3.13Å; G815-F817 WeakPolarHBondContact O-CD2 3.42Å; G815-F817 VanDerWaalsContact O-CE2 3.22Å; G815-F817 WeakPolarHBondContact O-CE2 3.33Å; G815-T826 CarbonylContact O-C 3.5Å; G815-T826 WeakPolarHBondContact O-CA 3.41Å; G815-F827 PolarHBondContact O-N 3.24Å; G815-T866 PolarHBondContact N-O 2.86Å
816	H	96.2	Very high	95.1	Very high	2 Å²	2	9.5 Å²	9.5	1%	0.009	5%	0.053	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	135.4	172.8	-57.4	-57.5	0	0	0	111.1	I811 Y812 E814 T826 P1103 F1106 D1107	I811-H816 VanDerWaalsContact CA-O 3.31Å; I811-H816 WeakPolarHBondContact CA-O 3.46Å; Y812-H816 HydrophobicContact CD1-CB 4.29Å; Y812-H816 HydrophobicContact CE1-CB 3.87Å; Y812-H816 HydrophobicContact CE2-CB 4.11Å; Y812-H816 PolarHBondContact N-O 2.81Å; Y812-H816 WeakPolarHBondContact O-CB 3.36Å; Y812-H816 PolarHBondContact O-N 2.94Å; Y812-H816 VanDerWaalsContact O-N 3.07Å; E814-H816 PolarHBondContact O-N 2.73Å; H816-T826 PolarHBondContact CE1-OG1 3.05Å; H816-T826 WeakPolarHBondContact ND1-CG2 3.11Å; H816-T826 PolarHBondContact ND1-OG1 2.99Å; H816-P1103 HydrophobicContact CB-CB 4.49Å; H816-P1103 WeakPolarHBondContact NE2-CA 3.43Å; H816-P1103 PolarHBondContact NE2-O 2.68Å; H816-F1106 AromaticContact CE1-CD1 3.76Å; H816-F1106 AromaticContact CE1-CG 3.85Å; H816-F1106 AromaticContact NE2-CD1 3.96Å; H816-D1107 IonicContact CD2-OD1 3.67Å; H816-D1107 IonicContact CD2-OD2 3.48Å; H816-D1107 IonicContact CE1-OD1 2.84Å; H816-D1107 IonicContact NE2-OD1 3.7Å; H816-D1107 PolarHBondContact NE2-OD1 2.92Å; H816-D1107 IonicContact NE2-OD2 2.77Å
817	F	97.3	Very high	95.2	Very high	2 Å²	2	9.4 Å²	9.4	1%	0.009	5%	0.052	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	142.5	-175	-67.6	-100.9	0	0	0	111.6	Y810 I811 G815 R824 Y825 F827 L835 M851 L1000 L1001	Y810-F817 CarbonylContact O-C 3.44Å; Y810-F817 WeakPolarHBondContact O-CA 3.08Å; I811-F817 HydrophobicContact CB-CD1 4.06Å; I811-F817 HydrophobicContact CB-CE1 3.97Å; I811-F817 HydrophobicContact CB-CZ 4.5Å; I811-F817 HydrophobicContact CD1-CD1 4.29Å; I811-F817 HydrophobicContact CD1-CE1 3.42Å; I811-F817 VanDerWaalsContact CD1-CE1 3.42Å; I811-F817 HydrophobicContact CD1-CE2 3.98Å; I811-F817 HydrophobicContact CD1-CZ 3.23Å; I811-F817 HydrophobicContact CG1-CD1 4.19Å; I811-F817 HydrophobicContact CG1-CE1 3.81Å; I811-F817 HydrophobicContact CG1-CE2 4.23Å; I811-F817 HydrophobicContact CG1-CZ 3.82Å; G815-F817 WeakPolarHBondContact O-CD2 3.42Å; G815-F817 VanDerWaalsContact O-CE2 3.22Å; G815-F817 WeakPolarHBondContact O-CE2 3.33Å; F817-R824 WeakPolarHBondContact O-CA 3.48Å; F817-Y825 HydrophobicContact CB-CD1 3.93Å; F817-Y825 HydrophobicContact CB-CE1 3.48Å; F817-Y825 VanDerWaalsContact CB-CE1 3.48Å; F817-Y825 HydrophobicContact CB-CE2 4.14Å; F817-Y825 HydrophobicContact CB-CG 4.43Å; F817-Y825 HydrophobicContact CD2-CD2 4.4Å; F817-Y825 AromaticContact CD2-CE2 3.77Å; F817-Y825 HydrophobicContact CD2-CE2 3.77Å; F817-Y825 AromaticContact CD2-CZ 3.88Å; F817-Y825 HydrophobicContact CE2-CE2 4.39Å; F817-Y825 HydrophobicContact CG-CE1 4.04Å; F817-Y825 AromaticContact CG-CE2 3.99Å; F817-Y825 HydrophobicContact CG-CE2 3.99Å; F817-Y825 AromaticContact CG-CZ 3.59Å; F817-Y825 WeakPolarHBondContact CG-OH 3.32Å; F817-Y825 PolarHBondContact N-O 3.01Å; F817-Y825 PolarHBondContact O-N 3.23Å; F817-F827 HydrophobicContact CD2-CB 4.21Å; F817-F827 HydrophobicContact CE2-CB 3.79Å; F817-F827 HydrophobicContact CE2-CD1 4.18Å; F817-F827 HydrophobicContact CZ-CD1 4.26Å; F817-L835 HydrophobicContact CD1-CD1 4.44Å; F817-L835 HydrophobicContact CE1-CD1 3.87Å; F817-M851 HydrophobicContact CE2-CE 4.39Å; F817-M851 HydrophobicContact CZ-CE 4.32Å; F817-M851 HydrophobicContact CZ-SD 4.36Å; F817-L1000 HydrophobicContact CD1-CB 4.11Å; F817-L1000 HydrophobicContact CE1-CB 3.6Å; F817-L1000 HydrophobicContact CE1-CD1 3.94Å; F817-L1000 HydrophobicContact CE1-CG 4.36Å; F817-L1000 HydrophobicContact CZ-CB 4.3Å; F817-L1000 HydrophobicContact CZ-CD1 3.89Å; F817-L1001 HydrophobicContact CD1-CD2 4.26Å
818	I	97.2	Very high	95.1	Very high	9 Å²	9	9.4 Å²	9.4	5%	0.046	5%	0.052	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	113.5	163.5	-57.6	168	0	0	0	106.8	G809 Y810 Y812 T823 R824 F1127	G809-I818 CarbonylContact C-O 3.6Å; G809-I818 WeakPolarHBondContact CA-O 3.38Å; Y810-I818 PolarHBondContact N-O 2.64Å; Y810-I818 PolarHBondContact O-N 2.88Å; Y812-I818 HydrophobicContact CE1-CD1 3.88Å; Y812-I818 HydrophobicContact CE1-CG1 4.07Å; I818-T823 WeakPolarHBondContact CA-O 3.46Å; I818-R824 HydrophobicContact CG1-CG 4.3Å; I818-F1127 HydrophobicContact CB-CE1 3.93Å; I818-F1127 HydrophobicContact CD1-CD1 3.53Å; I818-F1127 HydrophobicContact CD1-CE1 3.83Å; I818-F1127 HydrophobicContact CG1-CE1 4.48Å; I818-F1127 HydrophobicContact CG2-CE1 3.83Å
819	T	96.4	Very high	95	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.052	C	C	.	.			trans	-70.2	168.8	-178.7	64.1	0	0	0	0	111.9	D821 G822 T823 Y825 L1001 D1011	T819-D821 VanDerWaalsContact C-N 3.25Å; T819-D821 PolarHBondContact O-N 2.81Å; T819-G822 PolarHBondContact O-N 3.35Å; T819-G822 VanDerWaalsContact O-N 3.1Å; T819-G822 PolarHBondContact OG1-N 2.87Å; T819-T823 PolarHBondContact N-O 2.99Å; T819-T823 WeakPolarHBondContact OG1-CB 3.5Å; T819-T823 PolarHBondContact OG1-N 2.8Å; T819-T823 PolarHBondContact OG1-O 2.91Å; T819-Y825 HydrophobicContact CG2-CD1 4.39Å; T819-Y825 HydrophobicContact CG2-CE1 3.92Å; T819-L1001 CarbonylContact C-O 3.53Å; T819-L1001 WeakPolarHBondContact CA-O 3.32Å; T819-L1001 WeakPolarHBondContact CB-O 3.4Å; T819-D1011 HydrophobicContact CG2-CB 4.13Å; T819-D1011 PolarHBondContact OG1-OD1 3.38Å; T819-D1011 PolarHBondContact OG1-OD2 2.9Å
820	Y	95.1	Very high	94.8	Very high	3 Å²	3	9.9 Å²	9.9	1%	0.012	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-40.5	175.2	-62.2	-61.6	0	0	0	112.3	A807 G809 G822 T836 V957 V959 T997 L1001 F1004 K1131	A807-Y820 HydrophobicContact CB-CD1 4.26Å; G809-Y820 VanDerWaalsContact N-CD1 3.29Å; G809-Y820 VanDerWaalsContact N-CE1 3.34Å; Y820-G822 VanDerWaalsContact C-N 3.34Å; Y820-T836 VanDerWaalsContact OH-CB 3.31Å; Y820-T836 WeakPolarHBondContact OH-CB 3.4Å; Y820-T836 WeakPolarHBondContact OH-CG2 3.37Å; Y820-T836 PolarHBondContact OH-OG1 2.86Å; Y820-V957 HydrophobicContact CE1-CB 4.42Å; Y820-V957 VanDerWaalsContact OH-CG1 3.3Å; Y820-V957 WeakPolarHBondContact OH-CG1 3.29Å; Y820-V959 HydrophobicContact CD1-CG2 4.32Å; Y820-V959 HydrophobicContact CE1-CB 4.2Å; Y820-V959 HydrophobicContact CE1-CG2 3.45Å; Y820-V959 VanDerWaalsContact CE1-CG2 3.45Å; Y820-V959 HydrophobicContact CE2-CG2 4.28Å; Y820-V959 VanDerWaalsContact CZ-CG2 3.42Å; Y820-V959 VanDerWaalsContact OH-CG2 3.27Å; Y820-V959 WeakPolarHBondContact OH-CG2 3.35Å; Y820-T997 HydrophobicContact CD2-CG2 4.14Å; Y820-T997 HydrophobicContact CE2-CG2 3.89Å; Y820-L1001 HydrophobicContact CD2-CB 4.04Å; Y820-L1001 WeakPolarHBondContact CD2-O 3.41Å; Y820-L1001 HydrophobicContact CE1-CB 4.44Å; Y820-L1001 HydrophobicContact CE1-CD1 4.27Å; Y820-L1001 HydrophobicContact CE2-CB 3.53Å; Y820-L1001 HydrophobicContact CE2-CD1 4.49Å; Y820-L1001 PolarHBondContact N-O 3.32Å; Y820-F1004 HydrophobicContact CD2-CB 4.05Å; Y820-F1004 HydrophobicContact CG-CB 4.34Å; Y820-K1131 PolarHBondContact O-NZ 3.28Å
821	D	92.8	Very high	94.6	Very high	22 Å²	22	9.8 Å²	9.8	12%	0.118	6%	0.055	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-8.9	-179.5	-66.9	-18.9	0	0	0	113	T819 T1003 N1005 N1006 D1007 K1008	T819-D821 VanDerWaalsContact C-N 3.25Å; T819-D821 PolarHBondContact O-N 2.81Å; D821-T1003 VanDerWaalsContact OD2-O 3.08Å; D821-N1005 PolarHBondContact OD2-N 3.11Å; D821-N1005 VanDerWaalsContact OD2-N 3.12Å; D821-N1005 PolarHBondContact OD2-OD1 3.48Å; D821-N1006 VanDerWaalsContact CG-CA 3.41Å; D821-N1006 WeakPolarHBondContact OD1-CA 3.47Å; D821-N1006 PolarHBondContact OD1-N 2.99Å; D821-N1006 VanDerWaalsContact OD2-CA 3.23Å; D821-N1006 WeakPolarHBondContact OD2-CA 3.47Å; D821-N1006 PolarHBondContact OD2-N 3.08Å; D821-D1007 PolarHBondContact OD2-N 2.89Å; D821-K1008 HydrophobicContact CB-CG 4.22Å; D821-K1008 WeakPolarHBondContact O-CE 3.05Å; D821-K1008 WeakPolarHBondContact O-CG 3.46Å
822	G	92.8	Very high	94.5	Very high	14 Å²	14	11.8 Å²	11.8	14%	0.144	6%	0.062	C	C	.	.			trans	97.3	26.8	170.1	0	0	0	0	0	115.2	T819 Y820 K1008	T819-G822 PolarHBondContact O-N 3.35Å; T819-G822 VanDerWaalsContact O-N 3.1Å; T819-G822 PolarHBondContact OG1-N 2.87Å; Y820-G822 VanDerWaalsContact C-N 3.34Å; G822-K1008 WeakPolarHBondContact O-CE 3.47Å; G822-K1008 PolarHBondContact O-NZ 2.82Å
823	T	95.4	Very high	94.5	Very high	17 Å²	17	11.6 Å²	11.6	10%	0.104	6%	0.062	C	C	.	.			trans	-76.6	138.3	164.7	-63	0	0	0	0	109.8	I818 T819 K1008 D1011 T1022	I818-T823 WeakPolarHBondContact CA-O 3.46Å; T819-T823 PolarHBondContact N-O 2.99Å; T819-T823 WeakPolarHBondContact OG1-CB 3.5Å; T819-T823 PolarHBondContact OG1-N 2.8Å; T819-T823 PolarHBondContact OG1-O 2.91Å; T823-K1008 WeakPolarHBondContact OG1-CB 3.29Å; T823-K1008 PolarHBondContact OG1-O 2.98Å; T823-D1011 WeakPolarHBondContact CB-OD2 3.34Å; T823-D1011 HydrophobicContact CG2-CB 4.46Å; T823-D1011 PolarHBondContact N-OD2 3.31Å; T823-D1011 PolarHBondContact OG1-OD2 3.28Å; T823-T1022 HydrophobicContact CG2-CG2 4.44Å
824	R	95.3	Very high	94.7	Very high	58 Å²	58	11.2 Å²	11.2	22%	0.219	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	129.8	-177.8	-60.7	171.7	78.6	149.9	5	109	F817 I818 Y1024 E1124 E1128	F817-R824 WeakPolarHBondContact O-CA 3.48Å; I818-R824 HydrophobicContact CG1-CG 4.3Å; R824-Y1024 HydrophobicContact CB-CD1 4.13Å; R824-Y1024 HydrophobicContact CB-CD2 3.39Å; R824-Y1024 HydrophobicContact CB-CE1 4.28Å; R824-Y1024 HydrophobicContact CB-CE2 3.58Å; R824-Y1024 HydrophobicContact CB-CG 3.66Å; R824-Y1024 VanDerWaalsContact NE-CE1 3.27Å; R824-Y1024 VanDerWaalsContact NE-CZ 3.29Å; R824-Y1024 PolarHBondContact NE-OH 2.83Å; R824-Y1024 PolarHBondContact NH2-OH 2.86Å; R824-Y1024 WeakPolarHBondContact O-CD2 3.35Å; R824-E1124 IonicContact CZ-OE1 3.6Å; R824-E1124 IonicContact NH2-OE1 2.71Å; R824-E1124 PolarHBondContact NH2-OE1 3Å; R824-E1124 IonicContact NH2-OE2 3.02Å; R824-E1128 IonicContact CZ-OE1 3.69Å; R824-E1128 IonicContact NH1-OE1 3.59Å; R824-E1128 PolarHBondContact NH1-OE1 3.09Å; R824-E1128 IonicContact NH2-OE1 2.91Å; R824-E1128 PolarHBondContact NH2-OE1 3.01Å
825	Y	95.7	Very high	94.9	Very high	6 Å²	6	11.1 Å²	11.1	2%	0.024	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	167.3	175.7	73.1	-84.8	0	0	0	110.5	F817 T819 F827 L1000 L1012 V1034 F1038	F817-Y825 HydrophobicContact CB-CD1 3.93Å; F817-Y825 HydrophobicContact CB-CE1 3.48Å; F817-Y825 VanDerWaalsContact CB-CE1 3.48Å; F817-Y825 HydrophobicContact CB-CE2 4.14Å; F817-Y825 HydrophobicContact CB-CG 4.43Å; F817-Y825 HydrophobicContact CD2-CD2 4.4Å; F817-Y825 AromaticContact CD2-CE2 3.77Å; F817-Y825 HydrophobicContact CD2-CE2 3.77Å; F817-Y825 AromaticContact CD2-CZ 3.88Å; F817-Y825 HydrophobicContact CE2-CE2 4.39Å; F817-Y825 HydrophobicContact CG-CE1 4.04Å; F817-Y825 AromaticContact CG-CE2 3.99Å; F817-Y825 HydrophobicContact CG-CE2 3.99Å; F817-Y825 AromaticContact CG-CZ 3.59Å; F817-Y825 WeakPolarHBondContact CG-OH 3.32Å; F817-Y825 PolarHBondContact N-O 3.01Å; F817-Y825 PolarHBondContact O-N 3.23Å; T819-Y825 HydrophobicContact CG2-CD1 4.39Å; T819-Y825 HydrophobicContact CG2-CE1 3.92Å; Y825-F827 HydrophobicContact CD2-CB 4.11Å; Y825-F827 HydrophobicContact CE2-CB 3.65Å; Y825-L1000 WeakPolarHBondContact OH-CA 3.44Å; Y825-L1000 PolarHBondContact OH-O 2.94Å; Y825-L1012 HydrophobicContact CD1-CD2 3.55Å; Y825-L1012 HydrophobicContact CE1-CD2 3.45Å; Y825-L1012 VanDerWaalsContact CE1-CD2 3.45Å; Y825-L1012 HydrophobicContact CG-CD2 4.21Å; Y825-V1034 HydrophobicContact CD2-CG1 3.52Å; Y825-V1034 HydrophobicContact CE2-CG1 4.11Å; Y825-V1034 HydrophobicContact CG-CG1 4.23Å; Y825-F1038 HydrophobicContact CE1-CE1 4.43Å; Y825-F1038 HydrophobicContact CE2-CE1 4.06Å; Y825-F1038 AromaticContact CZ-CE1 3.78Å
826	T	94.7	Very high	95	Very high	39 Å²	39	11.2 Å²	11.2	24%	0.239	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	134.2	176.6	-56.3	0	0	0	0	108.9	G815 H816	G815-T826 CarbonylContact O-C 3.5Å; G815-T826 WeakPolarHBondContact O-CA 3.41Å; H816-T826 PolarHBondContact CE1-OG1 3.05Å; H816-T826 WeakPolarHBondContact ND1-CG2 3.11Å; H816-T826 PolarHBondContact ND1-OG1 2.99Å
827	F	95.3	Very high	94.7	Very high	1 Å²	1	12.9 Å²	12.9	0%	0.004	7%	0.066	C	C	.	.			trans	-140.1	107	177.3	169.5	-111.1	0	0	0	110.4	G815 F817 Y825 G829 Y833 M851 L1000 Y1035 G1039 E1040	G815-F827 PolarHBondContact O-N 3.24Å; F817-F827 HydrophobicContact CD2-CB 4.21Å; F817-F827 HydrophobicContact CE2-CB 3.79Å; F817-F827 HydrophobicContact CE2-CD1 4.18Å; F817-F827 HydrophobicContact CZ-CD1 4.26Å; Y825-F827 HydrophobicContact CD2-CB 4.11Å; Y825-F827 HydrophobicContact CE2-CB 3.65Å; F827-G829 VanDerWaalsContact C-N 3.31Å; F827-G829 PolarHBondContact O-N 3.37Å; F827-Y833 AromaticContact CE1-CD1 3.82Å; F827-Y833 HydrophobicContact CE1-CD1 3.82Å; F827-Y833 HydrophobicContact CE1-CD2 4.28Å; F827-Y833 AromaticContact CE1-CE1 3.75Å; F827-Y833 HydrophobicContact CE1-CE1 3.75Å; F827-Y833 HydrophobicContact CE1-CE2 4.2Å; F827-Y833 HydrophobicContact CE1-CG 4.1Å; F827-Y833 AromaticContact CE1-CZ 3.93Å; F827-Y833 AromaticContact CZ-CD1 3.98Å; F827-Y833 HydrophobicContact CZ-CD1 3.98Å; F827-Y833 AromaticContact CZ-CE1 3.48Å; F827-Y833 HydrophobicContact CZ-CE1 3.48Å; F827-Y833 VanDerWaalsContact CZ-CE1 3.48Å; F827-Y833 HydrophobicContact CZ-CE2 4.42Å; F827-Y833 AromaticContact CZ-CZ 3.72Å; F827-M851 HydrophobicContact CD1-SD 4.37Å; F827-M851 HydrophobicContact CE1-SD 4.39Å; F827-M851 WeakPolarHBondContact O-CE 3.49Å; F827-L1000 HydrophobicContact CD1-CD1 4.19Å; F827-L1000 HydrophobicContact CD1-CD2 4.14Å; F827-L1000 HydrophobicContact CE1-CD1 4.2Å; F827-L1000 HydrophobicContact CE1-CD2 4.29Å; F827-Y1035 AromaticContact CD2-CD2 3.56Å; F827-Y1035 HydrophobicContact CD2-CD2 3.56Å; F827-Y1035 HydrophobicContact CD2-CE2 4.2Å; F827-Y1035 HydrophobicContact CD2-CG 4.25Å; F827-Y1035 AromaticContact CE2-CD2 3.43Å; F827-Y1035 HydrophobicContact CE2-CD2 3.43Å; F827-Y1035 VanDerWaalsContact CE2-CD2 3.43Å; F827-Y1035 AromaticContact CE2-CE2 3.72Å; F827-Y1035 HydrophobicContact CE2-CE2 3.72Å; F827-Y1035 HydrophobicContact CE2-CG 4.08Å; F827-G1039 VanDerWaalsContact CE2-CA 3.49Å; F827-E1040 HydrophobicContact CE2-CG 4.48Å
828	N	93.7	Very high	94.3	Very high	6 Å²	6	12.8 Å²	12.8	3%	0.032	7%	0.066	C	C	.	.			trans	-94.1	49.8	-178.6	-77.6	-54.6	0	0	0	112.4	E814 A865 T866 Y1035 Y1071 P1073 F1106	E814-N828 PolarHBondContact O-OD1 2.88Å; N828-A865 HydrophobicContact CB-CB 4.45Å; N828-A865 WeakPolarHBondContact OD1-CB 3.35Å; N828-T866 VanDerWaalsContact CA-OG1 3.31Å; N828-T866 WeakPolarHBondContact CA-OG1 3.14Å; N828-T866 PolarHBondContact O-OG1 2.85Å; N828-T866 PolarHBondContact OD1-N 3.4Å; N828-Y1035 WeakPolarHBondContact O-CE2 3.27Å; N828-Y1071 VanDerWaalsContact O-CE1 3.25Å; N828-Y1071 WeakPolarHBondContact O-CE1 3.23Å; N828-Y1071 PolarHBondContact O-OH 2.87Å; N828-P1073 HydrophobicContact CB-CB 4.06Å; N828-F1106 WeakPolarHBondContact ND2-CE1 3.46Å; N828-F1106 WeakPolarHBondContact ND2-CZ 3.31Å
829	G	93.3	Very high	93.4	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.087	C	C	.	.			trans	-68	139.1	177.6	0	0	0	0	0	112.5	F827 Y833 M851 T866	F827-G829 VanDerWaalsContact C-N 3.31Å; F827-G829 PolarHBondContact O-N 3.37Å; G829-Y833 VanDerWaalsContact C-OH 3.23Å; G829-Y833 WeakPolarHBondContact CA-OH 3.2Å; G829-M851 WeakPolarHBondContact O-CB 3.07Å; G829-T866 PolarHBondContact N-OG1 3.03Å; G829-T866 VanDerWaalsContact O-CB 3.32Å; G829-T866 WeakPolarHBondContact O-CB 3.26Å; G829-T866 VanDerWaalsContact O-CG2 3.26Å; G829-T866 WeakPolarHBondContact O-CG2 2.94Å; G829-T866 PolarHBondContact O-OG1 3.32Å
830	K	93.5	Very high	92.5	Very high	10 Å²	10	19.1 Å²	19.1	4%	0.043	10%	0.096	C	C	.	.			trans	-107.3	113.4	173.2	-170	-176.1	71	173.4	0	110.6	Y833 Q853 T866 R1043 S1065 F1066 S1068 Y1071	K830-Y833 PolarHBondContact N-OH 3.46Å; K830-Y833 PolarHBondContact O-OH 3.32Å; K830-Q853 HydrophobicContact CD-CG 4.21Å; K830-T866 HydrophobicContact CB-CG2 3.93Å; K830-T866 HydrophobicContact CG-CG2 4.35Å; K830-R1043 PolarHBondContact O-NH1 3.23Å; K830-R1043 PolarHBondContact O-NH2 2.95Å; K830-S1065 PolarHBondContact NZ-O 2.83Å; K830-F1066 WeakPolarHBondContact CE-O 3.49Å; K830-F1066 HydrophobicContact CG-CD2 4.08Å; K830-S1068 PolarHBondContact NZ-O 2.87Å; K830-Y1071 HydrophobicContact CB-CD1 3.69Å; K830-Y1071 HydrophobicContact CB-CE1 3.7Å; K830-Y1071 HydrophobicContact CB-CG 4.16Å; K830-Y1071 HydrophobicContact CD-CD1 4.41Å; K830-Y1071 HydrophobicContact CD-CD2 4.13Å; K830-Y1071 HydrophobicContact CD-CG 4.01Å; K830-Y1071 VanDerWaalsContact NZ-CB 3.34Å
831	G	93.3	Very high	91.3	Very high	4 Å²	4	28.9 Å²	28.9	4%	0.041	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	144.9	-157.5	-176.2	0	0	0	0	0	113.6	M851	G831-M851 PolarHBondContact N-O 3.45Å; G831-M851 PolarHBondContact O-N 3.18Å
832	Y	94.7	Very high	90.5	Very high	41 Å²	41	32.2 Å²	32.2	16%	0.161	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	135	172.5	-57.3	-80.3	0	0	0	109.1	V849 R850 R1043 A1044 L1051 F1053 F1066	Y832-V849 WeakPolarHBondContact CA-O 2.98Å; Y832-R850 HydrophobicContact CD1-CB 4.02Å; Y832-R850 HydrophobicContact CD1-CG 4.11Å; Y832-R850 HydrophobicContact CE1-CB 4.02Å; Y832-R850 HydrophobicContact CE1-CG 3.79Å; Y832-R850 VanDerWaalsContact CE1-NE 3.32Å; Y832-R850 PolarHBondContact OH-NH2 3.32Å; Y832-R1043 CarbonylContact O-C 3.51Å; Y832-R1043 WeakPolarHBondContact O-CA 3.4Å; Y832-A1044 WeakPolarHBondContact CB-O 3.45Å; Y832-A1044 PolarHBondContact O-N 2.78Å; Y832-L1051 HydrophobicContact CD1-CD1 4Å; Y832-L1051 HydrophobicContact CD2-CD1 4.07Å; Y832-L1051 HydrophobicContact CD2-CD2 4.45Å; Y832-L1051 HydrophobicContact CG-CD1 3.68Å; Y832-F1053 HydrophobicContact CD1-CB 4.15Å; Y832-F1053 AromaticContact CD1-CD2 3.3Å; Y832-F1053 HydrophobicContact CD1-CD2 3.3Å; Y832-F1053 AromaticContact CD1-CE2 3.75Å; Y832-F1053 HydrophobicContact CD1-CE2 3.75Å; Y832-F1053 AromaticContact CD1-CG 3.8Å; Y832-F1053 HydrophobicContact CD1-CG 3.8Å; Y832-F1053 HydrophobicContact CE1-CB 3.78Å; Y832-F1053 HydrophobicContact CE1-CD1 4.34Å; Y832-F1053 AromaticContact CE1-CD2 3.72Å; Y832-F1053 HydrophobicContact CE1-CD2 3.72Å; Y832-F1053 HydrophobicContact CE1-CE2 4.35Å; Y832-F1053 AromaticContact CE1-CG 3.69Å; Y832-F1053 HydrophobicContact CE1-CG 3.69Å; Y832-F1053 HydrophobicContact CG-CD2 4.28Å; Y832-F1066 HydrophobicContact CD2-CZ 4.35Å; Y832-F1066 AromaticContact CE2-CE1 3.95Å; Y832-F1066 HydrophobicContact CE2-CE1 3.95Å; Y832-F1066 AromaticContact CE2-CZ 3.94Å; Y832-F1066 HydrophobicContact CE2-CZ 3.94Å
833	Y	96.4	Very high	90.2	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	148.3	-178.1	-60.5	-88.6	0	0	0	111.6	F827 G829 K830 L835 Q848 V849 M851 L1000 E1040 W1042 R1043	F827-Y833 AromaticContact CE1-CD1 3.82Å; F827-Y833 HydrophobicContact CE1-CD1 3.82Å; F827-Y833 HydrophobicContact CE1-CD2 4.28Å; F827-Y833 AromaticContact CE1-CE1 3.75Å; F827-Y833 HydrophobicContact CE1-CE1 3.75Å; F827-Y833 HydrophobicContact CE1-CE2 4.2Å; F827-Y833 HydrophobicContact CE1-CG 4.1Å; F827-Y833 AromaticContact CE1-CZ 3.93Å; F827-Y833 AromaticContact CZ-CD1 3.98Å; F827-Y833 HydrophobicContact CZ-CD1 3.98Å; F827-Y833 AromaticContact CZ-CE1 3.48Å; F827-Y833 HydrophobicContact CZ-CE1 3.48Å; F827-Y833 VanDerWaalsContact CZ-CE1 3.48Å; F827-Y833 HydrophobicContact CZ-CE2 4.42Å; F827-Y833 AromaticContact CZ-CZ 3.72Å; G829-Y833 VanDerWaalsContact C-OH 3.23Å; G829-Y833 WeakPolarHBondContact CA-OH 3.2Å; K830-Y833 PolarHBondContact N-OH 3.46Å; K830-Y833 PolarHBondContact O-OH 3.32Å; Y833-L835 PolarHBondContact O-N 3.37Å; Y833-Q848 CarbonylContact O-C 3.55Å; Y833-Q848 VanDerWaalsContact O-CA 3.24Å; Y833-Q848 WeakPolarHBondContact O-CA 3.15Å; Y833-V849 PolarHBondContact N-O 3.38Å; Y833-V849 PolarHBondContact O-N 3.08Å; Y833-M851 HydrophobicContact CD2-CB 4.36Å; Y833-M851 HydrophobicContact CD2-CG 4.19Å; Y833-M851 HydrophobicContact CD2-SD 3.99Å; Y833-M851 HydrophobicContact CE2-CB 4.35Å; Y833-M851 HydrophobicContact CE2-SD 4.41Å; Y833-L1000 HydrophobicContact CG-CD1 4.26Å; Y833-E1040 PolarHBondContact OH-OE1 2.76Å; Y833-W1042 WeakPolarHBondContact CA-O 3.46Å; Y833-R1043 HydrophobicContact CD1-CB 4.19Å; Y833-R1043 HydrophobicContact CE1-CB 4.01Å; Y833-R1043 HydrophobicContact CE1-CG 4.39Å; Y833-R1043 PolarHBondContact OH-NH2 3.17Å
834	V	95.8	Very high	89.8	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	106.6	172.7	-179	0	0	0	0	108.6	M837 L1000 W1042 A1044 H1049	V834-M837 HydrophobicContact CG1-CB 3.99Å; V834-L1000 WeakPolarHBondContact O-CG 3.17Å; V834-L1000 PolarHBondContact O-N 3.38Å; V834-W1042 HydrophobicContact CB-CE3 3.96Å; V834-W1042 HydrophobicContact CG1-CE3 4.22Å; V834-W1042 HydrophobicContact CG1-CZ3 4.38Å; V834-W1042 PolarHBondContact N-O 3.44Å; V834-A1044 HydrophobicContact CG2-CB 4.17Å; V834-H1049 HydrophobicContact CG2-CB 4.01Å
835	L	96.6	Very high	89.5	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	-49.1	176.7	-176.2	64.8	0	0	0	110.2	I811 F817 Y833 V847 V849 V955 V957 L1000 L1001	I811-L835 HydrophobicContact CB-CD1 4.26Å; I811-L835 HydrophobicContact CD1-CD1 4.45Å; I811-L835 HydrophobicContact CG2-CD1 3.91Å; I811-L835 HydrophobicContact CG2-CD2 4.12Å; F817-L835 HydrophobicContact CD1-CD1 4.44Å; F817-L835 HydrophobicContact CE1-CD1 3.87Å; Y833-L835 PolarHBondContact O-N 3.37Å; L835-V847 HydrophobicContact CB-CB 4.48Å; L835-V847 HydrophobicContact CB-CG1 4.26Å; L835-V847 HydrophobicContact CD2-CG1 4.05Å; L835-V847 PolarHBondContact N-O 3.15Å; L835-V849 HydrophobicContact CB-CG1 4Å; L835-V849 HydrophobicContact CB-CG2 4.25Å; L835-V849 HydrophobicContact CD1-CG1 4.37Å; L835-V849 HydrophobicContact CD2-CG1 3.77Å; L835-V849 HydrophobicContact CG-CG1 4.26Å; L835-V955 HydrophobicContact CD2-CB 4.44Å; L835-V955 HydrophobicContact CD2-CG1 4.01Å; L835-V957 HydrophobicContact CD2-CG2 3.69Å; L835-V957 HydrophobicContact CG-CG2 4.47Å; L835-L1000 HydrophobicContact CD1-CB 4.42Å; L835-L1000 PolarHBondContact O-N 2.73Å; L835-L1000 VanDerWaalsContact O-N 3.09Å; L835-L1001 HydrophobicContact CD1-CD1 4.06Å; L835-L1001 HydrophobicContact CD1-CD2 4.02Å; L835-L1001 HydrophobicContact CD1-CG 3.69Å; L835-L1001 HydrophobicContact CD2-CD1 4.09Å; L835-L1001 HydrophobicContact CG-CD1 3.75Å; L835-L1001 HydrophobicContact CG-CG 3.85Å; L835-L1001 PolarHBondContact O-N 3.43Å
836	T	94.3	Very high	89.4	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.006	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	146.9	172.6	-164.6	0	0	0	0	110.1	Y820 V847 V957 M998	Y820-T836 VanDerWaalsContact OH-CB 3.31Å; Y820-T836 WeakPolarHBondContact OH-CB 3.4Å; Y820-T836 WeakPolarHBondContact OH-CG2 3.37Å; Y820-T836 PolarHBondContact OH-OG1 2.86Å; T836-V847 HydrophobicContact CG2-CB 3.73Å; T836-V847 HydrophobicContact CG2-CG2 3.62Å; T836-V847 PolarHBondContact N-O 2.72Å; T836-V847 PolarHBondContact O-N 3.43Å; T836-V957 HydrophobicContact CG2-CG1 3.92Å; T836-M998 CarbonylContact C-O 3.59Å
837	M	90	Very high	89.5	Confident	38 Å²	38	32.9 Å²	32.9	19%	0.187	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	128.7	171.5	-179.7	-177.8	66.9	0	0	107.7	V834 M845 M846 T997 M998	V834-M837 HydrophobicContact CG1-CB 3.99Å; M837-M845 WeakPolarHBondContact CA-O 3.48Å; M837-M846 HydrophobicContact CG-CE 4.38Å; M837-M846 HydrophobicContact SD-CE 4.15Å; M837-T997 WeakPolarHBondContact O-CA 3.3Å; M837-M998 PolarHBondContact N-O 2.88Å; M837-M998 PolarHBondContact O-N 3.32Å
838	L	87.5	Confident	89.6	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	115.3	-178.6	-52.4	169.5	0	0	0	108	N844 M845 L942 V959 Y963 T997	L838-N844 CarbonylContact O-C 3.51Å; L838-N844 WeakPolarHBondContact O-CA 3.32Å; L838-M845 HydrophobicContact CB-CB 4.05Å; L838-M845 HydrophobicContact CB-CG 4.4Å; L838-M845 HydrophobicContact CB-SD 4.15Å; L838-M845 HydrophobicContact CD1-CB 4.32Å; L838-M845 HydrophobicContact CD1-SD 3.53Å; L838-M845 VanDerWaalsContact CD1-SD 3.53Å; L838-M845 HydrophobicContact CG-CB 4.46Å; L838-M845 HydrophobicContact CG-SD 4.4Å; L838-M845 PolarHBondContact N-O 3.01Å; L838-M845 PolarHBondContact O-N 3.46Å; L838-L942 HydrophobicContact CD1-CD1 3.67Å; L838-L942 HydrophobicContact CD1-CD2 4.22Å; L838-L942 HydrophobicContact CD1-CG 4.41Å; L838-V959 HydrophobicContact CD1-CG1 4.13Å; L838-V959 HydrophobicContact CD1-CG2 4.17Å; L838-V959 HydrophobicContact CD2-CG1 3.96Å; L838-V959 HydrophobicContact CD2-CG2 4.31Å; L838-Y963 HydrophobicContact CB-CD1 4Å; L838-Y963 HydrophobicContact CB-CE1 4.37Å; L838-T997 HydrophobicContact CD2-CG2 3.19Å; L838-T997 WeakPolarHBondContact CD2-OG1 3.35Å
839	K	79.2	Confident	89.8	Confident	114 Å²	114	32.5 Å²	32.5	50%	0.496	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	119.9	177.9	-171.2	169.2	-177.2	171.1	0	110.3	Y995 R996	K839-Y995 HydrophobicContact CG-CD1 4.42Å; K839-Y995 CarbonylContact O-C 3.58Å; K839-Y995 VanDerWaalsContact O-C 3.31Å; K839-Y995 WeakPolarHBondContact O-CA 3.45Å; K839-Y995 WeakPolarHBondContact O-CB 3.25Å; K839-R996 PolarHBondContact N-O 2.82Å; K839-R996 PolarHBondContact O-N 2.92Å
840	S	76.5	Confident	89.9	Confident	27 Å²	27	32.6 Å²	32.6	19%	0.189	16%	0.159	C	C	.	.			trans	-124.1	176.7	172.9	72.5	0	0	0	0	110.2	S842 N843 Y995	S840-S842 PolarHBondContact O-N 2.99Å; S840-N843 PolarHBondContact N-O 3.4Å; S840-N843 WeakPolarHBondContact OG-CA 3.45Å; S840-N843 VanDerWaalsContact OG-CB 3.27Å; S840-N843 WeakPolarHBondContact OG-CB 3.44Å; S840-N843 PolarHBondContact OG-N 2.74Å; S840-N843 PolarHBondContact OG-O 2.92Å; S840-Y995 VanDerWaalsContact O-CD1 3.32Å; S840-Y995 WeakPolarHBondContact O-CD1 3.27Å; S840-Y995 VanDerWaalsContact O-CE1 3.27Å; S840-Y995 WeakPolarHBondContact O-CE1 3.48Å
841	R	71.1	Confident	89.9	Confident	208 Å²	208	32.1 Å²	32.1	79%	0.785	16%	0.157	S	C	*	.	S	Bend	trans	-60.2	-34.2	-178.1	-176.2	171.7	177.8	-176.5	0.3	113.3	Y995	R841-Y995 HydrophobicContact CB-CE1 3.94Å; R841-Y995 HydrophobicContact CB-CE2 3.94Å; R841-Y995 WeakPolarHBondContact CG-OH 3.36Å
842	S	76.4	Confident	89.9	Confident	93 Å²	93	32 Å²	32	65%	0.65	16%	0.156	S	C	*	.	S	Bend	trans	-112.2	-20.5	-176.6	52.8	0	0	0	0	113.6	S840	S840-S842 PolarHBondContact O-N 2.99Å
843	N	85.1	Confident	89.7	Confident	37 Å²	37	31.1 Å²	31.1	20%	0.198	15%	0.153	C	C	.	.			trans	-126.2	139.3	-172	-48.6	-51.2	0	0	0	112.3	S840 M845 N876 T940 Y963	S840-N843 PolarHBondContact N-O 3.4Å; S840-N843 WeakPolarHBondContact OG-CA 3.45Å; S840-N843 VanDerWaalsContact OG-CB 3.27Å; S840-N843 WeakPolarHBondContact OG-CB 3.44Å; S840-N843 PolarHBondContact OG-N 2.74Å; S840-N843 PolarHBondContact OG-O 2.92Å; N843-M845 HydrophobicContact CB-CE 3.87Å; N843-N876 VanDerWaalsContact CA-OD1 3.22Å; N843-N876 WeakPolarHBondContact CA-OD1 3.21Å; N843-N876 PolarHBondContact OD1-ND2 3.32Å; N843-N876 VanDerWaalsContact OD1-ND2 3.15Å; N843-T940 HydrophobicContact CB-CG2 4.05Å; N843-Y963 PolarHBondContact ND2-OH 3.25Å
844	N	86.9	Confident	89.3	Confident	82 Å²	82	31.9 Å²	31.9	44%	0.439	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	118.1	175.1	-179	33.1	0	0	0	109	L838 N876	L838-N844 CarbonylContact O-C 3.51Å; L838-N844 WeakPolarHBondContact O-CA 3.32Å; N844-N876 PolarHBondContact N-OD1 2.83Å; N844-N876 PolarHBondContact O-N 3.05Å
845	M	90.3	Very high	88.6	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	148.9	-178	-51.7	167.6	-152.1	0	0	110.5	M837 L838 N843 Q874 D875 T940 L942 Y963	M837-M845 WeakPolarHBondContact CA-O 3.48Å; L838-M845 HydrophobicContact CB-CB 4.05Å; L838-M845 HydrophobicContact CB-CG 4.4Å; L838-M845 HydrophobicContact CB-SD 4.15Å; L838-M845 HydrophobicContact CD1-CB 4.32Å; L838-M845 HydrophobicContact CD1-SD 3.53Å; L838-M845 VanDerWaalsContact CD1-SD 3.53Å; L838-M845 HydrophobicContact CG-CB 4.46Å; L838-M845 HydrophobicContact CG-SD 4.4Å; L838-M845 PolarHBondContact N-O 3.01Å; L838-M845 PolarHBondContact O-N 3.46Å; N843-M845 HydrophobicContact CB-CE 3.87Å; M845-Q874 WeakPolarHBondContact CA-O 3.48Å; M845-D875 HydrophobicContact CG-CB 4.01Å; M845-D875 VanDerWaalsContact CG-OD1 3.23Å; M845-D875 WeakPolarHBondContact CG-OD1 3.46Å; M845-T940 HydrophobicContact CE-CG2 3.62Å; M845-T940 WeakPolarHBondContact CE-OG1 3.48Å; M845-T940 PolarHBondContact SD-OG1 3.25Å; M845-T940 VanDerWaalsContact SD-OG1 3.42Å; M845-L942 HydrophobicContact CB-CD2 4.19Å; M845-L942 HydrophobicContact CG-CD2 4.48Å; M845-L942 HydrophobicContact SD-CB 3.76Å; M845-L942 HydrophobicContact SD-CD2 3.81Å; M845-L942 HydrophobicContact SD-CG 4.31Å; M845-Y963 HydrophobicContact CE-CE1 3.71Å; M845-Y963 HydrophobicContact CE-CE2 3.84Å; M845-Y963 WeakPolarHBondContact CE-OH 3.43Å
846	M	92.7	Very high	88	Confident	26 Å²	26	40 Å²	40	13%	0.128	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	130.6	177.4	-170.6	172.7	-67.4	0	0	110.1	M837 Q848 A873 Q874 L1052	M837-M846 HydrophobicContact CG-CE 4.38Å; M837-M846 HydrophobicContact SD-CE 4.15Å; M846-Q848 HydrophobicContact CG-CG 4.02Å; M846-Q848 HydrophobicContact SD-CG 4.29Å; M846-Q848 PolarHBondContact SD-NE2 3.23Å; M846-A873 WeakPolarHBondContact O-CA 3.36Å; M846-Q874 PolarHBondContact N-O 3.08Å; M846-Q874 PolarHBondContact O-N 3.35Å; M846-L1052 HydrophobicContact CB-CD1 4.18Å; M846-L1052 HydrophobicContact CG-CD1 4.28Å
847	V	96.9	Very high	87.3	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.006	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	127.4	171.1	-174.4	0	0	0	0	107.5	L835 T836 V871 A872 A873 L942 L944	L835-V847 HydrophobicContact CB-CB 4.48Å; L835-V847 HydrophobicContact CB-CG1 4.26Å; L835-V847 HydrophobicContact CD2-CG1 4.05Å; L835-V847 PolarHBondContact N-O 3.15Å; T836-V847 HydrophobicContact CG2-CB 3.73Å; T836-V847 HydrophobicContact CG2-CG2 3.62Å; T836-V847 PolarHBondContact N-O 2.72Å; T836-V847 PolarHBondContact O-N 3.43Å; V847-V871 HydrophobicContact CG1-CG1 4.11Å; V847-A872 CarbonylContact C-O 3.6Å; V847-A872 WeakPolarHBondContact CA-O 3.25Å; V847-A873 HydrophobicContact CG1-CB 4.37Å; V847-A873 HydrophobicContact CG2-CB 4.11Å; V847-L942 HydrophobicContact CG2-CD2 3.98Å; V847-L944 HydrophobicContact CG1-CD1 4.38Å; V847-L944 HydrophobicContact CG1-CD2 4.15Å; V847-L944 HydrophobicContact CG2-CD1 4.49Å; V847-L944 HydrophobicContact CG2-CD2 3.92Å
848	Q	97.1	Very high	86.4	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	150.1	-179.7	-60.5	-178.8	-13.5	0	0	109.9	Y833 M846 V871 A872 H1050 L1052 F1053	Y833-Q848 CarbonylContact O-C 3.55Å; Y833-Q848 VanDerWaalsContact O-CA 3.24Å; Y833-Q848 WeakPolarHBondContact O-CA 3.15Å; M846-Q848 HydrophobicContact CG-CG 4.02Å; M846-Q848 HydrophobicContact SD-CG 4.29Å; M846-Q848 PolarHBondContact SD-NE2 3.23Å; Q848-V871 CarbonylContact O-C 3.27Å; Q848-V871 WeakPolarHBondContact O-CA 3.43Å; Q848-A872 PolarHBondContact N-O 3.23Å; Q848-A872 PolarHBondContact O-N 2.86Å; Q848-H1050 PolarHBondContact NE2-O 2.63Å; Q848-L1052 HydrophobicContact CG-CD1 4.36Å; Q848-F1053 HydrophobicContact CB-CD2 4.15Å; Q848-F1053 HydrophobicContact CB-CE2 3.62Å
849	V	97.3	Very high	85.7	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	146	174.2	-71.3	0	0	0	0	110.2	Y832 Y833 L835 M851 V868 G870 V871	Y832-V849 WeakPolarHBondContact CA-O 2.98Å; Y833-V849 PolarHBondContact N-O 3.38Å; Y833-V849 PolarHBondContact O-N 3.08Å; L835-V849 HydrophobicContact CB-CG1 4Å; L835-V849 HydrophobicContact CB-CG2 4.25Å; L835-V849 HydrophobicContact CD1-CG1 4.37Å; L835-V849 HydrophobicContact CD2-CG1 3.77Å; L835-V849 HydrophobicContact CG-CG1 4.26Å; V849-M851 HydrophobicContact CG2-CG 4.16Å; V849-M851 HydrophobicContact CG2-SD 4.4Å; V849-V868 HydrophobicContact CB-CG1 4.14Å; V849-V868 HydrophobicContact CG1-CG1 4.1Å; V849-G870 CarbonylContact C-O 3.31Å; V849-G870 WeakPolarHBondContact CA-O 3.41Å; V849-V871 HydrophobicContact CG1-CG2 4.39Å
850	R	95.4	Very high	85.7	Confident	1 Å²	1	46.9 Å²	46.9	0%	0.004	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	120.4	168.6	-177.7	-170.7	-60.8	-164.1	-9	108	Y832 E852 V868 T869 G870 Y884 F1053 F1057 Q1058 F1066	Y832-R850 HydrophobicContact CD1-CB 4.02Å; Y832-R850 HydrophobicContact CD1-CG 4.11Å; Y832-R850 HydrophobicContact CE1-CB 4.02Å; Y832-R850 HydrophobicContact CE1-CG 3.79Å; Y832-R850 VanDerWaalsContact CE1-NE 3.32Å; Y832-R850 PolarHBondContact OH-NH2 3.32Å; R850-E852 WeakPolarHBondContact CD-OE1 3.32Å; R850-E852 HydrophobicContact CG-CG 4.18Å; R850-V868 WeakPolarHBondContact O-CA 3.41Å; R850-T869 PolarHBondContact O-N 2.72Å; R850-T869 PolarHBondContact O-OG1 2.8Å; R850-G870 PolarHBondContact N-O 3.02Å; R850-Y884 VanDerWaalsContact CZ-CE1 3.45Å; R850-Y884 PolarHBondContact NH2-OH 3.15Å; R850-F1053 HydrophobicContact CB-CE1 4.23Å; R850-F1053 HydrophobicContact CB-CE2 4.33Å; R850-F1053 HydrophobicContact CB-CZ 3.93Å; R850-F1057 VanDerWaalsContact CZ-O 3.23Å; R850-F1057 PolarHBondContact NH1-O 3.44Å; R850-F1057 PolarHBondContact NH2-O 3.28Å; R850-Q1058 VanDerWaalsContact NH1-C 3.33Å; R850-Q1058 PolarHBondContact NH1-O 3.07Å; R850-Q1058 VanDerWaalsContact NH1-O 3.15Å; R850-F1066 HydrophobicContact CG-CE2 4.36Å; R850-F1066 HydrophobicContact CG-CZ 4.33Å
851	M	95	Very high	85.9	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	117.8	-179.5	-60.5	-173.8	78.6	0	0	110.2	I811 F817 F827 G829 G831 Y833 V849 V867 F1066	I811-M851 HydrophobicContact CD1-CE 4.11Å; I811-M851 HydrophobicContact CD1-SD 4.37Å; F817-M851 HydrophobicContact CE2-CE 4.39Å; F817-M851 HydrophobicContact CZ-CE 4.32Å; F817-M851 HydrophobicContact CZ-SD 4.36Å; F827-M851 HydrophobicContact CD1-SD 4.37Å; F827-M851 HydrophobicContact CE1-SD 4.39Å; F827-M851 WeakPolarHBondContact O-CE 3.49Å; G829-M851 WeakPolarHBondContact O-CB 3.07Å; G831-M851 PolarHBondContact N-O 3.45Å; G831-M851 PolarHBondContact O-N 3.18Å; Y833-M851 HydrophobicContact CD2-CB 4.36Å; Y833-M851 HydrophobicContact CD2-CG 4.19Å; Y833-M851 HydrophobicContact CD2-SD 3.99Å; Y833-M851 HydrophobicContact CE2-CB 4.35Å; Y833-M851 HydrophobicContact CE2-SD 4.41Å; V849-M851 HydrophobicContact CG2-CG 4.16Å; V849-M851 HydrophobicContact CG2-SD 4.4Å; M851-V867 VanDerWaalsContact CA-O 3.32Å; M851-V867 WeakPolarHBondContact CA-O 3.19Å; M851-F1066 WeakPolarHBondContact O-CE2 3.15Å
852	E	92	Very high	86.5	Confident	3 Å²	3	40.6 Å²	40.6	1%	0.014	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	154.9	-175.6	-65.5	178.7	-140.4	0	0	111	R850 T866 V867 T869 P1059 I1060 Y1061 F1066	R850-E852 WeakPolarHBondContact CD-OE1 3.32Å; R850-E852 HydrophobicContact CG-CG 4.18Å; E852-T866 CarbonylContact O-C 3.44Å; E852-T866 WeakPolarHBondContact O-CA 3.37Å; E852-T866 WeakPolarHBondContact O-CB 3.33Å; E852-V867 PolarHBondContact N-O 3.47Å; E852-V867 PolarHBondContact O-N 3.32Å; E852-T869 HydrophobicContact CB-CG2 3.86Å; E852-T869 HydrophobicContact CG-CG2 4.09Å; E852-T869 WeakPolarHBondContact CG-OG1 3.45Å; E852-T869 WeakPolarHBondContact OE1-CB 3.29Å; E852-T869 PolarHBondContact OE1-OG1 2.89Å; E852-P1059 VanDerWaalsContact CD-CB 3.46Å; E852-P1059 HydrophobicContact CG-CB 4.26Å; E852-P1059 VanDerWaalsContact OE1-CA 3.27Å; E852-P1059 WeakPolarHBondContact OE1-CA 3.31Å; E852-P1059 VanDerWaalsContact OE2-CB 3.31Å; E852-P1059 WeakPolarHBondContact OE2-CB 3.27Å; E852-I1060 PolarHBondContact OE1-N 2.94Å; E852-I1060 PolarHBondContact OE2-N 3.08Å; E852-Y1061 PolarHBondContact OE2-N 2.85Å; E852-F1066 HydrophobicContact CB-CD2 4.42Å; E852-F1066 HydrophobicContact CG-CD2 3.71Å; E852-F1066 HydrophobicContact CG-CE2 3.84Å
853	Q	91.1	Very high	86.9	Confident	21 Å²	21	36.4 Å²	36.4	10%	0.098	19%	0.19	C	C	.	.			trans	-66.8	130.8	167.2	-66	178.8	-88.9	0	0	108.8	K830 V863 T866 Y1061 S1065 Y1071	K830-Q853 HydrophobicContact CD-CG 4.21Å; Q853-V863 PolarHBondContact NE2-O 3.06Å; Q853-T866 HydrophobicContact CG-CG2 4.23Å; Q853-Y1061 WeakPolarHBondContact O-CD2 3.46Å; Q853-S1065 PolarHBondContact OE1-OG 3.36Å; Q853-S1065 VanDerWaalsContact OE1-OG 3.05Å; Q853-Y1071 HydrophobicContact CG-CD2 4.25Å; Q853-Y1071 HydrophobicContact CG-CE2 3.85Å
854	P	88.1	Confident	87.1	Confident	17 Å²	17	37.9 Å²	37.9	11%	0.11	20%	0.197	C	C	.	.			trans	-66.4	176.4	176.5	28.8	-33.4	0	0	0	111	V863 A865 V867	P854-V863 HydrophobicContact CG-CB 3.76Å; P854-V863 HydrophobicContact CG-CG1 3.75Å; P854-V863 HydrophobicContact CG-CG2 4.07Å; P854-A865 VanDerWaalsContact CD-O 3.25Å; P854-A865 WeakPolarHBondContact CD-O 3.08Å; P854-V867 HydrophobicContact CB-CG1 4.18Å; P854-V867 HydrophobicContact CB-CG2 3.94Å; P854-V867 HydrophobicContact CG-CG1 4.23Å
855	P	82.2	Confident	87.2	Confident	70 Å²	70	34 Å²	34	46%	0.455	18%	0.176	S	C	.	.	S	Bend	trans	-53.1	155.8	172.8	-24.9	34.9	0	0	0	111.9	Y1061	P855-Y1061 VanDerWaalsContact CD-CE1 3.44Å; P855-Y1061 HydrophobicContact CG-CD1 3.55Å; P855-Y1061 HydrophobicContact CG-CE1 3.29Å; P855-Y1061 HydrophobicContact CG-CG 4.36Å
856	K	83.2	Confident	87.4	Confident	101 Å²	101	34 Å²	34	44%	0.439	18%	0.176	S	C	.	.	P	Polyproline II helix	trans	-55	149.8	175.7	-67.4	-174.2	176.9	-171.7	0	111.8	N860 A861 N862	K856-N860 WeakPolarHBondContact CD-OD1 2.86Å; K856-N860 PolarHBondContact NZ-OD1 2.9Å; K856-N860 VanDerWaalsContact NZ-OD1 3.14Å; K856-A861 CarbonylContact C-O 3.36Å; K856-A861 WeakPolarHBondContact CA-O 3.29Å; K856-A861 VanDerWaalsContact CB-O 3.25Å; K856-A861 WeakPolarHBondContact CB-O 3.42Å; K856-N862 VanDerWaalsContact CE-OD1 3.22Å; K856-N862 WeakPolarHBondContact CE-OD1 3.49Å
857	T	79.4	Confident	87.4	Confident	8 Å²	8	32.9 Å²	32.9	5%	0.049	17%	0.171	C	C	.	.	P	Polyproline II helix	trans	-58.9	166.9	174.3	60.4	0	0	0	0	111.7	W859 N860 A861 V863 T1110	T857-W859 HydrophobicContact CG2-CZ2 3.77Å; T857-W859 PolarHBondContact O-N 3.28Å; T857-W859 VanDerWaalsContact O-N 3.08Å; T857-W859 PolarHBondContact OG1-NE1 3.1Å; T857-N860 PolarHBondContact O-N 3.22Å; T857-A861 PolarHBondContact N-O 2.91Å; T857-A861 PolarHBondContact OG1-N 3.25Å; T857-A861 PolarHBondContact OG1-O 2.78Å; T857-V863 HydrophobicContact CG2-CG2 3.55Å; T857-T1110 WeakPolarHBondContact CG2-O 3.21Å
858	M	71.8	Confident	87.4	Confident	108 Å²	108	32.8 Å²	32.8	53%	0.532	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-23.1	176.3	-67	-165	-62.7	0	0	113.5	I1090 G1112 R1113	M858-I1090 HydrophobicContact CE-CG2 4.16Å; M858-G1112 WeakPolarHBondContact CE-O 3.46Å; M858-R1113 HydrophobicContact CG-CG 4.35Å; M858-R1113 HydrophobicContact SD-CG 4.44Å
859	W	72.9	Confident	87.2	Confident	64 Å²	64	32.8 Å²	32.8	24%	0.242	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	19.7	177.1	49.6	-89.1	0	0	0	113.1	T857 A861 T1084 W1086 E1087	T857-W859 HydrophobicContact CG2-CZ2 3.77Å; T857-W859 PolarHBondContact O-N 3.28Å; T857-W859 VanDerWaalsContact O-N 3.08Å; T857-W859 PolarHBondContact OG1-NE1 3.1Å; W859-A861 HydrophobicContact CD2-CB 4.17Å; W859-A861 HydrophobicContact CE3-CB 3.37Å; W859-A861 HydrophobicContact CH2-CB 3.22Å; W859-A861 HydrophobicContact CZ2-CB 4.01Å; W859-A861 HydrophobicContact CZ3-CB 2.89Å; W859-A861 PolarHBondContact O-N 3.04Å; W859-T1084 HydrophobicContact CE3-CG2 4.33Å; W859-T1084 HydrophobicContact CZ3-CG2 3.9Å; W859-W1086 HydrophobicContact CB-CB 4.25Å; W859-E1087 HydrophobicContact CD2-CG 3.9Å; W859-E1087 HydrophobicContact CE3-CG 4.38Å; W859-E1087 HydrophobicContact CG-CG 4.44Å; W859-E1087 VanDerWaalsContact CH2-CD 3.41Å; W859-E1087 HydrophobicContact CH2-CG 3.98Å; W859-E1087 WeakPolarHBondContact CH2-OE1 3.04Å; W859-E1087 HydrophobicContact CZ2-CG 3.48Å; W859-E1087 VanDerWaalsContact CZ2-CG 3.48Å; W859-E1087 VanDerWaalsContact CZ2-OE1 3.29Å; W859-E1087 WeakPolarHBondContact CZ2-OE1 3.36Å; W859-E1087 HydrophobicContact CZ3-CG 4.35Å; W859-E1087 WeakPolarHBondContact CZ3-OE1 3.14Å
860	N	78.3	Confident	87.2	Confident	116 Å²	116	32.8 Å²	32.8	62%	0.62	17%	0.17	S	C	*	.	S	Bend	trans	64.2	32.9	170.6	-169	30.5	0	0	0	115.7	K856 T857	K856-N860 WeakPolarHBondContact CD-OD1 2.86Å; K856-N860 PolarHBondContact NZ-OD1 2.9Å; K856-N860 VanDerWaalsContact NZ-OD1 3.14Å; T857-N860 PolarHBondContact O-N 3.22Å
861	A	81.3	Confident	87.3	Confident	25 Å²	25	32.9 Å²	32.9	21%	0.207	17%	0.171	C	C	.	.			trans	-109.4	157.7	168.6	0	0	0	0	0	113	K856 T857 W859 V863	K856-A861 CarbonylContact C-O 3.36Å; K856-A861 WeakPolarHBondContact CA-O 3.29Å; K856-A861 VanDerWaalsContact CB-O 3.25Å; K856-A861 WeakPolarHBondContact CB-O 3.42Å; T857-A861 PolarHBondContact N-O 2.91Å; T857-A861 PolarHBondContact OG1-N 3.25Å; T857-A861 PolarHBondContact OG1-O 2.78Å; W859-A861 HydrophobicContact CD2-CB 4.17Å; W859-A861 HydrophobicContact CE3-CB 3.37Å; W859-A861 HydrophobicContact CH2-CB 3.22Å; W859-A861 HydrophobicContact CZ2-CB 4.01Å; W859-A861 HydrophobicContact CZ3-CB 2.89Å; W859-A861 PolarHBondContact O-N 3.04Å; A861-V863 PolarHBondContact O-N 3.45Å
862	N	83.2	Confident	87.4	Confident	79 Å²	79	32.9 Å²	32.9	42%	0.422	17%	0.171	S	C	.	.			trans	-72	128.5	175.6	-63.4	-21.3	0	0	0	109.1	K856 M864	K856-N862 VanDerWaalsContact CE-OD1 3.22Å; K856-N862 WeakPolarHBondContact CE-OD1 3.49Å; N862-M864 PolarHBondContact O-N 3.49Å
863	V	85.7	Confident	87.7	Confident	4 Å²	4	32.9 Å²	32.9	2%	0.024	17%	0.171	C	C	.	.			trans	-68.3	122.1	171.8	179.4	0	0	0	0	108	Q853 P854 T857 A861 A865	Q853-V863 PolarHBondContact NE2-O 3.06Å; P854-V863 HydrophobicContact CG-CB 3.76Å; P854-V863 HydrophobicContact CG-CG1 3.75Å; P854-V863 HydrophobicContact CG-CG2 4.07Å; T857-V863 HydrophobicContact CG2-CG2 3.55Å; A861-V863 PolarHBondContact O-N 3.45Å; V863-A865 HydrophobicContact CG1-CB 3.9Å; V863-A865 PolarHBondContact O-N 3.32Å; V863-A865 VanDerWaalsContact O-N 3.14Å
864	M	87.6	Confident	87.9	Confident	69 Å²	69	34.2 Å²	34.2	34%	0.34	18%	0.177	S	C	.	.	S	Bend	trans	-86.1	36	179.5	-56.9	-60.2	-74.6	0	0	111.7	N862 Q1072 P1073 I1074	N862-M864 PolarHBondContact O-N 3.49Å; M864-Q1072 HydrophobicContact CE-CB 4.27Å; M864-Q1072 WeakPolarHBondContact CE-O 3.46Å; M864-P1073 CarbonylContact O-C 3.56Å; M864-P1073 VanDerWaalsContact O-CA 3.32Å; M864-P1073 WeakPolarHBondContact O-CA 3.47Å; M864-I1074 HydrophobicContact CB-CB 4.26Å; M864-I1074 WeakPolarHBondContact O-CG2 3.23Å; M864-I1074 PolarHBondContact O-N 2.92Å
865	A	90.4	Very high	88.1	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.174	C	C	.	.	S	Bend	trans	-136.3	168	176.5	0	0	0	0	0	108.9	E814 N828 P854 V863 I1074 F1106 T1110	E814-A865 HydrophobicContact CB-CB 4.2Å; E814-A865 VanDerWaalsContact OE2-CB 3.29Å; E814-A865 WeakPolarHBondContact OE2-CB 3.2Å; N828-A865 HydrophobicContact CB-CB 4.45Å; N828-A865 WeakPolarHBondContact OD1-CB 3.35Å; P854-A865 VanDerWaalsContact CD-O 3.25Å; P854-A865 WeakPolarHBondContact CD-O 3.08Å; V863-A865 HydrophobicContact CG1-CB 3.9Å; V863-A865 PolarHBondContact O-N 3.32Å; V863-A865 VanDerWaalsContact O-N 3.14Å; A865-I1074 HydrophobicContact CB-CG2 4.4Å; A865-F1106 HydrophobicContact CB-CE1 3.98Å; A865-F1106 HydrophobicContact CB-CZ 4.37Å; A865-T1110 HydrophobicContact CB-CG2 4.38Å
866	T	93.4	Very high	88.5	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.166	C	C	.	.			trans	-129.4	147.9	-176.3	55.9	0	0	0	0	112.7	E814 G815 N828 G829 K830 E852 Q853 Y1071	E814-T866 CarbonylContact C-O 3.59Å; E814-T866 VanDerWaalsContact CA-O 3.23Å; E814-T866 WeakPolarHBondContact CA-O 3.45Å; G815-T866 PolarHBondContact N-O 2.86Å; N828-T866 VanDerWaalsContact CA-OG1 3.31Å; N828-T866 WeakPolarHBondContact CA-OG1 3.14Å; N828-T866 PolarHBondContact O-OG1 2.85Å; N828-T866 PolarHBondContact OD1-N 3.4Å; G829-T866 PolarHBondContact N-OG1 3.03Å; G829-T866 VanDerWaalsContact O-CB 3.32Å; G829-T866 WeakPolarHBondContact O-CB 3.26Å; G829-T866 VanDerWaalsContact O-CG2 3.26Å; G829-T866 WeakPolarHBondContact O-CG2 2.94Å; G829-T866 PolarHBondContact O-OG1 3.32Å; K830-T866 HydrophobicContact CB-CG2 3.93Å; K830-T866 HydrophobicContact CG-CG2 4.35Å; E852-T866 CarbonylContact O-C 3.44Å; E852-T866 WeakPolarHBondContact O-CA 3.37Å; E852-T866 WeakPolarHBondContact O-CB 3.33Å; Q853-T866 HydrophobicContact CG-CG2 4.23Å; T866-Y1071 HydrophobicContact CG2-CE2 4.5Å; T866-Y1071 WeakPolarHBondContact CG2-OH 3.44Å
867	V	93.9	Very high	88.9	Confident	3 Å²	3	34.1 Å²	34.1	2%	0.018	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	154.9	176.8	-65.8	0	0	0	0	109.8	E814 M851 E852 P854 T869 T952 Y1061	E814-V867 HydrophobicContact CB-CG1 4.4Å; E814-V867 HydrophobicContact CG-CG1 3.81Å; M851-V867 VanDerWaalsContact CA-O 3.32Å; M851-V867 WeakPolarHBondContact CA-O 3.19Å; E852-V867 PolarHBondContact N-O 3.47Å; E852-V867 PolarHBondContact O-N 3.32Å; P854-V867 HydrophobicContact CB-CG1 4.18Å; P854-V867 HydrophobicContact CB-CG2 3.94Å; P854-V867 HydrophobicContact CG-CG1 4.23Å; V867-T869 HydrophobicContact CG2-CG2 4.19Å; V867-T869 PolarHBondContact O-N 3.34Å; V867-T952 HydrophobicContact CB-CG2 3.78Å; V867-T952 HydrophobicContact CG1-CG2 3.78Å; V867-T952 HydrophobicContact CG2-CG2 4.01Å; V867-Y1061 HydrophobicContact CG2-CE2 4.27Å
868	V	95.9	Very high	89.6	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	124.4	173	-172.5	0	0	0	0	109.4	I811 V849 R850 G870 V871 L953 V955	I811-V868 HydrophobicContact CD1-CG2 3.3Å; I811-V868 HydrophobicContact CG1-CG2 3.8Å; I811-V868 HydrophobicContact CG2-CG2 4.37Å; V849-V868 HydrophobicContact CB-CG1 4.14Å; V849-V868 HydrophobicContact CG1-CG1 4.1Å; R850-V868 WeakPolarHBondContact O-CA 3.41Å; V868-G870 WeakPolarHBondContact CG1-O 3.28Å; V868-V871 HydrophobicContact CG1-CG2 4.33Å; V868-L953 HydrophobicContact CB-CB 4.2Å; V868-L953 WeakPolarHBondContact CB-O 3.42Å; V868-L953 HydrophobicContact CG1-CB 4Å; V868-L953 PolarHBondContact O-N 2.97Å; V868-V955 HydrophobicContact CG1-CG2 4.26Å
869	T	94.3	Very high	90.7	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	-15.4	176.8	54.5	0	0	0	0	112.7	R850 E852 V867 Y884 A885 I1060 Y1061	R850-T869 PolarHBondContact O-N 2.72Å; R850-T869 PolarHBondContact O-OG1 2.8Å; E852-T869 HydrophobicContact CB-CG2 3.86Å; E852-T869 HydrophobicContact CG-CG2 4.09Å; E852-T869 WeakPolarHBondContact CG-OG1 3.45Å; E852-T869 WeakPolarHBondContact OE1-CB 3.29Å; E852-T869 PolarHBondContact OE1-OG1 2.89Å; V867-T869 HydrophobicContact CG2-CG2 4.19Å; V867-T869 PolarHBondContact O-N 3.34Å; T869-Y884 CarbonylContact O-C 3.49Å; T869-Y884 WeakPolarHBondContact O-CA 3.41Å; T869-A885 PolarHBondContact O-N 2.98Å; T869-I1060 HydrophobicContact CG2-CD1 4.25Å; T869-Y1061 HydrophobicContact CG2-CD2 4.11Å; T869-Y1061 HydrophobicContact CG2-CE2 3.76Å
870	G	95.8	Very high	91.8	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	151.3	179.3	0	0	0	0	0	113.4	V849 R850 V868 I883	V849-G870 CarbonylContact C-O 3.31Å; V849-G870 WeakPolarHBondContact CA-O 3.41Å; R850-G870 PolarHBondContact N-O 3.02Å; V868-G870 WeakPolarHBondContact CG1-O 3.28Å; G870-I883 CarbonylContact C-O 3.58Å; G870-I883 WeakPolarHBondContact CA-O 3.42Å
871	V	97.6	Very high	92.7	Very high	3 Å²	3	21.9 Å²	21.9	2%	0.018	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	134.6	174.5	-175.1	0	0	0	0	108.2	V847 Q848 V849 V868 E882 I883 V946 L953 V955	V847-V871 HydrophobicContact CG1-CG1 4.11Å; Q848-V871 CarbonylContact O-C 3.27Å; Q848-V871 WeakPolarHBondContact O-CA 3.43Å; V849-V871 HydrophobicContact CG1-CG2 4.39Å; V868-V871 HydrophobicContact CG1-CG2 4.33Å; V871-E882 CarbonylContact O-C 3.49Å; V871-E882 VanDerWaalsContact O-CA 3.3Å; V871-E882 WeakPolarHBondContact O-CA 3.37Å; V871-I883 PolarHBondContact N-O 3.29Å; V871-I883 PolarHBondContact O-N 2.91Å; V871-V946 HydrophobicContact CG2-CG1 4.44Å; V871-V946 HydrophobicContact CG2-CG2 4.37Å; V871-L953 HydrophobicContact CG2-CD1 4.11Å; V871-V955 HydrophobicContact CG1-CG1 4.38Å; V871-V955 HydrophobicContact CG2-CB 4.42Å; V871-V955 HydrophobicContact CG2-CG1 4.22Å; V871-V955 HydrophobicContact CG2-CG2 3.35Å
872	A	97.6	Very high	93.5	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	136.1	171.3	0	0	0	0	0	109.7	V847 Q848 V881 E882 L1052 F1053	V847-A872 CarbonylContact C-O 3.6Å; V847-A872 WeakPolarHBondContact CA-O 3.25Å; Q848-A872 PolarHBondContact N-O 3.23Å; Q848-A872 PolarHBondContact O-N 2.86Å; A872-V881 CarbonylContact C-O 3.59Å; A872-V881 VanDerWaalsContact CA-O 3.25Å; A872-V881 WeakPolarHBondContact CA-O 3.43Å; A872-E882 HydrophobicContact CB-CG 4.18Å; A872-L1052 HydrophobicContact CB-CB 3.82Å; A872-F1053 HydrophobicContact CB-CD1 3.71Å; A872-F1053 HydrophobicContact CB-CD2 3.93Å; A872-F1053 HydrophobicContact CB-CE1 3.6Å; A872-F1053 HydrophobicContact CB-CE2 3.83Å; A872-F1053 HydrophobicContact CB-CG 3.9Å; A872-F1053 HydrophobicContact CB-CZ 3.67Å; A872-F1053 VanDerWaalsContact N-CZ 3.35Å
873	A	97.2	Very high	94.2	Very high	2 Å²	2	17.1 Å²	17.1	2%	0.017	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	143.7	-179.3	0	0	0	0	0	112.4	M846 V847 V881 F938 L944	M846-A873 WeakPolarHBondContact O-CA 3.36Å; V847-A873 HydrophobicContact CG1-CB 4.37Å; V847-A873 HydrophobicContact CG2-CB 4.11Å; A873-V881 PolarHBondContact N-O 2.85Å; A873-V881 PolarHBondContact O-N 3.45Å; A873-F938 HydrophobicContact CB-CE2 3.84Å; A873-F938 HydrophobicContact CB-CZ 3.57Å; A873-L944 HydrophobicContact CB-CD1 3.51Å
874	Q	95.6	Very high	94.6	Very high	49 Å²	49	17.4 Å²	17.4	23%	0.229	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	139.8	175.3	-174.3	179	41.7	0	0	109.9	M845 M846 S878 I880 L1052	M845-Q874 WeakPolarHBondContact CA-O 3.48Å; M846-Q874 PolarHBondContact N-O 3.08Å; M846-Q874 PolarHBondContact O-N 3.35Å; Q874-S878 PolarHBondContact NE2-O 2.83Å; Q874-I880 HydrophobicContact CB-CG1 4.4Å; Q874-I880 HydrophobicContact CG-CG1 4.29Å; Q874-L1052 HydrophobicContact CB-CD1 3.96Å; Q874-L1052 HydrophobicContact CB-CD2 4.04Å
875	D	92.7	Very high	94.9	Very high	6 Å²	6	14.3 Å²	14.3	3%	0.032	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	114.8	173.1	174.8	17.8	0	0	0	109.4	M845 D877 S878 F938 T940	M845-D875 HydrophobicContact CG-CB 4.01Å; M845-D875 VanDerWaalsContact CG-OD1 3.23Å; M845-D875 WeakPolarHBondContact CG-OD1 3.46Å; D875-D877 PolarHBondContact O-N 3.27Å; D875-S878 PolarHBondContact N-OG 2.86Å; D875-S878 WeakPolarHBondContact O-CB 3.49Å; D875-S878 PolarHBondContact O-N 3.3Å; D875-S878 PolarHBondContact O-OG 3Å; D875-F938 HydrophobicContact CB-CB 3.93Å; D875-F938 HydrophobicContact CB-CD1 3.49Å; D875-F938 VanDerWaalsContact CB-CD1 3.49Å; D875-F938 HydrophobicContact CB-CE1 4.18Å; D875-F938 HydrophobicContact CB-CG 3.83Å; D875-T940 VanDerWaalsContact CG-OG1 3.27Å; D875-T940 WeakPolarHBondContact OD1-CG2 3.36Å; D875-T940 VanDerWaalsContact OD2-CB 3.23Å; D875-T940 WeakPolarHBondContact OD2-CB 3.3Å; D875-T940 WeakPolarHBondContact OD2-CG2 3.2Å; D875-T940 PolarHBondContact OD2-N 2.92Å; D875-T940 PolarHBondContact OD2-OG1 2.95Å
876	N	91.3	Very high	94.8	Very high	55 Å²	55	14.4 Å²	14.4	29%	0.294	8%	0.076	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	-114.5	-176	-64.3	-41.2	0	0	0	111.5	N843 N844	N843-N876 VanDerWaalsContact CA-OD1 3.22Å; N843-N876 WeakPolarHBondContact CA-OD1 3.21Å; N843-N876 PolarHBondContact OD1-ND2 3.32Å; N843-N876 VanDerWaalsContact OD1-ND2 3.15Å; N844-N876 PolarHBondContact N-OD1 2.83Å; N844-N876 PolarHBondContact O-N 3.05Å
877	D	91.5	Very high	94.1	Very high	125 Å²	125	16.3 Å²	16.3	67%	0.668	9%	0.085	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.9	19.2	-178.1	-42.4	-25.7	0	0	0	111.4	D875 K918	D875-D877 PolarHBondContact O-N 3.27Å; D877-K918 WeakPolarHBondContact O-CD 2.91Å; D877-K918 WeakPolarHBondContact O-CE 3.4Å; D877-K918 PolarHBondContact O-NZ 3.05Å
878	S	94.7	Very high	93.4	Very high	8 Å²	8	22.2 Å²	22.2	6%	0.056	11%	0.112	C	C	.	.	P	Polyproline II helix	trans	-61.5	162.8	176	78.7	0	0	0	0	111.1	Q874 D875 K918	Q874-S878 PolarHBondContact NE2-O 2.83Å; D875-S878 PolarHBondContact N-OG 2.86Å; D875-S878 WeakPolarHBondContact O-CB 3.49Å; D875-S878 PolarHBondContact O-N 3.3Å; D875-S878 PolarHBondContact O-OG 3Å; S878-K918 CarbonylContact C-O 3.48Å; S878-K918 VanDerWaalsContact CA-O 3.3Å; S878-K918 WeakPolarHBondContact CA-O 3.49Å; S878-K918 WeakPolarHBondContact CB-O 3.1Å
879	A	94.3	Very high	92.4	Very high	2 Å²	2	29.3 Å²	29.3	2%	0.017	14%	0.143	C	C	.	.	P	Polyproline II helix	trans	-56.9	144.9	163.6	0	0	0	0	0	110	V900 D901 F917 K918 V920	A879-V900 HydrophobicContact CB-CG1 3.65Å; A879-D901 VanDerWaalsContact CA-OD1 3.24Å; A879-D901 WeakPolarHBondContact CA-OD1 3.44Å; A879-D901 WeakPolarHBondContact CB-OD2 3.09Å; A879-F917 HydrophobicContact CB-CB 4.37Å; A879-K918 PolarHBondContact N-O 3.48Å; A879-V920 HydrophobicContact CB-CG1 4.13Å
880	I	96.1	Very high	91.9	Very high	27 Å²	27	30.6 Å²	30.6	14%	0.138	15%	0.148	C	C	.	.	P	Polyproline II helix	trans	-81.8	124.9	174.4	-59.1	175.9	0	0	0	107.6	Q874 E882 V900 D901 L1052	Q874-I880 HydrophobicContact CB-CG1 4.4Å; Q874-I880 HydrophobicContact CG-CG1 4.29Å; I880-E882 HydrophobicContact CG2-CG 4.17Å; I880-V900 WeakPolarHBondContact O-CA 3.07Å; I880-D901 PolarHBondContact N-OD1 2.76Å; I880-D901 PolarHBondContact O-N 2.7Å; I880-L1052 HydrophobicContact CG2-CB 4.49Å
881	V	97.4	Very high	91.4	Very high	3 Å²	3	31.9 Å²	31.9	2%	0.018	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	123.2	176.4	-178.2	0	0	0	0	108.8	A872 A873 I883 V920 I922 V936	A872-V881 CarbonylContact C-O 3.59Å; A872-V881 VanDerWaalsContact CA-O 3.25Å; A872-V881 WeakPolarHBondContact CA-O 3.43Å; A873-V881 PolarHBondContact N-O 2.85Å; A873-V881 PolarHBondContact O-N 3.45Å; V881-I883 HydrophobicContact CG1-CD1 4.28Å; V881-I883 HydrophobicContact CG1-CG1 4.16Å; V881-V920 HydrophobicContact CG2-CB 4.48Å; V881-V920 HydrophobicContact CG2-CG1 3.89Å; V881-V920 HydrophobicContact CG2-CG2 3.95Å; V881-I922 HydrophobicContact CG1-CD1 3.76Å; V881-I922 HydrophobicContact CG2-CD1 3.96Å; V881-V936 HydrophobicContact CG1-CG1 4.4Å; V881-V936 HydrophobicContact CG1-CG2 4.33Å; V881-V936 HydrophobicContact CG2-CG1 4.34Å
882	E	97.3	Very high	90.8	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	125.7	174.4	-58.6	172.4	85.6	0	0	109.6	V871 A872 I880 Y884 V898 Y899 Q1054	V871-E882 CarbonylContact O-C 3.49Å; V871-E882 VanDerWaalsContact O-CA 3.3Å; V871-E882 WeakPolarHBondContact O-CA 3.37Å; A872-E882 HydrophobicContact CB-CG 4.18Å; I880-E882 HydrophobicContact CG2-CG 4.17Å; E882-Y884 HydrophobicContact CB-CD2 4.49Å; E882-Y884 HydrophobicContact CB-CE2 3.68Å; E882-Y884 PolarHBondContact OE1-OH 2.8Å; E882-V898 CarbonylContact O-C 3.49Å; E882-V898 WeakPolarHBondContact O-CA 3.24Å; E882-Y899 PolarHBondContact N-O 2.98Å; E882-Y899 PolarHBondContact O-N 3.25Å; E882-Q1054 PolarHBondContact OE1-N 3.45Å; E882-Q1054 WeakPolarHBondContact OE2-CG 3.22Å
883	I	97.3	Very high	90.3	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.01	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	125	178.1	-59.9	168.8	0	0	0	108.1	G870 V871 V881 T896 D897 V898 L934 V936 V946	G870-I883 CarbonylContact C-O 3.58Å; G870-I883 WeakPolarHBondContact CA-O 3.42Å; V871-I883 PolarHBondContact N-O 3.29Å; V871-I883 PolarHBondContact O-N 2.91Å; V881-I883 HydrophobicContact CG1-CD1 4.28Å; V881-I883 HydrophobicContact CG1-CG1 4.16Å; I883-T896 HydrophobicContact CG2-CG2 4.29Å; I883-D897 CarbonylContact C-O 3.53Å; I883-D897 WeakPolarHBondContact CA-O 3.25Å; I883-V898 HydrophobicContact CG1-CG1 4.19Å; I883-V898 HydrophobicContact CG1-CG2 4.32Å; I883-L934 HydrophobicContact CD1-CB 4.33Å; I883-L934 HydrophobicContact CD1-CD1 3.99Å; I883-L934 HydrophobicContact CG1-CD1 4.32Å; I883-L934 HydrophobicContact CG2-CD1 4Å; I883-V936 HydrophobicContact CD1-CG2 3.78Å; I883-V946 HydrophobicContact CD1-CB 4.26Å; I883-V946 HydrophobicContact CD1-CG2 3.92Å; I883-V946 HydrophobicContact CG2-CG1 3.95Å
884	Y	94.8	Very high	90	Very high	10 Å²	10	39.5 Å²	39.5	4%	0.039	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	145.1	-179.9	-60.2	-78.3	0	0	0	110.9	R850 T869 E882 T896 D897 Y899 F1053 F1057	R850-Y884 VanDerWaalsContact CZ-CE1 3.45Å; R850-Y884 PolarHBondContact NH2-OH 3.15Å; T869-Y884 CarbonylContact O-C 3.49Å; T869-Y884 WeakPolarHBondContact O-CA 3.41Å; E882-Y884 HydrophobicContact CB-CD2 4.49Å; E882-Y884 HydrophobicContact CB-CE2 3.68Å; E882-Y884 PolarHBondContact OE1-OH 2.8Å; Y884-T896 CarbonylContact O-C 3.5Å; Y884-T896 WeakPolarHBondContact O-CA 3.43Å; Y884-T896 WeakPolarHBondContact O-CB 3.44Å; Y884-D897 PolarHBondContact N-O 3.47Å; Y884-D897 PolarHBondContact O-N 2.91Å; Y884-Y899 AromaticContact CD2-CD2 3.79Å; Y884-Y899 HydrophobicContact CD2-CD2 3.79Å; Y884-Y899 AromaticContact CD2-CE2 3.9Å; Y884-Y899 HydrophobicContact CD2-CE2 3.9Å; Y884-Y899 AromaticContact CE2-CD2 3.84Å; Y884-Y899 HydrophobicContact CE2-CD2 3.84Å; Y884-Y899 HydrophobicContact CE2-CE2 4.19Å; Y884-F1053 AromaticContact CE1-CD1 3.91Å; Y884-F1053 HydrophobicContact CE1-CD1 3.91Å; Y884-F1053 AromaticContact CE1-CE1 3.93Å; Y884-F1053 HydrophobicContact CE1-CE1 3.93Å; Y884-F1053 AromaticContact CZ-CD1 3.97Å; Y884-F1053 WeakPolarHBondContact OH-CD1 3.39Å; Y884-F1057 HydrophobicContact CE1-CB 4.46Å; Y884-F1057 HydrophobicContact CE2-CB 4.03Å; Y884-F1057 AromaticContact CE2-CD2 3.69Å; Y884-F1057 HydrophobicContact CE2-CD2 3.69Å; Y884-F1057 HydrophobicContact CE2-CE2 4.32Å; Y884-F1057 AromaticContact CE2-CG 3.98Å; Y884-F1057 HydrophobicContact CE2-CG 3.98Å; Y884-F1057 AromaticContact CZ-CD2 3.94Å
885	A	93.1	Very high	89.9	Confident	4 Å²	4	39.9 Å²	39.9	3%	0.033	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	159.1	162.8	0	0	0	0	0	110.1	T869 G951 L953 I1060	T869-A885 PolarHBondContact O-N 2.98Å; A885-G951 WeakPolarHBondContact CB-O 3.35Å; A885-L953 HydrophobicContact CB-CD2 3.99Å; A885-L953 HydrophobicContact CB-CG 4.13Å; A885-I1060 HydrophobicContact CB-CD1 3.87Å; A885-I1060 WeakPolarHBondContact O-CD1 3.22Å
886	R	88.6	Confident	89.9	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.008	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-102.1	151.8	172.6	-66.7	-160.8	-170.2	-163.9	-3.1	112.5	E393 R890 R891 Y894 K895 T896 D897	E393-R886 IonicContact OE1-NH1 3.77Å; E393-R886 IonicContact OE2-CZ 2.83Å; E393-R886 IonicContact OE2-NH1 3.39Å; E393-R886 PolarHBondContact OE2-NH1 2.8Å; E393-R886 IonicContact OE2-NH2 2.87Å; R886-R890 HydrophobicContact CB-CB 4.37Å; R886-R891 HydrophobicContact CB-CG 3.76Å; R886-R891 WeakPolarHBondContact O-CD 3.42Å; R886-R891 WeakPolarHBondContact O-CG 3.06Å; R886-R891 PolarHBondContact O-NH1 3.46Å; R886-Y894 WeakPolarHBondContact CD-O 3.43Å; R886-Y894 VanDerWaalsContact CZ-CB 3.44Å; R886-Y894 VanDerWaalsContact NH2-CD2 3.27Å; R886-K895 WeakPolarHBondContact CB-O 3.29Å; R886-K895 PolarHBondContact N-O 2.79Å; R886-T896 PolarHBondContact NE-O 3.05Å; R886-T896 PolarHBondContact NH2-O 2.8Å; R886-D897 IonicContact CZ-OD1 3.84Å; R886-D897 IonicContact NE-OD1 3.8Å; R886-D897 PolarHBondContact NE-OD1 2.83Å; R886-D897 IonicContact NE-OD2 2.79Å; R886-D897 IonicContact NH1-OD1 3.7Å; R886-D897 IonicContact NH2-OD1 3.83Å; R886-D897 PolarHBondContact NH2-OD1 3.27Å
887	K	80.3	Confident	90	Very high	41 Å²	41	37.4 Å²	37.4	18%	0.178	17%	0.169	C	C	.	.	P	Polyproline II helix	trans	-55.8	146.8	167.8	-65.6	-175.3	-178.4	-174.5	0	110.6	N357 F889 R890 R891 I1060	N357-K887 PolarHBondContact O-NZ 2.81Å; K887-F889 PolarHBondContact O-N 3.39Å; K887-R890 WeakPolarHBondContact O-CA 3.32Å; K887-R890 PolarHBondContact O-N 3Å; K887-R891 WeakPolarHBondContact O-CG 3.46Å; K887-R891 PolarHBondContact O-N 3.08Å; K887-I1060 HydrophobicContact CB-CG2 4.35Å; K887-I1060 VanDerWaalsContact CE-O 3.25Å; K887-I1060 WeakPolarHBondContact CE-O 3.27Å; K887-I1060 HydrophobicContact CG-CG2 3.47Å; K887-I1060 VanDerWaalsContact CG-CG2 3.47Å
888	E	78.6	Confident	90.2	Very high	126 Å²	126	31.5 Å²	31.5	59%	0.589	14%	0.137	S	C	*	.	G	3₁₀ helix	trans	-47.8	-51.9	-174.3	-173.5	171.1	-170.9	0	0	114.5	R890 R891	E888-R890 VanDerWaalsContact C-N 3.25Å; E888-R890 PolarHBondContact O-N 3.46Å; E888-R891 VanDerWaalsContact CA-CZ 3.41Å; E888-R891 WeakPolarHBondContact O-CB 3.36Å; E888-R891 PolarHBondContact O-N 3.14Å; E888-R891 VanDerWaalsContact O-N 3.1Å
889	F	75.5	Confident	90.2	Very high	150 Å²	150	32.5 Å²	32.5	66%	0.658	14%	0.14	S	C	*	.	G	3₁₀ helix	trans	-72.1	-14.6	-178.8	-52.4	-74.5	0	0	0	114.3	F129 K887	F129-F889 HydrophobicContact CD1-CB 3.72Å; F129-F889 HydrophobicContact CE1-CB 3.98Å; K887-F889 PolarHBondContact O-N 3.39Å
890	R	82.3	Confident	90.1	Very high	26 Å²	26	32.6 Å²	32.6	10%	0.098	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-91	-6.1	172.4	-66.7	-177.9	73.4	-126.3	-1.5	112.9	Y127 G128 F129 R886 K887 E888 W892 D897	Y127-R890 PolarHBondContact O-NE 3.5Å; G128-R890 WeakPolarHBondContact O-CA 3.11Å; F129-R890 HydrophobicContact CD1-CG 3.82Å; F129-R890 HydrophobicContact CD2-CG 4.25Å; F129-R890 HydrophobicContact CE1-CG 3.57Å; F129-R890 HydrophobicContact CE2-CG 4.03Å; F129-R890 HydrophobicContact CG-CG 4.16Å; F129-R890 HydrophobicContact CZ-CG 3.68Å; R886-R890 HydrophobicContact CB-CB 4.37Å; K887-R890 WeakPolarHBondContact O-CA 3.32Å; K887-R890 PolarHBondContact O-N 3Å; E888-R890 VanDerWaalsContact C-N 3.25Å; E888-R890 PolarHBondContact O-N 3.46Å; R890-W892 VanDerWaalsContact C-N 3.27Å; R890-W892 PolarHBondContact O-N 2.91Å; R890-D897 IonicContact CZ-OD2 3.49Å; R890-D897 IonicContact NH1-OD2 2.87Å; R890-D897 PolarHBondContact NH1-OD2 3.29Å; R890-D897 IonicContact NH2-OD2 3.58Å
891	R	86.2	Confident	89.9	Confident	28 Å²	28	34.4 Å²	34.4	11%	0.106	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	7.4	-178.2	-72.3	-171.8	-60.8	-119.9	16.9	114.6	R886 K887 E888 Y894 K895 E948 R950	R886-R891 HydrophobicContact CB-CG 3.76Å; R886-R891 WeakPolarHBondContact O-CD 3.42Å; R886-R891 WeakPolarHBondContact O-CG 3.06Å; R886-R891 PolarHBondContact O-NH1 3.46Å; K887-R891 WeakPolarHBondContact O-CG 3.46Å; K887-R891 PolarHBondContact O-N 3.08Å; E888-R891 VanDerWaalsContact CA-CZ 3.41Å; E888-R891 WeakPolarHBondContact O-CB 3.36Å; E888-R891 PolarHBondContact O-N 3.14Å; E888-R891 VanDerWaalsContact O-N 3.1Å; R891-Y894 VanDerWaalsContact CA-O 3.32Å; R891-Y894 WeakPolarHBondContact CA-O 3.03Å; R891-K895 HydrophobicContact CB-CD 3.93Å; R891-K895 HydrophobicContact CG-CD 4.22Å; R891-K895 PolarHBondContact O-NZ 2.78Å; R891-E948 VanDerWaalsContact CD-OE1 3.3Å; R891-E948 WeakPolarHBondContact CD-OE1 3.34Å; R891-R950 PolarHBondContact NH2-O 3.35Å
892	W	84.4	Confident	89.3	Confident	86 Å²	86	37.3 Å²	37.3	33%	0.326	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-36.6	-176.6	73.7	-89.3	0	0	0	112.5	P125 G128 R130 R890	P125-W892 HydrophobicContact CB-CZ2 4.31Å; P125-W892 HydrophobicContact CG-CH2 4.43Å; P125-W892 HydrophobicContact CG-CZ2 4.3Å; G128-W892 VanDerWaalsContact O-CD1 3.25Å; G128-W892 PolarHBondContact O-NE1 2.85Å; R130-W892 HydrophobicContact CB-CD2 4.29Å; R130-W892 HydrophobicContact CB-CG 4.19Å; R890-W892 VanDerWaalsContact C-N 3.27Å; R890-W892 PolarHBondContact O-N 2.91Å
893	R	87.5	Confident	88.8	Confident	69 Å²	69	39 Å²	39	26%	0.26	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-54.8	178.4	-170	172.8	176.5	171.2	-4.9	112.3	D908	R893-D908 IonicContact NH2-OD2 3.77Å; R893-D908 PolarHBondContact NH2-OD2 3Å
894	Y	90.9	Very high	88.4	Confident	9 Å²	9	40.5 Å²	40.5	4%	0.035	19%	0.185	C	C	.	.			trans	-122.2	143.2	-176.9	-50.2	-62.1	0	0	0	111.1	E393 R886 R891 F906 D908 N930 M931	E393-Y894 HydrophobicContact CG-CE2 4.26Å; E393-Y894 WeakPolarHBondContact OE1-CD2 3.39Å; E393-Y894 WeakPolarHBondContact OE1-CE2 3.17Å; R886-Y894 WeakPolarHBondContact CD-O 3.43Å; R886-Y894 VanDerWaalsContact CZ-CB 3.44Å; R886-Y894 VanDerWaalsContact NH2-CD2 3.27Å; R891-Y894 VanDerWaalsContact CA-O 3.32Å; R891-Y894 WeakPolarHBondContact CA-O 3.03Å; Y894-F906 HydrophobicContact CD2-CD1 4.34Å; Y894-F906 HydrophobicContact CD2-CE1 4.03Å; Y894-F906 HydrophobicContact CE1-CD1 4.48Å; Y894-F906 AromaticContact CE2-CD1 3.84Å; Y894-F906 HydrophobicContact CE2-CD1 3.84Å; Y894-F906 AromaticContact CE2-CE1 3.63Å; Y894-F906 HydrophobicContact CE2-CE1 3.63Å; Y894-F906 AromaticContact CZ-CD1 3.9Å; Y894-D908 HydrophobicContact CE1-CB 3.65Å; Y894-D908 PolarHBondContact OH-OD2 2.85Å; Y894-N930 CarbonylContact C-O 3.59Å; Y894-N930 WeakPolarHBondContact CA-O 3.49Å; Y894-M931 HydrophobicContact CD1-CG 4.29Å; Y894-M931 HydrophobicContact CD1-SD 3.87Å; Y894-M931 HydrophobicContact CE1-SD 4.3Å; Y894-M931 HydrophobicContact CG-SD 4.37Å
895	K	92.5	Very high	88.2	Confident	57 Å²	57	40.7 Å²	40.7	25%	0.248	19%	0.187	C	C	.	.	S	Bend	trans	-91.1	-30	-178.6	-61.4	-51.2	-177.9	-172.8	0	113.2	R886 R891 N930 E948	R886-K895 WeakPolarHBondContact CB-O 3.29Å; R886-K895 PolarHBondContact N-O 2.79Å; R891-K895 HydrophobicContact CB-CD 3.93Å; R891-K895 HydrophobicContact CG-CD 4.22Å; R891-K895 PolarHBondContact O-NZ 2.78Å; K895-N930 HydrophobicContact CG-CB 4.13Å; K895-N930 PolarHBondContact N-O 2.97Å; K895-E948 HydrophobicContact CB-CB 4.18Å; K895-E948 HydrophobicContact CB-CG 4Å; K895-E948 WeakPolarHBondContact CB-OE2 3.42Å; K895-E948 WeakPolarHBondContact CG-OE2 3.33Å
896	T	94.2	Very high	88	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.006	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	158.1	179.9	61.1	0	0	0	0	112.3	I883 Y884 R886 M931 E948 L953	I883-T896 HydrophobicContact CG2-CG2 4.29Å; Y884-T896 CarbonylContact O-C 3.5Å; Y884-T896 WeakPolarHBondContact O-CA 3.43Å; Y884-T896 WeakPolarHBondContact O-CB 3.44Å; R886-T896 PolarHBondContact NE-O 3.05Å; R886-T896 PolarHBondContact NH2-O 2.8Å; T896-M931 WeakPolarHBondContact CG2-O 3.33Å; T896-M931 PolarHBondContact OG1-O 2.79Å; T896-E948 HydrophobicContact CG2-CB 3.76Å; T896-E948 HydrophobicContact CG2-CG 4.2Å; T896-L953 HydrophobicContact CG2-CD2 4.09Å
897	D	92.4	Very high	88.2	Confident	9 Å²	9	42.8 Å²	42.8	5%	0.048	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	126	165.8	-84.1	-36.5	0	0	0	108.3	I883 Y884 R886 R890 Y899 R904	I883-D897 CarbonylContact C-O 3.53Å; I883-D897 WeakPolarHBondContact CA-O 3.25Å; Y884-D897 PolarHBondContact N-O 3.47Å; Y884-D897 PolarHBondContact O-N 2.91Å; R886-D897 IonicContact CZ-OD1 3.84Å; R886-D897 IonicContact NE-OD1 3.8Å; R886-D897 PolarHBondContact NE-OD1 2.83Å; R886-D897 IonicContact NE-OD2 2.79Å; R886-D897 IonicContact NH1-OD1 3.7Å; R886-D897 IonicContact NH2-OD1 3.83Å; R886-D897 PolarHBondContact NH2-OD1 3.27Å; R890-D897 IonicContact CZ-OD2 3.49Å; R890-D897 IonicContact NH1-OD2 2.87Å; R890-D897 PolarHBondContact NH1-OD2 3.29Å; R890-D897 IonicContact NH2-OD2 3.58Å; D897-Y899 HydrophobicContact CB-CE2 3.87Å; D897-R904 IonicContact OD1-CZ 2.58Å; D897-R904 VanDerWaalsContact OD1-CZ 3.23Å; D897-R904 IonicContact OD1-NE 2.79Å; D897-R904 PolarHBondContact OD1-NE 3.17Å; D897-R904 IonicContact OD1-NH2 3.01Å; D897-R904 PolarHBondContact OD1-NH2 3.03Å; D897-R904 IonicContact OD2-NH2 3.75Å
898	V	95.2	Very high	88.3	Confident	1 Å²	1	42 Å²	42	1%	0.006	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	127.4	-177.8	-174.4	0	0	0	0	109	E882 I883 R904 V905 F907 I922 M931 L934	E882-V898 CarbonylContact O-C 3.49Å; E882-V898 WeakPolarHBondContact O-CA 3.24Å; I883-V898 HydrophobicContact CG1-CG1 4.19Å; I883-V898 HydrophobicContact CG1-CG2 4.32Å; V898-R904 CarbonylContact O-C 3.54Å; V898-R904 WeakPolarHBondContact O-CA 3.3Å; V898-V905 PolarHBondContact O-N 3.39Å; V898-F907 HydrophobicContact CB-CE2 4.38Å; V898-F907 HydrophobicContact CG1-CE2 4.07Å; V898-F907 HydrophobicContact CG2-CE2 4.46Å; V898-I922 HydrophobicContact CG1-CD1 4.45Å; V898-M931 HydrophobicContact CB-CE 4.4Å; V898-M931 HydrophobicContact CG2-CE 3.67Å; V898-L934 HydrophobicContact CG2-CD1 3.32Å
899	Y	94.6	Very high	88.7	Confident	28 Å²	28	37.4 Å²	37.4	11%	0.11	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	136.7	174.9	-59.2	-87.4	0	0	0	110.1	E882 Y884 D897 A903 R904 F1057	E882-Y899 PolarHBondContact N-O 2.98Å; E882-Y899 PolarHBondContact O-N 3.25Å; Y884-Y899 AromaticContact CD2-CD2 3.79Å; Y884-Y899 HydrophobicContact CD2-CD2 3.79Å; Y884-Y899 AromaticContact CD2-CE2 3.9Å; Y884-Y899 HydrophobicContact CD2-CE2 3.9Å; Y884-Y899 AromaticContact CE2-CD2 3.84Å; Y884-Y899 HydrophobicContact CE2-CD2 3.84Å; Y884-Y899 HydrophobicContact CE2-CE2 4.19Å; D897-Y899 HydrophobicContact CB-CE2 3.87Å; Y899-A903 CarbonylContact C-O 3.57Å; Y899-A903 VanDerWaalsContact CA-O 3.29Å; Y899-A903 WeakPolarHBondContact CA-O 3.26Å; Y899-R904 HydrophobicContact CD1-CB 3.82Å; Y899-R904 HydrophobicContact CD1-CG 4.16Å; Y899-R904 HydrophobicContact CE1-CB 3.62Å; Y899-R904 HydrophobicContact CE1-CG 3.76Å; Y899-F1057 HydrophobicContact CD1-CE1 4Å; Y899-F1057 HydrophobicContact CD1-CE2 4.14Å; Y899-F1057 AromaticContact CD1-CZ 3.36Å; Y899-F1057 HydrophobicContact CD1-CZ 3.36Å; Y899-F1057 HydrophobicContact CD2-CD2 4.46Å; Y899-F1057 HydrophobicContact CD2-CE1 4.18Å; Y899-F1057 AromaticContact CD2-CE2 3.9Å; Y899-F1057 HydrophobicContact CD2-CE2 3.9Å; Y899-F1057 AromaticContact CD2-CZ 3.72Å; Y899-F1057 HydrophobicContact CD2-CZ 3.72Å; Y899-F1057 AromaticContact CE1-CE1 3.52Å; Y899-F1057 HydrophobicContact CE1-CE1 3.52Å; Y899-F1057 HydrophobicContact CE1-CE2 4.47Å; Y899-F1057 AromaticContact CE1-CZ 3.41Å; Y899-F1057 HydrophobicContact CE1-CZ 3.41Å; Y899-F1057 VanDerWaalsContact CE1-CZ 3.41Å; Y899-F1057 HydrophobicContact CE2-CD1 4.12Å; Y899-F1057 AromaticContact CE2-CE1 3.72Å; Y899-F1057 HydrophobicContact CE2-CE1 3.72Å; Y899-F1057 HydrophobicContact CE2-CE2 4.24Å; Y899-F1057 AromaticContact CE2-CZ 3.75Å; Y899-F1057 HydrophobicContact CE2-CZ 3.75Å; Y899-F1057 HydrophobicContact CG-CE1 4.31Å; Y899-F1057 AromaticContact CG-CE2 3.84Å; Y899-F1057 HydrophobicContact CG-CE2 3.84Å; Y899-F1057 AromaticContact CG-CZ 3.53Å; Y899-F1057 HydrophobicContact CG-CZ 3.53Å; Y899-F1057 AromaticContact CZ-CE1 3.37Å; Y899-F1057 AromaticContact CZ-CZ 3.61Å
900	V	94	Very high	89.2	Confident	5 Å²	5	34.5 Å²	34.5	3%	0.03	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	117.2	174.4	-176.2	0	0	0	0	107.6	A879 I880 N902 A903 V905 F917 I922	A879-V900 HydrophobicContact CB-CG1 3.65Å; I880-V900 WeakPolarHBondContact O-CA 3.07Å; V900-N902 VanDerWaalsContact C-N 3.29Å; V900-N902 PolarHBondContact O-N 3.14Å; V900-A903 PolarHBondContact N-O 3.32Å; V900-A903 PolarHBondContact O-N 3.47Å; V900-A903 VanDerWaalsContact O-N 3.11Å; V900-V905 HydrophobicContact CB-CG2 4.09Å; V900-V905 HydrophobicContact CG2-CG2 3.89Å; V900-F917 HydrophobicContact CB-CE1 4.49Å; V900-F917 HydrophobicContact CG1-CB 4.14Å; V900-F917 HydrophobicContact CG1-CD1 3.89Å; V900-F917 HydrophobicContact CG1-CD2 4.16Å; V900-F917 HydrophobicContact CG1-CE1 4.35Å; V900-F917 HydrophobicContact CG1-CG 3.79Å; V900-F917 HydrophobicContact CG2-CD2 4.33Å; V900-F917 HydrophobicContact CG2-CE2 4.12Å; V900-F917 HydrophobicContact CG2-CZ 4.31Å; V900-I922 HydrophobicContact CG2-CD1 3.64Å
901	D	90.8	Very high	89.4	Confident	65 Å²	65	36.2 Å²	36.2	35%	0.348	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.4	55.3	-170.8	-66.1	-23.8	0	0	0	111.6	A879 I880 A903	A879-D901 VanDerWaalsContact CA-OD1 3.24Å; A879-D901 WeakPolarHBondContact CA-OD1 3.44Å; A879-D901 WeakPolarHBondContact CB-OD2 3.09Å; I880-D901 PolarHBondContact N-OD1 2.76Å; I880-D901 PolarHBondContact O-N 2.7Å; D901-A903 PolarHBondContact O-N 3.19Å
902	N	84.6	Confident	89.6	Confident	63 Å²	63	36 Å²	36	34%	0.337	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	-6.1	178.7	-59.7	-25.8	0	0	0	116.8	V900 Q1054 K1056	V900-N902 VanDerWaalsContact C-N 3.29Å; V900-N902 PolarHBondContact O-N 3.14Å; N902-Q1054 VanDerWaalsContact OD1-CD 3.26Å; N902-Q1054 WeakPolarHBondContact OD1-CG 3.32Å; N902-Q1054 PolarHBondContact OD1-NE2 3.04Å; N902-K1056 PolarHBondContact O-NZ 3.39Å; N902-K1056 VanDerWaalsContact O-NZ 3.08Å
903	A	87.3	Confident	89.9	Confident	36 Å²	36	32.5 Å²	32.5	30%	0.298	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	132.3	179	0	0	0	0	0	110.7	Y899 V900 D901	Y899-A903 CarbonylContact C-O 3.57Å; Y899-A903 VanDerWaalsContact CA-O 3.29Å; Y899-A903 WeakPolarHBondContact CA-O 3.26Å; V900-A903 PolarHBondContact N-O 3.32Å; V900-A903 PolarHBondContact O-N 3.47Å; V900-A903 VanDerWaalsContact O-N 3.11Å; D901-A903 PolarHBondContact O-N 3.19Å
904	R	87.9	Confident	90.1	Very high	35 Å²	35	29.8 Å²	29.8	13%	0.132	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	137.6	179.4	-159.6	175.3	-176.6	-164.8	-4.5	110.7	E393 E394 D897 V898 Y899 F906	E393-R904 PolarHBondContact O-NH1 3.33Å; E393-R904 IonicContact OE2-CZ 3.69Å; E393-R904 IonicContact OE2-NH1 3.79Å; E393-R904 IonicContact OE2-NH2 2.81Å; E393-R904 PolarHBondContact OE2-NH2 3.43Å; E394-R904 VanDerWaalsContact CG-NH1 3.25Å; E394-R904 WeakPolarHBondContact OE1-CD 3.45Å; E394-R904 IonicContact OE1-CZ 3.66Å; E394-R904 IonicContact OE1-NE 3.79Å; E394-R904 IonicContact OE1-NH1 3.93Å; E394-R904 PolarHBondContact OE1-NH1 3.25Å; D897-R904 IonicContact OD1-CZ 2.58Å; D897-R904 VanDerWaalsContact OD1-CZ 3.23Å; D897-R904 IonicContact OD1-NE 2.79Å; D897-R904 PolarHBondContact OD1-NE 3.17Å; D897-R904 IonicContact OD1-NH2 3.01Å; D897-R904 PolarHBondContact OD1-NH2 3.03Å; D897-R904 IonicContact OD2-NH2 3.75Å; V898-R904 CarbonylContact O-C 3.54Å; V898-R904 WeakPolarHBondContact O-CA 3.3Å; Y899-R904 HydrophobicContact CD1-CB 3.82Å; Y899-R904 HydrophobicContact CD1-CG 4.16Å; Y899-R904 HydrophobicContact CE1-CB 3.62Å; Y899-R904 HydrophobicContact CE1-CG 3.76Å; R904-F906 HydrophobicContact CG-CE2 4.25Å; R904-F906 HydrophobicContact CG-CZ 4.26Å
905	V	90.7	Very high	90.2	Very high	13 Å²	13	30 Å²	30	8%	0.079	16%	0.156	C	C	.	.			trans	-126.1	137.6	-178.4	-176.3	0	0	0	0	109.9	V898 V900 F907 F917	V898-V905 PolarHBondContact O-N 3.39Å; V900-V905 HydrophobicContact CB-CG2 4.09Å; V900-V905 HydrophobicContact CG2-CG2 3.89Å; V905-F907 HydrophobicContact CB-CE2 4.13Å; V905-F907 HydrophobicContact CG1-CD2 4.34Å; V905-F907 HydrophobicContact CG1-CE2 3.58Å; V905-F907 HydrophobicContact CG1-CZ 3.68Å; V905-F917 HydrophobicContact CG1-CZ 3.93Å; V905-F917 HydrophobicContact CG2-CE1 4.34Å; V905-F917 HydrophobicContact CG2-CZ 3.96Å
906	F	90.2	Very high	90.1	Very high	51 Å²	51	29 Å²	29	22%	0.224	16%	0.155	C	C	.	.			trans	-113.1	145.8	177.5	-63.6	-87.4	0	0	0	111	Y894 R904 Q915 M931	Y894-F906 HydrophobicContact CD2-CD1 4.34Å; Y894-F906 HydrophobicContact CD2-CE1 4.03Å; Y894-F906 HydrophobicContact CE1-CD1 4.48Å; Y894-F906 AromaticContact CE2-CD1 3.84Å; Y894-F906 HydrophobicContact CE2-CD1 3.84Å; Y894-F906 AromaticContact CE2-CE1 3.63Å; Y894-F906 HydrophobicContact CE2-CE1 3.63Å; Y894-F906 AromaticContact CZ-CD1 3.9Å; R904-F906 HydrophobicContact CG-CE2 4.25Å; R904-F906 HydrophobicContact CG-CZ 4.26Å; F906-Q915 PolarHBondContact O-NE2 3.02Å; F906-M931 HydrophobicContact CB-SD 4.47Å; F906-M931 HydrophobicContact CD1-SD 4.2Å
907	F	92.1	Very high	90.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.158	C	C	.	.			trans	-126.2	36.5	179.2	-60.3	-98.9	0	0	0	110.6	V898 V905 Q912 K913 Q915 I922 M931 L934	V898-F907 HydrophobicContact CB-CE2 4.38Å; V898-F907 HydrophobicContact CG1-CE2 4.07Å; V898-F907 HydrophobicContact CG2-CE2 4.46Å; V905-F907 HydrophobicContact CB-CE2 4.13Å; V905-F907 HydrophobicContact CG1-CD2 4.34Å; V905-F907 HydrophobicContact CG1-CE2 3.58Å; V905-F907 HydrophobicContact CG1-CZ 3.68Å; F907-Q912 WeakPolarHBondContact CD1-O 3.41Å; F907-K913 WeakPolarHBondContact O-CD 3.49Å; F907-K913 WeakPolarHBondContact O-CE 3.11Å; F907-K913 PolarHBondContact O-NZ 3.39Å; F907-Q915 HydrophobicContact CE1-CB 3.97Å; F907-Q915 HydrophobicContact CE1-CG 4.2Å; F907-I922 HydrophobicContact CE1-CB 3.81Å; F907-I922 HydrophobicContact CE1-CG2 3.68Å; F907-I922 WeakPolarHBondContact CE1-O 3.45Å; F907-I922 HydrophobicContact CE2-CG2 3.98Å; F907-I922 HydrophobicContact CZ-CB 3.58Å; F907-I922 HydrophobicContact CZ-CD1 4.28Å; F907-I922 HydrophobicContact CZ-CG2 3.36Å; F907-M931 HydrophobicContact CB-CG 4.35Å; F907-M931 HydrophobicContact CD2-CE 4.05Å; F907-L934 HydrophobicContact CD2-CD2 4.14Å; F907-L934 HydrophobicContact CG-CD2 4.36Å
908	D	82.9	Confident	90	Very high	24 Å²	24	36 Å²	36	13%	0.128	19%	0.185	C	C	.	.			trans	-88.3	-36	-172.2	69.5	-33.8	0	0	0	112.4	R893 Y894 Q912 K913 M929	R893-D908 IonicContact NH2-OD2 3.77Å; R893-D908 PolarHBondContact NH2-OD2 3Å; Y894-D908 HydrophobicContact CE1-CB 3.65Å; Y894-D908 PolarHBondContact OH-OD2 2.85Å; D908-Q912 PolarHBondContact OD1-OE1 2.91Å; D908-K913 WeakPolarHBondContact O-CE 3.42Å; D908-K913 PolarHBondContact O-NZ 3.31Å; D908-M929 WeakPolarHBondContact O-CE 3.12Å
909	T	86.3	Confident	89.8	Confident	30 Å²	30	36.7 Å²	36.7	18%	0.184	19%	0.192	C	C	.	.	S	Bend	trans	-85.9	153.3	178.1	67.3	0	0	0	0	113.5	W911 Q912 K913	T909-W911 VanDerWaalsContact C-N 3.28Å; T909-W911 HydrophobicContact CG2-CZ2 3.9Å; T909-W911 PolarHBondContact O-N 2.86Å; T909-W911 PolarHBondContact OG1-NE1 3.14Å; T909-W911 VanDerWaalsContact OG1-NE1 3.08Å; T909-Q912 PolarHBondContact O-N 2.69Å; T909-Q912 WeakPolarHBondContact OG1-CB 3.38Å; T909-Q912 VanDerWaalsContact OG1-CG 3.25Å; T909-Q912 WeakPolarHBondContact OG1-CG 3.45Å; T909-Q912 PolarHBondContact OG1-OE1 2.93Å; T909-K913 WeakPolarHBondContact O-CG 3.39Å; T909-K913 PolarHBondContact O-N 3.14Å
910	P	86.6	Confident	89.8	Confident	88 Å²	88	35.4 Å²	35.4	57%	0.571	19%	0.187	S	C	*	.	G	3₁₀ helix	trans	-55	-37.9	-177.4	-28.5	35.9	0	0	0	114.8	Q912 K913	P910-Q912 VanDerWaalsContact C-N 3.34Å; P910-K913 WeakPolarHBondContact O-CB 3.34Å; P910-K913 WeakPolarHBondContact O-CG 3.25Å
911	W	86.9	Confident	89.8	Confident	62 Å²	62	35.3 Å²	35.3	24%	0.235	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-84.4	-5.8	-179.3	53.1	76.4	0	0	0	113.7	Q414 L491 L495 R497 T909	Q414-W911 VanDerWaalsContact NE2-CD1 3.27Å; L491-W911 HydrophobicContact CD1-CB 4.21Å; L491-W911 HydrophobicContact CD1-CG 4.35Å; L491-W911 VanDerWaalsContact CD2-O 3.29Å; L491-W911 WeakPolarHBondContact CD2-O 3.3Å; L495-W911 WeakPolarHBondContact O-CB 3.45Å; R497-W911 HydrophobicContact CB-CD2 4.25Å; R497-W911 HydrophobicContact CB-CE3 3.74Å; R497-W911 HydrophobicContact CB-CZ3 4Å; R497-W911 HydrophobicContact CG-CE3 4.15Å; R497-W911 HydrophobicContact CG-CZ3 3.93Å; T909-W911 VanDerWaalsContact C-N 3.28Å; T909-W911 HydrophobicContact CG2-CZ2 3.9Å; T909-W911 PolarHBondContact O-N 2.86Å; T909-W911 PolarHBondContact OG1-NE1 3.14Å; T909-W911 VanDerWaalsContact OG1-NE1 3.08Å
912	Q	89.3	Confident	90.1	Very high	24 Å²	24	32.2 Å²	32.2	11%	0.112	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-101.7	-4.2	171.7	-74.4	170.1	-31.1	0	0	112.5	Q414 F907 D908 T909 P910 L914 Q915	Q414-Q912 VanDerWaalsContact NE2-CG 3.26Å; F907-Q912 WeakPolarHBondContact CD1-O 3.41Å; D908-Q912 PolarHBondContact OD1-OE1 2.91Å; T909-Q912 PolarHBondContact O-N 2.69Å; T909-Q912 WeakPolarHBondContact OG1-CB 3.38Å; T909-Q912 VanDerWaalsContact OG1-CG 3.25Å; T909-Q912 WeakPolarHBondContact OG1-CG 3.45Å; T909-Q912 PolarHBondContact OG1-OE1 2.93Å; P910-Q912 VanDerWaalsContact C-N 3.34Å; Q912-L914 PolarHBondContact O-N 2.77Å; Q912-L914 VanDerWaalsContact O-N 3.16Å; Q912-Q915 PolarHBondContact O-NE2 2.96Å
913	K	91.6	Very high	90.6	Very high	12 Å²	12	30.2 Å²	30.2	5%	0.052	16%	0.158	C	C	.	.	S	Bend	trans	-60.5	-23.6	-178.8	-68.4	-60.4	173.7	-162.7	0	113.4	F907 D908 T909 P910 R923 S924 P926 N928 M929	F907-K913 WeakPolarHBondContact O-CD 3.49Å; F907-K913 WeakPolarHBondContact O-CE 3.11Å; F907-K913 PolarHBondContact O-NZ 3.39Å; D908-K913 WeakPolarHBondContact O-CE 3.42Å; D908-K913 PolarHBondContact O-NZ 3.31Å; T909-K913 WeakPolarHBondContact O-CG 3.39Å; T909-K913 PolarHBondContact O-N 3.14Å; P910-K913 WeakPolarHBondContact O-CB 3.34Å; P910-K913 WeakPolarHBondContact O-CG 3.25Å; K913-R923 CarbonylContact O-C 3.5Å; K913-R923 WeakPolarHBondContact O-CA 3.43Å; K913-S924 WeakPolarHBondContact CB-O 3.49Å; K913-S924 PolarHBondContact O-N 3.46Å; K913-P926 WeakPolarHBondContact CE-O 3.4Å; K913-N928 PolarHBondContact NZ-O 3.44Å; K913-M929 PolarHBondContact NZ-SD 2.89Å
914	L	91.9	Very high	90.9	Very high	13 Å²	13	28.5 Å²	28.5	7%	0.068	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	121.3	174.9	-179.4	72	0	0	0	108.4	L495 W754 Q912 T921 R923 M937	L495-L914 HydrophobicContact CD1-CB 4.42Å; L495-L914 HydrophobicContact CD1-CD2 4.2Å; W754-L914 HydrophobicContact CD2-CD2 4.3Å; W754-L914 HydrophobicContact CH2-CD1 4.09Å; W754-L914 HydrophobicContact CH2-CD2 3.78Å; W754-L914 HydrophobicContact CZ2-CD1 4.4Å; W754-L914 HydrophobicContact CZ2-CD2 3.35Å; W754-L914 HydrophobicContact CZ3-CD2 4.49Å; Q912-L914 PolarHBondContact O-N 2.77Å; Q912-L914 VanDerWaalsContact O-N 3.16Å; L914-T921 HydrophobicContact CD1-CG2 3.52Å; L914-T921 HydrophobicContact CG-CG2 4.31Å; L914-R923 HydrophobicContact CD1-CB 3.76Å; L914-R923 HydrophobicContact CD1-CG 4.11Å; L914-M937 HydrophobicContact CD1-CE 4.11Å
915	Q	92.6	Very high	91.1	Very high	12 Å²	12	29.5 Å²	29.5	6%	0.056	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	134.7	177.4	-68.7	175.6	71.7	0	0	111	Y489 F906 F907 Q912 F917 T921 I922	Y489-Q915 HydrophobicContact CE1-CG 4.38Å; Y489-Q915 HydrophobicContact CE2-CB 3.98Å; Y489-Q915 HydrophobicContact CE2-CG 4.15Å; Y489-Q915 VanDerWaalsContact OH-CA 3.29Å; Y489-Q915 WeakPolarHBondContact OH-CA 3.23Å; F906-Q915 PolarHBondContact O-NE2 3.02Å; F907-Q915 HydrophobicContact CE1-CB 3.97Å; F907-Q915 HydrophobicContact CE1-CG 4.2Å; Q912-Q915 PolarHBondContact O-NE2 2.96Å; Q915-F917 HydrophobicContact CB-CE2 3.72Å; Q915-F917 HydrophobicContact CB-CZ 3.91Å; Q915-T921 WeakPolarHBondContact O-CA 3.36Å; Q915-I922 PolarHBondContact N-O 3.38Å; Q915-I922 PolarHBondContact O-N 3.24Å
916	T	91.3	Very high	91.1	Very high	36 Å²	36	31.4 Å²	31.4	22%	0.221	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	129.8	-178.9	-59.1	0	0	0	0	109.9	Y489 T921	Y489-T916 PolarHBondContact OH-N 3.39Å; T916-T921 WeakPolarHBondContact CG2-OG1 3.22Å; T916-T921 PolarHBondContact OG1-OG1 3.4Å
917	F	92.2	Very high	91	Very high	18 Å²	18	37.4 Å²	37.4	8%	0.079	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	-176.5	177.8	-56.2	-84.5	0	0	0	109.5	A879 V900 V905 Q915 G919 V920 I922	A879-F917 HydrophobicContact CB-CB 4.37Å; V900-F917 HydrophobicContact CB-CE1 4.49Å; V900-F917 HydrophobicContact CG1-CB 4.14Å; V900-F917 HydrophobicContact CG1-CD1 3.89Å; V900-F917 HydrophobicContact CG1-CD2 4.16Å; V900-F917 HydrophobicContact CG1-CE1 4.35Å; V900-F917 HydrophobicContact CG1-CG 3.79Å; V900-F917 HydrophobicContact CG2-CD2 4.33Å; V900-F917 HydrophobicContact CG2-CE2 4.12Å; V900-F917 HydrophobicContact CG2-CZ 4.31Å; V905-F917 HydrophobicContact CG1-CZ 3.93Å; V905-F917 HydrophobicContact CG2-CE1 4.34Å; V905-F917 HydrophobicContact CG2-CZ 3.96Å; Q915-F917 HydrophobicContact CB-CE2 3.72Å; Q915-F917 HydrophobicContact CB-CZ 3.91Å; F917-G919 PolarHBondContact O-N 3.46Å; F917-G919 VanDerWaalsContact O-N 3.08Å; F917-V920 CarbonylContact C-O 3.28Å; F917-V920 WeakPolarHBondContact CA-O 3.32Å; F917-V920 HydrophobicContact CB-CG1 3.92Å; F917-V920 PolarHBondContact N-O 2.85Å; F917-V920 PolarHBondContact O-N 3.08Å; F917-I922 HydrophobicContact CD2-CD1 4.36Å; F917-I922 HydrophobicContact CE2-CD1 4.21Å
918	K	90.9	Very high	90.9	Very high	140 Å²	140	38.2 Å²	38.2	61%	0.609	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	112.6	178.4	-173.5	-168.2	179.3	-154.2	0	110	D877 S878 A879 V920	D877-K918 WeakPolarHBondContact O-CD 2.91Å; D877-K918 WeakPolarHBondContact O-CE 3.4Å; D877-K918 PolarHBondContact O-NZ 3.05Å; S878-K918 CarbonylContact C-O 3.48Å; S878-K918 VanDerWaalsContact CA-O 3.3Å; S878-K918 WeakPolarHBondContact CA-O 3.49Å; S878-K918 WeakPolarHBondContact CB-O 3.1Å; A879-K918 PolarHBondContact N-O 3.48Å; K918-V920 PolarHBondContact O-N 3.16Å
919	G	91.6	Very high	91.1	Very high	16 Å²	16	42.2 Å²	42.2	17%	0.165	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.6	2.8	174.9	0	0	0	0	0	115.9	F917 D939	F917-G919 PolarHBondContact O-N 3.46Å; F917-G919 VanDerWaalsContact O-N 3.08Å; G919-D939 WeakPolarHBondContact CA-OD2 3.2Å; G919-D939 PolarHBondContact O-N 2.78Å; G919-D939 VanDerWaalsContact O-N 3.1Å
920	V	94.5	Very high	91.4	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	138.9	-174.4	66.4	0	0	0	0	111.8	A879 V881 F917 K918 I922 V936 M937 F938	A879-V920 HydrophobicContact CB-CG1 4.13Å; V881-V920 HydrophobicContact CG2-CB 4.48Å; V881-V920 HydrophobicContact CG2-CG1 3.89Å; V881-V920 HydrophobicContact CG2-CG2 3.95Å; F917-V920 CarbonylContact C-O 3.28Å; F917-V920 WeakPolarHBondContact CA-O 3.32Å; F917-V920 HydrophobicContact CB-CG1 3.92Å; F917-V920 PolarHBondContact N-O 2.85Å; F917-V920 PolarHBondContact O-N 3.08Å; K918-V920 PolarHBondContact O-N 3.16Å; V920-I922 HydrophobicContact CG2-CG1 4.43Å; V920-V936 HydrophobicContact CG2-CG1 3.51Å; V920-M937 CarbonylContact C-O 3.46Å; V920-M937 WeakPolarHBondContact CA-O 3.44Å; V920-F938 HydrophobicContact CB-CD1 3.78Å; V920-F938 HydrophobicContact CB-CE1 3.85Å; V920-F938 HydrophobicContact CG2-CD1 3.72Å; V920-F938 HydrophobicContact CG2-CE1 3.61Å; V920-F938 HydrophobicContact CG2-CG 4.24Å; V920-F938 HydrophobicContact CG2-CZ 4.02Å
921	T	94.4	Very high	91.7	Very high	4 Å²	4	39.3 Å²	39.3	3%	0.025	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	133.4	172	-61.9	0	0	0	0	109.3	W754 L914 Q915 T916 M937	W754-T921 HydrophobicContact CZ3-CG2 4.32Å; L914-T921 HydrophobicContact CD1-CG2 3.52Å; L914-T921 HydrophobicContact CG-CG2 4.31Å; Q915-T921 WeakPolarHBondContact O-CA 3.36Å; T916-T921 WeakPolarHBondContact CG2-OG1 3.22Å; T916-T921 PolarHBondContact OG1-OG1 3.4Å; T921-M937 HydrophobicContact CG2-CE 3.59Å; T921-M937 PolarHBondContact N-O 3.21Å; T921-M937 PolarHBondContact O-N 3.2Å
922	I	96.2	Very high	92.1	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	133.4	179.1	-53.7	173.9	0	0	0	108.5	V881 V898 V900 F907 Q915 F917 V920 E935 V936	V881-I922 HydrophobicContact CG1-CD1 3.76Å; V881-I922 HydrophobicContact CG2-CD1 3.96Å; V898-I922 HydrophobicContact CG1-CD1 4.45Å; V900-I922 HydrophobicContact CG2-CD1 3.64Å; F907-I922 HydrophobicContact CE1-CB 3.81Å; F907-I922 HydrophobicContact CE1-CG2 3.68Å; F907-I922 WeakPolarHBondContact CE1-O 3.45Å; F907-I922 HydrophobicContact CE2-CG2 3.98Å; F907-I922 HydrophobicContact CZ-CB 3.58Å; F907-I922 HydrophobicContact CZ-CD1 4.28Å; F907-I922 HydrophobicContact CZ-CG2 3.36Å; Q915-I922 PolarHBondContact N-O 3.38Å; Q915-I922 PolarHBondContact O-N 3.24Å; F917-I922 HydrophobicContact CD2-CD1 4.36Å; F917-I922 HydrophobicContact CE2-CD1 4.21Å; V920-I922 HydrophobicContact CG2-CG1 4.43Å; I922-E935 CarbonylContact C-O 3.59Å; I922-E935 WeakPolarHBondContact CA-O 3.21Å; I922-V936 HydrophobicContact CG1-CG1 4.31Å; I922-V936 HydrophobicContact CG1-CG2 4.44Å; I922-V936 HydrophobicContact CG2-CG2 4.47Å
923	R	94.7	Very high	92.4	Very high	20 Å²	20	37.3 Å²	37.3	8%	0.075	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	136.7	177.9	-177.3	177.1	171	-108.7	0.5	111.3	V682 D688 K913 L914 E935 M937	V682-R923 VanDerWaalsContact CG2-CD 3.45Å; D688-R923 IonicContact OD1-NH2 3.73Å; D688-R923 IonicContact OD2-CZ 3.99Å; D688-R923 IonicContact OD2-NH2 3.61Å; D688-R923 PolarHBondContact OD2-NH2 3.27Å; K913-R923 CarbonylContact O-C 3.5Å; K913-R923 WeakPolarHBondContact O-CA 3.43Å; L914-R923 HydrophobicContact CD1-CB 3.76Å; L914-R923 HydrophobicContact CD1-CG 4.11Å; R923-E935 HydrophobicContact CB-CB 4.27Å; R923-E935 IonicContact CZ-OE2 3.52Å; R923-E935 PolarHBondContact N-O 3.36Å; R923-E935 IonicContact NH1-OE1 2.69Å; R923-E935 IonicContact NH1-OE2 3.31Å; R923-E935 PolarHBondContact NH1-OE2 2.03Å; R923-E935 PolarHBondContact O-N 3.38Å; R923-M937 HydrophobicContact CB-CE 3.97Å
924	S	94.7	Very high	92.6	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.007	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	133.8	159.8	-179	0	0	0	0	108.3	K913 N928	K913-S924 WeakPolarHBondContact CB-O 3.49Å; K913-S924 PolarHBondContact O-N 3.46Å; S924-N928 PolarHBondContact OG-ND2 3.22Å; S924-N928 VanDerWaalsContact OG-ND2 3.13Å; S924-N928 PolarHBondContact OG-O 3.03Å
925	R	92.4	Very high	92.9	Very high	56 Å²	56	36.8 Å²	36.8	21%	0.211	18%	0.18	C	C	.	.			trans	-57.2	146.2	178.8	-64.1	177	-178.6	179.2	0.3	111.1	N690 R927 N928 E935	N690-R925 HydrophobicContact CB-CB 4.46Å; R925-R927 VanDerWaalsContact C-N 3.33Å; R925-R927 PolarHBondContact O-N 2.84Å; R925-R927 VanDerWaalsContact O-N 3.15Å; R925-N928 HydrophobicContact CB-CB 4.4Å; R925-N928 WeakPolarHBondContact O-CB 3.36Å; R925-N928 PolarHBondContact O-N 2.97Å; R925-E935 IonicContact CZ-OE1 2.65Å; R925-E935 IonicContact NE-OE1 3.07Å; R925-E935 PolarHBondContact NE-OE1 3.36Å; R925-E935 IonicContact NH2-OE1 3.21Å; R925-E935 PolarHBondContact NH2-OE1 2.71Å; R925-E935 VanDerWaalsContact NH2-OE1 3.08Å
926	P	89	Confident	93.1	Very high	53 Å²	53	36.2 Å²	36.2	34%	0.344	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-39.6	-168.9	-30	36.2	0	0	0	115.4	D688 K913	D688-P926 VanDerWaalsContact OD2-CD 3.27Å; D688-P926 WeakPolarHBondContact OD2-CD 3.44Å; D688-P926 WeakPolarHBondContact OD2-CG 3.36Å; K913-P926 WeakPolarHBondContact CE-O 3.4Å
927	R	88.1	Confident	93.4	Very high	176 Å²	176	34.5 Å²	34.5	66%	0.664	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-10.4	179	-67.2	177.3	-165.8	-171.7	8.7	114	N690 G691 H693 R925 M929	N690-R927 VanDerWaalsContact O-CD 3.27Å; N690-R927 WeakPolarHBondContact O-CD 3.39Å; N690-R927 VanDerWaalsContact O-CG 3.25Å; N690-R927 WeakPolarHBondContact O-CG 3.2Å; N690-R927 PolarHBondContact O-NE 3.45Å; N690-R927 VanDerWaalsContact O-NE 3.16Å; G691-R927 PolarHBondContact O-NH2 3.41Å; H693-R927 PolarHBondContact NE2-NH2 3.48Å; R925-R927 VanDerWaalsContact C-N 3.33Å; R925-R927 PolarHBondContact O-N 2.84Å; R925-R927 VanDerWaalsContact O-N 3.15Å; R927-M929 PolarHBondContact O-N 2.82Å; R927-M929 VanDerWaalsContact O-N 3.17Å
928	N	90.9	Very high	93.5	Very high	18 Å²	18	33.7 Å²	33.7	10%	0.096	16%	0.163	C	C	.	.			trans	-80.3	96	178.4	174.7	13.4	0	0	0	110.1	K913 S924 R925 N930 M931 S932 A933	K913-N928 PolarHBondContact NZ-O 3.44Å; S924-N928 PolarHBondContact OG-ND2 3.22Å; S924-N928 VanDerWaalsContact OG-ND2 3.13Å; S924-N928 PolarHBondContact OG-O 3.03Å; R925-N928 HydrophobicContact CB-CB 4.4Å; R925-N928 WeakPolarHBondContact O-CB 3.36Å; R925-N928 PolarHBondContact O-N 2.97Å; N928-N930 PolarHBondContact OD1-N 3.18Å; N928-N930 PolarHBondContact OD1-OD1 2.81Å; N928-M931 PolarHBondContact OD1-N 2.86Å; N928-S932 PolarHBondContact ND2-N 3.28Å; N928-S932 PolarHBondContact OD1-N 2.95Å; N928-A933 PolarHBondContact ND2-N 3.35Å; N928-A933 PolarHBondContact ND2-O 2.92Å
929	M	87.7	Confident	93.5	Very high	108 Å²	108	30.6 Å²	30.6	53%	0.532	15%	0.153	S	C	.	.			trans	-90.6	-22.7	-179.9	-63.6	-61.4	-70.4	0	0	113.9	D908 K913 R927	D908-M929 WeakPolarHBondContact O-CE 3.12Å; K913-M929 PolarHBondContact NZ-SD 2.89Å; R927-M929 PolarHBondContact O-N 2.82Å; R927-M929 VanDerWaalsContact O-N 3.17Å
930	N	91.2	Very high	93.4	Very high	56 Å²	56	30.8 Å²	30.8	30%	0.299	15%	0.151	S	C	.	.	S	Bend	trans	-94.4	6.1	-175	66.8	1.2	0	0	0	112.6	Y894 K895 N928 S932	Y894-N930 CarbonylContact C-O 3.59Å; Y894-N930 WeakPolarHBondContact CA-O 3.49Å; K895-N930 HydrophobicContact CG-CB 4.13Å; K895-N930 PolarHBondContact N-O 2.97Å; N928-N930 PolarHBondContact OD1-N 3.18Å; N928-N930 PolarHBondContact OD1-OD1 2.81Å; N930-S932 VanDerWaalsContact C-N 3.26Å; N930-S932 PolarHBondContact O-N 3.3Å; N930-S932 VanDerWaalsContact OD1-CB 3.32Å; N930-S932 WeakPolarHBondContact OD1-CB 3.49Å; N930-S932 PolarHBondContact OD1-N 3.24Å; N930-S932 VanDerWaalsContact OD1-N 3.15Å; N930-S932 PolarHBondContact OD1-OG 2.92Å
931	M	93.3	Very high	93.2	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.005	16%	0.155	C	C	.	.			trans	56	37.9	-178.9	-60.8	172.7	50.3	0	0	112.7	Y894 T896 V898 F906 F907 N928	Y894-M931 HydrophobicContact CD1-CG 4.29Å; Y894-M931 HydrophobicContact CD1-SD 3.87Å; Y894-M931 HydrophobicContact CE1-SD 4.3Å; Y894-M931 HydrophobicContact CG-SD 4.37Å; T896-M931 WeakPolarHBondContact CG2-O 3.33Å; T896-M931 PolarHBondContact OG1-O 2.79Å; V898-M931 HydrophobicContact CB-CE 4.4Å; V898-M931 HydrophobicContact CG2-CE 3.67Å; F906-M931 HydrophobicContact CB-SD 4.47Å; F906-M931 HydrophobicContact CD1-SD 4.2Å; F907-M931 HydrophobicContact CB-CG 4.35Å; F907-M931 HydrophobicContact CD2-CE 4.05Å; N928-M931 PolarHBondContact OD1-N 2.86Å
932	S	94.9	Very high	93.2	Very high	32 Å²	32	31 Å²	31	22%	0.224	15%	0.154	C	C	.	.			trans	-79.7	-31.2	177.7	67.7	0	0	0	0	113.3	N928 N930 E947 E948	N928-S932 PolarHBondContact ND2-N 3.28Å; N928-S932 PolarHBondContact OD1-N 2.95Å; N930-S932 VanDerWaalsContact C-N 3.26Å; N930-S932 PolarHBondContact O-N 3.3Å; N930-S932 VanDerWaalsContact OD1-CB 3.32Å; N930-S932 WeakPolarHBondContact OD1-CB 3.49Å; N930-S932 PolarHBondContact OD1-N 3.24Å; N930-S932 VanDerWaalsContact OD1-N 3.15Å; N930-S932 PolarHBondContact OD1-OG 2.92Å; S932-E947 CarbonylContact O-C 3.52Å; S932-E947 WeakPolarHBondContact O-CA 3.45Å; S932-E948 PolarHBondContact O-N 3.31Å
933	A	95.5	Very high	93.3	Very high	12 Å²	12	31 Å²	31	10%	0.099	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	124.8	178.6	0	0	0	0	0	112	N928 V946 E947	N928-A933 PolarHBondContact ND2-N 3.35Å; N928-A933 PolarHBondContact ND2-O 2.92Å; A933-V946 CarbonylContact C-O 3.54Å; A933-V946 WeakPolarHBondContact CA-O 3.28Å; A933-E947 HydrophobicContact CB-CG 4.13Å
934	L	97.3	Very high	93.4	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	135.4	-178.2	-65	166.5	0	0	0	110.7	I883 V898 F907 L945 V946	I883-L934 HydrophobicContact CD1-CB 4.33Å; I883-L934 HydrophobicContact CD1-CD1 3.99Å; I883-L934 HydrophobicContact CG1-CD1 4.32Å; I883-L934 HydrophobicContact CG2-CD1 4Å; V898-L934 HydrophobicContact CG2-CD1 3.32Å; F907-L934 HydrophobicContact CD2-CD2 4.14Å; F907-L934 HydrophobicContact CG-CD2 4.36Å; L934-L945 WeakPolarHBondContact O-CA 3.45Å; L934-V946 PolarHBondContact N-O 3.02Å; L934-V946 PolarHBondContact O-N 3.2Å
935	E	97	Very high	93.5	Very high	13 Å²	13	30.8 Å²	30.8	6%	0.061	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	118.3	176	-67.8	164	-176.3	0	0	107.9	V678 I922 R923 R925 L944 L945	V678-E935 HydrophobicContact CG1-CB 3.76Å; V678-E935 HydrophobicContact CG1-CG 3.84Å; I922-E935 CarbonylContact C-O 3.59Å; I922-E935 WeakPolarHBondContact CA-O 3.21Å; R923-E935 HydrophobicContact CB-CB 4.27Å; R923-E935 IonicContact CZ-OE2 3.52Å; R923-E935 PolarHBondContact N-O 3.36Å; R923-E935 IonicContact NH1-OE1 2.69Å; R923-E935 IonicContact NH1-OE2 3.31Å; R923-E935 PolarHBondContact NH1-OE2 2.03Å; R923-E935 PolarHBondContact O-N 3.38Å; R925-E935 IonicContact CZ-OE1 2.65Å; R925-E935 IonicContact NE-OE1 3.07Å; R925-E935 PolarHBondContact NE-OE1 3.36Å; R925-E935 IonicContact NH2-OE1 3.21Å; R925-E935 PolarHBondContact NH2-OE1 2.71Å; R925-E935 VanDerWaalsContact NH2-OE1 3.08Å; E935-L944 CarbonylContact C-O 3.44Å; E935-L944 WeakPolarHBondContact CA-O 3.39Å; E935-L945 HydrophobicContact CG-CD1 3.87Å
936	V	97.9	Very high	93.8	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	125.7	178.2	-174	0	0	0	0	108.2	V881 I883 V920 I922 F938 G943 L944	V881-V936 HydrophobicContact CG1-CG1 4.4Å; V881-V936 HydrophobicContact CG1-CG2 4.33Å; V881-V936 HydrophobicContact CG2-CG1 4.34Å; I883-V936 HydrophobicContact CD1-CG2 3.78Å; V920-V936 HydrophobicContact CG2-CG1 3.51Å; I922-V936 HydrophobicContact CG1-CG1 4.31Å; I922-V936 HydrophobicContact CG1-CG2 4.44Å; I922-V936 HydrophobicContact CG2-CG2 4.47Å; V936-F938 HydrophobicContact CG1-CD2 4.3Å; V936-F938 HydrophobicContact CG1-CE2 3.66Å; V936-F938 HydrophobicContact CG1-CZ 3.87Å; V936-G943 CarbonylContact O-C 3.54Å; V936-G943 VanDerWaalsContact O-CA 3.32Å; V936-G943 WeakPolarHBondContact O-CA 3.46Å; V936-L944 HydrophobicContact CB-CB 4.02Å; V936-L944 HydrophobicContact CB-CD1 4.26Å; V936-L944 HydrophobicContact CB-CG 4.34Å; V936-L944 HydrophobicContact CG1-CD1 4.44Å; V936-L944 HydrophobicContact CG2-CB 4.46Å; V936-L944 PolarHBondContact N-O 3.13Å; V936-L944 PolarHBondContact O-N 3.23Å
937	M	96.5	Very high	94.1	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	111.7	-170.4	-48	177.1	-87.6	0	0	108.5	V678 V682 T708 L914 V920 T921 R923	V678-M937 WeakPolarHBondContact O-CG 3.49Å; V682-M937 HydrophobicContact CB-CE 4.26Å; V682-M937 HydrophobicContact CB-SD 3.69Å; V682-M937 HydrophobicContact CG2-CE 3.81Å; V682-M937 HydrophobicContact CG2-SD 3.79Å; T708-M937 HydrophobicContact CG2-CB 3.9Å; T708-M937 HydrophobicContact CG2-CE 4.4Å; T708-M937 HydrophobicContact CG2-SD 4Å; L914-M937 HydrophobicContact CD1-CE 4.11Å; V920-M937 CarbonylContact C-O 3.46Å; V920-M937 WeakPolarHBondContact CA-O 3.44Å; T921-M937 HydrophobicContact CG2-CE 3.59Å; T921-M937 PolarHBondContact N-O 3.21Å; T921-M937 PolarHBondContact O-N 3.2Å; R923-M937 HydrophobicContact CB-CE 3.97Å
938	F	95.5	Very high	94.4	Very high	2 Å²	2	19.7 Å²	19.7	1%	0.009	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	153.1	179.3	-68.1	-82.9	0	0	0	111.5	A873 D875 V920 V936 T940 G941 L942 L944	A873-F938 HydrophobicContact CB-CE2 3.84Å; A873-F938 HydrophobicContact CB-CZ 3.57Å; D875-F938 HydrophobicContact CB-CB 3.93Å; D875-F938 HydrophobicContact CB-CD1 3.49Å; D875-F938 VanDerWaalsContact CB-CD1 3.49Å; D875-F938 HydrophobicContact CB-CE1 4.18Å; D875-F938 HydrophobicContact CB-CG 3.83Å; V920-F938 HydrophobicContact CB-CD1 3.78Å; V920-F938 HydrophobicContact CB-CE1 3.85Å; V920-F938 HydrophobicContact CG2-CD1 3.72Å; V920-F938 HydrophobicContact CG2-CE1 3.61Å; V920-F938 HydrophobicContact CG2-CG 4.24Å; V920-F938 HydrophobicContact CG2-CZ 4.02Å; V936-F938 HydrophobicContact CG1-CD2 4.3Å; V936-F938 HydrophobicContact CG1-CE2 3.66Å; V936-F938 HydrophobicContact CG1-CZ 3.87Å; F938-T940 PolarHBondContact O-N 2.57Å; F938-G941 PolarHBondContact O-N 3.2Å; F938-L942 HydrophobicContact CB-CB 4.25Å; F938-L942 HydrophobicContact CD2-CB 4.25Å; F938-L942 HydrophobicContact CD2-CD2 4.05Å; F938-L942 HydrophobicContact CD2-CG 4.21Å; F938-L942 HydrophobicContact CE2-CD2 4.44Å; F938-L942 PolarHBondContact N-O 2.8Å; F938-L944 HydrophobicContact CE2-CD1 3.94Å; F938-L944 HydrophobicContact CE2-CG 4.32Å
939	D	89.9	Confident	94.4	Very high	75 Å²	75	19.9 Å²	19.9	40%	0.401	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-21.7	-175.1	-80.8	-2.1	0	0	0	113.6	R709 G919 G941	R709-D939 PolarHBondContact NH1-O 2.79Å; G919-D939 WeakPolarHBondContact CA-OD2 3.2Å; G919-D939 PolarHBondContact O-N 2.78Å; G919-D939 VanDerWaalsContact O-N 3.1Å; D939-G941 VanDerWaalsContact C-N 3.29Å
940	T	89.3	Confident	94.2	Very high	20 Å²	20	21.1 Å²	21.1	12%	0.123	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-5.2	175.2	54.8	0	0	0	0	114.5	N843 M845 D875 F938	N843-T940 HydrophobicContact CB-CG2 4.05Å; M845-T940 HydrophobicContact CE-CG2 3.62Å; M845-T940 WeakPolarHBondContact CE-OG1 3.48Å; M845-T940 PolarHBondContact SD-OG1 3.25Å; M845-T940 VanDerWaalsContact SD-OG1 3.42Å; D875-T940 VanDerWaalsContact CG-OG1 3.27Å; D875-T940 WeakPolarHBondContact OD1-CG2 3.36Å; D875-T940 VanDerWaalsContact OD2-CB 3.23Å; D875-T940 WeakPolarHBondContact OD2-CB 3.3Å; D875-T940 WeakPolarHBondContact OD2-CG2 3.2Å; D875-T940 PolarHBondContact OD2-N 2.92Å; D875-T940 PolarHBondContact OD2-OG1 2.95Å; F938-T940 PolarHBondContact O-N 2.57Å
941	G	91.3	Very high	94	Very high	7 Å²	7	18.5 Å²	18.5	7%	0.072	10%	0.096	C	C	.	.	S	Bend	trans	95	1.8	-179.5	0	0	0	0	0	114.6	G679 F938 D939 G943 P960	G679-G941 CarbonylContact C-O 3.16Å; G679-G941 WeakPolarHBondContact CA-O 3.28Å; F938-G941 PolarHBondContact O-N 3.2Å; D939-G941 VanDerWaalsContact C-N 3.29Å; G941-G943 PolarHBondContact O-N 2.78Å; G941-P960 VanDerWaalsContact C-CG 3.46Å; G941-P960 VanDerWaalsContact O-CG 3.29Å; G941-P960 WeakPolarHBondContact O-CG 3.39Å
942	L	94.9	Very high	93.8	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.005	10%	0.104	C	C	.	.			trans	-66.5	128.8	169.6	179.4	67.5	0	0	0	109.9	L838 M845 V847 F938 V957 V959	L838-L942 HydrophobicContact CD1-CD1 3.67Å; L838-L942 HydrophobicContact CD1-CD2 4.22Å; L838-L942 HydrophobicContact CD1-CG 4.41Å; M845-L942 HydrophobicContact CB-CD2 4.19Å; M845-L942 HydrophobicContact CG-CD2 4.48Å; M845-L942 HydrophobicContact SD-CB 3.76Å; M845-L942 HydrophobicContact SD-CD2 3.81Å; M845-L942 HydrophobicContact SD-CG 4.31Å; V847-L942 HydrophobicContact CG2-CD2 3.98Å; F938-L942 HydrophobicContact CB-CB 4.25Å; F938-L942 HydrophobicContact CD2-CB 4.25Å; F938-L942 HydrophobicContact CD2-CD2 4.05Å; F938-L942 HydrophobicContact CD2-CG 4.21Å; F938-L942 HydrophobicContact CE2-CD2 4.44Å; F938-L942 PolarHBondContact N-O 2.8Å; L942-V957 HydrophobicContact CD1-CG1 3.67Å; L942-V959 HydrophobicContact CD1-CG2 3.91Å
943	G	96.5	Very high	93.9	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	140.9	177.2	0	0	0	0	0	112	G679 V936 G941 V957 S958	G679-G943 VanDerWaalsContact CA-CA 3.41Å; V936-G943 CarbonylContact O-C 3.54Å; V936-G943 VanDerWaalsContact O-CA 3.32Å; V936-G943 WeakPolarHBondContact O-CA 3.46Å; G941-G943 PolarHBondContact O-N 2.78Å; G943-V957 CarbonylContact O-C 3.51Å; G943-V957 WeakPolarHBondContact O-CA 3.23Å; G943-S958 PolarHBondContact N-O 2.82Å; G943-S958 PolarHBondContact O-N 2.87Å
944	L	98	Very high	94	Very high	3 Å²	3	17.9 Å²	17.9	2%	0.016	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	134.5	168.7	-46.1	172.8	0	0	0	109.1	V847 A873 E935 V936 F938 M956 V957	V847-L944 HydrophobicContact CG1-CD1 4.38Å; V847-L944 HydrophobicContact CG1-CD2 4.15Å; V847-L944 HydrophobicContact CG2-CD1 4.49Å; V847-L944 HydrophobicContact CG2-CD2 3.92Å; A873-L944 HydrophobicContact CB-CD1 3.51Å; E935-L944 CarbonylContact C-O 3.44Å; E935-L944 WeakPolarHBondContact CA-O 3.39Å; V936-L944 HydrophobicContact CB-CB 4.02Å; V936-L944 HydrophobicContact CB-CD1 4.26Å; V936-L944 HydrophobicContact CB-CG 4.34Å; V936-L944 HydrophobicContact CG1-CD1 4.44Å; V936-L944 HydrophobicContact CG2-CB 4.46Å; V936-L944 PolarHBondContact N-O 3.13Å; V936-L944 PolarHBondContact O-N 3.23Å; F938-L944 HydrophobicContact CE2-CD1 3.94Å; F938-L944 HydrophobicContact CE2-CG 4.32Å; L944-M956 CarbonylContact C-O 3.36Å; L944-M956 WeakPolarHBondContact CA-O 3.38Å; L944-V957 HydrophobicContact CD2-CB 4.13Å; L944-V957 HydrophobicContact CD2-CG1 3.78Å; L944-V957 HydrophobicContact CD2-CG2 3.71Å
945	L	97.4	Very high	94	Very high	13 Å²	13	17.9 Å²	17.9	7%	0.068	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	112.2	166.6	172.3	67.2	0	0	0	107.7	L934 E935 E947 V955 M956	L934-L945 WeakPolarHBondContact O-CA 3.45Å; E935-L945 HydrophobicContact CG-CD1 3.87Å; L945-E947 HydrophobicContact CD1-CG 4.21Å; L945-E947 HydrophobicContact CG-CG 4.13Å; L945-V955 WeakPolarHBondContact O-CA 3.04Å; L945-M956 HydrophobicContact CB-CB 4.2Å; L945-M956 HydrophobicContact CD2-SD 4.29Å; L945-M956 PolarHBondContact N-O 3.3Å; L945-M956 PolarHBondContact O-N 2.76Å
946	V	98.1	Very high	94.1	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	114.3	-179.7	-175.6	0	0	0	0	108.5	V871 I883 A933 L934 L953 N954 V955	V871-V946 HydrophobicContact CG2-CG1 4.44Å; V871-V946 HydrophobicContact CG2-CG2 4.37Å; I883-V946 HydrophobicContact CD1-CB 4.26Å; I883-V946 HydrophobicContact CD1-CG2 3.92Å; I883-V946 HydrophobicContact CG2-CG1 3.95Å; A933-V946 CarbonylContact C-O 3.54Å; A933-V946 WeakPolarHBondContact CA-O 3.28Å; L934-V946 PolarHBondContact N-O 3.02Å; L934-V946 PolarHBondContact O-N 3.2Å; V946-L953 HydrophobicContact CG1-CB 4.34Å; V946-L953 HydrophobicContact CG1-CD1 4.21Å; V946-L953 HydrophobicContact CG1-CD2 4.16Å; V946-L953 HydrophobicContact CG1-CG 4.48Å; V946-N954 WeakPolarHBondContact CA-O 3.25Å; V946-V955 HydrophobicContact CG2-CG1 4.32Å
947	E	96.1	Very high	94	Very high	31 Å²	31	17.7 Å²	17.7	15%	0.145	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	125.3	179	-63.5	-172.7	122.1	0	0	110	S932 A933 L945 L953 N954 K1126	S932-E947 CarbonylContact O-C 3.52Å; S932-E947 WeakPolarHBondContact O-CA 3.45Å; A933-E947 HydrophobicContact CB-CG 4.13Å; L945-E947 HydrophobicContact CD1-CG 4.21Å; L945-E947 HydrophobicContact CG-CG 4.13Å; E947-L953 CarbonylContact O-C 3.53Å; E947-L953 WeakPolarHBondContact O-CA 3.34Å; E947-N954 PolarHBondContact N-O 3.44Å; E947-N954 PolarHBondContact O-N 2.77Å; E947-K1126 VanDerWaalsContact CD-NZ 3.27Å; E947-K1126 IonicContact OE1-NZ 2.73Å; E947-K1126 PolarHBondContact OE1-NZ 3.2Å; E947-K1126 IonicContact OE2-NZ 3.21Å; E947-K1126 PolarHBondContact OE2-NZ 3.33Å
948	E	94.3	Very high	94	Very high	22 Å²	22	17.8 Å²	17.8	10%	0.103	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	135.1	175	-170.7	-85.6	173	0	0	111	R891 K895 T896 S932 R950 G951 T952 L953	R891-E948 VanDerWaalsContact CD-OE1 3.3Å; R891-E948 WeakPolarHBondContact CD-OE1 3.34Å; K895-E948 HydrophobicContact CB-CB 4.18Å; K895-E948 HydrophobicContact CB-CG 4Å; K895-E948 WeakPolarHBondContact CB-OE2 3.42Å; K895-E948 WeakPolarHBondContact CG-OE2 3.33Å; T896-E948 HydrophobicContact CG2-CB 3.76Å; T896-E948 HydrophobicContact CG2-CG 4.2Å; S932-E948 PolarHBondContact O-N 3.31Å; E948-R950 PolarHBondContact OE1-N 3.08Å; E948-G951 WeakPolarHBondContact OE1-CA 3.27Å; E948-G951 PolarHBondContact OE1-N 3.21Å; E948-T952 CarbonylContact C-O 3.55Å; E948-T952 WeakPolarHBondContact CA-O 3.37Å; E948-L953 HydrophobicContact CB-CD2 3.93Å; E948-L953 HydrophobicContact CG-CD2 4.08Å
949	A	88.9	Confident	94	Very high	22 Å²	22	17.7 Å²	17.7	18%	0.182	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	113.2	168.9	0	0	0	0	0	109.9	G951 T952	A949-G951 PolarHBondContact O-N 3.27Å; A949-T952 PolarHBondContact N-O 3.39Å; A949-T952 PolarHBondContact O-N 2.85Å; A949-T952 PolarHBondContact O-OG1 3.04Å
950	R	85.3	Confident	94	Very high	133 Å²	133	14.2 Å²	14.2	50%	0.502	7%	0.071	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	26.3	170.9	-62.2	-178.5	164.3	120.1	-2.4	115.7	R891 E948 E1115 D1119	R891-R950 PolarHBondContact NH2-O 3.35Å; E948-R950 PolarHBondContact OE1-N 3.08Å; R950-E1115 PolarHBondContact NH1-O 2.84Å; R950-D1119 IonicContact CZ-OD2 2.89Å; R950-D1119 IonicContact NH1-OD1 3.48Å; R950-D1119 PolarHBondContact NH1-OD1 3.34Å; R950-D1119 IonicContact NH1-OD2 2.57Å; R950-D1119 PolarHBondContact NH1-OD2 3.02Å
951	G	85.8	Confident	94	Very high	1 Å²	1	14 Å²	14	1%	0.01	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	100.8	0.6	-178.7	0	0	0	0	0	114.9	A885 E948 A949 Y1061	A885-G951 WeakPolarHBondContact CB-O 3.35Å; E948-G951 WeakPolarHBondContact OE1-CA 3.27Å; E948-G951 PolarHBondContact OE1-N 3.21Å; A949-G951 PolarHBondContact O-N 3.27Å; G951-Y1061 PolarHBondContact O-OH 2.76Å
952	T	90.5	Very high	93.6	Very high	28 Å²	28	20.2 Å²	20.2	17%	0.172	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	150	175.5	69.3	0	0	0	0	109.6	V867 E948 A949	V867-T952 HydrophobicContact CB-CG2 3.78Å; V867-T952 HydrophobicContact CG1-CG2 3.78Å; V867-T952 HydrophobicContact CG2-CG2 4.01Å; E948-T952 CarbonylContact C-O 3.55Å; E948-T952 WeakPolarHBondContact CA-O 3.37Å; A949-T952 PolarHBondContact N-O 3.39Å; A949-T952 PolarHBondContact O-N 2.85Å; A949-T952 PolarHBondContact O-OG1 3.04Å
953	L	95.8	Very high	93.2	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.005	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	127.2	175.4	-57.4	-178.5	0	0	0	109.7	V868 V871 A885 T896 V946 E947 E948 V955	V868-L953 HydrophobicContact CB-CB 4.2Å; V868-L953 WeakPolarHBondContact CB-O 3.42Å; V868-L953 HydrophobicContact CG1-CB 4Å; V868-L953 PolarHBondContact O-N 2.97Å; V871-L953 HydrophobicContact CG2-CD1 4.11Å; A885-L953 HydrophobicContact CB-CD2 3.99Å; A885-L953 HydrophobicContact CB-CG 4.13Å; T896-L953 HydrophobicContact CG2-CD2 4.09Å; V946-L953 HydrophobicContact CG1-CB 4.34Å; V946-L953 HydrophobicContact CG1-CD1 4.21Å; V946-L953 HydrophobicContact CG1-CD2 4.16Å; V946-L953 HydrophobicContact CG1-CG 4.48Å; E947-L953 CarbonylContact O-C 3.53Å; E947-L953 WeakPolarHBondContact O-CA 3.34Å; E948-L953 HydrophobicContact CB-CD2 3.93Å; E948-L953 HydrophobicContact CG-CD2 4.08Å; L953-V955 HydrophobicContact CB-CG2 4.32Å
954	N	97.2	Very high	92.7	Very high	3 Å²	3	21.1 Å²	21.1	2%	0.016	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	132.4	163.6	-59.5	-35.3	0	0	0	108.1	Y810 I811 Y812 G813 V946 E947 N1123	Y810-N954 HydrophobicContact CE2-CB 3.98Å; Y810-N954 WeakPolarHBondContact OH-CB 2.93Å; I811-N954 WeakPolarHBondContact O-CA 3.06Å; Y812-N954 VanDerWaalsContact CA-OD1 3.27Å; Y812-N954 WeakPolarHBondContact CA-OD1 3.32Å; Y812-N954 WeakPolarHBondContact CB-OD1 3.36Å; G813-N954 PolarHBondContact N-OD1 2.82Å; V946-N954 WeakPolarHBondContact CA-O 3.25Å; E947-N954 PolarHBondContact N-O 3.44Å; E947-N954 PolarHBondContact O-N 2.77Å; N954-N1123 VanDerWaalsContact ND2-CG 3.34Å; N954-N1123 PolarHBondContact ND2-ND2 3.12Å
955	V	98.2	Very high	91.5	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	113.4	-171.9	-170.8	0	0	0	0	109.1	Y810 I811 L835 V868 V871 L945 V946 L953 V957	Y810-V955 WeakPolarHBondContact CA-O 3.1Å; Y810-V955 VanDerWaalsContact CD2-O 3.31Å; Y810-V955 WeakPolarHBondContact CD2-O 3.48Å; I811-V955 HydrophobicContact CG2-CB 3.61Å; I811-V955 HydrophobicContact CG2-CG2 4.13Å; I811-V955 PolarHBondContact N-O 3.27Å; I811-V955 PolarHBondContact O-N 2.68Å; L835-V955 HydrophobicContact CD2-CB 4.44Å; L835-V955 HydrophobicContact CD2-CG1 4.01Å; V868-V955 HydrophobicContact CG1-CG2 4.26Å; V871-V955 HydrophobicContact CG1-CG1 4.38Å; V871-V955 HydrophobicContact CG2-CB 4.42Å; V871-V955 HydrophobicContact CG2-CG1 4.22Å; V871-V955 HydrophobicContact CG2-CG2 3.35Å; L945-V955 WeakPolarHBondContact O-CA 3.04Å; V946-V955 HydrophobicContact CG2-CG1 4.32Å; L953-V955 HydrophobicContact CB-CG2 4.32Å; V955-V957 HydrophobicContact CG1-CG2 4.36Å
956	M	97.7	Very high	90.2	Very high	10 Å²	10	23.7 Å²	23.7	5%	0.049	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	134.3	168.4	173.3	-163.4	-71.7	0	0	108.9	V808 G809 Y810 L944 L945 F1127 L1130	V808-M956 HydrophobicContact CB-CG 4.25Å; V808-M956 HydrophobicContact CG1-CG 4.25Å; V808-M956 HydrophobicContact CG1-SD 4.15Å; G809-M956 WeakPolarHBondContact O-CA 3.35Å; Y810-M956 HydrophobicContact CD2-CB 3.76Å; Y810-M956 HydrophobicContact CE2-CB 4.17Å; L944-M956 CarbonylContact C-O 3.36Å; L944-M956 WeakPolarHBondContact CA-O 3.38Å; L945-M956 HydrophobicContact CB-CB 4.2Å; L945-M956 HydrophobicContact CD2-SD 4.29Å; L945-M956 PolarHBondContact N-O 3.3Å; L945-M956 PolarHBondContact O-N 2.76Å; M956-F1127 HydrophobicContact CE-CD2 3.39Å; M956-F1127 HydrophobicContact CE-CE2 3.56Å; M956-F1127 HydrophobicContact CG-CE2 4.04Å; M956-F1127 HydrophobicContact SD-CE2 4.45Å; M956-L1130 HydrophobicContact CE-CD1 4.18Å
957	V	97.7	Very high	88.3	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	122.8	174.4	-174.6	0	0	0	0	108.6	V808 G809 Y820 L835 T836 L942 G943 L944 V955 V959 L1001	V808-V957 VanDerWaalsContact CA-O 3.23Å; V808-V957 WeakPolarHBondContact CA-O 3.22Å; G809-V957 PolarHBondContact N-O 3.4Å; G809-V957 PolarHBondContact O-N 2.87Å; Y820-V957 HydrophobicContact CE1-CB 4.42Å; Y820-V957 VanDerWaalsContact OH-CG1 3.3Å; Y820-V957 WeakPolarHBondContact OH-CG1 3.29Å; L835-V957 HydrophobicContact CD2-CG2 3.69Å; L835-V957 HydrophobicContact CG-CG2 4.47Å; T836-V957 HydrophobicContact CG2-CG1 3.92Å; L942-V957 HydrophobicContact CD1-CG1 3.67Å; G943-V957 CarbonylContact O-C 3.51Å; G943-V957 WeakPolarHBondContact O-CA 3.23Å; L944-V957 HydrophobicContact CD2-CB 4.13Å; L944-V957 HydrophobicContact CD2-CG1 3.78Å; L944-V957 HydrophobicContact CD2-CG2 3.71Å; V955-V957 HydrophobicContact CG1-CG2 4.36Å; V957-V959 HydrophobicContact CG1-CG2 4.01Å; V957-L1001 HydrophobicContact CB-CD1 3.65Å; V957-L1001 HydrophobicContact CG2-CD1 3.48Å; V957-L1001 VanDerWaalsContact CG2-CD1 3.48Å
958	S	96.1	Very high	86.2	Confident	1 Å²	1	26.2 Å²	26.2	1%	0.007	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	114.4	176.3	173.5	0	0	0	0	110.2	V676 P806 G943	V676-S958 PolarHBondContact O-OG 3.03Å; P806-S958 VanDerWaalsContact CB-OG 3.3Å; P806-S958 WeakPolarHBondContact CB-OG 3.14Å; G943-S958 PolarHBondContact N-O 2.82Å; G943-S958 PolarHBondContact O-N 2.87Å
959	V	94	Very high	84	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	129.4	-175.6	179	0	0	0	0	110.5	P806 A807 Y820 L838 L942 V957 Y963 F1004	P806-V959 VanDerWaalsContact CA-O 3.28Å; P806-V959 WeakPolarHBondContact CA-O 3.39Å; P806-V959 WeakPolarHBondContact CB-O 3.37Å; A807-V959 PolarHBondContact N-O 3.18Å; A807-V959 PolarHBondContact O-N 3.27Å; Y820-V959 HydrophobicContact CD1-CG2 4.32Å; Y820-V959 HydrophobicContact CE1-CB 4.2Å; Y820-V959 HydrophobicContact CE1-CG2 3.45Å; Y820-V959 VanDerWaalsContact CE1-CG2 3.45Å; Y820-V959 HydrophobicContact CE2-CG2 4.28Å; Y820-V959 VanDerWaalsContact CZ-CG2 3.42Å; Y820-V959 VanDerWaalsContact OH-CG2 3.27Å; Y820-V959 WeakPolarHBondContact OH-CG2 3.35Å; L838-V959 HydrophobicContact CD1-CG1 4.13Å; L838-V959 HydrophobicContact CD1-CG2 4.17Å; L838-V959 HydrophobicContact CD2-CG1 3.96Å; L838-V959 HydrophobicContact CD2-CG2 4.31Å; L942-V959 HydrophobicContact CD1-CG2 3.91Å; V957-V959 HydrophobicContact CG1-CG2 4.01Å; V959-Y963 HydrophobicContact CG1-CD2 4.17Å; V959-Y963 HydrophobicContact CG1-CG 4.23Å; V959-F1004 HydrophobicContact CG1-CD1 4.19Å; V959-F1004 HydrophobicContact CG1-CE1 4.34Å
960	P	91.8	Very high	82	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.013	17%	0.173	C	C	.	.			trans	-58.7	147.4	173.7	-25.4	33.7	0	0	0	112.8	G941 E962 Y963	G941-P960 VanDerWaalsContact C-CG 3.46Å; G941-P960 VanDerWaalsContact O-CG 3.29Å; G941-P960 WeakPolarHBondContact O-CG 3.39Å; P960-E962 PolarHBondContact O-N 2.75Å; P960-Y963 HydrophobicContact CB-CD2 3.97Å; P960-Y963 HydrophobicContact CB-CE2 4.2Å; P960-Y963 HydrophobicContact CG-CD2 4.11Å; P960-Y963 HydrophobicContact CG-CE2 4.08Å; P960-Y963 PolarHBondContact O-N 2.92Å; P960-Y963 VanDerWaalsContact O-N 3.13Å
961	P	88.7	Confident	80.2	Confident	16 Å²	16	37.5 Å²	37.5	10%	0.104	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-63.7	-17	-177.1	25.7	-35.1	0	0	0	114.1	R804 Y963 N964	R804-P961 HydrophobicContact CB-CB 4.08Å; R804-P961 HydrophobicContact CB-CG 3.65Å; P961-Y963 PolarHBondContact O-N 3.26Å; P961-N964 VanDerWaalsContact O-CB 3.32Å; P961-N964 WeakPolarHBondContact O-CB 3.2Å; P961-N964 PolarHBondContact O-N 2.66Å
962	E	83.2	Confident	78.3	Confident	137 Å²	137	41.1 Å²	41.1	64%	0.64	20%	0.202	S	C	*	.	G	3₁₀ helix	trans	-66.2	-24.2	177.1	-64.6	161.8	-144.8	0	0	113	P960 N964	P960-E962 PolarHBondContact O-N 2.75Å; E962-N964 VanDerWaalsContact C-N 3.28Å
963	Y	86.4	Confident	76.1	Confident	16 Å²	16	44.3 Å²	44.3	6%	0.063	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-86.8	3.2	177.9	-66.5	-78.3	0	0	0	113.2	L838 N843 M845 V959 P960 P961 E965 T997	L838-Y963 HydrophobicContact CB-CD1 4Å; L838-Y963 HydrophobicContact CB-CE1 4.37Å; N843-Y963 PolarHBondContact ND2-OH 3.25Å; M845-Y963 HydrophobicContact CE-CE1 3.71Å; M845-Y963 HydrophobicContact CE-CE2 3.84Å; M845-Y963 WeakPolarHBondContact CE-OH 3.43Å; V959-Y963 HydrophobicContact CG1-CD2 4.17Å; V959-Y963 HydrophobicContact CG1-CG 4.23Å; P960-Y963 HydrophobicContact CB-CD2 3.97Å; P960-Y963 HydrophobicContact CB-CE2 4.2Å; P960-Y963 HydrophobicContact CG-CD2 4.11Å; P960-Y963 HydrophobicContact CG-CE2 4.08Å; P960-Y963 PolarHBondContact O-N 2.92Å; P960-Y963 VanDerWaalsContact O-N 3.13Å; P961-Y963 PolarHBondContact O-N 3.26Å; Y963-E965 PolarHBondContact O-N 2.84Å; Y963-T997 WeakPolarHBondContact CB-OG1 3.43Å; Y963-T997 PolarHBondContact O-OG1 2.92Å
964	N	85.2	Confident	73.6	Confident	4 Å²	4	54 Å²	54	2%	0.021	26%	0.264	C	S	.	.	S	Bend	trans	-72.3	127.9	171.7	-176.2	-53.2	0	0	0	109.9	P961 E962 T966 F967 A968 F1004 N1006	P961-N964 VanDerWaalsContact O-CB 3.32Å; P961-N964 WeakPolarHBondContact O-CB 3.2Å; P961-N964 PolarHBondContact O-N 2.66Å; E962-N964 VanDerWaalsContact C-N 3.28Å; N964-T966 PolarHBondContact O-N 2.76Å; N964-T966 VanDerWaalsContact O-N 3.1Å; N964-T966 WeakPolarHBondContact OD1-CB 3.16Å; N964-T966 WeakPolarHBondContact OD1-CG2 3.49Å; N964-T966 PolarHBondContact OD1-N 2.75Å; N964-T966 PolarHBondContact OD1-OG1 2.74Å; N964-F967 HydrophobicContact CB-CD2 3.96Å; N964-F967 WeakPolarHBondContact O-CB 3.34Å; N964-F967 PolarHBondContact O-N 2.95Å; N964-A968 PolarHBondContact O-N 2.84Å; N964-F1004 WeakPolarHBondContact CA-O 2.95Å; N964-F1004 HydrophobicContact CB-CD1 3.76Å; N964-F1004 HydrophobicContact CB-CD2 4.43Å; N964-F1004 HydrophobicContact CB-CE1 3.46Å; N964-F1004 VanDerWaalsContact CB-CE1 3.46Å; N964-F1004 HydrophobicContact CB-CE2 4.15Å; N964-F1004 HydrophobicContact CB-CG 4.24Å; N964-F1004 HydrophobicContact CB-CZ 3.66Å; N964-F1004 WeakPolarHBondContact ND2-CE2 3.19Å; N964-F1004 WeakPolarHBondContact ND2-CZ 3.39Å; N964-N1006 PolarHBondContact ND2-ND2 2.88Å
965	E	73.9	Confident	71.1	Confident	10 Å²	10	56.7 Å²	56.7	5%	0.047	29%	0.292	C	S	.	.	H	α-helix	trans	-60.2	-27.7	-173.6	-60	-170.3	160.7	0	0	113.4	Y963 F967 A968 Y969 R996 T1003 F1004 N1005	Y963-E965 PolarHBondContact O-N 2.84Å; E965-F967 PolarHBondContact O-N 3.03Å; E965-A968 WeakPolarHBondContact O-CB 3.48Å; E965-A968 PolarHBondContact O-N 3.2Å; E965-A968 VanDerWaalsContact O-N 3.13Å; E965-Y969 PolarHBondContact O-N 3.21Å; E965-R996 VanDerWaalsContact CD-NH1 3.25Å; E965-R996 HydrophobicContact CG-CB 4.39Å; E965-R996 HydrophobicContact CG-CG 4.22Å; E965-R996 WeakPolarHBondContact OE1-CB 3.2Å; E965-R996 WeakPolarHBondContact OE1-CD 3.25Å; E965-R996 WeakPolarHBondContact OE1-CG 3.44Å; E965-R996 IonicContact OE1-CZ 3.47Å; E965-R996 IonicContact OE1-NE 3.74Å; E965-R996 IonicContact OE1-NH1 2.91Å; E965-R996 PolarHBondContact OE1-NH1 2.91Å; E965-R996 IonicContact OE2-CZ 2.99Å; E965-R996 IonicContact OE2-NH1 2.8Å; E965-R996 PolarHBondContact OE2-NH1 3.17Å; E965-T1003 VanDerWaalsContact CD-CG2 3.43Å; E965-T1003 HydrophobicContact CG-CG2 4.4Å; E965-T1003 VanDerWaalsContact OE1-CG2 3.27Å; E965-T1003 WeakPolarHBondContact OE1-CG2 3.5Å; E965-F1004 PolarHBondContact N-O 3.26Å; E965-N1005 HydrophobicContact CB-CB 4.07Å; E965-N1005 HydrophobicContact CG-CB 4.47Å
966	T	69.3	Low	68	Low	61 Å²	61	66.9 Å²	66.9	37%	0.374	33%	0.332	S	S	.	.	H	α-helix	trans	-62.8	-24.7	176.6	64.4	0	0	0	0	112.5	N964 N1005	N964-T966 PolarHBondContact O-N 2.76Å; N964-T966 VanDerWaalsContact O-N 3.1Å; N964-T966 WeakPolarHBondContact OD1-CB 3.16Å; N964-T966 WeakPolarHBondContact OD1-CG2 3.49Å; N964-T966 PolarHBondContact OD1-N 2.75Å; N964-T966 PolarHBondContact OD1-OG1 2.74Å; T966-N1005 HydrophobicContact CG2-CB 4.28Å; T966-N1005 VanDerWaalsContact CG2-O 3.3Å; T966-N1005 WeakPolarHBondContact CG2-O 3.32Å
967	F	57.9	Low	65	Low	56 Å²	56	71.3 Å²	71.3	25%	0.246	36%	0.362	C	S	.	.	H	α-helix	trans	-85.1	-35.1	173.1	-71.8	-81.5	0	0	0	112.5	N964 E965 Y969 R970 T971	N964-F967 HydrophobicContact CB-CD2 3.96Å; N964-F967 WeakPolarHBondContact O-CB 3.34Å; N964-F967 PolarHBondContact O-N 2.95Å; E965-F967 PolarHBondContact O-N 3.03Å; F967-Y969 PolarHBondContact O-N 2.86Å; F967-R970 PolarHBondContact O-N 3.41Å; F967-T971 PolarHBondContact O-N 3.41Å
968	A	53	Low	62.2	Low	27 Å²	27	80.7 Å²	80.7	22%	0.223	40%	0.398	C	S	.	.	H	α-helix	trans	-58.5	-36.8	176.4	0	0	0	0	0	111.8	N964 E965 R970 T971	N964-A968 PolarHBondContact O-N 2.84Å; E965-A968 WeakPolarHBondContact O-CB 3.48Å; E965-A968 PolarHBondContact O-N 3.2Å; E965-A968 VanDerWaalsContact O-N 3.13Å; A968-R970 VanDerWaalsContact C-N 3.31Å; A968-R970 PolarHBondContact O-N 3.47Å; A968-T971 PolarHBondContact O-OG1 3.14Å
969	Y	48.1	Very low	59.2	Low	126 Å²	126	86.6 Å²	86.6	49%	0.494	43%	0.434	S	S	.	.	H	α-helix	trans	-66.1	-27	175.1	-94.1	-72.2	0	0	0	114.5	E965 F967	E965-Y969 PolarHBondContact O-N 3.21Å; F967-Y969 PolarHBondContact O-N 2.86Å
970	R	46.3	Very low	56.1	Low	174 Å²	174	94.7 Å²	94.7	66%	0.657	47%	0.472	S	S	*	.	H	α-helix	trans	-84.8	-29.7	-175.5	-99.4	-159.5	-78.1	-150.6	-3	113.8	F967 A968 T973	F967-R970 PolarHBondContact O-N 3.41Å; A968-R970 VanDerWaalsContact C-N 3.31Å; A968-R970 PolarHBondContact O-N 3.47Å; R970-T973 PolarHBondContact O-OG1 2.79Å
971	T	47.3	Very low	53.2	Low	115 Å²	115	98.4 Å²	98.4	71%	0.706	50%	0.503	S	S	*	.	H	α-helix	trans	-78.5	-24.7	-178.5	46.6	0	0	0	0	112.7	F967 A968	F967-T971 PolarHBondContact O-N 3.41Å; A968-T971 PolarHBondContact O-OG1 3.14Å
972	D	45.6	Very low	50.6	Low	76 Å²	76	101.2 Å²	101.2	41%	0.406	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-9.5	-173.6	-134.3	16.5	0	0	0	114.6	F974	D972-F974 PolarHBondContact O-N 3.5Å
973	T	44	Very low	48	Very low	96 Å²	96	100.8 Å²	100.8	59%	0.589	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-5.1	179.1	36	0	0	0	0	114.8	R970 G975	R970-T973 PolarHBondContact O-OG1 2.79Å; T973-G975 PolarHBondContact O-N 2.64Å
974	F	44.2	Very low	45.2	Very low	204 Å²	204	102.1 Å²	102.1	90%	0.895	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	74.3	174.8	-88.4	-88.9	0	0	0	111.5	D972	D972-F974 PolarHBondContact O-N 3.5Å
975	G	43.9	Very low	43	Very low	59 Å²	59	110.3 Å²	110.3	61%	0.608	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	148	-17.9	156.8	0	0	0	0	0	118.2	T973	T973-G975 PolarHBondContact O-N 2.64Å
976	Y	34.6	Very low	41.1	Very low	214 Å²	214	119.1 Å²	119.1	84%	0.839	63%	0.633	S	S	*	*			trans	-126.5	113.6	176.2	-78.3	-85.2	0	0	0	111.2
977	P	34.7	Very low	39.5	Very low	104 Å²	104	119.2 Å²	119.2	68%	0.675	65%	0.645	S	S	*	*			trans	-65.6	135.5	173.4	25.1	-29.9	0	0	0	110.3	T979	P977-T979 PolarHBondContact O-N 2.87Å
978	R	38	Very low	38.6	Very low	197 Å²	197	120 Å²	120	74%	0.743	66%	0.655	S	S	*	*			trans	-60.6	100.7	169.3	-67.5	177	-170.6	-107.9	2.9	109.1
979	T	33.2	Very low	38	Very low	125 Å²	125	120.1 Å²	120.1	77%	0.767	66%	0.659	S	S	*	*			trans	-103.7	-3.3	174.1	49.2	0	0	0	0	114.4	P977	P977-T979 PolarHBondContact O-N 2.87Å
980	E	29.2	Very low	38	Very low	170 Å²	170	121.1 Å²	121.1	79%	0.794	67%	0.666	S	S	*	*			trans	-107.6	101.1	177.2	-69.5	-177.6	-178.8	0	0	110.5	A982	E980-A982 PolarHBondContact O-N 2.96Å
981	A	30.6	Very low	38.5	Very low	80 Å²	80	114.4 Å²	114.4	66%	0.661	65%	0.645	S	S	*	*			trans	-58.5	126.4	155.7	0	0	0	0	0	107.5	T983	A981-T983 PolarHBondContact O-N 2.98Å
982	A	34.2	Very low	38.5	Very low	74 Å²	74	111.7 Å²	111.7	61%	0.612	64%	0.635	S	S	*	*			trans	-66.7	76.9	177.9	0	0	0	0	0	110.8	E980 T988	E980-A982 PolarHBondContact O-N 2.96Å; A982-T988 VanDerWaalsContact CA-OG1 3.28Å; A982-T988 WeakPolarHBondContact CA-OG1 3.42Å; A982-T988 WeakPolarHBondContact CB-OG1 3.32Å
983	T	28.5	Very low	38.6	Very low	129 Å²	129	113.4 Å²	113.4	79%	0.791	64%	0.644	S	S	*	*			trans	-125.5	85.4	175.7	55.3	0	0	0	0	108.8	A981	A981-T983 PolarHBondContact O-N 2.98Å
984	G	27.7	Very low	39.1	Very low	43 Å²	43	114.7 Å²	114.7	44%	0.443	64%	0.641	S	S	.	*			trans	-155.5	135.6	175.1	0	0	0	0	0	110.5	F986 G987	G984-F986 CarbonylContact O-C 3.54Å; G984-F986 VanDerWaalsContact O-C 3.27Å; G984-F986 PolarHBondContact O-N 2.79Å; G984-G987 WeakPolarHBondContact O-CA 3.46Å; G984-G987 PolarHBondContact O-N 2.82Å
985	I	38	Very low	39.8	Very low	177 Å²	177	108.1 Å²	108.1	91%	0.908	61%	0.611	S	S	*	*	S	Bend	trans	-60.2	-24.3	-175.6	-68.2	166.1	0	0	0	112.3	G987	I985-G987 PolarHBondContact O-N 2.83Å
986	F	35.2	Very low	41.1	Very low	195 Å²	195	107.3 Å²	107.3	86%	0.855	59%	0.589	S	S	*	*	S	Bend	trans	-89	86.2	160.2	-60	-77.6	0	0	0	106.5	G984 T988	G984-F986 CarbonylContact O-C 3.54Å; G984-F986 VanDerWaalsContact O-C 3.27Å; G984-F986 PolarHBondContact O-N 2.79Å; F986-T988 PolarHBondContact O-N 2.88Å
987	G	35.6	Very low	43.5	Very low	62 Å²	62	97.1 Å²	97.1	64%	0.639	55%	0.55	S	S	*	.			trans	-42.8	116.6	-173.6	0	0	0	0	0	109.7	G984 I985 G989	G984-G987 WeakPolarHBondContact O-CA 3.46Å; G984-G987 PolarHBondContact O-N 2.82Å; I985-G987 PolarHBondContact O-N 2.83Å; G987-G989 PolarHBondContact O-N 2.69Å
988	T	38.8	Very low	46	Very low	72 Å²	72	92.7 Å²	92.7	44%	0.442	52%	0.52	S	S	.	.			trans	-63.5	69.1	161.9	37.9	0	0	0	0	106.3	A982 F986	A982-T988 VanDerWaalsContact CA-OG1 3.28Å; A982-T988 WeakPolarHBondContact CA-OG1 3.42Å; A982-T988 WeakPolarHBondContact CB-OG1 3.32Å; F986-T988 PolarHBondContact O-N 2.88Å
989	G	40.6	Very low	48.6	Very low	30 Å²	30	83.3 Å²	83.3	31%	0.309	49%	0.485	S	S	.	.			trans	-69	160.4	-169.1	0	0	0	0	0	108.9	G987 C991 A992	G987-G989 PolarHBondContact O-N 2.69Å; G989-C991 PolarHBondContact O-N 3Å; G989-A992 PolarHBondContact O-N 3.4Å
990	K	47.6	Very low	51.7	Low	148 Å²	148	77.4 Å²	77.4	64%	0.643	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44	-27	-175.4	-71.8	179.3	172.3	-176.3	0	114.5	R996	K990-R996 PolarHBondContact O-NE 3.03Å; K990-R996 PolarHBondContact O-NH2 3.05Å
991	C	57.5	Low	54.9	Low	32 Å²	32	69.3 Å²	69.3	22%	0.216	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-2.4	-179.4	-17.9	0	0	0	0	116.9	G989 N993 C1017	G989-C991 PolarHBondContact O-N 3Å; C991-N993 VanDerWaalsContact C-N 3.33Å; C991-N993 PolarHBondContact O-N 2.9Å; C991-C1017 VanDerWaalsContact CA-SG 3.51Å; C991-C1017 HydrophobicContact CB-CB 4.33Å; C991-C1017 WeakPolarHBondContact CB-SG 3.23Å; C991-C1017 PolarHBondContact N-SG 3.39Å; C991-C1017 WeakPolarHBondContact SG-CA 3.33Å; C991-C1017 WeakPolarHBondContact SG-CB 3.5Å; C991-C1017 CovalentContact SG-SG 2.01Å; C991-C1017 PolarHBondContact SG-SG 2.66Å
992	A	47.7	Very low	57.8	Low	59 Å²	59	65.5 Å²	65.5	49%	0.488	38%	0.379	S	S	.	.	S	Bend	trans	-68.7	-24.3	-167.9	0	0	0	0	0	114.9	G989	G989-A992 PolarHBondContact O-N 3.4Å
993	N	47.2	Very low	60.4	Low	112 Å²	112	62 Å²	62	60%	0.599	35%	0.35	S	S	*	.	S	Bend	trans	-151.1	90.5	-166.8	-87	-24.5	0	0	0	111.5	C991	C991-N993 VanDerWaalsContact C-N 3.33Å; C991-N993 PolarHBondContact O-N 2.9Å
994	F	54.4	Low	63.3	Low	122 Å²	122	56.3 Å²	56.3	54%	0.535	32%	0.315	S	S	.	.	S	Bend		160.7	-67.4	113.9	-80.3	-67.2	0	0	0	111.3
995	Y	58.9	Low	66.1	Low	66 Å²	66	55.2 Å²	55.2	26%	0.259	30%	0.299	S	S	.	.			trans	-153.6	122.9	-173	-59	-59.5	0	0	0	111.2	K839 S840 R841	K839-Y995 HydrophobicContact CG-CD1 4.42Å; K839-Y995 CarbonylContact O-C 3.58Å; K839-Y995 VanDerWaalsContact O-C 3.31Å; K839-Y995 WeakPolarHBondContact O-CA 3.45Å; K839-Y995 WeakPolarHBondContact O-CB 3.25Å; S840-Y995 VanDerWaalsContact O-CD1 3.32Å; S840-Y995 WeakPolarHBondContact O-CD1 3.27Å; S840-Y995 VanDerWaalsContact O-CE1 3.27Å; S840-Y995 WeakPolarHBondContact O-CE1 3.48Å; R841-Y995 HydrophobicContact CB-CE1 3.94Å; R841-Y995 HydrophobicContact CB-CE2 3.94Å; R841-Y995 WeakPolarHBondContact CG-OH 3.36Å
996	R	70	Confident	68.3	Low	42 Å²	42	51.4 Å²	51.4	16%	0.158	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	156.2	-171.8	-68.5	-170.1	171.5	-112.4	-0.8	113.4	K839 E965 K990 M998	K839-R996 PolarHBondContact N-O 2.82Å; K839-R996 PolarHBondContact O-N 2.92Å; E965-R996 VanDerWaalsContact CD-NH1 3.25Å; E965-R996 HydrophobicContact CG-CB 4.39Å; E965-R996 HydrophobicContact CG-CG 4.22Å; E965-R996 WeakPolarHBondContact OE1-CB 3.2Å; E965-R996 WeakPolarHBondContact OE1-CD 3.25Å; E965-R996 WeakPolarHBondContact OE1-CG 3.44Å; E965-R996 IonicContact OE1-CZ 3.47Å; E965-R996 IonicContact OE1-NE 3.74Å; E965-R996 IonicContact OE1-NH1 2.91Å; E965-R996 PolarHBondContact OE1-NH1 2.91Å; E965-R996 IonicContact OE2-CZ 2.99Å; E965-R996 IonicContact OE2-NH1 2.8Å; E965-R996 PolarHBondContact OE2-NH1 3.17Å; K990-R996 PolarHBondContact O-NE 3.03Å; K990-R996 PolarHBondContact O-NH2 3.05Å; R996-M998 HydrophobicContact CB-CG 3.98Å; R996-M998 HydrophobicContact CB-SD 4.11Å
997	T	85.7	Confident	70.8	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.006	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	110.9	172.3	-66.5	0	0	0	0	107.8	Y820 M837 L838 Y963 T1003 F1004	Y820-T997 HydrophobicContact CD2-CG2 4.14Å; Y820-T997 HydrophobicContact CE2-CG2 3.89Å; M837-T997 WeakPolarHBondContact O-CA 3.3Å; L838-T997 HydrophobicContact CD2-CG2 3.19Å; L838-T997 WeakPolarHBondContact CD2-OG1 3.35Å; Y963-T997 WeakPolarHBondContact CB-OG1 3.43Å; Y963-T997 PolarHBondContact O-OG1 2.92Å; T997-T1003 WeakPolarHBondContact O-CA 3.49Å; T997-F1004 HydrophobicContact CG2-CB 3.48Å; T997-F1004 VanDerWaalsContact CG2-CB 3.48Å; T997-F1004 HydrophobicContact CG2-CD1 4.49Å; T997-F1004 HydrophobicContact CG2-CG 4.49Å; T997-F1004 PolarHBondContact O-N 2.94Å
998	M	88	Confident	73.4	Confident	10 Å²	10	47 Å²	47	5%	0.049	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	164.7	-173.9	-53.9	-176.5	107.9	0	0	111.1	T836 M837 R996 T1013 W1042	T836-M998 CarbonylContact C-O 3.59Å; M837-M998 PolarHBondContact N-O 2.88Å; M837-M998 PolarHBondContact O-N 3.32Å; R996-M998 HydrophobicContact CB-CG 3.98Å; R996-M998 HydrophobicContact CB-SD 4.11Å; M998-T1013 HydrophobicContact CE-CG2 3.42Å; M998-T1013 VanDerWaalsContact CE-CG2 3.42Å; M998-W1042 HydrophobicContact CB-CH2 3.62Å; M998-W1042 HydrophobicContact CB-CZ2 3.91Å
999	G	92.6	Very high	75.7	Confident	1 Å²	1	52 Å²	52	1%	0.01	26%	0.256	C	S	.	.	S	Bend	trans	143.8	-161.8	177.7	0	0	0	0	0	110.6	L1001 G1002	G999-L1001 VanDerWaalsContact C-N 3.26Å; G999-L1001 PolarHBondContact O-N 2.76Å; G999-G1002 PolarHBondContact O-N 2.64Å; G999-G1002 VanDerWaalsContact O-N 3.09Å
1000	L	96.9	Very high	78	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-28.6	173.6	-65.5	176	0	0	0	112.6	F817 Y825 F827 Y833 V834 L835 G1002 F1038 W1042	F817-L1000 HydrophobicContact CD1-CB 4.11Å; F817-L1000 HydrophobicContact CE1-CB 3.6Å; F817-L1000 HydrophobicContact CE1-CD1 3.94Å; F817-L1000 HydrophobicContact CE1-CG 4.36Å; F817-L1000 HydrophobicContact CZ-CB 4.3Å; F817-L1000 HydrophobicContact CZ-CD1 3.89Å; Y825-L1000 WeakPolarHBondContact OH-CA 3.44Å; Y825-L1000 PolarHBondContact OH-O 2.94Å; F827-L1000 HydrophobicContact CD1-CD1 4.19Å; F827-L1000 HydrophobicContact CD1-CD2 4.14Å; F827-L1000 HydrophobicContact CE1-CD1 4.2Å; F827-L1000 HydrophobicContact CE1-CD2 4.29Å; Y833-L1000 HydrophobicContact CG-CD1 4.26Å; V834-L1000 WeakPolarHBondContact O-CG 3.17Å; V834-L1000 PolarHBondContact O-N 3.38Å; L835-L1000 HydrophobicContact CD1-CB 4.42Å; L835-L1000 PolarHBondContact O-N 2.73Å; L835-L1000 VanDerWaalsContact O-N 3.09Å; L1000-G1002 PolarHBondContact O-N 3.13Å; L1000-G1002 VanDerWaalsContact O-N 3.16Å; L1000-F1038 HydrophobicContact CD2-CE1 3.95Å; L1000-F1038 HydrophobicContact CD2-CZ 4.3Å; L1000-W1042 HydrophobicContact CD2-CB 4.07Å; L1000-W1042 HydrophobicContact CD2-CG 4.37Å; L1000-W1042 HydrophobicContact CG-CB 4.24Å
1001	L	96.5	Very high	80	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	7.8	172.9	-66.1	179.6	0	0	0	114.4	F817 T819 Y820 L835 V957 G999	F817-L1001 HydrophobicContact CD1-CD2 4.26Å; T819-L1001 CarbonylContact C-O 3.53Å; T819-L1001 WeakPolarHBondContact CA-O 3.32Å; T819-L1001 WeakPolarHBondContact CB-O 3.4Å; Y820-L1001 HydrophobicContact CD2-CB 4.04Å; Y820-L1001 WeakPolarHBondContact CD2-O 3.41Å; Y820-L1001 HydrophobicContact CE1-CB 4.44Å; Y820-L1001 HydrophobicContact CE1-CD1 4.27Å; Y820-L1001 HydrophobicContact CE2-CB 3.53Å; Y820-L1001 HydrophobicContact CE2-CD1 4.49Å; Y820-L1001 PolarHBondContact N-O 3.32Å; L835-L1001 HydrophobicContact CD1-CD1 4.06Å; L835-L1001 HydrophobicContact CD1-CD2 4.02Å; L835-L1001 HydrophobicContact CD1-CG 3.69Å; L835-L1001 HydrophobicContact CD2-CD1 4.09Å; L835-L1001 HydrophobicContact CG-CD1 3.75Å; L835-L1001 HydrophobicContact CG-CG 3.85Å; L835-L1001 PolarHBondContact O-N 3.43Å; V957-L1001 HydrophobicContact CB-CD1 3.65Å; V957-L1001 HydrophobicContact CG2-CD1 3.48Å; V957-L1001 VanDerWaalsContact CG2-CD1 3.48Å; G999-L1001 VanDerWaalsContact C-N 3.26Å; G999-L1001 PolarHBondContact O-N 2.76Å
1002	G	92.5	Very high	81.7	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.207	C	C	.	.			trans	84.9	172.6	170.7	0	0	0	0	0	115.1	G999 L1000 D1011	G999-G1002 PolarHBondContact O-N 2.64Å; G999-G1002 VanDerWaalsContact O-N 3.09Å; L1000-G1002 PolarHBondContact O-N 3.13Å; L1000-G1002 VanDerWaalsContact O-N 3.16Å; G1002-D1011 WeakPolarHBondContact CA-O 3.33Å
1003	T	89.6	Confident	83.7	Confident	1 Å²	1	40.8 Å²	40.8	1%	0.006	19%	0.186	C	C	.	.			trans	-76.2	121.9	174.3	-51.6	0	0	0	0	109.7	D821 E965 T997 N1005 D1010 D1011 T1013	D821-T1003 VanDerWaalsContact OD2-O 3.08Å; E965-T1003 VanDerWaalsContact CD-CG2 3.43Å; E965-T1003 HydrophobicContact CG-CG2 4.4Å; E965-T1003 VanDerWaalsContact OE1-CG2 3.27Å; E965-T1003 WeakPolarHBondContact OE1-CG2 3.5Å; T997-T1003 WeakPolarHBondContact O-CA 3.49Å; T1003-N1005 PolarHBondContact O-N 2.85Å; T1003-D1010 WeakPolarHBondContact CB-O 3.26Å; T1003-D1010 PolarHBondContact OG1-O 3.46Å; T1003-D1011 PolarHBondContact N-O 3.46Å; T1003-T1013 PolarHBondContact OG1-OG1 3.05Å
1004	F	89.1	Confident	85.7	Confident	10 Å²	10	35.6 Å²	35.6	4%	0.044	16%	0.158	C	C	.	.			trans	-88.9	93.9	-179.2	178.6	-147.9	0	0	0	112.1	A807 Y820 V959 N964 E965 T997	A807-F1004 HydrophobicContact CB-CD1 4.48Å; A807-F1004 HydrophobicContact CB-CD2 3.99Å; A807-F1004 HydrophobicContact CB-CE1 3.88Å; A807-F1004 HydrophobicContact CB-CE2 3.33Å; A807-F1004 HydrophobicContact CB-CZ 3.27Å; Y820-F1004 HydrophobicContact CD2-CB 4.05Å; Y820-F1004 HydrophobicContact CG-CB 4.34Å; V959-F1004 HydrophobicContact CG1-CD1 4.19Å; V959-F1004 HydrophobicContact CG1-CE1 4.34Å; N964-F1004 WeakPolarHBondContact CA-O 2.95Å; N964-F1004 HydrophobicContact CB-CD1 3.76Å; N964-F1004 HydrophobicContact CB-CD2 4.43Å; N964-F1004 HydrophobicContact CB-CE1 3.46Å; N964-F1004 VanDerWaalsContact CB-CE1 3.46Å; N964-F1004 HydrophobicContact CB-CE2 4.15Å; N964-F1004 HydrophobicContact CB-CG 4.24Å; N964-F1004 HydrophobicContact CB-CZ 3.66Å; N964-F1004 WeakPolarHBondContact ND2-CE2 3.19Å; N964-F1004 WeakPolarHBondContact ND2-CZ 3.39Å; E965-F1004 PolarHBondContact N-O 3.26Å; T997-F1004 HydrophobicContact CG2-CB 3.48Å; T997-F1004 VanDerWaalsContact CG2-CB 3.48Å; T997-F1004 HydrophobicContact CG2-CD1 4.49Å; T997-F1004 HydrophobicContact CG2-CG 4.49Å; T997-F1004 PolarHBondContact O-N 2.94Å
1005	N	85.7	Confident	87.1	Confident	20 Å²	20	31.3 Å²	31.3	11%	0.107	14%	0.143	C	C	.	.	S	Bend	trans	-145.8	6.1	179.4	66.3	19.1	0	0	0	114.7	D821 E965 T966 T1003 D1007 D1010	D821-N1005 PolarHBondContact OD2-N 3.11Å; D821-N1005 VanDerWaalsContact OD2-N 3.12Å; D821-N1005 PolarHBondContact OD2-OD1 3.48Å; E965-N1005 HydrophobicContact CB-CB 4.07Å; E965-N1005 HydrophobicContact CG-CB 4.47Å; T966-N1005 HydrophobicContact CG2-CB 4.28Å; T966-N1005 VanDerWaalsContact CG2-O 3.3Å; T966-N1005 WeakPolarHBondContact CG2-O 3.32Å; T1003-N1005 PolarHBondContact O-N 2.85Å; N1005-D1007 VanDerWaalsContact C-N 3.34Å; N1005-D1007 WeakPolarHBondContact OD1-CA 3.47Å; N1005-D1007 VanDerWaalsContact OD1-CB 3.27Å; N1005-D1007 WeakPolarHBondContact OD1-CB 3.36Å; N1005-D1007 PolarHBondContact OD1-N 3.49Å; N1005-D1010 VanDerWaalsContact ND2-CG 3.3Å; N1005-D1010 PolarHBondContact ND2-OD1 3.22Å; N1005-D1010 PolarHBondContact ND2-OD2 2.88Å; N1005-D1010 PolarHBondContact OD1-OD1 2.82Å
1006	N	85.1	Confident	88.2	Confident	96 Å²	96	31.6 Å²	31.6	51%	0.513	15%	0.149	S	C	.	.	S	Bend	trans	67	20.9	-170.3	-41.7	-86.8	0	0	0	115.1	D821 N964	D821-N1006 VanDerWaalsContact CG-CA 3.41Å; D821-N1006 WeakPolarHBondContact OD1-CA 3.47Å; D821-N1006 PolarHBondContact OD1-N 2.99Å; D821-N1006 VanDerWaalsContact OD2-CA 3.23Å; D821-N1006 WeakPolarHBondContact OD2-CA 3.47Å; D821-N1006 PolarHBondContact OD2-N 3.08Å; N964-N1006 PolarHBondContact ND2-ND2 2.88Å
1007	D	87.5	Confident	88.6	Confident	48 Å²	48	31 Å²	31	26%	0.257	15%	0.15	S	C	.	.			trans	-120.6	99	174.2	-170.7	-3.3	0	0	0	111.3	D821 N1005 R1009 D1010	D821-D1007 PolarHBondContact OD2-N 2.89Å; N1005-D1007 VanDerWaalsContact C-N 3.34Å; N1005-D1007 WeakPolarHBondContact OD1-CA 3.47Å; N1005-D1007 VanDerWaalsContact OD1-CB 3.27Å; N1005-D1007 WeakPolarHBondContact OD1-CB 3.36Å; N1005-D1007 PolarHBondContact OD1-N 3.49Å; D1007-R1009 PolarHBondContact O-N 2.74Å; D1007-R1009 WeakPolarHBondContact OD1-CB 3.08Å; D1007-R1009 WeakPolarHBondContact OD1-CG 3.35Å; D1007-R1009 IonicContact OD1-CZ 3.68Å; D1007-R1009 PolarHBondContact OD1-N 2.67Å; D1007-R1009 VanDerWaalsContact OD1-N 3.07Å; D1007-R1009 IonicContact OD1-NE 2.84Å; D1007-R1009 PolarHBondContact OD1-NE 3.5Å; D1007-R1009 IonicContact OD1-NH2 3.23Å; D1007-R1009 IonicContact OD2-CZ 2.95Å; D1007-R1009 IonicContact OD2-NE 3.57Å; D1007-R1009 PolarHBondContact OD2-NE 2.85Å; D1007-R1009 IonicContact OD2-NH2 2.76Å; D1007-R1009 PolarHBondContact OD2-NH2 2.83Å; D1007-D1010 PolarHBondContact O-N 2.94Å
1008	K	90	Very high	88.7	Confident	118 Å²	118	35.7 Å²	35.7	51%	0.513	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-54.5	-21.5	178.1	-68	-172.5	176	-164.9	0	114.7	D821 G822 T823 D1010	D821-K1008 HydrophobicContact CB-CG 4.22Å; D821-K1008 WeakPolarHBondContact O-CE 3.05Å; D821-K1008 WeakPolarHBondContact O-CG 3.46Å; G822-K1008 WeakPolarHBondContact O-CE 3.47Å; G822-K1008 PolarHBondContact O-NZ 2.82Å; T823-K1008 WeakPolarHBondContact OG1-CB 3.29Å; T823-K1008 PolarHBondContact OG1-O 2.98Å; K1008-D1010 VanDerWaalsContact C-N 3.29Å; K1008-D1010 PolarHBondContact O-N 3.43Å
1009	R	87.4	Confident	88.7	Confident	176 Å²	176	37.8 Å²	37.8	66%	0.664	19%	0.189	S	C	*	.	G	3₁₀ helix	trans	-76.4	-13.9	-174.8	-59.3	171.8	-62.2	173	6.2	113.4	D1007 V1019 N1021	D1007-R1009 PolarHBondContact O-N 2.74Å; D1007-R1009 WeakPolarHBondContact OD1-CB 3.08Å; D1007-R1009 WeakPolarHBondContact OD1-CG 3.35Å; D1007-R1009 IonicContact OD1-CZ 3.68Å; D1007-R1009 PolarHBondContact OD1-N 2.67Å; D1007-R1009 VanDerWaalsContact OD1-N 3.07Å; D1007-R1009 IonicContact OD1-NE 2.84Å; D1007-R1009 PolarHBondContact OD1-NE 3.5Å; D1007-R1009 IonicContact OD1-NH2 3.23Å; D1007-R1009 IonicContact OD2-CZ 2.95Å; D1007-R1009 IonicContact OD2-NE 3.57Å; D1007-R1009 PolarHBondContact OD2-NE 2.85Å; D1007-R1009 IonicContact OD2-NH2 2.76Å; D1007-R1009 PolarHBondContact OD2-NH2 2.83Å; R1009-V1019 WeakPolarHBondContact O-CG1 3.35Å; R1009-N1021 PolarHBondContact O-OD1 3.3Å
1010	D	87.5	Confident	88.7	Confident	23 Å²	23	38.3 Å²	38.3	12%	0.123	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-121.3	16.4	175.8	74.8	-4.8	0	0	0	113.4	T1003 N1005 D1007 K1008 L1012 T1013 V1019	T1003-D1010 WeakPolarHBondContact CB-O 3.26Å; T1003-D1010 PolarHBondContact OG1-O 3.46Å; N1005-D1010 VanDerWaalsContact ND2-CG 3.3Å; N1005-D1010 PolarHBondContact ND2-OD1 3.22Å; N1005-D1010 PolarHBondContact ND2-OD2 2.88Å; N1005-D1010 PolarHBondContact OD1-OD1 2.82Å; D1007-D1010 PolarHBondContact O-N 2.94Å; K1008-D1010 VanDerWaalsContact C-N 3.29Å; K1008-D1010 PolarHBondContact O-N 3.43Å; D1010-L1012 VanDerWaalsContact C-N 3.32Å; D1010-L1012 PolarHBondContact O-N 3.03Å; D1010-T1013 WeakPolarHBondContact O-CB 3.42Å; D1010-T1013 PolarHBondContact O-N 2.81Å; D1010-T1013 PolarHBondContact O-OG1 3.18Å; D1010-V1019 HydrophobicContact CB-CG1 4.33Å; D1010-V1019 HydrophobicContact CB-CG2 4.2Å
1011	D	90	Very high	88.2	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-49.3	173.5	-95.2	-37.6	0	0	0	110.8	T819 T823 G1002 T1003 T1013	T819-D1011 HydrophobicContact CG2-CB 4.13Å; T819-D1011 PolarHBondContact OG1-OD1 3.38Å; T819-D1011 PolarHBondContact OG1-OD2 2.9Å; T823-D1011 WeakPolarHBondContact CB-OD2 3.34Å; T823-D1011 HydrophobicContact CG2-CB 4.46Å; T823-D1011 PolarHBondContact N-OD2 3.31Å; T823-D1011 PolarHBondContact OG1-OD2 3.28Å; G1002-D1011 WeakPolarHBondContact CA-O 3.33Å; T1003-D1011 PolarHBondContact N-O 3.46Å; D1011-T1013 PolarHBondContact O-N 3.47Å
1012	L	93.3	Very high	88	Confident	3 Å²	3	44.9 Å²	44.9	2%	0.016	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	59.5	-178.9	-41	-177.6	0	0	0	111.9	Y825 D1010 V1020 T1022 V1034 F1038	Y825-L1012 HydrophobicContact CD1-CD2 3.55Å; Y825-L1012 HydrophobicContact CE1-CD2 3.45Å; Y825-L1012 VanDerWaalsContact CE1-CD2 3.45Å; Y825-L1012 HydrophobicContact CG-CD2 4.21Å; D1010-L1012 VanDerWaalsContact C-N 3.32Å; D1010-L1012 PolarHBondContact O-N 3.03Å; L1012-V1020 HydrophobicContact CB-CB 4.32Å; L1012-V1020 WeakPolarHBondContact CB-O 3.35Å; L1012-V1020 PolarHBondContact O-N 3.07Å; L1012-T1022 HydrophobicContact CD1-CG2 3.61Å; L1012-V1034 HydrophobicContact CD1-CG1 4.29Å; L1012-V1034 HydrophobicContact CD1-CG2 3.87Å; L1012-F1038 VanDerWaalsContact C-CD2 3.42Å; L1012-F1038 HydrophobicContact CB-CB 4.47Å; L1012-F1038 HydrophobicContact CB-CD1 3.98Å; L1012-F1038 HydrophobicContact CB-CD2 3.7Å; L1012-F1038 HydrophobicContact CB-CE1 4.09Å; L1012-F1038 HydrophobicContact CB-CE2 3.8Å; L1012-F1038 HydrophobicContact CB-CG 3.79Å; L1012-F1038 HydrophobicContact CB-CZ 4Å; L1012-F1038 HydrophobicContact CD1-CD1 4.44Å; L1012-F1038 HydrophobicContact CD2-CD1 4.1Å; L1012-F1038 HydrophobicContact CD2-CE1 3.6Å; L1012-F1038 HydrophobicContact CD2-CE2 4.47Å; L1012-F1038 HydrophobicContact CD2-CZ 3.8Å; L1012-F1038 HydrophobicContact CG-CD1 4.4Å; L1012-F1038 HydrophobicContact CG-CE1 4.33Å; L1012-F1038 WeakPolarHBondContact O-CD2 3.29Å
1013	T	90.4	Very high	87.9	Confident	8 Å²	8	50.2 Å²	50.2	5%	0.049	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-87.9	127.4	173.2	-62.4	0	0	0	0	110.9	M998 T1003 D1010 D1011 F1038 W1042	M998-T1013 HydrophobicContact CE-CG2 3.42Å; M998-T1013 VanDerWaalsContact CE-CG2 3.42Å; T1003-T1013 PolarHBondContact OG1-OG1 3.05Å; D1010-T1013 WeakPolarHBondContact O-CB 3.42Å; D1010-T1013 PolarHBondContact O-N 2.81Å; D1010-T1013 PolarHBondContact O-OG1 3.18Å; D1011-T1013 PolarHBondContact O-N 3.47Å; T1013-F1038 WeakPolarHBondContact O-CE2 3.28Å; T1013-W1042 VanDerWaalsContact O-CZ2 3.25Å; T1013-W1042 WeakPolarHBondContact O-CZ2 3.13Å; T1013-W1042 PolarHBondContact O-NE1 2.78Å
1014	T	89	Confident	87.8	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.012	27%	0.271	C	S	.	.			trans	-74.1	162.4	175.1	57.4	0	0	0	0	112.8	D1016 C1017 N1018 E1037 F1038 R1041	T1014-D1016 PolarHBondContact O-N 3.4Å; T1014-D1016 VanDerWaalsContact O-N 3.15Å; T1014-C1017 PolarHBondContact O-N 2.94Å; T1014-C1017 PolarHBondContact OG1-N 3.14Å; T1014-N1018 PolarHBondContact N-O 3.28Å; T1014-N1018 WeakPolarHBondContact OG1-CA 3.28Å; T1014-N1018 WeakPolarHBondContact OG1-CB 3.4Å; T1014-N1018 PolarHBondContact OG1-N 3.16Å; T1014-N1018 PolarHBondContact OG1-O 3.45Å; T1014-E1037 WeakPolarHBondContact CG2-O 3.48Å; T1014-F1038 HydrophobicContact CG2-CB 4.5Å; T1014-F1038 HydrophobicContact CG2-CD2 4.28Å; T1014-R1041 HydrophobicContact CG2-CB 4.19Å; T1014-R1041 HydrophobicContact CG2-CG 3.97Å
1015	P	83.9	Confident	87.7	Confident	33 Å²	33	57.6 Å²	57.6	21%	0.214	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-27.2	171.6	-25.1	35.6	0	0	0	113.9	C1017 R1041 W1042	P1015-C1017 VanDerWaalsContact C-N 3.29Å; P1015-R1041 HydrophobicContact CG-CB 4.49Å; P1015-R1041 WeakPolarHBondContact CG-O 3.3Å; P1015-W1042 HydrophobicContact CG-CD2 3.75Å; P1015-W1042 HydrophobicContact CG-CE3 3.73Å; P1015-W1042 HydrophobicContact CG-CG 4.39Å; P1015-W1042 HydrophobicContact CG-CH2 4.04Å; P1015-W1042 HydrophobicContact CG-CZ2 4.05Å; P1015-W1042 HydrophobicContact CG-CZ3 3.89Å
1016	D	80.9	Confident	87.8	Confident	72 Å²	72	58.6 Å²	58.6	39%	0.385	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	9.4	178.1	-52.9	-40.5	0	0	0	112.4	T1014 N1018 R1041 R1048	T1014-D1016 PolarHBondContact O-N 3.4Å; T1014-D1016 VanDerWaalsContact O-N 3.15Å; D1016-N1018 VanDerWaalsContact C-N 3.35Å; D1016-N1018 PolarHBondContact O-N 3.34Å; D1016-R1041 IonicContact OD2-NH1 3.97Å; D1016-R1041 PolarHBondContact OD2-NH1 3.17Å; D1016-R1048 IonicContact OD1-CZ 2.75Å; D1016-R1048 IonicContact OD1-NH1 3.99Å; D1016-R1048 PolarHBondContact OD1-NH1 3.08Å; D1016-R1048 IonicContact OD2-NH1 2.57Å; D1016-R1048 PolarHBondContact OD2-NH1 2.85Å; D1016-R1048 IonicContact OD2-NH2 3.81Å
1017	C	78.7	Confident	88.1	Confident	28 Å²	28	56.5 Å²	56.5	19%	0.189	30%	0.3	C	S	.	.	S	Bend	trans	71.6	12.1	176.7	-47.1	0	0	0	0	117.8	C991 T1014 P1015	C991-C1017 VanDerWaalsContact CA-SG 3.51Å; C991-C1017 HydrophobicContact CB-CB 4.33Å; C991-C1017 WeakPolarHBondContact CB-SG 3.23Å; C991-C1017 PolarHBondContact N-SG 3.39Å; C991-C1017 WeakPolarHBondContact SG-CA 3.33Å; C991-C1017 WeakPolarHBondContact SG-CB 3.5Å; C991-C1017 CovalentContact SG-SG 2.01Å; C991-C1017 PolarHBondContact SG-SG 2.66Å; T1014-C1017 PolarHBondContact O-N 2.94Å; T1014-C1017 PolarHBondContact OG1-N 3.14Å; P1015-C1017 VanDerWaalsContact C-N 3.29Å
1018	N	87.7	Confident	88.1	Confident	100 Å²	100	57 Å²	57	54%	0.535	30%	0.301	S	S	.	.			trans	-79.4	136.2	168.3	-60.9	-37.8	0	0	0	109.6	T1014 D1016	T1014-N1018 PolarHBondContact N-O 3.28Å; T1014-N1018 WeakPolarHBondContact OG1-CA 3.28Å; T1014-N1018 WeakPolarHBondContact OG1-CB 3.4Å; T1014-N1018 PolarHBondContact OG1-N 3.16Å; T1014-N1018 PolarHBondContact OG1-O 3.45Å; D1016-N1018 VanDerWaalsContact C-N 3.35Å; D1016-N1018 PolarHBondContact O-N 3.34Å
1019	V	88.4	Confident	88.1	Confident	55 Å²	55	55.9 Å²	55.9	33%	0.333	30%	0.3	S	S	.	.	B	Isolated β-bridge	trans	-99.8	129.7	177.3	179.9	0	0	0	0	108.9	R1009 D1010	R1009-V1019 WeakPolarHBondContact O-CG1 3.35Å; D1010-V1019 HydrophobicContact CB-CG1 4.33Å; D1010-V1019 HydrophobicContact CB-CG2 4.2Å
1020	V	91.7	Very high	88.4	Confident	12 Å²	12	49.4 Å²	49.4	7%	0.073	28%	0.277	C	S	.	.			trans	-105.9	134.4	171.7	-178.5	0	0	0	0	108	L1012 V1034 E1037 F1038	L1012-V1020 HydrophobicContact CB-CB 4.32Å; L1012-V1020 WeakPolarHBondContact CB-O 3.35Å; L1012-V1020 PolarHBondContact O-N 3.07Å; V1020-V1034 HydrophobicContact CG1-CG2 4.37Å; V1020-E1037 HydrophobicContact CG2-CB 3.91Å; V1020-F1038 HydrophobicContact CB-CB 4.1Å; V1020-F1038 HydrophobicContact CG2-CB 3.9Å
1021	N	87.5	Confident	88.6	Confident	113 Å²	113	49 Å²	49	60%	0.604	28%	0.277	S	S	*	.			trans	-106.7	145.7	176.6	-72.7	-47	0	0	0	110	R1009	R1009-N1021 PolarHBondContact O-OD1 3.3Å
1022	T	91.1	Very high	88.7	Confident	25 Å²	25	53.6 Å²	53.6	15%	0.153	29%	0.294	C	S	.	.			trans	-143.1	144.8	174.3	-172.8	0	0	0	0	110.5	T823 L1012 V1034	T823-T1022 HydrophobicContact CG2-CG2 4.44Å; L1012-T1022 HydrophobicContact CD1-CG2 3.61Å; T1022-V1034 HydrophobicContact CG2-CG2 4.09Å
1023	N	90.5	Very high	88.8	Confident	111 Å²	111	56.1 Å²	56.1	59%	0.594	31%	0.308	S	S	*	.			trans	-86.8	168.5	164.4	-62.9	-60.3	0	0	0	110.6	A1026 E1030	N1023-A1026 WeakPolarHBondContact O-CA 3.49Å; N1023-A1026 PolarHBondContact O-N 2.79Å; N1023-E1030 PolarHBondContact N-OE1 3.11Å; N1023-E1030 PolarHBondContact ND2-OE1 2.79Å
1024	Y	88.2	Confident	89	Confident	77 Å²	77	55.9 Å²	55.9	30%	0.302	31%	0.306	S	S	.	.	S	Bend	trans	-132.1	126.5	175.5	-174.6	-96.7	0	0	0	111.2	R824 P1102 P1103	R824-Y1024 HydrophobicContact CB-CD1 4.13Å; R824-Y1024 HydrophobicContact CB-CD2 3.39Å; R824-Y1024 HydrophobicContact CB-CE1 4.28Å; R824-Y1024 HydrophobicContact CB-CE2 3.58Å; R824-Y1024 HydrophobicContact CB-CG 3.66Å; R824-Y1024 VanDerWaalsContact NE-CE1 3.27Å; R824-Y1024 VanDerWaalsContact NE-CZ 3.29Å; R824-Y1024 PolarHBondContact NE-OH 2.83Å; R824-Y1024 PolarHBondContact NH2-OH 2.86Å; R824-Y1024 WeakPolarHBondContact O-CD2 3.35Å; Y1024-P1102 HydrophobicContact CE1-CG 4.28Å; Y1024-P1103 WeakPolarHBondContact OH-CD 3.43Å; Y1024-P1103 WeakPolarHBondContact OH-CG 3.39Å
1025	P	87.2	Confident	89.3	Confident	89 Å²	89	56.3 Å²	56.3	58%	0.578	31%	0.307	S	S	*	.	S	Bend	cis	-63.7	144.5	-6.3	28.4	-34.5	0	0	0	111.7	P1102	P1025-P1102 HydrophobicContact CB-CB 4.31Å; P1025-P1102 HydrophobicContact CB-CG 4.08Å
1026	A	88.2	Confident	89.9	Confident	41 Å²	41	59.8 Å²	59.8	34%	0.339	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-74.2	142.3	-179.9	0	0	0	0	0	110.7	N1023 E1030 A1031	N1023-A1026 WeakPolarHBondContact O-CA 3.49Å; N1023-A1026 PolarHBondContact O-N 2.79Å; A1026-E1030 HydrophobicContact CB-CB 4.11Å; A1026-A1031 HydrophobicContact CB-CB 4.38Å
1027	S	90.4	Very high	90.5	Very high	53 Å²	53	61.2 Å²	61.2	37%	0.371	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-70.5	162.7	164.7	63.1	0	0	0	0	111.2	I1029 E1030 A1031	S1027-I1029 VanDerWaalsContact C-N 3.26Å; S1027-I1029 PolarHBondContact O-N 2.85Å; S1027-I1029 WeakPolarHBondContact OG-CG2 3.33Å; S1027-E1030 WeakPolarHBondContact CB-OE2 3.5Å; S1027-E1030 PolarHBondContact N-OE2 2.87Å; S1027-E1030 PolarHBondContact O-N 3.49Å; S1027-E1030 VanDerWaalsContact O-N 3.09Å; S1027-E1030 VanDerWaalsContact OG-CD 3.3Å; S1027-E1030 VanDerWaalsContact OG-CG 3.32Å; S1027-E1030 WeakPolarHBondContact OG-CG 3.36Å; S1027-E1030 PolarHBondContact OG-OE2 3.35Å; S1027-A1031 PolarHBondContact O-N 2.81Å
1028	E	87.9	Confident	91.3	Very high	58 Å²	58	59.9 Å²	59.9	27%	0.271	31%	0.312	S	S	.	.	H	α-helix	trans	-54.7	-41.7	-180	-170	-78	157.9	0	0	112.5	A1031 R1032 F1075 D1076	E1028-A1031 PolarHBondContact O-N 2.95Å; E1028-R1032 WeakPolarHBondContact O-CB 3.05Å; E1028-R1032 PolarHBondContact O-N 3.11Å; E1028-R1032 IonicContact OE1-CZ 3.83Å; E1028-R1032 VanDerWaalsContact OE1-CZ 3.28Å; E1028-R1032 IonicContact OE1-NE 3.68Å; E1028-R1032 PolarHBondContact OE1-NE 3.12Å; E1028-R1032 IonicContact OE1-NH2 3.46Å; E1028-R1032 PolarHBondContact OE1-NH2 2.94Å; E1028-R1032 IonicContact OE2-NE 2.72Å; E1028-F1075 HydrophobicContact CG-CB 4.06Å; E1028-D1076 HydrophobicContact CB-CB 4.17Å; E1028-D1076 HydrophobicContact CG-CB 4.13Å
1029	I	90.5	Very high	91.6	Very high	95 Å²	95	55.1 Å²	55.1	49%	0.487	29%	0.287	S	S	.	.	H	α-helix	trans	-67.5	-40	178.8	-173.6	61.8	0	0	0	111.9	S1027 R1032 N1033	S1027-I1029 VanDerWaalsContact C-N 3.26Å; S1027-I1029 PolarHBondContact O-N 2.85Å; S1027-I1029 WeakPolarHBondContact OG-CG2 3.33Å; I1029-R1032 PolarHBondContact O-N 2.94Å; I1029-N1033 PolarHBondContact O-N 3.18Å; I1029-N1033 PolarHBondContact O-OD1 3.44Å
1030	E	92.2	Very high	91.9	Very high	40 Å²	40	54.7 Å²	54.7	19%	0.187	28%	0.281	C	S	.	.	H	α-helix	trans	-65.8	-45.6	175.8	-72.3	166.7	130	0	0	110.7	N1023 A1026 S1027 R1032 N1033 V1034	N1023-E1030 PolarHBondContact N-OE1 3.11Å; N1023-E1030 PolarHBondContact ND2-OE1 2.79Å; A1026-E1030 HydrophobicContact CB-CB 4.11Å; S1027-E1030 WeakPolarHBondContact CB-OE2 3.5Å; S1027-E1030 PolarHBondContact N-OE2 2.87Å; S1027-E1030 PolarHBondContact O-N 3.49Å; S1027-E1030 VanDerWaalsContact O-N 3.09Å; S1027-E1030 VanDerWaalsContact OG-CD 3.3Å; S1027-E1030 VanDerWaalsContact OG-CG 3.32Å; S1027-E1030 WeakPolarHBondContact OG-CG 3.36Å; S1027-E1030 PolarHBondContact OG-OE2 3.35Å; E1030-R1032 VanDerWaalsContact C-N 3.29Å; E1030-R1032 PolarHBondContact O-N 2.95Å; E1030-N1033 PolarHBondContact O-N 2.82Å; E1030-N1033 VanDerWaalsContact O-N 3.16Å; E1030-V1034 VanDerWaalsContact O-CG2 3.29Å; E1030-V1034 WeakPolarHBondContact O-CG2 3.43Å; E1030-V1034 PolarHBondContact O-N 3.13Å
1031	A	91.6	Very high	91.9	Very high	14 Å²	14	58.9 Å²	58.9	12%	0.116	30%	0.296	C	S	.	.	H	α-helix	trans	-60	-39.5	176.8	0	0	0	0	0	112	A1026 S1027 E1028 V1034 Y1035 F1075	A1026-A1031 HydrophobicContact CB-CB 4.38Å; S1027-A1031 PolarHBondContact O-N 2.81Å; E1028-A1031 PolarHBondContact O-N 2.95Å; A1031-V1034 PolarHBondContact O-N 3.16Å; A1031-Y1035 WeakPolarHBondContact O-CB 3.43Å; A1031-Y1035 PolarHBondContact O-N 3.46Å; A1031-F1075 HydrophobicContact CB-CB 4.12Å; A1031-F1075 HydrophobicContact CB-CD1 4.15Å
1032	R	93.5	Very high	92.2	Very high	96 Å²	96	53.6 Å²	53.6	36%	0.362	27%	0.267	S	S	.	.	H	α-helix	trans	-63.2	-44.9	173.8	-175.5	179.6	-67	-92.3	-0.8	112	E1028 I1029 E1030 Y1035 Y1036 F1075	E1028-R1032 WeakPolarHBondContact O-CB 3.05Å; E1028-R1032 PolarHBondContact O-N 3.11Å; E1028-R1032 IonicContact OE1-CZ 3.83Å; E1028-R1032 VanDerWaalsContact OE1-CZ 3.28Å; E1028-R1032 IonicContact OE1-NE 3.68Å; E1028-R1032 PolarHBondContact OE1-NE 3.12Å; E1028-R1032 IonicContact OE1-NH2 3.46Å; E1028-R1032 PolarHBondContact OE1-NH2 2.94Å; E1028-R1032 IonicContact OE2-NE 2.72Å; I1029-R1032 PolarHBondContact O-N 2.94Å; E1030-R1032 VanDerWaalsContact C-N 3.29Å; E1030-R1032 PolarHBondContact O-N 2.95Å; R1032-Y1035 PolarHBondContact O-N 3.15Å; R1032-Y1036 HydrophobicContact CG-CD2 3.7Å; R1032-Y1036 HydrophobicContact CG-CE2 3.81Å; R1032-Y1036 VanDerWaalsContact O-CD2 3.32Å; R1032-Y1036 WeakPolarHBondContact O-CD2 3.21Å; R1032-Y1036 PolarHBondContact O-N 2.62Å; R1032-F1075 HydrophobicContact CB-CD2 4.27Å; R1032-F1075 HydrophobicContact CB-CE1 4.48Å; R1032-F1075 HydrophobicContact CB-CE2 4.22Å; R1032-F1075 HydrophobicContact CB-CG 4.4Å; R1032-F1075 HydrophobicContact CB-CZ 4.31Å; R1032-F1075 HydrophobicContact CG-CE2 4.07Å; R1032-F1075 HydrophobicContact CG-CZ 4.23Å
1033	N	94.9	Very high	92.3	Very high	57 Å²	57	56.1 Å²	56.1	31%	0.305	27%	0.274	S	S	.	.	H	α-helix	trans	-64.8	-45.5	177	-67.6	-9.5	0	0	0	111.2	I1029 E1030 Y1035 Y1036 E1037	I1029-N1033 PolarHBondContact O-N 3.18Å; I1029-N1033 PolarHBondContact O-OD1 3.44Å; E1030-N1033 PolarHBondContact O-N 2.82Å; E1030-N1033 VanDerWaalsContact O-N 3.16Å; N1033-Y1035 PolarHBondContact O-N 2.99Å; N1033-Y1036 PolarHBondContact O-N 2.8Å; N1033-E1037 WeakPolarHBondContact O-CA 3.41Å; N1033-E1037 VanDerWaalsContact O-CB 3.23Å; N1033-E1037 WeakPolarHBondContact O-CB 3.45Å; N1033-E1037 PolarHBondContact O-N 2.74Å
1034	V	95.3	Very high	92.3	Very high	2 Å²	2	51 Å²	51	1%	0.012	25%	0.247	C	C	.	.	I	π-helix	trans	-56.4	-39.5	175.4	170.4	0	0	0	0	111	Y825 L1012 V1020 T1022 E1030 A1031 F1038 G1039	Y825-V1034 HydrophobicContact CD2-CG1 3.52Å; Y825-V1034 HydrophobicContact CE2-CG1 4.11Å; Y825-V1034 HydrophobicContact CG-CG1 4.23Å; L1012-V1034 HydrophobicContact CD1-CG1 4.29Å; L1012-V1034 HydrophobicContact CD1-CG2 3.87Å; V1020-V1034 HydrophobicContact CG1-CG2 4.37Å; T1022-V1034 HydrophobicContact CG2-CG2 4.09Å; E1030-V1034 VanDerWaalsContact O-CG2 3.29Å; E1030-V1034 WeakPolarHBondContact O-CG2 3.43Å; E1030-V1034 PolarHBondContact O-N 3.13Å; A1031-V1034 PolarHBondContact O-N 3.16Å; V1034-F1038 HydrophobicContact CG1-CD1 4.3Å; V1034-F1038 WeakPolarHBondContact O-CB 3.23Å; V1034-F1038 PolarHBondContact O-N 3.23Å; V1034-G1039 PolarHBondContact O-N 3.28Å
1035	Y	95.5	Very high	92	Very high	12 Å²	12	51.1 Å²	51.1	5%	0.047	25%	0.253	C	S	.	.	I	π-helix	trans	-68.9	-57.6	177	-177.4	-86.2	0	0	0	113.4	F827 N828 A1031 R1032 N1033 G1039 E1040 P1073 F1075	F827-Y1035 AromaticContact CD2-CD2 3.56Å; F827-Y1035 HydrophobicContact CD2-CD2 3.56Å; F827-Y1035 HydrophobicContact CD2-CE2 4.2Å; F827-Y1035 HydrophobicContact CD2-CG 4.25Å; F827-Y1035 AromaticContact CE2-CD2 3.43Å; F827-Y1035 HydrophobicContact CE2-CD2 3.43Å; F827-Y1035 VanDerWaalsContact CE2-CD2 3.43Å; F827-Y1035 AromaticContact CE2-CE2 3.72Å; F827-Y1035 HydrophobicContact CE2-CE2 3.72Å; F827-Y1035 HydrophobicContact CE2-CG 4.08Å; N828-Y1035 WeakPolarHBondContact O-CE2 3.27Å; A1031-Y1035 WeakPolarHBondContact O-CB 3.43Å; A1031-Y1035 PolarHBondContact O-N 3.46Å; R1032-Y1035 PolarHBondContact O-N 3.15Å; N1033-Y1035 PolarHBondContact O-N 2.99Å; Y1035-G1039 PolarHBondContact O-N 3.12Å; Y1035-E1040 HydrophobicContact CD1-CG 4.04Å; Y1035-E1040 HydrophobicContact CE1-CG 3.62Å; Y1035-E1040 WeakPolarHBondContact O-CB 3.34Å; Y1035-E1040 WeakPolarHBondContact O-CG 3.36Å; Y1035-E1040 PolarHBondContact O-N 2.82Å; Y1035-P1073 HydrophobicContact CD1-CG 4.17Å; Y1035-P1073 HydrophobicContact CD2-CB 4.34Å; Y1035-P1073 HydrophobicContact CD2-CG 3.81Å; Y1035-P1073 HydrophobicContact CE1-CG 3.92Å; Y1035-P1073 HydrophobicContact CE2-CB 3.98Å; Y1035-P1073 HydrophobicContact CE2-CG 3.53Å; Y1035-P1073 HydrophobicContact CG-CG 4.14Å; Y1035-F1075 VanDerWaalsContact CB-CE1 3.47Å; Y1035-F1075 HydrophobicContact CD1-CE1 4.29Å; Y1035-F1075 HydrophobicContact CD1-CZ 4.12Å; Y1035-F1075 HydrophobicContact CD2-CE1 4.19Å; Y1035-F1075 AromaticContact CG-CE1 3.74Å; Y1035-F1075 HydrophobicContact CG-CE1 3.74Å; Y1035-F1075 HydrophobicContact CG-CZ 4.04Å
1036	Y	95	Very high	91.7	Very high	105 Å²	105	49 Å²	49	41%	0.412	25%	0.247	S	C	.	.	I	π-helix	trans	-79.8	-36.1	-171.2	-72.3	-67.4	0	0	0	113.7	R1032 N1033 F1075	R1032-Y1036 HydrophobicContact CG-CD2 3.7Å; R1032-Y1036 HydrophobicContact CG-CE2 3.81Å; R1032-Y1036 VanDerWaalsContact O-CD2 3.32Å; R1032-Y1036 WeakPolarHBondContact O-CD2 3.21Å; R1032-Y1036 PolarHBondContact O-N 2.62Å; N1033-Y1036 PolarHBondContact O-N 2.8Å; Y1036-F1075 HydrophobicContact CD2-CZ 4.41Å; Y1036-F1075 HydrophobicContact CE2-CE2 4.18Å; Y1036-F1075 AromaticContact CE2-CZ 3.79Å; Y1036-F1075 HydrophobicContact CE2-CZ 3.79Å
1037	E	94.8	Very high	91.3	Very high	103 Å²	103	54 Å²	54	48%	0.481	27%	0.267	S	S	.	.	I	π-helix	trans	-91.6	-26	-174.7	-55.6	-171.9	166.4	0	0	112.4	T1014 V1020 N1033 R1041	T1014-E1037 WeakPolarHBondContact CG2-O 3.48Å; V1020-E1037 HydrophobicContact CG2-CB 3.91Å; N1033-E1037 WeakPolarHBondContact O-CA 3.41Å; N1033-E1037 VanDerWaalsContact O-CB 3.23Å; N1033-E1037 WeakPolarHBondContact O-CB 3.45Å; N1033-E1037 PolarHBondContact O-N 2.74Å; E1037-R1041 WeakPolarHBondContact O-CG 3.32Å
1038	F	95.3	Very high	90.5	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	27%	0.273	C	S	.	.	I	π-helix	trans	-114.4	-67.6	-180	169	-104.3	0	0	0	114.3	Y825 L1000 L1012 T1013 T1014 V1020 V1034 E1040 R1041 W1042	Y825-F1038 HydrophobicContact CE1-CE1 4.43Å; Y825-F1038 HydrophobicContact CE2-CE1 4.06Å; Y825-F1038 AromaticContact CZ-CE1 3.78Å; L1000-F1038 HydrophobicContact CD2-CE1 3.95Å; L1000-F1038 HydrophobicContact CD2-CZ 4.3Å; L1012-F1038 VanDerWaalsContact C-CD2 3.42Å; L1012-F1038 HydrophobicContact CB-CB 4.47Å; L1012-F1038 HydrophobicContact CB-CD1 3.98Å; L1012-F1038 HydrophobicContact CB-CD2 3.7Å; L1012-F1038 HydrophobicContact CB-CE1 4.09Å; L1012-F1038 HydrophobicContact CB-CE2 3.8Å; L1012-F1038 HydrophobicContact CB-CG 3.79Å; L1012-F1038 HydrophobicContact CB-CZ 4Å; L1012-F1038 HydrophobicContact CD1-CD1 4.44Å; L1012-F1038 HydrophobicContact CD2-CD1 4.1Å; L1012-F1038 HydrophobicContact CD2-CE1 3.6Å; L1012-F1038 HydrophobicContact CD2-CE2 4.47Å; L1012-F1038 HydrophobicContact CD2-CZ 3.8Å; L1012-F1038 HydrophobicContact CG-CD1 4.4Å; L1012-F1038 HydrophobicContact CG-CE1 4.33Å; L1012-F1038 WeakPolarHBondContact O-CD2 3.29Å; T1013-F1038 WeakPolarHBondContact O-CE2 3.28Å; T1014-F1038 HydrophobicContact CG2-CB 4.5Å; T1014-F1038 HydrophobicContact CG2-CD2 4.28Å; V1020-F1038 HydrophobicContact CB-CB 4.1Å; V1020-F1038 HydrophobicContact CG2-CB 3.9Å; V1034-F1038 HydrophobicContact CG1-CD1 4.3Å; V1034-F1038 WeakPolarHBondContact O-CB 3.23Å; V1034-F1038 PolarHBondContact O-N 3.23Å; F1038-E1040 PolarHBondContact O-N 2.84Å; F1038-R1041 VanDerWaalsContact O-CB 3.27Å; F1038-R1041 WeakPolarHBondContact O-CB 3.21Å; F1038-R1041 PolarHBondContact O-N 3.45Å; F1038-W1042 AromaticContact CD2-CD1 3.97Å; F1038-W1042 AromaticContact CD2-NE1 3.8Å; F1038-W1042 AromaticContact CE2-CD1 3.57Å; F1038-W1042 AromaticContact CE2-NE1 3.21Å; F1038-W1042 AromaticContact CZ-CD1 3.89Å; F1038-W1042 AromaticContact CZ-NE1 3.84Å
1039	G	94.1	Very high	90.2	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-63	-44.1	-168.2	0	0	0	0	0	113.4	F827 V1034 Y1035 R1041 W1042	F827-G1039 VanDerWaalsContact CE2-CA 3.49Å; V1034-G1039 PolarHBondContact O-N 3.28Å; Y1035-G1039 PolarHBondContact O-N 3.12Å; G1039-R1041 PolarHBondContact O-N 3Å; G1039-W1042 PolarHBondContact O-N 3.34Å
1040	E	93.4	Very high	90	Very high	45 Å²	45	57.9 Å²	57.9	21%	0.21	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-63.7	-22.2	175.6	-79.2	-61.2	114.8	0	0	113.4	F827 Y833 Y1035 F1038 W1042 R1043	F827-E1040 HydrophobicContact CE2-CG 4.48Å; Y833-E1040 PolarHBondContact OH-OE1 2.76Å; Y1035-E1040 HydrophobicContact CD1-CG 4.04Å; Y1035-E1040 HydrophobicContact CE1-CG 3.62Å; Y1035-E1040 WeakPolarHBondContact O-CB 3.34Å; Y1035-E1040 WeakPolarHBondContact O-CG 3.36Å; Y1035-E1040 PolarHBondContact O-N 2.82Å; F1038-E1040 PolarHBondContact O-N 2.84Å; E1040-W1042 VanDerWaalsContact C-N 3.25Å; E1040-W1042 PolarHBondContact O-N 2.73Å; E1040-R1043 WeakPolarHBondContact O-CB 3.36Å; E1040-R1043 PolarHBondContact O-N 3.34Å; E1040-R1043 IonicContact OE1-NH2 3.29Å; E1040-R1043 PolarHBondContact OE1-NH2 2.7Å; E1040-R1043 VanDerWaalsContact OE1-NH2 3.15Å; E1040-R1043 IonicContact OE2-CZ 3.89Å; E1040-R1043 IonicContact OE2-NE 3.48Å; E1040-R1043 PolarHBondContact OE2-NE 2.91Å; E1040-R1043 VanDerWaalsContact OE2-NE 3.12Å; E1040-R1043 IonicContact OE2-NH2 2.94Å; E1040-R1043 PolarHBondContact OE2-NH2 2.74Å
1041	R	92.5	Very high	89.9	Confident	100 Å²	100	57.9 Å²	57.9	38%	0.377	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-70.8	-22.6	175.4	-59.8	-67	-172.8	127.4	-3.6	112.6	T1014 P1015 D1016 E1037 F1038 G1039 R1043	T1014-R1041 HydrophobicContact CG2-CB 4.19Å; T1014-R1041 HydrophobicContact CG2-CG 3.97Å; P1015-R1041 HydrophobicContact CG-CB 4.49Å; P1015-R1041 WeakPolarHBondContact CG-O 3.3Å; D1016-R1041 IonicContact OD2-NH1 3.97Å; D1016-R1041 PolarHBondContact OD2-NH1 3.17Å; E1037-R1041 WeakPolarHBondContact O-CG 3.32Å; F1038-R1041 VanDerWaalsContact O-CB 3.27Å; F1038-R1041 WeakPolarHBondContact O-CB 3.21Å; F1038-R1041 PolarHBondContact O-N 3.45Å; G1039-R1041 PolarHBondContact O-N 3Å; R1041-R1043 VanDerWaalsContact C-N 3.32Å
1042	W	93.6	Very high	90	Very high	2 Å²	2	57.4 Å²	57.4	1%	0.008	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-90.7	13.8	179.1	-74.5	109.2	0	0	0	114.1	Y833 V834 M998 L1000 T1013 P1015 F1038 G1039 E1040 A1044	Y833-W1042 WeakPolarHBondContact CA-O 3.46Å; V834-W1042 HydrophobicContact CB-CE3 3.96Å; V834-W1042 HydrophobicContact CG1-CE3 4.22Å; V834-W1042 HydrophobicContact CG1-CZ3 4.38Å; V834-W1042 PolarHBondContact N-O 3.44Å; M998-W1042 HydrophobicContact CB-CH2 3.62Å; M998-W1042 HydrophobicContact CB-CZ2 3.91Å; L1000-W1042 HydrophobicContact CD2-CB 4.07Å; L1000-W1042 HydrophobicContact CD2-CG 4.37Å; L1000-W1042 HydrophobicContact CG-CB 4.24Å; T1013-W1042 VanDerWaalsContact O-CZ2 3.25Å; T1013-W1042 WeakPolarHBondContact O-CZ2 3.13Å; T1013-W1042 PolarHBondContact O-NE1 2.78Å; P1015-W1042 HydrophobicContact CG-CD2 3.75Å; P1015-W1042 HydrophobicContact CG-CE3 3.73Å; P1015-W1042 HydrophobicContact CG-CG 4.39Å; P1015-W1042 HydrophobicContact CG-CH2 4.04Å; P1015-W1042 HydrophobicContact CG-CZ2 4.05Å; P1015-W1042 HydrophobicContact CG-CZ3 3.89Å; F1038-W1042 AromaticContact CD2-CD1 3.97Å; F1038-W1042 AromaticContact CD2-NE1 3.8Å; F1038-W1042 AromaticContact CE2-CD1 3.57Å; F1038-W1042 AromaticContact CE2-NE1 3.21Å; F1038-W1042 AromaticContact CZ-CD1 3.89Å; F1038-W1042 AromaticContact CZ-NE1 3.84Å; G1039-W1042 PolarHBondContact O-N 3.34Å; E1040-W1042 VanDerWaalsContact C-N 3.25Å; E1040-W1042 PolarHBondContact O-N 2.73Å; W1042-A1044 PolarHBondContact O-N 2.84Å
1043	R	93.5	Very high	89.9	Confident	79 Å²	79	53.1 Å²	53.1	30%	0.298	25%	0.251	S	S	.	.	B	Isolated β-bridge	trans	-60.7	129.1	175.7	-173.4	178	-76.3	-87.9	-0.8	110.8	K830 Y832 Y833 E1040 R1041 D1045	K830-R1043 PolarHBondContact O-NH1 3.23Å; K830-R1043 PolarHBondContact O-NH2 2.95Å; Y832-R1043 CarbonylContact O-C 3.51Å; Y832-R1043 WeakPolarHBondContact O-CA 3.4Å; Y833-R1043 HydrophobicContact CD1-CB 4.19Å; Y833-R1043 HydrophobicContact CE1-CB 4.01Å; Y833-R1043 HydrophobicContact CE1-CG 4.39Å; Y833-R1043 PolarHBondContact OH-NH2 3.17Å; E1040-R1043 WeakPolarHBondContact O-CB 3.36Å; E1040-R1043 PolarHBondContact O-N 3.34Å; E1040-R1043 IonicContact OE1-NH2 3.29Å; E1040-R1043 PolarHBondContact OE1-NH2 2.7Å; E1040-R1043 VanDerWaalsContact OE1-NH2 3.15Å; E1040-R1043 IonicContact OE2-CZ 3.89Å; E1040-R1043 IonicContact OE2-NE 3.48Å; E1040-R1043 PolarHBondContact OE2-NE 2.91Å; E1040-R1043 VanDerWaalsContact OE2-NE 3.12Å; E1040-R1043 IonicContact OE2-NH2 2.94Å; E1040-R1043 PolarHBondContact OE2-NH2 2.74Å; R1041-R1043 VanDerWaalsContact C-N 3.32Å; R1043-D1045 PolarHBondContact O-N 3.49Å
1044	A	90.4	Very high	89.4	Confident	2 Å²	2	53.2 Å²	53.2	2%	0.017	25%	0.25	C	C	.	.			trans	-94.2	86.7	174.4	0	0	0	0	0	109.5	Y832 V834 W1042 L1051	Y832-A1044 WeakPolarHBondContact CB-O 3.45Å; Y832-A1044 PolarHBondContact O-N 2.78Å; V834-A1044 HydrophobicContact CG2-CB 4.17Å; W1042-A1044 PolarHBondContact O-N 2.84Å; A1044-L1051 HydrophobicContact CB-CD1 4.38Å
1045	D	82.4	Confident	88.4	Confident	81 Å²	81	59.2 Å²	59.2	43%	0.433	29%	0.287	S	S	.	.			trans	-98.4	1.4	-176.8	62.1	-1.1	0	0	0	114	R1043 I1047 R1048	R1043-D1045 PolarHBondContact O-N 3.49Å; D1045-I1047 VanDerWaalsContact C-N 3.25Å; D1045-I1047 PolarHBondContact O-N 2.83Å; D1045-I1047 WeakPolarHBondContact OD1-CA 3.18Å; D1045-I1047 WeakPolarHBondContact OD1-CB 3.35Å; D1045-I1047 PolarHBondContact OD1-N 2.92Å; D1045-R1048 PolarHBondContact OD1-N 2.92Å; D1045-R1048 VanDerWaalsContact OD1-N 3.16Å
1046	G	80	Confident	87.4	Confident	44 Å²	44	64 Å²	64	45%	0.454	31%	0.308	S	S	.	.	S	Bend	trans	83.5	-9.2	-173.5	0	0	0	0	0	114.3	H1049	G1046-H1049 CarbonylContact C-O 3.6Å; G1046-H1049 WeakPolarHBondContact CA-O 3.47Å; G1046-H1049 PolarHBondContact N-O 2.91Å; G1046-H1049 VanDerWaalsContact N-O 3.11Å
1047	I	79.5	Confident	86.7	Confident	147 Å²	147	60.5 Å²	60.5	75%	0.754	30%	0.295	S	S	*	.	S	Bend	trans	-92.7	-58.1	179.6	-55.4	174.6	0	0	0	109.8	D1045	D1045-I1047 VanDerWaalsContact C-N 3.25Å; D1045-I1047 PolarHBondContact O-N 2.83Å; D1045-I1047 WeakPolarHBondContact OD1-CA 3.18Å; D1045-I1047 WeakPolarHBondContact OD1-CB 3.35Å; D1045-I1047 PolarHBondContact OD1-N 2.92Å
1048	R	74.8	Confident	85.8	Confident	133 Å²	133	61 Å²	61	50%	0.502	30%	0.297	S	S	.	.	S	Bend	trans	-80.9	-39.6	179.1	-70.9	-173.7	176.5	-140.2	-2.6	112.1	D1016 D1045	D1016-R1048 IonicContact OD1-CZ 2.75Å; D1016-R1048 IonicContact OD1-NH1 3.99Å; D1016-R1048 PolarHBondContact OD1-NH1 3.08Å; D1016-R1048 IonicContact OD2-NH1 2.57Å; D1016-R1048 PolarHBondContact OD2-NH1 2.85Å; D1016-R1048 IonicContact OD2-NH2 3.81Å; D1045-R1048 PolarHBondContact OD1-N 2.92Å; D1045-R1048 VanDerWaalsContact OD1-N 3.16Å
1049	H	81.5	Confident	84.9	Confident	25 Å²	25	61.6 Å²	61.6	12%	0.116	30%	0.301	C	S	.	.	S	Bend	trans	-131.7	131.8	-179.5	-58.7	-68.8	0	0	0	109.2	V834 G1046 L1051	V834-H1049 HydrophobicContact CG2-CB 4.01Å; G1046-H1049 CarbonylContact C-O 3.6Å; G1046-H1049 WeakPolarHBondContact CA-O 3.47Å; G1046-H1049 PolarHBondContact N-O 2.91Å; G1046-H1049 VanDerWaalsContact N-O 3.11Å; H1049-L1051 PolarHBondContact O-N 2.89Å
1050	H	85.6	Confident	84.1	Confident	128 Å²	128	62.4 Å²	62.4	59%	0.593	31%	0.305	S	S	*	.			trans	-59.3	129	176.5	176.3	60.8	0	0	0	110.3	Q848	Q848-H1050 PolarHBondContact NE2-O 2.63Å
1051	L	91.2	Very high	83.3	Confident	40 Å²	40	62.5 Å²	62.5	21%	0.209	30%	0.304	C	S	.	.			trans	-80.2	120.2	179.4	-176.6	66.8	0	0	0	109.8	Y832 A1044 H1049 F1053	Y832-L1051 HydrophobicContact CD1-CD1 4Å; Y832-L1051 HydrophobicContact CD2-CD1 4.07Å; Y832-L1051 HydrophobicContact CD2-CD2 4.45Å; Y832-L1051 HydrophobicContact CG-CD1 3.68Å; A1044-L1051 HydrophobicContact CB-CD1 4.38Å; H1049-L1051 PolarHBondContact O-N 2.89Å; L1051-F1053 HydrophobicContact CD1-CB 4.07Å; L1051-F1053 HydrophobicContact CD1-CD2 4Å; L1051-F1053 HydrophobicContact CG-CB 4.16Å
1052	L	92.4	Very high	82.6	Confident	4 Å²	4	60.5 Å²	60.5	2%	0.021	30%	0.301	C	S	.	.			trans	-80.7	-28.7	176.8	-63	-179.4	0	0	0	112.3	M846 Q848 A872 Q874 I880	M846-L1052 HydrophobicContact CB-CD1 4.18Å; M846-L1052 HydrophobicContact CG-CD1 4.28Å; Q848-L1052 HydrophobicContact CG-CD1 4.36Å; A872-L1052 HydrophobicContact CB-CB 3.82Å; Q874-L1052 HydrophobicContact CB-CD1 3.96Å; Q874-L1052 HydrophobicContact CB-CD2 4.04Å; I880-L1052 HydrophobicContact CG2-CB 4.49Å
1053	F	91.8	Very high	81.9	Confident	6 Å²	6	61.3 Å²	61.3	3%	0.026	31%	0.306	C	S	.	.	S	Bend	trans	-66.3	134.9	179.2	-72.5	-77.1	0	0	0	111.8	Y832 Q848 R850 A872 Y884 L1051	Y832-F1053 HydrophobicContact CD1-CB 4.15Å; Y832-F1053 AromaticContact CD1-CD2 3.3Å; Y832-F1053 HydrophobicContact CD1-CD2 3.3Å; Y832-F1053 AromaticContact CD1-CE2 3.75Å; Y832-F1053 HydrophobicContact CD1-CE2 3.75Å; Y832-F1053 AromaticContact CD1-CG 3.8Å; Y832-F1053 HydrophobicContact CD1-CG 3.8Å; Y832-F1053 HydrophobicContact CE1-CB 3.78Å; Y832-F1053 HydrophobicContact CE1-CD1 4.34Å; Y832-F1053 AromaticContact CE1-CD2 3.72Å; Y832-F1053 HydrophobicContact CE1-CD2 3.72Å; Y832-F1053 HydrophobicContact CE1-CE2 4.35Å; Y832-F1053 AromaticContact CE1-CG 3.69Å; Y832-F1053 HydrophobicContact CE1-CG 3.69Å; Y832-F1053 HydrophobicContact CG-CD2 4.28Å; Q848-F1053 HydrophobicContact CB-CD2 4.15Å; Q848-F1053 HydrophobicContact CB-CE2 3.62Å; R850-F1053 HydrophobicContact CB-CE1 4.23Å; R850-F1053 HydrophobicContact CB-CE2 4.33Å; R850-F1053 HydrophobicContact CB-CZ 3.93Å; A872-F1053 HydrophobicContact CB-CD1 3.71Å; A872-F1053 HydrophobicContact CB-CD2 3.93Å; A872-F1053 HydrophobicContact CB-CE1 3.6Å; A872-F1053 HydrophobicContact CB-CE2 3.83Å; A872-F1053 HydrophobicContact CB-CG 3.9Å; A872-F1053 HydrophobicContact CB-CZ 3.67Å; A872-F1053 VanDerWaalsContact N-CZ 3.35Å; Y884-F1053 AromaticContact CE1-CD1 3.91Å; Y884-F1053 HydrophobicContact CE1-CD1 3.91Å; Y884-F1053 AromaticContact CE1-CE1 3.93Å; Y884-F1053 HydrophobicContact CE1-CE1 3.93Å; Y884-F1053 AromaticContact CZ-CD1 3.97Å; Y884-F1053 WeakPolarHBondContact OH-CD1 3.39Å; L1051-F1053 HydrophobicContact CD1-CB 4.07Å; L1051-F1053 HydrophobicContact CD1-CD2 4Å; L1051-F1053 HydrophobicContact CG-CB 4.16Å
1054	Q	85.5	Confident	81.2	Confident	60 Å²	60	61.1 Å²	61.1	28%	0.28	31%	0.31	S	S	.	.			trans	-79.4	138	174.9	-62.3	-72	-27.6	0	0	111.7	E882 N902 K1056 F1057	E882-Q1054 PolarHBondContact OE1-N 3.45Å; E882-Q1054 WeakPolarHBondContact OE2-CG 3.22Å; N902-Q1054 VanDerWaalsContact OD1-CD 3.26Å; N902-Q1054 WeakPolarHBondContact OD1-CG 3.32Å; N902-Q1054 PolarHBondContact OD1-NE2 3.04Å; Q1054-K1056 HydrophobicContact CB-CG 4.02Å; Q1054-K1056 PolarHBondContact O-N 3.12Å; Q1054-F1057 HydrophobicContact CB-CD2 3.88Å; Q1054-F1057 HydrophobicContact CB-CE2 4.13Å; Q1054-F1057 HydrophobicContact CG-CE2 4.48Å; Q1054-F1057 PolarHBondContact O-N 3.29Å
1055	T	73.4	Confident	80.7	Confident	127 Å²	127	62.2 Å²	62.2	78%	0.779	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-22	-179.1	53	0	0	0	0	113.1	F1057	T1055-F1057 VanDerWaalsContact C-N 3.27Å; T1055-F1057 PolarHBondContact O-N 2.82Å
1056	K	75	Confident	80.9	Confident	113 Å²	113	60 Å²	60	49%	0.491	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-28.7	178	63.2	170.1	170.4	161.3	0	113.5	N902 Q1054 Q1058	N902-K1056 PolarHBondContact O-NZ 3.39Å; N902-K1056 VanDerWaalsContact O-NZ 3.08Å; Q1054-K1056 HydrophobicContact CB-CG 4.02Å; Q1054-K1056 PolarHBondContact O-N 3.12Å; K1056-Q1058 PolarHBondContact O-N 3.2Å
1057	F	81	Confident	81	Confident	31 Å²	31	61.9 Å²	61.9	14%	0.136	32%	0.316	C	S	.	.	S	Bend	trans	-93.2	90.9	-177.5	-56.7	-54	0	0	0	109.9	R850 Y884 Y899 Q1054 T1055	R850-F1057 VanDerWaalsContact CZ-O 3.23Å; R850-F1057 PolarHBondContact NH1-O 3.44Å; R850-F1057 PolarHBondContact NH2-O 3.28Å; Y884-F1057 HydrophobicContact CE1-CB 4.46Å; Y884-F1057 HydrophobicContact CE2-CB 4.03Å; Y884-F1057 AromaticContact CE2-CD2 3.69Å; Y884-F1057 HydrophobicContact CE2-CD2 3.69Å; Y884-F1057 HydrophobicContact CE2-CE2 4.32Å; Y884-F1057 AromaticContact CE2-CG 3.98Å; Y884-F1057 HydrophobicContact CE2-CG 3.98Å; Y884-F1057 AromaticContact CZ-CD2 3.94Å; Y899-F1057 HydrophobicContact CD1-CE1 4Å; Y899-F1057 HydrophobicContact CD1-CE2 4.14Å; Y899-F1057 AromaticContact CD1-CZ 3.36Å; Y899-F1057 HydrophobicContact CD1-CZ 3.36Å; Y899-F1057 HydrophobicContact CD2-CD2 4.46Å; Y899-F1057 HydrophobicContact CD2-CE1 4.18Å; Y899-F1057 AromaticContact CD2-CE2 3.9Å; Y899-F1057 HydrophobicContact CD2-CE2 3.9Å; Y899-F1057 AromaticContact CD2-CZ 3.72Å; Y899-F1057 HydrophobicContact CD2-CZ 3.72Å; Y899-F1057 AromaticContact CE1-CE1 3.52Å; Y899-F1057 HydrophobicContact CE1-CE1 3.52Å; Y899-F1057 HydrophobicContact CE1-CE2 4.47Å; Y899-F1057 AromaticContact CE1-CZ 3.41Å; Y899-F1057 HydrophobicContact CE1-CZ 3.41Å; Y899-F1057 VanDerWaalsContact CE1-CZ 3.41Å; Y899-F1057 HydrophobicContact CE2-CD1 4.12Å; Y899-F1057 AromaticContact CE2-CE1 3.72Å; Y899-F1057 HydrophobicContact CE2-CE1 3.72Å; Y899-F1057 HydrophobicContact CE2-CE2 4.24Å; Y899-F1057 AromaticContact CE2-CZ 3.75Å; Y899-F1057 HydrophobicContact CE2-CZ 3.75Å; Y899-F1057 HydrophobicContact CG-CE1 4.31Å; Y899-F1057 AromaticContact CG-CE2 3.84Å; Y899-F1057 HydrophobicContact CG-CE2 3.84Å; Y899-F1057 AromaticContact CG-CZ 3.53Å; Y899-F1057 HydrophobicContact CG-CZ 3.53Å; Y899-F1057 AromaticContact CZ-CE1 3.37Å; Y899-F1057 AromaticContact CZ-CZ 3.61Å; Q1054-F1057 HydrophobicContact CB-CD2 3.88Å; Q1054-F1057 HydrophobicContact CB-CE2 4.13Å; Q1054-F1057 HydrophobicContact CG-CE2 4.48Å; Q1054-F1057 PolarHBondContact O-N 3.29Å; T1055-F1057 VanDerWaalsContact C-N 3.27Å; T1055-F1057 PolarHBondContact O-N 2.82Å
1058	Q	74.6	Confident	81.2	Confident	113 Å²	113	56.9 Å²	56.9	53%	0.528	29%	0.294	S	S	.	.			trans	-65.9	158.9	-176	-67.2	-169.8	-4.4	0	0	113.4	R850 K1056 P1063	R850-Q1058 VanDerWaalsContact NH1-C 3.33Å; R850-Q1058 PolarHBondContact NH1-O 3.07Å; R850-Q1058 VanDerWaalsContact NH1-O 3.15Å; K1056-Q1058 PolarHBondContact O-N 3.2Å; Q1058-P1063 HydrophobicContact CB-CG 4.29Å
1059	P	77.1	Confident	81.4	Confident	13 Å²	13	55.7 Å²	55.7	8%	0.084	31%	0.306	C	S	.	.			trans	-51	144.1	170.3	-28.3	35.8	0	0	0	113.2	E852 P1063 F1066	E852-P1059 VanDerWaalsContact CD-CB 3.46Å; E852-P1059 HydrophobicContact CG-CB 4.26Å; E852-P1059 VanDerWaalsContact OE1-CA 3.27Å; E852-P1059 WeakPolarHBondContact OE1-CA 3.31Å; E852-P1059 VanDerWaalsContact OE2-CB 3.31Å; E852-P1059 WeakPolarHBondContact OE2-CB 3.27Å; P1059-P1063 HydrophobicContact CB-CB 4.39Å; P1059-P1063 HydrophobicContact CB-CG 4.15Å; P1059-P1063 HydrophobicContact CG-CB 4.32Å; P1059-P1063 WeakPolarHBondContact O-CG 3.08Å; P1059-F1066 HydrophobicContact CB-CB 4.07Å; P1059-F1066 HydrophobicContact CB-CD1 4.31Å; P1059-F1066 HydrophobicContact CB-CD2 4.48Å; P1059-F1066 HydrophobicContact CB-CG 4.05Å; P1059-F1066 HydrophobicContact CG-CB 3.92Å; P1059-F1066 HydrophobicContact CG-CD1 3.35Å; P1059-F1066 HydrophobicContact CG-CD2 4.27Å; P1059-F1066 HydrophobicContact CG-CE1 3.82Å; P1059-F1066 HydrophobicContact CG-CG 3.59Å; P1059-F1066 HydrophobicContact CG-CZ 4.43Å
1060	I	77.7	Confident	81.4	Confident	17 Å²	17	62.5 Å²	62.5	9%	0.087	34%	0.337	C	S	.	.	S	Bend	trans	-77.7	-42.9	-168.1	-57.9	175.7	0	0	0	111.6	E852 T869 A885 K887	E852-I1060 PolarHBondContact OE1-N 2.94Å; E852-I1060 PolarHBondContact OE2-N 3.08Å; T869-I1060 HydrophobicContact CG2-CD1 4.25Å; A885-I1060 HydrophobicContact CB-CD1 3.87Å; A885-I1060 WeakPolarHBondContact O-CD1 3.22Å; K887-I1060 HydrophobicContact CB-CG2 4.35Å; K887-I1060 VanDerWaalsContact CE-O 3.25Å; K887-I1060 WeakPolarHBondContact CE-O 3.27Å; K887-I1060 HydrophobicContact CG-CG2 3.47Å; K887-I1060 VanDerWaalsContact CG-CG2 3.47Å
1061	Y	76.8	Confident	81.5	Confident	48 Å²	48	57.6 Å²	57.6	19%	0.188	31%	0.314	C	S	.	.	S	Bend	trans	-91.6	-56.2	-168.9	-64.4	-61.3	0	0	0	112.8	E852 Q853 P855 V867 T869 G951	E852-Y1061 PolarHBondContact OE2-N 2.85Å; Q853-Y1061 WeakPolarHBondContact O-CD2 3.46Å; P855-Y1061 VanDerWaalsContact CD-CE1 3.44Å; P855-Y1061 HydrophobicContact CG-CD1 3.55Å; P855-Y1061 HydrophobicContact CG-CE1 3.29Å; P855-Y1061 HydrophobicContact CG-CG 4.36Å; V867-Y1061 HydrophobicContact CG2-CE2 4.27Å; T869-Y1061 HydrophobicContact CG2-CD2 4.11Å; T869-Y1061 HydrophobicContact CG2-CE2 3.76Å; G951-Y1061 PolarHBondContact O-OH 2.76Å
1062	N	77.3	Confident	81.3	Confident	58 Å²	58	62.6 Å²	62.6	31%	0.31	34%	0.336	S	S	.	.			trans	-152.1	94	179.7	-172.1	-22.9	0	0	0	111.1	I1064 S1065 F1066	N1062-I1064 PolarHBondContact O-N 2.9Å; N1062-I1064 PolarHBondContact OD1-N 2.73Å; N1062-S1065 VanDerWaalsContact CG-CB 3.44Å; N1062-S1065 PolarHBondContact O-N 3.49Å; N1062-S1065 PolarHBondContact OD1-N 2.82Å; N1062-F1066 WeakPolarHBondContact O-CB 3.42Å; N1062-F1066 PolarHBondContact O-N 2.97Å
1063	P	78.3	Confident	81.2	Confident	19 Å²	19	62.9 Å²	62.9	12%	0.123	34%	0.338	C	S	.	.	H	α-helix	trans	-58.6	-31.8	179.6	-29.7	38.5	0	0	0	114.8	W161 Q1058 P1059 F1066 A1067	W161-P1063 HydrophobicContact CH2-CG 4.06Å; W161-P1063 HydrophobicContact CZ3-CG 3.68Å; Q1058-P1063 HydrophobicContact CB-CG 4.29Å; P1059-P1063 HydrophobicContact CB-CB 4.39Å; P1059-P1063 HydrophobicContact CB-CG 4.15Å; P1059-P1063 HydrophobicContact CG-CB 4.32Å; P1059-P1063 WeakPolarHBondContact O-CG 3.08Å; P1063-F1066 PolarHBondContact O-N 2.76Å; P1063-A1067 WeakPolarHBondContact O-CB 3.33Å; P1063-A1067 PolarHBondContact O-N 3.41Å
1064	I	78.9	Confident	81	Confident	75 Å²	75	63.8 Å²	63.8	39%	0.385	34%	0.343	S	S	.	.	H	α-helix	trans	-75.6	-43.6	-179.2	-61.9	178.9	0	0	0	110.2	N1062 F1066 A1067 S1068	N1062-I1064 PolarHBondContact O-N 2.9Å; N1062-I1064 PolarHBondContact OD1-N 2.73Å; I1064-F1066 VanDerWaalsContact C-N 3.28Å; I1064-F1066 PolarHBondContact O-N 3.22Å; I1064-A1067 PolarHBondContact O-N 3.21Å; I1064-S1068 PolarHBondContact O-N 3.4Å
1065	S	79.8	Confident	81.1	Confident	25 Å²	25	62.4 Å²	62.4	18%	0.175	34%	0.336	C	S	.	.	H	α-helix	trans	-61.6	-40.1	170.8	-165.3	0	0	0	0	110.8	K830 Q853 N1062 A1067 S1068	K830-S1065 PolarHBondContact NZ-O 2.83Å; Q853-S1065 PolarHBondContact OE1-OG 3.36Å; Q853-S1065 VanDerWaalsContact OE1-OG 3.05Å; N1062-S1065 VanDerWaalsContact CG-CB 3.44Å; N1062-S1065 PolarHBondContact O-N 3.49Å; N1062-S1065 PolarHBondContact OD1-N 2.82Å; S1065-A1067 PolarHBondContact O-N 2.92Å; S1065-S1068 WeakPolarHBondContact O-CB 3.39Å; S1065-S1068 PolarHBondContact O-N 3.26Å
1066	F	86.5	Confident	81.6	Confident	34 Å²	34	58.2 Å²	58.2	15%	0.149	31%	0.309	C	S	.	.	H	α-helix	trans	-59.9	-44.3	176	-178.4	-97.7	0	0	0	112.2	K830 Y832 R850 M851 E852 P1059 N1062 P1063 I1064	K830-F1066 WeakPolarHBondContact CE-O 3.49Å; K830-F1066 HydrophobicContact CG-CD2 4.08Å; Y832-F1066 HydrophobicContact CD2-CZ 4.35Å; Y832-F1066 AromaticContact CE2-CE1 3.95Å; Y832-F1066 HydrophobicContact CE2-CE1 3.95Å; Y832-F1066 AromaticContact CE2-CZ 3.94Å; Y832-F1066 HydrophobicContact CE2-CZ 3.94Å; R850-F1066 HydrophobicContact CG-CE2 4.36Å; R850-F1066 HydrophobicContact CG-CZ 4.33Å; M851-F1066 WeakPolarHBondContact O-CE2 3.15Å; E852-F1066 HydrophobicContact CB-CD2 4.42Å; E852-F1066 HydrophobicContact CG-CD2 3.71Å; E852-F1066 HydrophobicContact CG-CE2 3.84Å; P1059-F1066 HydrophobicContact CB-CB 4.07Å; P1059-F1066 HydrophobicContact CB-CD1 4.31Å; P1059-F1066 HydrophobicContact CB-CD2 4.48Å; P1059-F1066 HydrophobicContact CB-CG 4.05Å; P1059-F1066 HydrophobicContact CG-CB 3.92Å; P1059-F1066 HydrophobicContact CG-CD1 3.35Å; P1059-F1066 HydrophobicContact CG-CD2 4.27Å; P1059-F1066 HydrophobicContact CG-CE1 3.82Å; P1059-F1066 HydrophobicContact CG-CG 3.59Å; P1059-F1066 HydrophobicContact CG-CZ 4.43Å; N1062-F1066 WeakPolarHBondContact O-CB 3.42Å; N1062-F1066 PolarHBondContact O-N 2.97Å; P1063-F1066 PolarHBondContact O-N 2.76Å; I1064-F1066 VanDerWaalsContact C-N 3.28Å; I1064-F1066 PolarHBondContact O-N 3.22Å
1067	A	83.6	Confident	81.6	Confident	84 Å²	84	54 Å²	54	69%	0.694	29%	0.293	S	S	*	.	H	α-helix	trans	-74.4	-21.5	178.5	0	0	0	0	0	114.3	P1063 I1064 S1065 S1069	P1063-A1067 WeakPolarHBondContact O-CB 3.33Å; P1063-A1067 PolarHBondContact O-N 3.41Å; I1064-A1067 PolarHBondContact O-N 3.21Å; S1065-A1067 PolarHBondContact O-N 2.92Å; A1067-S1069 PolarHBondContact O-N 2.77Å
1068	S	83.3	Confident	81.2	Confident	42 Å²	42	59.3 Å²	59.3	29%	0.294	31%	0.313	S	S	.	.			trans	-62.6	134	179.9	176.9	0	0	0	0	112.2	K830 I1064 S1065 H1070	K830-S1068 PolarHBondContact NZ-O 2.87Å; I1064-S1068 PolarHBondContact O-N 3.4Å; S1065-S1068 WeakPolarHBondContact O-CB 3.39Å; S1065-S1068 PolarHBondContact O-N 3.26Å; S1068-H1070 VanDerWaalsContact C-N 3.26Å; S1068-H1070 PolarHBondContact O-N 2.83Å; S1068-H1070 PolarHBondContact OG-N 2.98Å; S1068-H1070 VanDerWaalsContact OG-N 3.14Å
1069	S	78.6	Confident	80.9	Confident	108 Å²	108	62.9 Å²	62.9	76%	0.755	32%	0.321	S	S	*	.	S	Bend	trans	-73.7	-16.1	171.8	55.5	0	0	0	0	113.3	A1067 Y1071	A1067-S1069 PolarHBondContact O-N 2.77Å; S1069-Y1071 VanDerWaalsContact C-N 3.32Å; S1069-Y1071 PolarHBondContact O-N 3.31Å
1070	H	81.2	Confident	80.2	Confident	167 Å²	167	65 Å²	65	77%	0.773	33%	0.332	S	S	*	.			trans	-82.1	72.5	-179.6	-59	-57.5	0	0	0	111.5	S1068	S1068-H1070 VanDerWaalsContact C-N 3.26Å; S1068-H1070 PolarHBondContact O-N 2.83Å; S1068-H1070 PolarHBondContact OG-N 2.98Å; S1068-H1070 VanDerWaalsContact OG-N 3.14Å
1071	Y	88.4	Confident	79	Confident	25 Å²	25	73.2 Å²	73.2	10%	0.098	37%	0.37	C	S	.	.			trans	-131.2	126.4	173.9	173.3	-105.7	0	0	0	110.6	N828 K830 Q853 T866 S1069 P1073	N828-Y1071 VanDerWaalsContact O-CE1 3.25Å; N828-Y1071 WeakPolarHBondContact O-CE1 3.23Å; N828-Y1071 PolarHBondContact O-OH 2.87Å; K830-Y1071 HydrophobicContact CB-CD1 3.69Å; K830-Y1071 HydrophobicContact CB-CE1 3.7Å; K830-Y1071 HydrophobicContact CB-CG 4.16Å; K830-Y1071 HydrophobicContact CD-CD1 4.41Å; K830-Y1071 HydrophobicContact CD-CD2 4.13Å; K830-Y1071 HydrophobicContact CD-CG 4.01Å; K830-Y1071 VanDerWaalsContact NZ-CB 3.34Å; Q853-Y1071 HydrophobicContact CG-CD2 4.25Å; Q853-Y1071 HydrophobicContact CG-CE2 3.85Å; T866-Y1071 HydrophobicContact CG2-CE2 4.5Å; T866-Y1071 WeakPolarHBondContact CG2-OH 3.44Å; S1069-Y1071 VanDerWaalsContact C-N 3.32Å; S1069-Y1071 PolarHBondContact O-N 3.31Å; Y1071-P1073 HydrophobicContact CE1-CB 4.06Å
1072	Q	87.2	Confident	78	Confident	145 Å²	145	77.6 Å²	77.6	68%	0.678	40%	0.397	S	S	*	.			trans	-127.1	105.6	177.1	-72.3	-174.9	-37.9	0	0	108.3	M864	M864-Q1072 HydrophobicContact CE-CB 4.27Å; M864-Q1072 WeakPolarHBondContact CE-O 3.46Å
1073	P	89.6	Confident	76.9	Confident	11 Å²	11	77.4 Å²	77.4	7%	0.071	40%	0.403	C	S	.	.			trans	-65	153.3	-177.1	32.5	-41.3	0	0	0	111.5	N828 M864 Y1035 Y1071 F1075	N828-P1073 HydrophobicContact CB-CB 4.06Å; M864-P1073 CarbonylContact O-C 3.56Å; M864-P1073 VanDerWaalsContact O-CA 3.32Å; M864-P1073 WeakPolarHBondContact O-CA 3.47Å; Y1035-P1073 HydrophobicContact CD1-CG 4.17Å; Y1035-P1073 HydrophobicContact CD2-CB 4.34Å; Y1035-P1073 HydrophobicContact CD2-CG 3.81Å; Y1035-P1073 HydrophobicContact CE1-CG 3.92Å; Y1035-P1073 HydrophobicContact CE2-CB 3.98Å; Y1035-P1073 HydrophobicContact CE2-CG 3.53Å; Y1035-P1073 HydrophobicContact CG-CG 4.14Å; Y1071-P1073 HydrophobicContact CE1-CB 4.06Å; P1073-F1075 HydrophobicContact CB-CE1 4.42Å; P1073-F1075 HydrophobicContact CG-CE1 3.69Å; P1073-F1075 HydrophobicContact CG-CE2 4.12Å; P1073-F1075 HydrophobicContact CG-CZ 3.44Å; P1073-F1075 VanDerWaalsContact CG-CZ 3.44Å
1074	I	87.5	Confident	76.1	Confident	24 Å²	24	79.1 Å²	79.1	12%	0.123	41%	0.413	C	S	.	.			trans	-82.2	127.6	168.3	-162.8	171.2	0	0	0	109.6	M864 A865 P1077 N1080 F1106 T1110	M864-I1074 HydrophobicContact CB-CB 4.26Å; M864-I1074 WeakPolarHBondContact O-CG2 3.23Å; M864-I1074 PolarHBondContact O-N 2.92Å; A865-I1074 HydrophobicContact CB-CG2 4.4Å; I1074-P1077 HydrophobicContact CD1-CB 4.12Å; I1074-P1077 HydrophobicContact CD1-CG 4.31Å; I1074-N1080 HydrophobicContact CD1-CB 3.85Å; I1074-N1080 VanDerWaalsContact CD1-ND2 3.28Å; I1074-N1080 WeakPolarHBondContact CD1-ND2 3.22Å; I1074-N1080 HydrophobicContact CG1-CB 4.38Å; I1074-F1106 HydrophobicContact CG2-CE2 4.23Å; I1074-F1106 HydrophobicContact CG2-CZ 3.65Å; I1074-T1110 HydrophobicContact CG2-CG2 3.83Å
1075	F	88.1	Confident	75.1	Confident	32 Å²	32	82.6 Å²	82.6	14%	0.14	43%	0.426	C	S	.	.	S	Bend	trans	-100.8	-32.3	-179	-63.5	-62	0	0	0	112.9	E1028 A1031 R1032 Y1035 Y1036 P1073	E1028-F1075 HydrophobicContact CG-CB 4.06Å; A1031-F1075 HydrophobicContact CB-CB 4.12Å; A1031-F1075 HydrophobicContact CB-CD1 4.15Å; R1032-F1075 HydrophobicContact CB-CD2 4.27Å; R1032-F1075 HydrophobicContact CB-CE1 4.48Å; R1032-F1075 HydrophobicContact CB-CE2 4.22Å; R1032-F1075 HydrophobicContact CB-CG 4.4Å; R1032-F1075 HydrophobicContact CB-CZ 4.31Å; R1032-F1075 HydrophobicContact CG-CE2 4.07Å; R1032-F1075 HydrophobicContact CG-CZ 4.23Å; Y1035-F1075 VanDerWaalsContact CB-CE1 3.47Å; Y1035-F1075 HydrophobicContact CD1-CE1 4.29Å; Y1035-F1075 HydrophobicContact CD1-CZ 4.12Å; Y1035-F1075 HydrophobicContact CD2-CE1 4.19Å; Y1035-F1075 AromaticContact CG-CE1 3.74Å; Y1035-F1075 HydrophobicContact CG-CE1 3.74Å; Y1035-F1075 HydrophobicContact CG-CZ 4.04Å; Y1036-F1075 HydrophobicContact CD2-CZ 4.41Å; Y1036-F1075 HydrophobicContact CE2-CE2 4.18Å; Y1036-F1075 AromaticContact CE2-CZ 3.79Å; Y1036-F1075 HydrophobicContact CE2-CZ 3.79Å; P1073-F1075 HydrophobicContact CB-CE1 4.42Å; P1073-F1075 HydrophobicContact CG-CE1 3.69Å; P1073-F1075 HydrophobicContact CG-CE2 4.12Å; P1073-F1075 HydrophobicContact CG-CZ 3.44Å; P1073-F1075 VanDerWaalsContact CG-CZ 3.44Å
1076	D	83	Confident	74	Confident	39 Å²	39	89.4 Å²	89.4	21%	0.209	45%	0.448	C	S	.	.			trans	-141	101.7	177.2	-177.9	-10.6	0	0	0	108.7	E1028 W1078 R1079 N1080	E1028-D1076 HydrophobicContact CB-CB 4.17Å; E1028-D1076 HydrophobicContact CG-CB 4.13Å; D1076-W1078 PolarHBondContact O-N 3.16Å; D1076-W1078 WeakPolarHBondContact OD1-CB 3.07Å; D1076-W1078 PolarHBondContact OD1-N 2.88Å; D1076-R1079 HydrophobicContact CB-CB 4.22Å; D1076-R1079 PolarHBondContact O-N 2.76Å; D1076-R1079 PolarHBondContact OD1-N 3.49Å; D1076-R1079 WeakPolarHBondContact OD2-CD 3.41Å; D1076-R1079 WeakPolarHBondContact OD2-CG 3.46Å; D1076-R1079 IonicContact OD2-NE 2.95Å; D1076-R1079 PolarHBondContact OD2-NE 2.83Å; D1076-N1080 PolarHBondContact O-N 3.25Å
1077	P	75.7	Confident	72.7	Confident	24 Å²	24	88.7 Å²	88.7	16%	0.156	45%	0.445	C	S	.	.	G	3₁₀ helix	trans	-60.7	-30.9	179.8	-24.1	34.5	0	0	0	113.5	I1074 R1079 N1080 F1106 L1109 T1110	I1074-P1077 HydrophobicContact CD1-CB 4.12Å; I1074-P1077 HydrophobicContact CD1-CG 4.31Å; P1077-R1079 VanDerWaalsContact C-N 3.35Å; P1077-R1079 PolarHBondContact O-N 2.95Å; P1077-N1080 PolarHBondContact O-N 2.9Å; P1077-F1106 HydrophobicContact CG-CD2 3.33Å; P1077-F1106 HydrophobicContact CG-CE2 3.46Å; P1077-F1106 VanDerWaalsContact CG-CE2 3.46Å; P1077-F1106 HydrophobicContact CG-CG 3.98Å; P1077-F1106 HydrophobicContact CG-CZ 4.2Å; P1077-L1109 HydrophobicContact CB-CB 3.77Å; P1077-L1109 HydrophobicContact CB-CD1 3.97Å; P1077-T1110 HydrophobicContact CG-CG2 4.07Å
1078	W	72	Confident	71.7	Confident	143 Å²	143	88.6 Å²	88.6	54%	0.542	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-70.8	-31.1	-179.6	-72.3	103.3	0	0	0	112.8	D1076 R1093 L1109	D1076-W1078 PolarHBondContact O-N 3.16Å; D1076-W1078 WeakPolarHBondContact OD1-CB 3.07Å; D1076-W1078 PolarHBondContact OD1-N 2.88Å; W1078-R1093 HydrophobicContact CH2-CB 4.45Å; W1078-R1093 HydrophobicContact CH2-CG 3.94Å; W1078-L1109 HydrophobicContact CD2-CD1 3.87Å; W1078-L1109 HydrophobicContact CG-CD1 4.14Å; W1078-L1109 HydrophobicContact CZ2-CD1 3.88Å
1079	R	68.7	Low	70.6	Confident	187 Å²	187	91.8 Å²	91.8	71%	0.706	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-91.4	-1.3	178.8	-72.6	-175.7	-176.7	-146.6	-1.6	113.8	D1076 P1077 Q1081	D1076-R1079 HydrophobicContact CB-CB 4.22Å; D1076-R1079 PolarHBondContact O-N 2.76Å; D1076-R1079 PolarHBondContact OD1-N 3.49Å; D1076-R1079 WeakPolarHBondContact OD2-CD 3.41Å; D1076-R1079 WeakPolarHBondContact OD2-CG 3.46Å; D1076-R1079 IonicContact OD2-NE 2.95Å; D1076-R1079 PolarHBondContact OD2-NE 2.83Å; P1077-R1079 VanDerWaalsContact C-N 3.35Å; P1077-R1079 PolarHBondContact O-N 2.95Å; R1079-Q1081 PolarHBondContact O-N 3.48Å
1080	N	62.7	Low	69.7	Low	59 Å²	59	88.9 Å²	88.9	32%	0.316	43%	0.428	S	S	.	.			trans	-68.2	97.2	-175.9	-170.4	10.8	0	0	0	111.1	I1074 D1076 P1077 N1082 A1083	I1074-N1080 HydrophobicContact CD1-CB 3.85Å; I1074-N1080 VanDerWaalsContact CD1-ND2 3.28Å; I1074-N1080 WeakPolarHBondContact CD1-ND2 3.22Å; I1074-N1080 HydrophobicContact CG1-CB 4.38Å; D1076-N1080 PolarHBondContact O-N 3.25Å; P1077-N1080 PolarHBondContact O-N 2.9Å; N1080-N1082 PolarHBondContact O-N 3.22Å; N1080-N1082 PolarHBondContact OD1-N 2.87Å; N1080-A1083 PolarHBondContact O-N 2.8Å
1081	Q	51.3	Low	68.6	Low	188 Å²	188	83.1 Å²	83.1	88%	0.879	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-17.3	-178	-66.8	-178.8	-5.2	0	0	113.3	R1079 A1083	R1079-Q1081 PolarHBondContact O-N 3.48Å; Q1081-A1083 PolarHBondContact O-N 2.99Å
1082	N	55.6	Low	67.2	Low	141 Å²	141	83.8 Å²	83.8	75%	0.754	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	11.7	179.5	-69.4	-22.1	0	0	0	113.2	N1080 T1084	N1080-N1082 PolarHBondContact O-N 3.22Å; N1080-N1082 PolarHBondContact OD1-N 2.87Å; N1082-T1084 PolarHBondContact O-N 2.93Å
1083	A	56.1	Low	65.7	Low	53 Å²	53	86.9 Å²	86.9	44%	0.438	41%	0.414	S	S	.	.			trans	-60.2	123.8	176.3	0	0	0	0	0	110.7	N1080 Q1081 E1087	N1080-A1083 PolarHBondContact O-N 2.8Å; Q1081-A1083 PolarHBondContact O-N 2.99Å; A1083-E1087 WeakPolarHBondContact CA-OE2 3.43Å; A1083-E1087 HydrophobicContact CB-CB 4.38Å; A1083-E1087 WeakPolarHBondContact CB-OE2 3.47Å
1084	T	59.9	Low	64.2	Low	56 Å²	56	95 Å²	95	34%	0.344	45%	0.451	S	S	.	.			trans	-67.5	155	175.4	60.8	0	0	0	0	110.7	W859 N1082 W1086 E1087	W859-T1084 HydrophobicContact CE3-CG2 4.33Å; W859-T1084 HydrophobicContact CZ3-CG2 3.9Å; N1082-T1084 PolarHBondContact O-N 2.93Å; T1084-W1086 PolarHBondContact O-N 3.24Å; T1084-W1086 VanDerWaalsContact O-N 3.08Å; T1084-E1087 WeakPolarHBondContact CB-OE1 3.45Å; T1084-E1087 VanDerWaalsContact N-CD 3.32Å; T1084-E1087 PolarHBondContact N-OE1 3.48Å; T1084-E1087 WeakPolarHBondContact O-CB 3.32Å; T1084-E1087 PolarHBondContact O-N 2.89Å; T1084-E1087 WeakPolarHBondContact OG1-CG 3.15Å; T1084-E1087 PolarHBondContact OG1-OE1 2.04Å
1085	F	58.9	Low	63	Low	147 Å²	147	99.3 Å²	99.3	65%	0.645	47%	0.471	S	S	*	.	H	α-helix	trans	-49.5	-36.8	173.5	173	-101.7	0	0	0	112.6	E1087 S1088 L1089	F1085-E1087 PolarHBondContact O-N 3.23Å; F1085-S1088 PolarHBondContact O-N 3.25Å; F1085-S1088 PolarHBondContact O-OG 2.77Å; F1085-L1089 HydrophobicContact CD1-CD1 4.01Å; F1085-L1089 HydrophobicContact CE1-CD1 3.52Å; F1085-L1089 HydrophobicContact CZ-CD1 3.97Å
1086	W	56.3	Low	61.7	Low	168 Å²	168	98.4 Å²	98.4	64%	0.636	47%	0.468	S	S	*	.	H	α-helix	trans	-67	-32	178.9	-68.1	110.7	0	0	0	114.2	W859 T1084 L1089	W859-W1086 HydrophobicContact CB-CB 4.25Å; T1084-W1086 PolarHBondContact O-N 3.24Å; T1084-W1086 VanDerWaalsContact O-N 3.08Å; W1086-L1089 HydrophobicContact CE3-CD1 3.71Å; W1086-L1089 HydrophobicContact CZ3-CD1 3.99Å; W1086-L1089 PolarHBondContact O-N 3.2Å
1087	E	60.1	Low	61.2	Low	19 Å²	19	100.9 Å²	100.9	9%	0.089	48%	0.484	C	S	.	.	H	α-helix	trans	-62.5	-44	175.1	-73.8	160	-119.3	0	0	110.9	W859 A1083 T1084 F1085 L1089 I1090 F1091	W859-E1087 HydrophobicContact CD2-CG 3.9Å; W859-E1087 HydrophobicContact CE3-CG 4.38Å; W859-E1087 HydrophobicContact CG-CG 4.44Å; W859-E1087 VanDerWaalsContact CH2-CD 3.41Å; W859-E1087 HydrophobicContact CH2-CG 3.98Å; W859-E1087 WeakPolarHBondContact CH2-OE1 3.04Å; W859-E1087 HydrophobicContact CZ2-CG 3.48Å; W859-E1087 VanDerWaalsContact CZ2-CG 3.48Å; W859-E1087 VanDerWaalsContact CZ2-OE1 3.29Å; W859-E1087 WeakPolarHBondContact CZ2-OE1 3.36Å; W859-E1087 HydrophobicContact CZ3-CG 4.35Å; W859-E1087 WeakPolarHBondContact CZ3-OE1 3.14Å; A1083-E1087 WeakPolarHBondContact CA-OE2 3.43Å; A1083-E1087 HydrophobicContact CB-CB 4.38Å; A1083-E1087 WeakPolarHBondContact CB-OE2 3.47Å; T1084-E1087 WeakPolarHBondContact CB-OE1 3.45Å; T1084-E1087 VanDerWaalsContact N-CD 3.32Å; T1084-E1087 PolarHBondContact N-OE1 3.48Å; T1084-E1087 WeakPolarHBondContact O-CB 3.32Å; T1084-E1087 PolarHBondContact O-N 2.89Å; T1084-E1087 WeakPolarHBondContact OG1-CG 3.15Å; T1084-E1087 PolarHBondContact OG1-OE1 2.04Å; F1085-E1087 PolarHBondContact O-N 3.23Å; E1087-L1089 PolarHBondContact O-N 3.16Å; E1087-L1089 VanDerWaalsContact O-N 3.15Å; E1087-I1090 PolarHBondContact O-N 3.33Å; E1087-F1091 HydrophobicContact CB-CD2 4.05Å; E1087-F1091 HydrophobicContact CB-CE2 3.81Å; E1087-F1091 HydrophobicContact CG-CE2 4.14Å; E1087-F1091 WeakPolarHBondContact O-CD2 3.19Å; E1087-F1091 PolarHBondContact O-N 3.08Å; E1087-F1091 VanDerWaalsContact O-N 3.16Å
1088	S	62.4	Low	61.5	Low	83 Å²	83	100 Å²	100	58%	0.58	48%	0.479	S	S	*	.	H	α-helix	trans	-63.4	-22	-179.4	73.1	0	0	0	0	114.4	F1085	F1085-S1088 PolarHBondContact O-N 3.25Å; F1085-S1088 PolarHBondContact O-OG 2.77Å
1089	L	59.8	Low	62.1	Low	108 Å²	108	99.2 Å²	99.2	57%	0.565	48%	0.481	S	S	*	.	H	α-helix	trans	-80.8	-21.3	176.1	-76.4	161.1	0	0	0	113	F1085 W1086 E1087	F1085-L1089 HydrophobicContact CD1-CD1 4.01Å; F1085-L1089 HydrophobicContact CE1-CD1 3.52Å; F1085-L1089 HydrophobicContact CZ-CD1 3.97Å; W1086-L1089 HydrophobicContact CE3-CD1 3.71Å; W1086-L1089 HydrophobicContact CZ3-CD1 3.99Å; W1086-L1089 PolarHBondContact O-N 3.2Å; E1087-L1089 PolarHBondContact O-N 3.16Å; E1087-L1089 VanDerWaalsContact O-N 3.15Å
1090	I	59.3	Low	62.7	Low	48 Å²	48	93 Å²	93	25%	0.246	48%	0.476	C	S	.	.	H	α-helix	trans	-95.9	-32.5	-176.4	-63.7	167.2	0	0	0	110.9	M858 E1087 Y1108	M858-I1090 HydrophobicContact CE-CG2 4.16Å; E1087-I1090 PolarHBondContact O-N 3.33Å; I1090-Y1108 PolarHBondContact O-OH 3.48Å
1091	F	57.9	Low	64.1	Low	46 Å²	46	90.6 Å²	90.6	20%	0.202	46%	0.464	C	S	.	.			trans	-92.7	103.7	-175.4	-61.1	-59.6	0	0	0	112.2	E1087 Y1108 L1109	E1087-F1091 HydrophobicContact CB-CD2 4.05Å; E1087-F1091 HydrophobicContact CB-CE2 3.81Å; E1087-F1091 HydrophobicContact CG-CE2 4.14Å; E1087-F1091 WeakPolarHBondContact O-CD2 3.19Å; E1087-F1091 PolarHBondContact O-N 3.08Å; E1087-F1091 VanDerWaalsContact O-N 3.16Å; F1091-Y1108 HydrophobicContact CD1-CD1 4.4Å; F1091-Y1108 AromaticContact CD1-CE1 3.84Å; F1091-Y1108 HydrophobicContact CD1-CE1 3.84Å; F1091-Y1108 HydrophobicContact CD1-CE2 4.4Å; F1091-Y1108 AromaticContact CD1-CZ 3.83Å; F1091-Y1108 HydrophobicContact CE1-CE1 4.42Å; F1091-Y1108 HydrophobicContact CE1-CE2 4.42Å; F1091-Y1108 VanDerWaalsContact CE1-O 3.31Å; F1091-Y1108 WeakPolarHBondContact CE1-O 3.36Å; F1091-L1109 HydrophobicContact CB-CD2 4.41Å; F1091-L1109 HydrophobicContact CD1-CD2 3.78Å; F1091-L1109 HydrophobicContact CE1-CD2 4.17Å; F1091-L1109 HydrophobicContact CG-CD2 4Å; F1091-L1109 WeakPolarHBondContact CZ-O 3.41Å
1092	S	59.5	Low	66	Low	38 Å²	38	83.7 Å²	83.7	27%	0.266	44%	0.435	S	S	.	.			trans	-108.7	130.9	157.7	76.4	0	0	0	0	109.4	E1094 E1095	S1092-E1094 PolarHBondContact O-N 2.92Å; S1092-E1094 VanDerWaalsContact O-N 3.1Å; S1092-E1095 PolarHBondContact O-N 3.5Å; S1092-E1095 VanDerWaalsContact OG-CB 3.28Å; S1092-E1095 WeakPolarHBondContact OG-CB 3.16Å; S1092-E1095 WeakPolarHBondContact OG-CG 3.11Å; S1092-E1095 PolarHBondContact OG-N 3.27Å; S1092-E1095 PolarHBondContact OG-OE2 3.11Å
1093	R	55.6	Low	67.7	Low	211 Å²	211	77.1 Å²	77.1	80%	0.796	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-19.6	177.4	-159.7	171.2	80.5	175.1	5.7	112.2	W1078	W1078-R1093 HydrophobicContact CH2-CB 4.45Å; W1078-R1093 HydrophobicContact CH2-CG 3.94Å
1094	E	58.1	Low	69.4	Low	180 Å²	180	74.6 Å²	74.6	84%	0.841	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-28.4	-175.5	-70.1	162.5	-177.9	0	0	112.9	S1092	S1092-E1094 PolarHBondContact O-N 2.92Å; S1092-E1094 VanDerWaalsContact O-N 3.1Å
1095	E	61.6	Low	70.7	Confident	116 Å²	116	75 Å²	75	54%	0.542	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-26.9	-176.1	-81.7	169.6	153	0	0	114.3	S1092	S1092-E1095 PolarHBondContact O-N 3.5Å; S1092-E1095 VanDerWaalsContact OG-CB 3.28Å; S1092-E1095 WeakPolarHBondContact OG-CB 3.16Å; S1092-E1095 WeakPolarHBondContact OG-CG 3.11Å; S1092-E1095 PolarHBondContact OG-N 3.27Å; S1092-E1095 PolarHBondContact OG-OE2 3.11Å
1096	V	61.2	Low	72.1	Confident	12 Å²	12	68.8 Å²	68.8	7%	0.073	35%	0.35	C	S	.	.			trans	-113	101.1	-180	-174.1	0	0	0	0	110.9	C1098 Y1108 R1114	V1096-C1098 VanDerWaalsContact C-N 3.26Å; V1096-C1098 VanDerWaalsContact CG1-SG 3.57Å; V1096-C1098 PolarHBondContact O-N 2.89Å; V1096-Y1108 HydrophobicContact CB-CD1 3.95Å; V1096-Y1108 HydrophobicContact CB-CE1 3.83Å; V1096-Y1108 HydrophobicContact CB-CG 4.33Å; V1096-Y1108 HydrophobicContact CG1-CD1 4.27Å; V1096-Y1108 HydrophobicContact CG1-CG 4.27Å; V1096-Y1108 HydrophobicContact CG2-CD1 3.87Å; V1096-Y1108 HydrophobicContact CG2-CD2 3.82Å; V1096-Y1108 HydrophobicContact CG2-CE1 3.46Å; V1096-Y1108 VanDerWaalsContact CG2-CE1 3.46Å; V1096-Y1108 HydrophobicContact CG2-CE2 3.44Å; V1096-Y1108 VanDerWaalsContact CG2-CE2 3.44Å; V1096-Y1108 HydrophobicContact CG2-CG 4.03Å; V1096-R1114 HydrophobicContact CG1-CG 4.42Å; V1096-R1114 HydrophobicContact CG2-CB 3.94Å; V1096-R1114 HydrophobicContact CG2-CG 3.67Å
1097	T	71.6	Confident	73.7	Confident	91 Å²	91	60.8 Å²	60.8	56%	0.558	32%	0.32	S	S	*	.			trans	-76.9	76.5	172	-37.1	0	0	0	0	110.3	Q1099	T1097-Q1099 HydrophobicContact CG2-CG 3.92Å; T1097-Q1099 PolarHBondContact O-N 2.81Å; T1097-Q1099 VanDerWaalsContact O-N 3.16Å
1098	C	82.4	Confident	74.9	Confident	5 Å²	5	60.7 Å²	60.7	3%	0.034	32%	0.318	C	S	.	.			trans	-68.6	-1.9	171.8	-80.3	0	0	0	0	113.7	V1096 G1100 S1101 C1104 E1105	V1096-C1098 VanDerWaalsContact C-N 3.26Å; V1096-C1098 VanDerWaalsContact CG1-SG 3.57Å; V1096-C1098 PolarHBondContact O-N 2.89Å; C1098-G1100 PolarHBondContact O-N 2.92Å; C1098-S1101 WeakPolarHBondContact O-CB 3.47Å; C1098-S1101 PolarHBondContact O-N 3.15Å; C1098-C1104 WeakPolarHBondContact CA-SG 3.43Å; C1098-C1104 HydrophobicContact CB-CB 3.64Å; C1098-C1104 WeakPolarHBondContact CB-SG 3.28Å; C1098-C1104 WeakPolarHBondContact SG-CB 3.43Å; C1098-C1104 PolarHBondContact SG-O 3.25Å; C1098-C1104 CovalentContact SG-SG 2.05Å; C1098-C1104 PolarHBondContact SG-SG 3.35Å; C1098-E1105 HydrophobicContact CB-CG 3.65Å; C1098-E1105 PolarHBondContact SG-N 2.8Å; C1098-E1105 VanDerWaalsContact SG-N 3.43Å
1099	Q	84.3	Confident	75.9	Confident	127 Å²	127	58 Å²	58	59%	0.593	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	32	177.1	-58.3	179.1	22.1	0	0	112.8	T1097	T1097-Q1099 HydrophobicContact CG2-CG 3.92Å; T1097-Q1099 PolarHBondContact O-N 2.81Å; T1097-Q1099 VanDerWaalsContact O-N 3.16Å
1100	G	83.3	Confident	77	Confident	58 Å²	58	53.4 Å²	53.4	60%	0.598	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.6	14.5	179.6	0	0	0	0	0	115.6	C1098 P1102	C1098-G1100 PolarHBondContact O-N 2.92Å; G1100-P1102 VanDerWaalsContact O-CD 3.26Å; G1100-P1102 WeakPolarHBondContact O-CD 3.32Å
1101	S	91.4	Very high	78.1	Confident	8 Å²	8	51.4 Å²	51.4	6%	0.056	26%	0.264	C	S	.	.			trans	-77.8	113.3	171.8	168.4	0	0	0	0	110.5	C1098 P1103 C1104 E1105 L1121 E1124	C1098-S1101 WeakPolarHBondContact O-CB 3.47Å; C1098-S1101 PolarHBondContact O-N 3.15Å; S1101-P1103 WeakPolarHBondContact OG-CD 3.35Å; S1101-C1104 PolarHBondContact O-N 2.93Å; S1101-C1104 PolarHBondContact OG-N 3.36Å; S1101-E1105 WeakPolarHBondContact O-CG 3.5Å; S1101-E1105 PolarHBondContact O-N 2.96Å; S1101-L1121 VanDerWaalsContact CB-CD1 3.46Å; S1101-E1124 WeakPolarHBondContact CB-OE2 3.38Å; S1101-E1124 PolarHBondContact OG-OE2 3.12Å
1102	P	90.2	Very high	79.1	Confident	43 Å²	43	49.4 Å²	49.4	28%	0.279	26%	0.256	S	S	.	.	H	α-helix	trans	-60.7	-38	178.8	-19.4	31.3	0	0	0	114.1	Y1024 P1025 G1100 E1105 F1106	Y1024-P1102 HydrophobicContact CE1-CG 4.28Å; P1025-P1102 HydrophobicContact CB-CB 4.31Å; P1025-P1102 HydrophobicContact CB-CG 4.08Å; G1100-P1102 VanDerWaalsContact O-CD 3.26Å; G1100-P1102 WeakPolarHBondContact O-CD 3.32Å; P1102-E1105 PolarHBondContact O-N 2.86Å; P1102-F1106 WeakPolarHBondContact O-CB 3.33Å; P1102-F1106 PolarHBondContact O-N 2.92Å
1103	P	92.5	Very high	80.1	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.013	26%	0.261	C	S	.	.	H	α-helix	trans	-60.2	-44.8	174.3	-34.2	43.6	0	0	0	113.8	Y812 H816 Y1024 S1101 E1105 F1106 D1107 T1120 E1124	Y812-P1103 HydrophobicContact CE2-CB 4.28Å; H816-P1103 HydrophobicContact CB-CB 4.49Å; H816-P1103 WeakPolarHBondContact NE2-CA 3.43Å; H816-P1103 PolarHBondContact NE2-O 2.68Å; Y1024-P1103 WeakPolarHBondContact OH-CD 3.43Å; Y1024-P1103 WeakPolarHBondContact OH-CG 3.39Å; S1101-P1103 WeakPolarHBondContact OG-CD 3.35Å; P1103-E1105 VanDerWaalsContact C-N 3.32Å; P1103-E1105 PolarHBondContact O-N 2.68Å; P1103-F1106 PolarHBondContact O-N 2.8Å; P1103-D1107 PolarHBondContact O-N 2.79Å; P1103-T1120 HydrophobicContact CB-CG2 3.78Å; P1103-E1124 VanDerWaalsContact CG-OE1 3.31Å; P1103-E1124 WeakPolarHBondContact CG-OE1 3.45Å
1104	C	91.3	Very high	81.4	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59.8	-44.2	175.8	175.2	0	0	0	0	111.9	C1098 S1101 Y1108 G1117 L1121	C1098-C1104 WeakPolarHBondContact CA-SG 3.43Å; C1098-C1104 HydrophobicContact CB-CB 3.64Å; C1098-C1104 WeakPolarHBondContact CB-SG 3.28Å; C1098-C1104 WeakPolarHBondContact SG-CB 3.43Å; C1098-C1104 PolarHBondContact SG-O 3.25Å; C1098-C1104 CovalentContact SG-SG 2.05Å; C1098-C1104 PolarHBondContact SG-SG 3.35Å; S1101-C1104 PolarHBondContact O-N 2.93Å; S1101-C1104 PolarHBondContact OG-N 3.36Å; C1104-Y1108 VanDerWaalsContact O-CB 3.22Å; C1104-Y1108 WeakPolarHBondContact O-CB 3.04Å; C1104-Y1108 PolarHBondContact O-N 3.05Å; C1104-G1117 VanDerWaalsContact SG-C 3.58Å; C1104-G1117 PolarHBondContact SG-O 2.91Å; C1104-L1121 HydrophobicContact CB-CB 3.98Å
1105	E	87.7	Confident	82.8	Confident	64 Å²	64	42.9 Å²	42.9	30%	0.299	22%	0.221	S	C	.	.	H	α-helix	trans	-65.7	-42.3	178.3	-68.7	178	-166.8	0	0	111.2	C1098 S1101 P1102 P1103 L1109	C1098-E1105 HydrophobicContact CB-CG 3.65Å; C1098-E1105 PolarHBondContact SG-N 2.8Å; C1098-E1105 VanDerWaalsContact SG-N 3.43Å; S1101-E1105 WeakPolarHBondContact O-CG 3.5Å; S1101-E1105 PolarHBondContact O-N 2.96Å; P1102-E1105 PolarHBondContact O-N 2.86Å; P1103-E1105 VanDerWaalsContact C-N 3.32Å; P1103-E1105 PolarHBondContact O-N 2.68Å; E1105-L1109 WeakPolarHBondContact O-CB 3.27Å; E1105-L1109 WeakPolarHBondContact O-CD1 3.09Å; E1105-L1109 WeakPolarHBondContact O-CG 3.48Å; E1105-L1109 PolarHBondContact O-N 3.02Å
1106	F	88.7	Confident	84	Confident	18 Å²	18	39.7 Å²	39.7	8%	0.079	21%	0.207	C	C	.	.	H	α-helix	trans	-58.1	-59	176.7	-173	-81.1	0	0	0	111.1	E814 H816 N828 A865 I1074 P1077 P1102 P1103 Y1108 L1109 T1110	E814-F1106 HydrophobicContact CB-CE1 4.33Å; H816-F1106 AromaticContact CE1-CD1 3.76Å; H816-F1106 AromaticContact CE1-CG 3.85Å; H816-F1106 AromaticContact NE2-CD1 3.96Å; N828-F1106 WeakPolarHBondContact ND2-CE1 3.46Å; N828-F1106 WeakPolarHBondContact ND2-CZ 3.31Å; A865-F1106 HydrophobicContact CB-CE1 3.98Å; A865-F1106 HydrophobicContact CB-CZ 4.37Å; I1074-F1106 HydrophobicContact CG2-CE2 4.23Å; I1074-F1106 HydrophobicContact CG2-CZ 3.65Å; P1077-F1106 HydrophobicContact CG-CD2 3.33Å; P1077-F1106 HydrophobicContact CG-CE2 3.46Å; P1077-F1106 VanDerWaalsContact CG-CE2 3.46Å; P1077-F1106 HydrophobicContact CG-CG 3.98Å; P1077-F1106 HydrophobicContact CG-CZ 4.2Å; P1102-F1106 WeakPolarHBondContact O-CB 3.33Å; P1102-F1106 PolarHBondContact O-N 2.92Å; P1103-F1106 PolarHBondContact O-N 2.8Å; F1106-Y1108 VanDerWaalsContact C-N 3.29Å; F1106-Y1108 PolarHBondContact O-N 2.84Å; F1106-L1109 PolarHBondContact O-N 2.83Å; F1106-L1109 VanDerWaalsContact O-N 3.11Å; F1106-T1110 HydrophobicContact CD1-CG2 3.98Å; F1106-T1110 HydrophobicContact CE1-CG2 3.61Å; F1106-T1110 HydrophobicContact CZ-CG2 3.92Å; F1106-T1110 WeakPolarHBondContact O-CG2 2.9Å; F1106-T1110 PolarHBondContact O-N 3.05Å; F1106-T1110 PolarHBondContact O-OG1 2.57Å
1107	D	89.6	Confident	85.2	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.7	-35.8	-177.3	-75.9	4.8	0	0	0	112.5	G813 E814 H816 P1103 T1110 T1111 I1116 T1120	G813-D1107 WeakPolarHBondContact CA-OD2 3.19Å; E814-D1107 WeakPolarHBondContact CB-OD1 3.47Å; E814-D1107 HydrophobicContact CG-CB 4.48Å; E814-D1107 VanDerWaalsContact CG-OD1 3.23Å; E814-D1107 WeakPolarHBondContact CG-OD1 3.42Å; E814-D1107 PolarHBondContact N-OD1 2.79Å; E814-D1107 PolarHBondContact N-OD2 2.79Å; H816-D1107 IonicContact CD2-OD1 3.67Å; H816-D1107 IonicContact CD2-OD2 3.48Å; H816-D1107 IonicContact CE1-OD1 2.84Å; H816-D1107 IonicContact NE2-OD1 3.7Å; H816-D1107 PolarHBondContact NE2-OD1 2.92Å; H816-D1107 IonicContact NE2-OD2 2.77Å; P1103-D1107 PolarHBondContact O-N 2.79Å; D1107-T1110 WeakPolarHBondContact CA-OG1 3.37Å; D1107-T1110 PolarHBondContact O-OG1 3.49Å; D1107-T1111 WeakPolarHBondContact O-CB 3.45Å; D1107-T1111 WeakPolarHBondContact O-CG2 3.31Å; D1107-T1111 PolarHBondContact O-N 2.82Å; D1107-T1111 PolarHBondContact O-OG1 2.84Å; D1107-I1116 HydrophobicContact CB-CG2 4.28Å; D1107-T1120 VanDerWaalsContact OD2-CB 3.31Å; D1107-T1120 WeakPolarHBondContact OD2-CB 2.97Å; D1107-T1120 VanDerWaalsContact OD2-CG2 3.29Å; D1107-T1120 WeakPolarHBondContact OD2-CG2 3.44Å; D1107-T1120 PolarHBondContact OD2-OG1 3.29Å
1108	Y	84.8	Confident	86.1	Confident	17 Å²	17	37.7 Å²	37.7	7%	0.067	19%	0.192	C	C	.	.	H	α-helix	trans	-63.8	-48.7	174.7	173.7	-123.7	0	0	0	111.1	I1090 F1091 V1096 C1104 F1106 G1112 R1114	I1090-Y1108 PolarHBondContact O-OH 3.48Å; F1091-Y1108 HydrophobicContact CD1-CD1 4.4Å; F1091-Y1108 AromaticContact CD1-CE1 3.84Å; F1091-Y1108 HydrophobicContact CD1-CE1 3.84Å; F1091-Y1108 HydrophobicContact CD1-CE2 4.4Å; F1091-Y1108 AromaticContact CD1-CZ 3.83Å; F1091-Y1108 HydrophobicContact CE1-CE1 4.42Å; F1091-Y1108 HydrophobicContact CE1-CE2 4.42Å; F1091-Y1108 VanDerWaalsContact CE1-O 3.31Å; F1091-Y1108 WeakPolarHBondContact CE1-O 3.36Å; V1096-Y1108 HydrophobicContact CB-CD1 3.95Å; V1096-Y1108 HydrophobicContact CB-CE1 3.83Å; V1096-Y1108 HydrophobicContact CB-CG 4.33Å; V1096-Y1108 HydrophobicContact CG1-CD1 4.27Å; V1096-Y1108 HydrophobicContact CG1-CG 4.27Å; V1096-Y1108 HydrophobicContact CG2-CD1 3.87Å; V1096-Y1108 HydrophobicContact CG2-CD2 3.82Å; V1096-Y1108 HydrophobicContact CG2-CE1 3.46Å; V1096-Y1108 VanDerWaalsContact CG2-CE1 3.46Å; V1096-Y1108 HydrophobicContact CG2-CE2 3.44Å; V1096-Y1108 VanDerWaalsContact CG2-CE2 3.44Å; V1096-Y1108 HydrophobicContact CG2-CG 4.03Å; C1104-Y1108 VanDerWaalsContact O-CB 3.22Å; C1104-Y1108 WeakPolarHBondContact O-CB 3.04Å; C1104-Y1108 PolarHBondContact O-N 3.05Å; F1106-Y1108 VanDerWaalsContact C-N 3.29Å; F1106-Y1108 PolarHBondContact O-N 2.84Å; Y1108-G1112 WeakPolarHBondContact O-CA 3.15Å; Y1108-G1112 PolarHBondContact O-N 3.19Å; Y1108-R1114 HydrophobicContact CD2-CB 4.38Å; Y1108-R1114 HydrophobicContact CE2-CB 4.15Å
1109	L	82.4	Confident	86.5	Confident	26 Å²	26	39.3 Å²	39.3	14%	0.136	20%	0.2	C	C	.	.	H	α-helix	trans	-69.7	-34	-176.2	-69.7	171.3	0	0	0	113.4	P1077 W1078 F1091 E1105 F1106	P1077-L1109 HydrophobicContact CB-CB 3.77Å; P1077-L1109 HydrophobicContact CB-CD1 3.97Å; W1078-L1109 HydrophobicContact CD2-CD1 3.87Å; W1078-L1109 HydrophobicContact CG-CD1 4.14Å; W1078-L1109 HydrophobicContact CZ2-CD1 3.88Å; F1091-L1109 HydrophobicContact CB-CD2 4.41Å; F1091-L1109 HydrophobicContact CD1-CD2 3.78Å; F1091-L1109 HydrophobicContact CE1-CD2 4.17Å; F1091-L1109 HydrophobicContact CG-CD2 4Å; F1091-L1109 WeakPolarHBondContact CZ-O 3.41Å; E1105-L1109 WeakPolarHBondContact O-CB 3.27Å; E1105-L1109 WeakPolarHBondContact O-CD1 3.09Å; E1105-L1109 WeakPolarHBondContact O-CG 3.48Å; E1105-L1109 PolarHBondContact O-N 3.02Å; F1106-L1109 PolarHBondContact O-N 2.83Å; F1106-L1109 VanDerWaalsContact O-N 3.11Å
1110	T	83.4	Confident	86.9	Confident	12 Å²	12	33.4 Å²	33.4	7%	0.074	17%	0.173	C	C	.	.	H	α-helix	trans	-76.6	-38.3	179	51	0	0	0	0	112.5	E814 T857 A865 I1074 P1077 F1106 D1107	E814-T1110 VanDerWaalsContact OE2-CB 3.24Å; E814-T1110 WeakPolarHBondContact OE2-CB 3.4Å; E814-T1110 PolarHBondContact OE2-OG1 3Å; T857-T1110 WeakPolarHBondContact CG2-O 3.21Å; A865-T1110 HydrophobicContact CB-CG2 4.38Å; I1074-T1110 HydrophobicContact CG2-CG2 3.83Å; P1077-T1110 HydrophobicContact CG-CG2 4.07Å; F1106-T1110 HydrophobicContact CD1-CG2 3.98Å; F1106-T1110 HydrophobicContact CE1-CG2 3.61Å; F1106-T1110 HydrophobicContact CZ-CG2 3.92Å; F1106-T1110 WeakPolarHBondContact O-CG2 2.9Å; F1106-T1110 PolarHBondContact O-N 3.05Å; F1106-T1110 PolarHBondContact O-OG1 2.57Å; D1107-T1110 WeakPolarHBondContact CA-OG1 3.37Å; D1107-T1110 PolarHBondContact O-OG1 3.49Å
1111	T	82.4	Confident	87.4	Confident	6 Å²	6	31.1 Å²	31.1	4%	0.037	15%	0.147	C	C	.	.	H	α-helix	trans	-91	-26.2	-176.2	64.6	0	0	0	0	114	E814 D1107 R1113 I1116	E814-T1111 WeakPolarHBondContact OE1-CG2 3.34Å; D1107-T1111 WeakPolarHBondContact O-CB 3.45Å; D1107-T1111 WeakPolarHBondContact O-CG2 3.31Å; D1107-T1111 PolarHBondContact O-N 2.82Å; D1107-T1111 PolarHBondContact O-OG1 2.84Å; T1111-R1113 PolarHBondContact O-N 3.37Å; T1111-R1113 PolarHBondContact OG1-N 3.15Å; T1111-R1113 VanDerWaalsContact OG1-N 3.12Å; T1111-I1116 HydrophobicContact CG2-CD1 3.89Å; T1111-I1116 HydrophobicContact CG2-CG2 4.31Å
1112	G	78.6	Confident	87.5	Confident	4 Å²	4	36.1 Å²	36.1	4%	0.041	17%	0.171	C	C	.	.			trans	75.7	7.2	-168.6	0	0	0	0	0	114.1	M858 Y1108	M858-G1112 WeakPolarHBondContact CE-O 3.46Å; Y1108-G1112 WeakPolarHBondContact O-CA 3.15Å; Y1108-G1112 PolarHBondContact O-N 3.19Å
1113	R	81.9	Confident	87.7	Confident	94 Å²	94	34.7 Å²	34.7	36%	0.355	16%	0.161	S	C	.	.			trans	-116.4	113	-169.9	-71.6	175.9	-180	-101.2	6.1	111.2	M858 T1111 E1115 I1116 G1117	M858-R1113 HydrophobicContact CG-CG 4.35Å; M858-R1113 HydrophobicContact SD-CG 4.44Å; T1111-R1113 PolarHBondContact O-N 3.37Å; T1111-R1113 PolarHBondContact OG1-N 3.15Å; T1111-R1113 VanDerWaalsContact OG1-N 3.12Å; R1113-E1115 HydrophobicContact CB-CG 4.45Å; R1113-E1115 IonicContact NH1-OE1 2.74Å; R1113-E1115 PolarHBondContact NH1-OE1 3.09Å; R1113-E1115 PolarHBondContact O-N 2.92Å; R1113-I1116 HydrophobicContact CB-CB 4.37Å; R1113-I1116 HydrophobicContact CB-CD1 3.94Å; R1113-I1116 HydrophobicContact CB-CG1 3.93Å; R1113-I1116 HydrophobicContact CG-CD1 4.43Å; R1113-I1116 PolarHBondContact O-N 3Å; R1113-G1117 PolarHBondContact O-N 3.25Å
1114	R	82.7	Confident	87.8	Confident	129 Å²	129	34.9 Å²	34.9	49%	0.487	16%	0.162	S	C	.	.	H	α-helix	trans	-58	-38.7	179.2	174.8	175.6	179.8	-171	1.1	111.9	V1096 Y1108 I1116 G1117 L1118	V1096-R1114 HydrophobicContact CG1-CG 4.42Å; V1096-R1114 HydrophobicContact CG2-CB 3.94Å; V1096-R1114 HydrophobicContact CG2-CG 3.67Å; Y1108-R1114 HydrophobicContact CD2-CB 4.38Å; Y1108-R1114 HydrophobicContact CE2-CB 4.15Å; R1114-I1116 VanDerWaalsContact C-N 3.28Å; R1114-I1116 PolarHBondContact O-N 2.96Å; R1114-G1117 PolarHBondContact O-N 3.28Å; R1114-L1118 HydrophobicContact CG-CD1 3.91Å; R1114-L1118 HydrophobicContact CG-CG 4.25Å; R1114-L1118 WeakPolarHBondContact O-CG 3.19Å; R1114-L1118 PolarHBondContact O-N 2.94Å; R1114-L1118 VanDerWaalsContact O-N 3.07Å
1115	E	86.2	Confident	88	Confident	69 Å²	69	40 Å²	40	32%	0.322	18%	0.181	S	C	.	.	H	α-helix	trans	-63.1	-32.4	-178.3	64.1	-84.7	-164.9	0	0	113.1	R950 R1113 D1119	R950-E1115 PolarHBondContact NH1-O 2.84Å; R1113-E1115 HydrophobicContact CB-CG 4.45Å; R1113-E1115 IonicContact NH1-OE1 2.74Å; R1113-E1115 PolarHBondContact NH1-OE1 3.09Å; R1113-E1115 PolarHBondContact O-N 2.92Å; E1115-D1119 VanDerWaalsContact O-CG 3.3Å; E1115-D1119 PolarHBondContact O-N 3.2Å; E1115-D1119 VanDerWaalsContact O-N 3.12Å
1116	I	87.4	Confident	88.3	Confident	48 Å²	48	40.9 Å²	40.9	25%	0.246	18%	0.184	C	C	.	.	H	α-helix	trans	-73.1	-48.4	178.8	-60.5	-178	0	0	0	109.9	D1107 T1111 R1113 R1114 L1118 D1119 T1120	D1107-I1116 HydrophobicContact CB-CG2 4.28Å; T1111-I1116 HydrophobicContact CG2-CD1 3.89Å; T1111-I1116 HydrophobicContact CG2-CG2 4.31Å; R1113-I1116 HydrophobicContact CB-CB 4.37Å; R1113-I1116 HydrophobicContact CB-CD1 3.94Å; R1113-I1116 HydrophobicContact CB-CG1 3.93Å; R1113-I1116 HydrophobicContact CG-CD1 4.43Å; R1113-I1116 PolarHBondContact O-N 3Å; R1114-I1116 VanDerWaalsContact C-N 3.28Å; R1114-I1116 PolarHBondContact O-N 2.96Å; I1116-L1118 VanDerWaalsContact C-N 3.3Å; I1116-L1118 PolarHBondContact O-N 2.94Å; I1116-D1119 WeakPolarHBondContact O-CB 3.38Å; I1116-D1119 PolarHBondContact O-N 3.26Å; I1116-D1119 VanDerWaalsContact O-N 3.17Å; I1116-T1120 PolarHBondContact O-N 3.33Å; I1116-T1120 PolarHBondContact O-OG1 3.4Å
1117	G	87.5	Confident	88.7	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-58.6	-40.5	177	0	0	0	0	0	113	C1104 R1113 R1114 T1120 L1121	C1104-G1117 VanDerWaalsContact SG-C 3.58Å; C1104-G1117 PolarHBondContact SG-O 2.91Å; R1113-G1117 PolarHBondContact O-N 3.25Å; R1114-G1117 PolarHBondContact O-N 3.28Å; G1117-T1120 PolarHBondContact O-N 2.8Å; G1117-L1121 PolarHBondContact O-N 3.05Å
1118	L	89.7	Confident	88.9	Confident	62 Å²	62	43.8 Å²	43.8	33%	0.325	20%	0.198	S	C	.	.	H	α-helix	trans	-68.3	-36.7	176.7	-70.1	179.8	0	0	0	113.4	R1114 I1116 T1120 L1121 M1122	R1114-L1118 HydrophobicContact CG-CD1 3.91Å; R1114-L1118 HydrophobicContact CG-CG 4.25Å; R1114-L1118 WeakPolarHBondContact O-CG 3.19Å; R1114-L1118 PolarHBondContact O-N 2.94Å; R1114-L1118 VanDerWaalsContact O-N 3.07Å; I1116-L1118 VanDerWaalsContact C-N 3.3Å; I1116-L1118 PolarHBondContact O-N 2.94Å; L1118-T1120 VanDerWaalsContact C-N 3.33Å; L1118-L1121 PolarHBondContact O-N 3.14Å; L1118-M1122 WeakPolarHBondContact O-CB 3.22Å; L1118-M1122 PolarHBondContact O-N 3.03Å
1119	D	90.8	Very high	89.4	Confident	38 Å²	38	47.1 Å²	47.1	20%	0.203	21%	0.214	C	C	.	.	H	α-helix	trans	-61.7	-45	172.6	-78.7	7.2	0	0	0	110.4	R950 E1115 I1116 L1121 M1122 N1123	R950-D1119 IonicContact CZ-OD2 2.89Å; R950-D1119 IonicContact NH1-OD1 3.48Å; R950-D1119 PolarHBondContact NH1-OD1 3.34Å; R950-D1119 IonicContact NH1-OD2 2.57Å; R950-D1119 PolarHBondContact NH1-OD2 3.02Å; E1115-D1119 VanDerWaalsContact O-CG 3.3Å; E1115-D1119 PolarHBondContact O-N 3.2Å; E1115-D1119 VanDerWaalsContact O-N 3.12Å; I1116-D1119 WeakPolarHBondContact O-CB 3.38Å; I1116-D1119 PolarHBondContact O-N 3.26Å; I1116-D1119 VanDerWaalsContact O-N 3.17Å; D1119-L1121 PolarHBondContact O-N 3.46Å; D1119-M1122 PolarHBondContact O-N 2.98Å; D1119-N1123 WeakPolarHBondContact O-CB 3.48Å; D1119-N1123 PolarHBondContact O-N 3.09Å; D1119-N1123 PolarHBondContact O-ND2 2.86Å
1120	T	93.1	Very high	90	Very high	4 Å²	4	48 Å²	48	3%	0.025	22%	0.218	C	C	.	.	H	α-helix	trans	-59.8	-45.9	177.5	-63.9	0	0	0	0	111.5	Y812 P1103 D1107 I1116 G1117 L1118 M1122 N1123 E1124	Y812-T1120 HydrophobicContact CD2-CG2 3.9Å; Y812-T1120 HydrophobicContact CE2-CG2 3.73Å; P1103-T1120 HydrophobicContact CB-CG2 3.78Å; D1107-T1120 VanDerWaalsContact OD2-CB 3.31Å; D1107-T1120 WeakPolarHBondContact OD2-CB 2.97Å; D1107-T1120 VanDerWaalsContact OD2-CG2 3.29Å; D1107-T1120 WeakPolarHBondContact OD2-CG2 3.44Å; D1107-T1120 PolarHBondContact OD2-OG1 3.29Å; I1116-T1120 PolarHBondContact O-N 3.33Å; I1116-T1120 PolarHBondContact O-OG1 3.4Å; G1117-T1120 PolarHBondContact O-N 2.8Å; L1118-T1120 VanDerWaalsContact C-N 3.33Å; T1120-M1122 VanDerWaalsContact C-N 3.33Å; T1120-M1122 PolarHBondContact O-N 2.86Å; T1120-N1123 PolarHBondContact O-N 3.4Å; T1120-E1124 VanDerWaalsContact O-CB 3.3Å; T1120-E1124 WeakPolarHBondContact O-CB 3.14Å; T1120-E1124 PolarHBondContact O-N 3Å
1121	L	93.2	Very high	90.6	Very high	10 Å²	10	48.5 Å²	48.5	5%	0.052	22%	0.22	C	C	.	.	H	α-helix	trans	-58	-44.1	174.4	179.9	61.2	0	0	0	112.5	S1101 C1104 G1117 L1118 D1119 R1125	S1101-L1121 VanDerWaalsContact CB-CD1 3.46Å; C1104-L1121 HydrophobicContact CB-CB 3.98Å; G1117-L1121 PolarHBondContact O-N 3.05Å; L1118-L1121 PolarHBondContact O-N 3.14Å; D1119-L1121 PolarHBondContact O-N 3.46Å; L1121-R1125 HydrophobicContact CD1-CG 4.47Å; L1121-R1125 WeakPolarHBondContact O-CG 3.48Å; L1121-R1125 PolarHBondContact O-N 3.24Å; L1121-R1125 VanDerWaalsContact O-N 3.12Å
1122	M	93.1	Very high	91.2	Very high	112 Å²	112	55.2 Å²	55.2	55%	0.552	24%	0.244	S	C	*	.	H	α-helix	trans	-66.6	-44.1	-179.8	179.2	-174	72.2	0	0	111.4	L1118 D1119 T1120 R1125 K1126	L1118-M1122 WeakPolarHBondContact O-CB 3.22Å; L1118-M1122 PolarHBondContact O-N 3.03Å; D1119-M1122 PolarHBondContact O-N 2.98Å; T1120-M1122 VanDerWaalsContact C-N 3.33Å; T1120-M1122 PolarHBondContact O-N 2.86Å; M1122-R1125 PolarHBondContact O-N 2.94Å; M1122-K1126 VanDerWaalsContact O-CB 3.26Å; M1122-K1126 WeakPolarHBondContact O-CB 3.44Å; M1122-K1126 PolarHBondContact O-N 2.89Å
1123	N	94.7	Very high	92	Very high	14 Å²	14	57 Å²	57	8%	0.075	25%	0.253	C	S	.	.	H	α-helix	trans	-64.1	-43.2	178.3	-69.3	-37.1	0	0	0	111.5	Y812 N954 D1119 T1120 K1126 F1127	Y812-N1123 HydrophobicContact CD2-CB 4.45Å; N954-N1123 VanDerWaalsContact ND2-CG 3.34Å; N954-N1123 PolarHBondContact ND2-ND2 3.12Å; D1119-N1123 WeakPolarHBondContact O-CB 3.48Å; D1119-N1123 PolarHBondContact O-N 3.09Å; D1119-N1123 PolarHBondContact O-ND2 2.86Å; T1120-N1123 PolarHBondContact O-N 3.4Å; N1123-K1126 PolarHBondContact O-N 3.32Å; N1123-F1127 WeakPolarHBondContact O-CB 3.33Å; N1123-F1127 PolarHBondContact O-N 3.08Å
1124	E	95.1	Very high	92.5	Very high	6 Å²	6	52.5 Å²	52.5	3%	0.028	24%	0.236	C	C	.	.	H	α-helix	trans	-55.7	-55.5	174.8	-179.7	178.7	-120.9	0	0	111.4	Y812 R824 S1101 P1103 T1120 K1126 F1127 E1128	Y812-E1124 HydrophobicContact CE2-CB 3.72Å; Y812-E1124 HydrophobicContact CE2-CG 4.31Å; Y812-E1124 PolarHBondContact OH-OE1 3.09Å; Y812-E1124 VanDerWaalsContact OH-OE1 3.04Å; R824-E1124 IonicContact CZ-OE1 3.6Å; R824-E1124 IonicContact NH2-OE1 2.71Å; R824-E1124 PolarHBondContact NH2-OE1 3Å; R824-E1124 IonicContact NH2-OE2 3.02Å; S1101-E1124 WeakPolarHBondContact CB-OE2 3.38Å; S1101-E1124 PolarHBondContact OG-OE2 3.12Å; P1103-E1124 VanDerWaalsContact CG-OE1 3.31Å; P1103-E1124 WeakPolarHBondContact CG-OE1 3.45Å; T1120-E1124 VanDerWaalsContact O-CB 3.3Å; T1120-E1124 WeakPolarHBondContact O-CB 3.14Å; T1120-E1124 PolarHBondContact O-N 3Å; E1124-K1126 PolarHBondContact O-N 2.84Å; E1124-F1127 PolarHBondContact O-N 2.89Å; E1124-E1128 WeakPolarHBondContact O-CG 3.5Å; E1124-E1128 PolarHBondContact O-N 2.77Å
1125	R	95.2	Very high	93.1	Very high	106 Å²	106	48.8 Å²	48.8	40%	0.4	22%	0.224	S	C	.	.	H	α-helix	trans	-63.4	-42	-178.3	-72.1	176.7	177.3	-167	-4.9	113	L1121 M1122 F1127 E1128 E1129	L1121-R1125 HydrophobicContact CD1-CG 4.47Å; L1121-R1125 WeakPolarHBondContact O-CG 3.48Å; L1121-R1125 PolarHBondContact O-N 3.24Å; L1121-R1125 VanDerWaalsContact O-N 3.12Å; M1122-R1125 PolarHBondContact O-N 2.94Å; R1125-F1127 VanDerWaalsContact C-N 3.28Å; R1125-F1127 PolarHBondContact O-N 3.06Å; R1125-E1128 PolarHBondContact O-N 2.83Å; R1125-E1129 PolarHBondContact O-N 3.2Å; R1125-E1129 VanDerWaalsContact O-N 3.09Å
1126	K	94.7	Very high	93.4	Very high	84 Å²	84	51.7 Å²	51.7	37%	0.365	24%	0.236	S	C	.	.	H	α-helix	trans	-57.9	-46	175.6	179	-171.3	170.7	-160.6	0	109.8	E947 M1122 N1123 E1124 L1130	E947-K1126 VanDerWaalsContact CD-NZ 3.27Å; E947-K1126 IonicContact OE1-NZ 2.73Å; E947-K1126 PolarHBondContact OE1-NZ 3.2Å; E947-K1126 IonicContact OE2-NZ 3.21Å; E947-K1126 PolarHBondContact OE2-NZ 3.33Å; M1122-K1126 VanDerWaalsContact O-CB 3.26Å; M1122-K1126 WeakPolarHBondContact O-CB 3.44Å; M1122-K1126 PolarHBondContact O-N 2.89Å; N1123-K1126 PolarHBondContact O-N 3.32Å; E1124-K1126 PolarHBondContact O-N 2.84Å; K1126-L1130 HydrophobicContact CG-CD1 4.09Å; K1126-L1130 WeakPolarHBondContact O-CB 3.32Å; K1126-L1130 WeakPolarHBondContact O-CD1 3.46Å; K1126-L1130 VanDerWaalsContact O-CG 3.22Å; K1126-L1130 WeakPolarHBondContact O-CG 3.29Å; K1126-L1130 PolarHBondContact O-N 3.11Å; K1126-L1130 VanDerWaalsContact O-N 3.11Å
1127	F	95.8	Very high	93.4	Very high	3 Å²	3	57.2 Å²	57.2	1%	0.013	26%	0.258	C	S	.	.	H	α-helix	trans	-68.1	-43.8	178.9	178.9	-97.7	0	0	0	112.9	V808 Y810 I818 M956 N1123 E1124 R1125 E1129 L1130 K1131	V808-F1127 HydrophobicContact CB-CE2 4.16Å; V808-F1127 HydrophobicContact CB-CZ 4.24Å; V808-F1127 HydrophobicContact CG2-CE2 3.86Å; V808-F1127 HydrophobicContact CG2-CZ 3.79Å; Y810-F1127 VanDerWaalsContact CB-CZ 3.45Å; Y810-F1127 HydrophobicContact CD1-CB 3.59Å; Y810-F1127 AromaticContact CD1-CD1 3.76Å; Y810-F1127 HydrophobicContact CD1-CD1 3.76Å; Y810-F1127 AromaticContact CD1-CD2 3.72Å; Y810-F1127 HydrophobicContact CD1-CD2 3.72Å; Y810-F1127 HydrophobicContact CD1-CE1 4.4Å; Y810-F1127 HydrophobicContact CD1-CE2 4.41Å; Y810-F1127 AromaticContact CD1-CG 3.36Å; Y810-F1127 HydrophobicContact CD1-CG 3.36Å; Y810-F1127 AromaticContact CD2-CD2 4Å; Y810-F1127 HydrophobicContact CD2-CD2 4Å; Y810-F1127 HydrophobicContact CD2-CE2 4.34Å; Y810-F1127 HydrophobicContact CD2-CG 4.48Å; Y810-F1127 HydrophobicContact CE1-CB 3.59Å; Y810-F1127 HydrophobicContact CE1-CD2 4.27Å; Y810-F1127 AromaticContact CE1-CG 3.9Å; Y810-F1127 HydrophobicContact CE1-CG 3.9Å; Y810-F1127 HydrophobicContact CG-CB 4.33Å; Y810-F1127 HydrophobicContact CG-CD1 4.11Å; Y810-F1127 AromaticContact CG-CD2 3.57Å; Y810-F1127 HydrophobicContact CG-CD2 3.57Å; Y810-F1127 HydrophobicContact CG-CE1 4.34Å; Y810-F1127 AromaticContact CG-CE2 3.89Å; Y810-F1127 HydrophobicContact CG-CE2 3.89Å; Y810-F1127 AromaticContact CG-CG 3.71Å; Y810-F1127 HydrophobicContact CG-CG 3.71Å; Y810-F1127 HydrophobicContact CG-CZ 4.26Å; I818-F1127 HydrophobicContact CB-CE1 3.93Å; I818-F1127 HydrophobicContact CD1-CD1 3.53Å; I818-F1127 HydrophobicContact CD1-CE1 3.83Å; I818-F1127 HydrophobicContact CG1-CE1 4.48Å; I818-F1127 HydrophobicContact CG2-CE1 3.83Å; M956-F1127 HydrophobicContact CE-CD2 3.39Å; M956-F1127 HydrophobicContact CE-CE2 3.56Å; M956-F1127 HydrophobicContact CG-CE2 4.04Å; M956-F1127 HydrophobicContact SD-CE2 4.45Å; N1123-F1127 WeakPolarHBondContact O-CB 3.33Å; N1123-F1127 PolarHBondContact O-N 3.08Å; E1124-F1127 PolarHBondContact O-N 2.89Å; R1125-F1127 VanDerWaalsContact C-N 3.28Å; R1125-F1127 PolarHBondContact O-N 3.06Å; F1127-E1129 VanDerWaalsContact C-N 3.3Å; F1127-E1129 PolarHBondContact O-N 2.86Å; F1127-L1130 PolarHBondContact O-N 3.02Å; F1127-K1131 HydrophobicContact CE1-CB 4.21Å; F1127-K1131 HydrophobicContact CE1-CD 3.81Å; F1127-K1131 HydrophobicContact CZ-CB 4.25Å; F1127-K1131 HydrophobicContact CZ-CD 4Å; F1127-K1131 WeakPolarHBondContact O-CB 3.49Å; F1127-K1131 PolarHBondContact O-N 2.86Å
1128	E	94.8	Very high	93.5	Very high	75 Å²	75	58.7 Å²	58.7	35%	0.35	27%	0.267	S	S	.	.	H	α-helix	trans	-57.7	-44.3	178.9	-76.6	-178.1	163.6	0	0	111.7	R824 E1124 R1125 K1131 R1132	R824-E1128 IonicContact CZ-OE1 3.69Å; R824-E1128 IonicContact NH1-OE1 3.59Å; R824-E1128 PolarHBondContact NH1-OE1 3.09Å; R824-E1128 IonicContact NH2-OE1 2.91Å; R824-E1128 PolarHBondContact NH2-OE1 3.01Å; E1124-E1128 WeakPolarHBondContact O-CG 3.5Å; E1124-E1128 PolarHBondContact O-N 2.77Å; R1125-E1128 PolarHBondContact O-N 2.83Å; E1128-K1131 PolarHBondContact O-N 3.45Å; E1128-R1132 VanDerWaalsContact O-CB 3.27Å; E1128-R1132 WeakPolarHBondContact O-CB 3.1Å; E1128-R1132 PolarHBondContact O-N 3.04Å
1129	E	95.5	Very high	93.5	Very high	88 Å²	88	59.6 Å²	59.6	41%	0.411	27%	0.271	S	S	.	.	H	α-helix	trans	-68	-43.1	178	-176.2	63.4	176.5	0	0	111.8	R1125 F1127 K1131 R1132 L1133	R1125-E1129 PolarHBondContact O-N 3.2Å; R1125-E1129 VanDerWaalsContact O-N 3.09Å; F1127-E1129 VanDerWaalsContact C-N 3.3Å; F1127-E1129 PolarHBondContact O-N 2.86Å; E1129-K1131 PolarHBondContact O-N 2.89Å; E1129-R1132 PolarHBondContact O-N 2.73Å; E1129-R1132 IonicContact OE1-CZ 2.83Å; E1129-R1132 IonicContact OE1-NE 2.85Å; E1129-R1132 IonicContact OE1-NH2 3.66Å; E1129-R1132 PolarHBondContact OE1-NH2 2.77Å; E1129-R1132 IonicContact OE2-CZ 3.71Å; E1129-R1132 IonicContact OE2-NE 2.82Å; E1129-R1132 PolarHBondContact OE2-NE 2.88Å; E1129-R1132 IonicContact OE2-NH2 3.86Å; E1129-R1132 PolarHBondContact OE2-NH2 2.86Å; E1129-L1133 HydrophobicContact CG-CD1 4.07Å; E1129-L1133 PolarHBondContact O-N 2.78Å; E1129-L1133 WeakPolarHBondContact OE1-CD1 3.44Å
1130	L	94.6	Very high	93.5	Very high	43 Å²	43	58.1 Å²	58.1	23%	0.225	26%	0.264	C	S	.	.	H	α-helix	trans	-58.8	-45.9	174.8	-76.3	170.2	0	0	0	111.7	V676 M956 K1126 F1127 G1134	V676-L1130 HydrophobicContact CG2-CB 4.2Å; V676-L1130 HydrophobicContact CG2-CD2 4.23Å; M956-L1130 HydrophobicContact CE-CD1 4.18Å; K1126-L1130 HydrophobicContact CG-CD1 4.09Å; K1126-L1130 WeakPolarHBondContact O-CB 3.32Å; K1126-L1130 WeakPolarHBondContact O-CD1 3.46Å; K1126-L1130 VanDerWaalsContact O-CG 3.22Å; K1126-L1130 WeakPolarHBondContact O-CG 3.29Å; K1126-L1130 PolarHBondContact O-N 3.11Å; K1126-L1130 VanDerWaalsContact O-N 3.11Å; F1127-L1130 PolarHBondContact O-N 3.02Å; L1130-G1134 WeakPolarHBondContact O-CA 3.32Å; L1130-G1134 PolarHBondContact O-N 3.04Å
1131	K	95.6	Very high	93.3	Very high	24 Å²	24	58.8 Å²	58.8	10%	0.104	27%	0.268	C	S	.	.	H	α-helix	trans	-63.9	-46.1	178	-173.2	175.3	176.8	74.8	0	111	V808 Y820 F1127 E1128 E1129 L1133 E1135	V808-K1131 HydrophobicContact CG2-CB 4.06Å; V808-K1131 HydrophobicContact CG2-CD 4.34Å; V808-K1131 HydrophobicContact CG2-CG 3.85Å; V808-K1131 PolarHBondContact O-NZ 3.14Å; Y820-K1131 PolarHBondContact O-NZ 3.28Å; F1127-K1131 HydrophobicContact CE1-CB 4.21Å; F1127-K1131 HydrophobicContact CE1-CD 3.81Å; F1127-K1131 HydrophobicContact CZ-CB 4.25Å; F1127-K1131 HydrophobicContact CZ-CD 4Å; F1127-K1131 WeakPolarHBondContact O-CB 3.49Å; F1127-K1131 PolarHBondContact O-N 2.86Å; E1128-K1131 PolarHBondContact O-N 3.45Å; E1129-K1131 PolarHBondContact O-N 2.89Å; K1131-L1133 PolarHBondContact O-N 3.16Å; K1131-E1135 WeakPolarHBondContact CE-OE2 3.48Å; K1131-E1135 VanDerWaalsContact CG-CD 3.47Å; K1131-E1135 HydrophobicContact CG-CG 4.09Å; K1131-E1135 WeakPolarHBondContact CG-OE2 3.13Å; K1131-E1135 VanDerWaalsContact NZ-CD 3.27Å; K1131-E1135 IonicContact NZ-OE1 3.72Å; K1131-E1135 PolarHBondContact NZ-OE1 3.01Å; K1131-E1135 IonicContact NZ-OE2 3.77Å; K1131-E1135 PolarHBondContact NZ-OE2 2.92Å; K1131-E1135 VanDerWaalsContact NZ-OE2 3.07Å; K1131-E1135 VanDerWaalsContact O-CB 3.31Å; K1131-E1135 WeakPolarHBondContact O-CB 3.1Å; K1131-E1135 WeakPolarHBondContact O-CG 3.4Å; K1131-E1135 PolarHBondContact O-N 3.28Å
1132	R	95.7	Very high	93	Very high	146 Å²	146	58.4 Å²	58.4	55%	0.551	27%	0.267	S	S	*	.	H	α-helix	trans	-60.4	-42.2	-179.3	-172.1	-171.4	69.6	76.2	-2.7	112.6	E1128 E1129	E1128-R1132 VanDerWaalsContact O-CB 3.27Å; E1128-R1132 WeakPolarHBondContact O-CB 3.1Å; E1128-R1132 PolarHBondContact O-N 3.04Å; E1129-R1132 PolarHBondContact O-N 2.73Å; E1129-R1132 IonicContact OE1-CZ 2.83Å; E1129-R1132 IonicContact OE1-NE 2.85Å; E1129-R1132 IonicContact OE1-NH2 3.66Å; E1129-R1132 PolarHBondContact OE1-NH2 2.77Å; E1129-R1132 IonicContact OE2-CZ 3.71Å; E1129-R1132 IonicContact OE2-NE 2.82Å; E1129-R1132 PolarHBondContact OE2-NE 2.88Å; E1129-R1132 IonicContact OE2-NH2 3.86Å; E1129-R1132 PolarHBondContact OE2-NH2 2.86Å
1133	L	94.5	Very high	92.6	Very high	41 Å²	41	54.6 Å²	54.6	22%	0.215	25%	0.251	C	S	.	.	H	α-helix	trans	-81.8	-44.1	179.7	-67.5	176.7	0	0	0	112.1	D672 E1129 K1131 K1136	D672-L1133 HydrophobicContact CB-CB 3.7Å; E1129-L1133 HydrophobicContact CG-CD1 4.07Å; E1129-L1133 PolarHBondContact O-N 2.78Å; E1129-L1133 WeakPolarHBondContact OE1-CD1 3.44Å; K1131-L1133 PolarHBondContact O-N 3.16Å; L1133-K1136 VanDerWaalsContact O-CB 3.31Å; L1133-K1136 WeakPolarHBondContact O-CB 3.23Å; L1133-K1136 PolarHBondContact O-N 2.81Å
1134	G	93.1	Very high	92.1	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-72.6	-32.6	-175.2	0	0	0	0	0	114.6	Q673 P805 L1130 K1136	Q673-G1134 WeakPolarHBondContact CG-O 3.35Å; P805-G1134 WeakPolarHBondContact CB-O 3.33Å; L1130-G1134 WeakPolarHBondContact O-CA 3.32Å; L1130-G1134 PolarHBondContact O-N 3.04Å; G1134-K1136 VanDerWaalsContact C-N 3.32Å
1135	E	94.4	Very high	91.3	Very high	51 Å²	51	59.3 Å²	59.3	24%	0.238	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-0.2	177.5	-61	-173.5	168.5	0	0	113.1	A807 V808 K1131 K1137	A807-E1135 WeakPolarHBondContact CA-OE1 3.43Å; V808-E1135 HydrophobicContact CG2-CG 4.38Å; V808-E1135 VanDerWaalsContact CG2-OE1 3.3Å; V808-E1135 WeakPolarHBondContact CG2-OE1 3.39Å; V808-E1135 PolarHBondContact N-OE1 3.23Å; K1131-E1135 WeakPolarHBondContact CE-OE2 3.48Å; K1131-E1135 VanDerWaalsContact CG-CD 3.47Å; K1131-E1135 HydrophobicContact CG-CG 4.09Å; K1131-E1135 WeakPolarHBondContact CG-OE2 3.13Å; K1131-E1135 VanDerWaalsContact NZ-CD 3.27Å; K1131-E1135 IonicContact NZ-OE1 3.72Å; K1131-E1135 PolarHBondContact NZ-OE1 3.01Å; K1131-E1135 IonicContact NZ-OE2 3.77Å; K1131-E1135 PolarHBondContact NZ-OE2 2.92Å; K1131-E1135 VanDerWaalsContact NZ-OE2 3.07Å; K1131-E1135 VanDerWaalsContact O-CB 3.31Å; K1131-E1135 WeakPolarHBondContact O-CB 3.1Å; K1131-E1135 WeakPolarHBondContact O-CG 3.4Å; K1131-E1135 PolarHBondContact O-N 3.28Å; E1135-K1137 PolarHBondContact O-N 3.01Å
1136	K	92.5	Very high	90.5	Very high	131 Å²	131	56.1 Å²	56.1	57%	0.57	26%	0.261	S	S	*	.			trans	-62	107.9	-177.9	-173.8	-177.4	177.6	-173	0	110.3	Q673 L1133 G1134 T1138	Q673-K1136 PolarHBondContact NE2-O 3.32Å; L1133-K1136 VanDerWaalsContact O-CB 3.31Å; L1133-K1136 WeakPolarHBondContact O-CB 3.23Å; L1133-K1136 PolarHBondContact O-N 2.81Å; G1134-K1136 VanDerWaalsContact C-N 3.32Å; K1136-T1138 PolarHBondContact O-N 3.02Å; K1136-T1138 PolarHBondContact O-OG1 3.22Å
1137	K	88.7	Confident	89.8	Confident	164 Å²	164	56.1 Å²	56.1	71%	0.713	27%	0.266	S	S	*	.			trans	-64.1	120.6	172.9	-67.2	179.4	-175.7	169.9	0	109	E1135	E1135-K1137 PolarHBondContact O-N 3.01Å
1138	T	88.9	Confident	88.9	Confident	31 Å²	31	61.2 Å²	61.2	19%	0.19	29%	0.292	C	S	.	.			trans	-121.1	132	-176.9	-56.5	0	0	0	0	108	C669 Q673 K1136 L1160	C669-T1138 HydrophobicContact CB-CG2 4.34Å; Q673-T1138 PolarHBondContact NE2-OG1 3.18Å; K1136-T1138 PolarHBondContact O-N 3.02Å; K1136-T1138 PolarHBondContact O-OG1 3.22Å; T1138-L1160 HydrophobicContact CG2-CB 4.36Å; T1138-L1160 HydrophobicContact CG2-CD1 3.6Å; T1138-L1160 HydrophobicContact CG2-CD2 3.58Å; T1138-L1160 HydrophobicContact CG2-CG 4.01Å
1139	I	89.9	Confident	88.1	Confident	80 Å²	80	58 Å²	58	41%	0.41	28%	0.279	S	S	.	.			trans	-96.1	131.9	176.1	-61.5	171.3	0	0	0	107.6	L1160 D1161	I1139-L1160 WeakPolarHBondContact O-CA 2.95Å; I1139-D1161 HydrophobicContact CB-CB 3.97Å; I1139-D1161 HydrophobicContact CG2-CB 4.25Å; I1139-D1161 PolarHBondContact O-N 3Å
1140	S	90.3	Very high	87.6	Confident	8 Å²	8	54 Å²	54	6%	0.056	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-121.4	137.9	176.7	-178.3	0	0	0	0	110.1	C800 Q801 G1142 Y1159	C800-S1140 VanDerWaalsContact SG-CB 3.5Å; Q801-S1140 WeakPolarHBondContact CG-O 3.3Å; S1140-G1142 VanDerWaalsContact C-N 3.28Å; S1140-G1142 PolarHBondContact OG-N 2.81Å; S1140-Y1159 CarbonylContact C-O 3.42Å; S1140-Y1159 WeakPolarHBondContact CA-O 3.35Å; S1140-Y1159 PolarHBondContact OG-O 2.88Å
1141	C	90	Very high	87.1	Confident	17 Å²	17	53 Å²	53	12%	0.115	26%	0.255	C	S	.	.			trans	-85	-3.8	170.8	-64.8	0	0	0	0	112.9	Y1159 C1183 G1186 T1187 W1188	C1141-Y1159 PolarHBondContact N-O 2.74Å; C1141-C1183 HydrophobicContact CB-CB 3.84Å; C1141-C1183 WeakPolarHBondContact CB-SG 3.43Å; C1141-C1183 PolarHBondContact N-SG 2.76Å; C1141-C1183 WeakPolarHBondContact SG-CA 3.11Å; C1141-C1183 WeakPolarHBondContact SG-CB 3.3Å; C1141-C1183 CovalentContact SG-SG 2.01Å; C1141-C1183 PolarHBondContact SG-SG 3.16Å; C1141-G1186 WeakPolarHBondContact CA-O 3.32Å; C1141-G1186 WeakPolarHBondContact SG-CA 3.4Å; C1141-T1187 PolarHBondContact SG-N 3.26Å; C1141-T1187 PolarHBondContact SG-O 3.25Å; C1141-W1188 HydrophobicContact CB-CD2 3.95Å; C1141-W1188 HydrophobicContact CB-CG 4.05Å; C1141-W1188 HydrophobicContact CB-CZ2 3.75Å; C1141-W1188 PolarHBondContact O-NE1 2.84Å
1142	G	85.1	Confident	86.5	Confident	2 Å²	2	52.4 Å²	52.4	2%	0.021	25%	0.252	C	S	.	.			trans	77	166.3	-176.2	0	0	0	0	0	114.9	S1140 Y1159 W1188	S1140-G1142 VanDerWaalsContact C-N 3.28Å; S1140-G1142 PolarHBondContact OG-N 2.81Å; G1142-Y1159 WeakPolarHBondContact O-CB 3.4Å; G1142-Y1159 WeakPolarHBondContact O-CD1 3.39Å; G1142-Y1159 VanDerWaalsContact O-CG 3.31Å; G1142-W1188 PolarHBondContact O-NE1 3.44Å
1143	P	85.3	Confident	85.8	Confident	33 Å²	33	51.2 Å²	51.2	21%	0.214	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-69	141.7	-176.3	27.9	-33.7	0	0	0	113.3	F729 Q731 Y1159	F729-P1143 HydrophobicContact CD1-CB 3.74Å; F729-P1143 HydrophobicContact CD1-CG 3.81Å; F729-P1143 HydrophobicContact CE1-CB 4.08Å; F729-P1143 HydrophobicContact CE1-CG 3.87Å; F729-P1143 HydrophobicContact CG-CB 4.23Å; Q731-P1143 HydrophobicContact CB-CB 4.36Å; Q731-P1143 HydrophobicContact CG-CB 4.2Å; Q731-P1143 HydrophobicContact CG-CG 4.5Å; P1143-Y1159 VanDerWaalsContact CA-CD2 3.45Å; P1143-Y1159 VanDerWaalsContact CA-CZ 3.49Å; P1143-Y1159 HydrophobicContact CB-CD2 3.84Å; P1143-Y1159 HydrophobicContact CB-CE2 3.45Å; P1143-Y1159 VanDerWaalsContact CB-CE2 3.45Å
1144	L	83.8	Confident	85	Confident	10 Å²	10	51.8 Å²	51.8	5%	0.052	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-93.4	127.9	172.5	-71.5	173.7	0	0	0	109.6	Y1159 F1167 R1181 W1188 W1193	L1144-Y1159 HydrophobicContact CB-CE1 4.1Å; L1144-Y1159 HydrophobicContact CG-CE1 4.33Å; L1144-Y1159 VanDerWaalsContact N-CE1 3.35Å; L1144-F1167 HydrophobicContact CB-CZ 4.28Å; L1144-F1167 HydrophobicContact CD1-CE2 4.13Å; L1144-F1167 HydrophobicContact CD1-CZ 3.7Å; L1144-R1181 HydrophobicContact CD1-CB 3.99Å; L1144-R1181 HydrophobicContact CD1-CG 4.14Å; L1144-W1188 HydrophobicContact CD1-CD2 3.71Å; L1144-W1188 HydrophobicContact CD1-CE3 3.9Å; L1144-W1188 HydrophobicContact CD1-CG 4.24Å; L1144-W1188 HydrophobicContact CD1-CH2 4.34Å; L1144-W1188 HydrophobicContact CD1-CZ2 4.2Å; L1144-W1188 HydrophobicContact CD1-CZ3 4.18Å; L1144-W1188 HydrophobicContact CD2-CB 4.5Å; L1144-W1188 HydrophobicContact CD2-CD2 4.08Å; L1144-W1188 HydrophobicContact CD2-CG 3.78Å; L1144-W1188 HydrophobicContact CG-CD2 3.99Å; L1144-W1188 HydrophobicContact CG-CG 4.22Å; L1144-W1188 HydrophobicContact CG-CZ2 4.25Å; L1144-W1193 HydrophobicContact CB-CZ3 4.33Å; L1144-W1193 HydrophobicContact CD2-CH2 3.85Å; L1144-W1193 HydrophobicContact CD2-CZ3 3.95Å
1145	Q	78.4	Confident	83.8	Confident	108 Å²	108	56.1 Å²	56.1	51%	0.505	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-69.8	138.5	170.4	-72.1	-174	-16.2	0	0	110.2	W1193	Q1145-W1193 WeakPolarHBondContact O-CZ3 2.93Å
1146	K	79.5	Confident	82.5	Confident	39 Å²	39	54.3 Å²	54.3	17%	0.17	28%	0.278	C	S	.	.			trans	-117.3	144.1	177.2	65.3	-179.3	-176.2	172	0	110.8	Q731 D732 Y733 E734 V1150	Q731-K1146 WeakPolarHBondContact O-CE 3.2Å; D732-K1146 PolarHBondContact O-NZ 3.15Å; Y733-K1146 WeakPolarHBondContact O-CE 3.35Å; Y733-K1146 PolarHBondContact O-NZ 3.46Å; E734-K1146 IonicContact OE1-NZ 3.02Å; K1146-V1150 HydrophobicContact CB-CB 4.34Å; K1146-V1150 HydrophobicContact CB-CG1 4.44Å
1147	N	79	Confident	81.2	Confident	85 Å²	85	50.8 Å²	50.8	46%	0.455	27%	0.265	S	S	.	.			trans	-78.7	162.9	172.8	-69.5	-43.4	0	0	0	111	G1149 V1150 P1194 W1195	N1147-G1149 PolarHBondContact O-N 2.96Å; N1147-V1150 HydrophobicContact CB-CG2 4.17Å; N1147-V1150 WeakPolarHBondContact O-CB 3.41Å; N1147-V1150 WeakPolarHBondContact O-CG2 2.93Å; N1147-V1150 PolarHBondContact O-N 2.87Å; N1147-P1194 PolarHBondContact ND2-O 2.72Å; N1147-P1194 VanDerWaalsContact ND2-O 3.12Å; N1147-W1195 HydrophobicContact CB-CB 4.33Å
1148	I	77.3	Confident	80	Confident	110 Å²	110	43.4 Å²	43.4	56%	0.564	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	138.9	176.4	-58.1	177.2	0	0	0	110.2	F735 V1150	F735-I1148 HydrophobicContact CD2-CG1 4.24Å; F735-I1148 HydrophobicContact CD2-CG2 4.3Å; F735-I1148 HydrophobicContact CE2-CD1 4.37Å; F735-I1148 HydrophobicContact CE2-CG1 3.72Å; F735-I1148 HydrophobicContact CZ-CD1 4.34Å; F735-I1148 HydrophobicContact CZ-CG1 4.16Å; I1148-V1150 VanDerWaalsContact C-N 3.25Å; I1148-V1150 PolarHBondContact O-N 3.09Å
1149	G	78.4	Confident	79.7	Confident	7 Å²	7	41.9 Å²	41.9	7%	0.072	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.3	-12.3	-179.7	0	0	0	0	0	115.3	N1147 C1169 Q1170 C1196	N1147-G1149 PolarHBondContact O-N 2.96Å; G1149-C1169 WeakPolarHBondContact O-CA 3.42Å; G1149-Q1170 PolarHBondContact O-N 3.32Å; G1149-C1196 PolarHBondContact O-SG 3.25Å
1150	V	85.4	Confident	79.6	Confident	4 Å²	4	39 Å²	39	2%	0.024	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	128.5	176.9	-176.6	0	0	0	0	110	K1146 N1147 I1148 F1167 T1168 P1194 C1196	K1146-V1150 HydrophobicContact CB-CB 4.34Å; K1146-V1150 HydrophobicContact CB-CG1 4.44Å; N1147-V1150 HydrophobicContact CB-CG2 4.17Å; N1147-V1150 WeakPolarHBondContact O-CB 3.41Å; N1147-V1150 WeakPolarHBondContact O-CG2 2.93Å; N1147-V1150 PolarHBondContact O-N 2.87Å; I1148-V1150 VanDerWaalsContact C-N 3.25Å; I1148-V1150 PolarHBondContact O-N 3.09Å; V1150-F1167 HydrophobicContact CG1-CB 4.04Å; V1150-F1167 HydrophobicContact CG1-CD1 3.69Å; V1150-F1167 HydrophobicContact CG1-CG 4.29Å; V1150-T1168 CarbonylContact C-O 3.6Å; V1150-T1168 WeakPolarHBondContact CA-O 3.34Å; V1150-P1194 HydrophobicContact CG1-CB 4.39Å; V1150-P1194 HydrophobicContact CG1-CG 4.36Å; V1150-C1196 VanDerWaalsContact CA-SG 3.56Å; V1150-C1196 HydrophobicContact CG2-CB 4.34Å; V1150-C1196 WeakPolarHBondContact CG2-SG 3.5Å
1151	L	83.8	Confident	79.6	Confident	22 Å²	22	42.3 Å²	42.3	12%	0.115	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	143.9	173.6	-57.8	176.5	0	0	0	110	E734 Y1153 F1167 T1168 Q1170	E734-L1151 HydrophobicContact CG-CD2 4.3Å; E734-L1151 VanDerWaalsContact OE1-CD2 3.29Å; E734-L1151 WeakPolarHBondContact OE1-CD2 3.47Å; E734-L1151 VanDerWaalsContact OE2-CD2 3.26Å; E734-L1151 WeakPolarHBondContact OE2-CD2 3.39Å; L1151-Y1153 HydrophobicContact CB-CE2 4.18Å; L1151-F1167 WeakPolarHBondContact O-CA 3.45Å; L1151-T1168 PolarHBondContact N-O 3.32Å; L1151-T1168 PolarHBondContact O-N 3.42Å; L1151-Q1170 HydrophobicContact CD1-CG 4.04Å; L1151-Q1170 HydrophobicContact CD2-CG 3.98Å; L1151-Q1170 HydrophobicContact CG-CG 4.03Å
1152	K	82.2	Confident	79.5	Confident	12 Å²	12	44.2 Å²	44.2	5%	0.052	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	133.3	-176.5	-170	-166.6	101.6	-175	0	110.6	D732 P1154 N1158 Y1159 V1165 F1167	D732-K1152 WeakPolarHBondContact OD1-CD 3.26Å; D732-K1152 IonicContact OD1-NZ 3.53Å; D732-K1152 PolarHBondContact OD1-NZ 2.96Å; D732-K1152 IonicContact OD2-NZ 2.94Å; D732-K1152 PolarHBondContact OD2-NZ 3.3Å; K1152-P1154 WeakPolarHBondContact CE-O 3.27Å; K1152-N1158 PolarHBondContact NZ-OD1 3.24Å; K1152-Y1159 HydrophobicContact CD-CE1 4.33Å; K1152-Y1159 VanDerWaalsContact NZ-CZ 3.32Å; K1152-Y1159 PolarHBondContact NZ-OH 3.01Å; K1152-V1165 HydrophobicContact CD-CG1 3.88Å; K1152-V1165 HydrophobicContact CG-CG1 3.33Å; K1152-F1167 HydrophobicContact CG-CE1 4.24Å
1153	Y	82.3	Confident	79.7	Confident	120 Å²	120	44.9 Å²	44.9	47%	0.471	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	144.1	172.5	-69.5	-81.1	0	0	0	112.6	L1151 T1166 T1168	L1151-Y1153 HydrophobicContact CB-CE2 4.18Å; Y1153-T1166 PolarHBondContact N-O 3.27Å; Y1153-T1166 PolarHBondContact O-N 2.71Å; Y1153-T1168 WeakPolarHBondContact CE2-OG1 3.23Å
1154	P	77.8	Confident	79.9	Confident	54 Å²	54	45.9 Å²	45.9	35%	0.351	26%	0.259	S	S	.	.	S	Bend	cis	-65.8	156.2	-9.1	28.2	-34.2	0	0	0	112.5	K1152 G1156	K1152-P1154 WeakPolarHBondContact CE-O 3.27Å; P1154-G1156 VanDerWaalsContact C-N 3.28Å; P1154-G1156 WeakPolarHBondContact CB-O 3.49Å; P1154-G1156 WeakPolarHBondContact CG-O 3.35Å; P1154-G1156 PolarHBondContact O-N 3.31Å
1155	P	67.1	Low	80.1	Confident	91 Å²	91	45.5 Å²	45.5	59%	0.591	26%	0.257	S	S	*	.	S	Bend	trans	-68.8	-27	180	27.4	-34.5	0	0	0	112.8
1156	G	66.2	Low	80.6	Confident	12 Å²	12	41.9 Å²	41.9	12%	0.124	24%	0.242	C	C	.	.	S	Bend	trans	-122.9	-178.7	171.4	0	0	0	0	0	111.8	P1154	P1154-G1156 VanDerWaalsContact C-N 3.28Å; P1154-G1156 WeakPolarHBondContact CB-O 3.49Å; P1154-G1156 WeakPolarHBondContact CG-O 3.35Å; P1154-G1156 PolarHBondContact O-N 3.31Å
1157	N	65.2	Low	81	Confident	58 Å²	58	40.1 Å²	40.1	31%	0.31	24%	0.235	S	C	.	.	S	Bend	trans	72	65	-166.8	-167.4	15.8	0	0	0	113.3	W726	W726-N1157 VanDerWaalsContact CD1-N 3.34Å; W726-N1157 HydrophobicContact CD2-CB 4.39Å; W726-N1157 HydrophobicContact CZ2-CB 4.3Å
1158	N	65.2	Low	81.4	Confident	8 Å²	8	37.9 Å²	37.9	4%	0.043	22%	0.224	C	C	.	.			trans	-85.8	121.9	-157.9	-73.8	-39.7	0	0	0	115	L727 F729 K1152 L1160	L727-N1158 PolarHBondContact O-ND2 3.11Å; F729-N1158 HydrophobicContact CD2-CB 3.88Å; F729-N1158 HydrophobicContact CE2-CB 3.6Å; K1152-N1158 PolarHBondContact NZ-OD1 3.24Å; N1158-L1160 WeakPolarHBondContact O-CD2 3.35Å; N1158-L1160 WeakPolarHBondContact O-CG 3.24Å; N1158-L1160 PolarHBondContact O-N 3.07Å
1159	Y	81	Confident	81.9	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.204	C	C	.	.	S	Bend	trans	54.6	15.5	157.2	-50.9	-55.2	0	0	0	116.5	F729 D732 S1140 C1141 G1142 P1143 L1144 K1152 W1188	F729-Y1159 HydrophobicContact CB-CE2 4.29Å; F729-Y1159 HydrophobicContact CD1-CE2 4.4Å; F729-Y1159 AromaticContact CD2-CD2 3.77Å; F729-Y1159 HydrophobicContact CD2-CD2 3.77Å; F729-Y1159 AromaticContact CD2-CE2 3.65Å; F729-Y1159 HydrophobicContact CD2-CE2 3.65Å; F729-Y1159 HydrophobicContact CE1-CD2 4.45Å; F729-Y1159 AromaticContact CE2-CD2 3.65Å; F729-Y1159 HydrophobicContact CE2-CD2 3.65Å; F729-Y1159 HydrophobicContact CE2-CE2 4.06Å; F729-Y1159 HydrophobicContact CG-CD2 4.24Å; F729-Y1159 AromaticContact CG-CE2 3.85Å; F729-Y1159 HydrophobicContact CG-CE2 3.85Å; F729-Y1159 HydrophobicContact CZ-CD2 4Å; D732-Y1159 PolarHBondContact OD1-OH 2.79Å; S1140-Y1159 CarbonylContact C-O 3.42Å; S1140-Y1159 WeakPolarHBondContact CA-O 3.35Å; S1140-Y1159 PolarHBondContact OG-O 2.88Å; C1141-Y1159 PolarHBondContact N-O 2.74Å; G1142-Y1159 WeakPolarHBondContact O-CB 3.4Å; G1142-Y1159 WeakPolarHBondContact O-CD1 3.39Å; G1142-Y1159 VanDerWaalsContact O-CG 3.31Å; P1143-Y1159 VanDerWaalsContact CA-CD2 3.45Å; P1143-Y1159 VanDerWaalsContact CA-CZ 3.49Å; P1143-Y1159 HydrophobicContact CB-CD2 3.84Å; P1143-Y1159 HydrophobicContact CB-CE2 3.45Å; P1143-Y1159 VanDerWaalsContact CB-CE2 3.45Å; L1144-Y1159 HydrophobicContact CB-CE1 4.1Å; L1144-Y1159 HydrophobicContact CG-CE1 4.33Å; L1144-Y1159 VanDerWaalsContact N-CE1 3.35Å; K1152-Y1159 HydrophobicContact CD-CE1 4.33Å; K1152-Y1159 VanDerWaalsContact NZ-CZ 3.32Å; K1152-Y1159 PolarHBondContact NZ-OH 3.01Å; Y1159-W1188 AromaticContact CD1-CH2 3.78Å; Y1159-W1188 HydrophobicContact CD1-CH2 3.78Å; Y1159-W1188 AromaticContact CD1-CZ2 3.32Å; Y1159-W1188 HydrophobicContact CD1-CZ2 3.32Å; Y1159-W1188 HydrophobicContact CE1-CZ2 4.28Å; Y1159-W1188 AromaticContact CG-CZ2 3.98Å; Y1159-W1188 HydrophobicContact CG-CZ2 3.98Å
1160	L	88.8	Confident	82.2	Confident	19 Å²	19	35.6 Å²	35.6	10%	0.099	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-82.5	156.5	179	-55.5	-172.2	0	0	0	110.9	C669 W726 T1138 I1139 N1158 G1162 V1163 C1183	C669-L1160 HydrophobicContact CB-CD2 4.21Å; W726-L1160 HydrophobicContact CE3-CD1 4.15Å; W726-L1160 HydrophobicContact CH2-CD1 4.4Å; W726-L1160 HydrophobicContact CZ3-CD1 3.54Å; T1138-L1160 HydrophobicContact CG2-CB 4.36Å; T1138-L1160 HydrophobicContact CG2-CD1 3.6Å; T1138-L1160 HydrophobicContact CG2-CD2 3.58Å; T1138-L1160 HydrophobicContact CG2-CG 4.01Å; I1139-L1160 WeakPolarHBondContact O-CA 2.95Å; N1158-L1160 WeakPolarHBondContact O-CD2 3.35Å; N1158-L1160 WeakPolarHBondContact O-CG 3.24Å; N1158-L1160 PolarHBondContact O-N 3.07Å; L1160-G1162 PolarHBondContact O-N 3.01Å; L1160-V1163 HydrophobicContact CB-CG2 4.25Å; L1160-V1163 VanDerWaalsContact O-CB 3.29Å; L1160-V1163 WeakPolarHBondContact O-CB 3.41Å; L1160-V1163 WeakPolarHBondContact O-CG2 3.37Å; L1160-V1163 PolarHBondContact O-N 2.75Å; L1160-V1163 VanDerWaalsContact O-N 3.09Å; L1160-C1183 VanDerWaalsContact O-CB 3.31Å; L1160-C1183 WeakPolarHBondContact O-CB 3.46Å; L1160-C1183 PolarHBondContact O-SG 2.89Å
1161	D	89.5	Confident	82	Confident	77 Å²	77	40.6 Å²	40.6	41%	0.412	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	134.8	176.7	-170.9	46.2	0	0	0	112.5	I1139 V1163 C1183 I1184 N1185	I1139-D1161 HydrophobicContact CB-CB 3.97Å; I1139-D1161 HydrophobicContact CG2-CB 4.25Å; I1139-D1161 PolarHBondContact O-N 3Å; D1161-V1163 VanDerWaalsContact C-N 3.31Å; D1161-V1163 PolarHBondContact O-N 2.86Å; D1161-C1183 VanDerWaalsContact CA-SG 3.52Å; D1161-C1183 PolarHBondContact N-SG 3.4Å; D1161-I1184 WeakPolarHBondContact OD1-CA 3.2Å; D1161-N1185 PolarHBondContact OD1-N 3.4Å
1162	G	88.4	Confident	81.8	Confident	58 Å²	58	45 Å²	45	60%	0.598	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.7	-12.1	-175.3	0	0	0	0	0	115.4	L1160 C1183	L1160-G1162 PolarHBondContact O-N 3.01Å; G1162-C1183 PolarHBondContact N-O 3.1Å
1163	V	88.8	Confident	81.9	Confident	16 Å²	16	46 Å²	46	10%	0.097	27%	0.267	C	S	.	.			trans	-75.3	133.2	178.1	177.3	0	0	0	0	110.6	L1160 D1161 V1165 T1182 C1183	L1160-V1163 HydrophobicContact CB-CG2 4.25Å; L1160-V1163 VanDerWaalsContact O-CB 3.29Å; L1160-V1163 WeakPolarHBondContact O-CB 3.41Å; L1160-V1163 WeakPolarHBondContact O-CG2 3.37Å; L1160-V1163 PolarHBondContact O-N 2.75Å; L1160-V1163 VanDerWaalsContact O-N 3.09Å; D1161-V1163 VanDerWaalsContact C-N 3.31Å; D1161-V1163 PolarHBondContact O-N 2.86Å; V1163-V1165 HydrophobicContact CG1-CG2 4.33Å; V1163-T1182 WeakPolarHBondContact O-CA 3.4Å; V1163-C1183 PolarHBondContact O-N 2.67Å
1164	T	89.8	Confident	82	Confident	54 Å²	54	44.3 Å²	44.3	33%	0.331	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	118.9	169.1	-59.2	0	0	0	0	110	Q1180 R1181 T1182	T1164-Q1180 HydrophobicContact CG2-CB 4.16Å; T1164-Q1180 HydrophobicContact CG2-CG 4.45Å; T1164-R1181 CarbonylContact C-O 3.59Å; T1164-R1181 WeakPolarHBondContact CA-O 3.2Å; T1164-T1182 WeakPolarHBondContact CG2-OG1 3.45Å; T1164-T1182 VanDerWaalsContact OG1-CG2 3.32Å; T1164-T1182 WeakPolarHBondContact OG1-CG2 3.45Å; T1164-T1182 PolarHBondContact OG1-OG1 2.87Å
1165	V	88.1	Confident	82.4	Confident	2 Å²	2	43.8 Å²	43.8	1%	0.012	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	128	176.1	179.2	0	0	0	0	108.6	K1152 V1163 F1167 Q1180 R1181 W1188	K1152-V1165 HydrophobicContact CD-CG1 3.88Å; K1152-V1165 HydrophobicContact CG-CG1 3.33Å; V1163-V1165 HydrophobicContact CG1-CG2 4.33Å; V1165-F1167 HydrophobicContact CB-CE2 4.45Å; V1165-F1167 HydrophobicContact CG1-CD2 4.47Å; V1165-F1167 HydrophobicContact CG1-CE1 4.1Å; V1165-F1167 HydrophobicContact CG1-CE2 3.93Å; V1165-F1167 HydrophobicContact CG1-CZ 3.73Å; V1165-Q1180 WeakPolarHBondContact O-CA 3.24Å; V1165-R1181 PolarHBondContact N-O 2.99Å; V1165-R1181 PolarHBondContact O-N 2.77Å; V1165-W1188 HydrophobicContact CB-CZ3 4.5Å; V1165-W1188 HydrophobicContact CG2-CH2 3.74Å; V1165-W1188 HydrophobicContact CG2-CZ3 3.95Å
1166	T	89	Confident	83.3	Confident	32 Å²	32	41.5 Å²	41.5	20%	0.196	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	125.5	173.7	-57.1	0	0	0	0	109.5	Y1153 T1168 Q1179 Q1180	Y1153-T1166 PolarHBondContact N-O 3.27Å; Y1153-T1166 PolarHBondContact O-N 2.71Å; T1166-T1168 HydrophobicContact CG2-CG2 4.41Å; T1166-Q1179 CarbonylContact C-O 3.47Å; T1166-Q1179 WeakPolarHBondContact CA-O 3.33Å; T1166-Q1179 HydrophobicContact CG2-CG 4.04Å; T1166-Q1180 HydrophobicContact CG2-CG 4.2Å
1167	F	88.3	Confident	84.3	Confident	2 Å²	2	43 Å²	43	1%	0.009	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	136.9	174.1	-61.9	-80.1	0	0	0	110.1	L1144 V1150 L1151 K1152 V1165 L1175 Q1179 R1181 P1194	L1144-F1167 HydrophobicContact CB-CZ 4.28Å; L1144-F1167 HydrophobicContact CD1-CE2 4.13Å; L1144-F1167 HydrophobicContact CD1-CZ 3.7Å; V1150-F1167 HydrophobicContact CG1-CB 4.04Å; V1150-F1167 HydrophobicContact CG1-CD1 3.69Å; V1150-F1167 HydrophobicContact CG1-CG 4.29Å; L1151-F1167 WeakPolarHBondContact O-CA 3.45Å; K1152-F1167 HydrophobicContact CG-CE1 4.24Å; V1165-F1167 HydrophobicContact CB-CE2 4.45Å; V1165-F1167 HydrophobicContact CG1-CD2 4.47Å; V1165-F1167 HydrophobicContact CG1-CE1 4.1Å; V1165-F1167 HydrophobicContact CG1-CE2 3.93Å; V1165-F1167 HydrophobicContact CG1-CZ 3.73Å; F1167-L1175 WeakPolarHBondContact O-CD2 3.25Å; F1167-Q1179 PolarHBondContact N-O 2.79Å; F1167-Q1179 WeakPolarHBondContact O-CG 3.26Å; F1167-R1181 HydrophobicContact CD2-CG 4.39Å; F1167-R1181 HydrophobicContact CE2-CB 4.12Å; F1167-R1181 HydrophobicContact CE2-CG 3.64Å; F1167-P1194 HydrophobicContact CB-CB 3.84Å; F1167-P1194 HydrophobicContact CB-CG 3.88Å; F1167-P1194 HydrophobicContact CD1-CG 3.75Å; F1167-P1194 HydrophobicContact CD2-CB 4.42Å; F1167-P1194 HydrophobicContact CD2-CG 3.72Å; F1167-P1194 HydrophobicContact CE1-CG 4.17Å; F1167-P1194 HydrophobicContact CE2-CG 4.16Å; F1167-P1194 HydrophobicContact CG-CB 4.03Å; F1167-P1194 HydrophobicContact CG-CG 3.49Å; F1167-P1194 VanDerWaalsContact CG-CG 3.49Å; F1167-P1194 HydrophobicContact CZ-CG 4.36Å
1168	T	87.7	Confident	85.4	Confident	37 Å²	37	43.4 Å²	43.4	23%	0.227	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	172.1	173.8	57	0	0	0	0	108.4	V1150 L1151 Y1153 T1166	V1150-T1168 CarbonylContact C-O 3.6Å; V1150-T1168 WeakPolarHBondContact CA-O 3.34Å; L1151-T1168 PolarHBondContact N-O 3.32Å; L1151-T1168 PolarHBondContact O-N 3.42Å; Y1153-T1168 WeakPolarHBondContact CE2-OG1 3.23Å; T1166-T1168 HydrophobicContact CG2-CG2 4.41Å
1169	C	88	Confident	86.4	Confident	22 Å²	22	48 Å²	48	15%	0.149	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	157.3	172.1	-68.6	0	0	0	0	110.5	G1149 L1175 C1196	G1149-C1169 WeakPolarHBondContact O-CA 3.42Å; C1169-L1175 WeakPolarHBondContact SG-CA 3.18Å; C1169-L1175 VanDerWaalsContact SG-CB 3.53Å; C1169-L1175 VanDerWaalsContact SG-CD1 3.51Å; C1169-C1196 VanDerWaalsContact CA-SG 3.51Å; C1169-C1196 HydrophobicContact CB-CB 3.99Å; C1169-C1196 WeakPolarHBondContact CB-SG 3.35Å; C1169-C1196 VanDerWaalsContact SG-CA 3.56Å; C1169-C1196 WeakPolarHBondContact SG-CB 3.15Å; C1169-C1196 CovalentContact SG-SG 2.02Å; C1169-C1196 PolarHBondContact SG-SG 3.14Å
1170	Q	83.2	Confident	86.8	Confident	48 Å²	48	53.3 Å²	53.3	22%	0.224	30%	0.301	C	S	.	.			trans	-53.3	149.9	162.9	-71.1	176.6	-26.3	0	0	110.5	G1149 L1151 E1172 Y1173	G1149-Q1170 PolarHBondContact O-N 3.32Å; L1151-Q1170 HydrophobicContact CD1-CG 4.04Å; L1151-Q1170 HydrophobicContact CD2-CG 3.98Å; L1151-Q1170 HydrophobicContact CG-CG 4.03Å; Q1170-E1172 PolarHBondContact O-N 2.82Å; Q1170-Y1173 HydrophobicContact CB-CD2 3.85Å; Q1170-Y1173 HydrophobicContact CB-CE2 4.25Å; Q1170-Y1173 PolarHBondContact O-N 2.83Å
1171	P	81.5	Confident	86.8	Confident	108 Å²	108	53.3 Å²	53.3	70%	0.701	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-25	-170.7	-28.3	35.2	0	0	0	116.1	Y1173 R1199	P1171-Y1173 VanDerWaalsContact C-N 3.31Å; P1171-R1199 WeakPolarHBondContact O-CD 3.38Å; P1171-R1199 PolarHBondContact O-NE 2.86Å; P1171-R1199 PolarHBondContact O-NH1 3.43Å
1172	E	80.5	Confident	86.9	Confident	114 Å²	114	51.5 Å²	51.5	53%	0.533	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-9.2	-178.8	-66.1	155.1	-157.1	0	0	113.6	Q1170 W1198 R1199	Q1170-E1172 PolarHBondContact O-N 2.82Å; E1172-W1198 HydrophobicContact CB-CE3 4.5Å; E1172-W1198 HydrophobicContact CB-CZ3 4.21Å; E1172-R1199 VanDerWaalsContact O-CB 3.32Å; E1172-R1199 WeakPolarHBondContact O-CB 3.19Å; E1172-R1199 VanDerWaalsContact O-CG 3.27Å; E1172-R1199 WeakPolarHBondContact O-CG 3.3Å; E1172-R1199 PolarHBondContact O-N 3.21Å
1173	Y	83.7	Confident	87.1	Confident	35 Å²	35	48.7 Å²	48.7	14%	0.137	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	159.8	-173.2	-63.3	-103.2	0	0	0	112.5	Q1170 P1171 C1196 R1197 W1198	Q1170-Y1173 HydrophobicContact CB-CD2 3.85Å; Q1170-Y1173 HydrophobicContact CB-CE2 4.25Å; Q1170-Y1173 PolarHBondContact O-N 2.83Å; P1171-Y1173 VanDerWaalsContact C-N 3.31Å; Y1173-C1196 HydrophobicContact CD1-CB 3.91Å; Y1173-C1196 HydrophobicContact CG-CB 4.06Å; Y1173-R1197 CarbonylContact C-O 3.57Å; Y1173-R1197 WeakPolarHBondContact CA-O 3.25Å; Y1173-R1197 WeakPolarHBondContact CB-O 3.39Å; Y1173-W1198 HydrophobicContact CD1-CG 4.36Å; Y1173-W1198 AromaticContact CE1-CD1 3.74Å; Y1173-W1198 AromaticContact CE1-CD2 3.97Å; Y1173-W1198 HydrophobicContact CE1-CD2 3.97Å; Y1173-W1198 AromaticContact CE1-CE2 3.74Å; Y1173-W1198 AromaticContact CE1-CG 3.97Å; Y1173-W1198 HydrophobicContact CE1-CG 3.97Å; Y1173-W1198 HydrophobicContact CE1-CZ2 4.37Å; Y1173-W1198 AromaticContact CE1-NE1 3.56Å; Y1173-W1198 HydrophobicContact CE2-CZ2 4.48Å; Y1173-W1198 AromaticContact CZ-CE2 3.61Å; Y1173-W1198 AromaticContact CZ-CZ2 3.77Å; Y1173-W1198 AromaticContact CZ-NE1 3.84Å; Y1173-W1198 VanDerWaalsContact OH-CE2 3.29Å; Y1173-W1198 WeakPolarHBondContact OH-CZ2 3.24Å
1174	F	84.2	Confident	87.3	Confident	84 Å²	84	53 Å²	53	37%	0.368	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	131.1	172.8	-163.7	-91.8	0	0	0	109.7	H1176 C1196 R1197 R1199 E1202	F1174-H1176 AromaticContact CD1-NE2 3.77Å; F1174-C1196 WeakPolarHBondContact O-CA 2.93Å; F1174-R1197 PolarHBondContact N-O 2.99Å; F1174-R1197 PolarHBondContact O-N 2.92Å; F1174-R1199 HydrophobicContact CB-CG 4.49Å; F1174-E1202 HydrophobicContact CB-CB 4.39Å; F1174-E1202 HydrophobicContact CB-CG 4.11Å; F1174-E1202 HydrophobicContact CD1-CG 4.21Å; F1174-E1202 HydrophobicContact CG-CG 4.11Å
1175	L	86.1	Confident	87.2	Confident	42 Å²	42	56.4 Å²	56.4	22%	0.22	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	134.2	-178.3	-175.7	70.7	0	0	0	111.1	F1167 C1169 Q1179 P1194	F1167-L1175 WeakPolarHBondContact O-CD2 3.25Å; C1169-L1175 WeakPolarHBondContact SG-CA 3.18Å; C1169-L1175 VanDerWaalsContact SG-CB 3.53Å; C1169-L1175 VanDerWaalsContact SG-CD1 3.51Å; L1175-Q1179 HydrophobicContact CD2-CB 4.14Å; L1175-Q1179 HydrophobicContact CD2-CG 3.77Å; L1175-P1194 HydrophobicContact CD1-CB 4.06Å
1176	H	87.3	Confident	87.2	Confident	43 Å²	43	57.6 Å²	57.6	20%	0.199	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	153.3	170	-69.7	-83.9	0	0	0	110.1	F1174 P1194 W1195 E1202	F1174-H1176 AromaticContact CD1-NE2 3.77Å; H1176-P1194 VanDerWaalsContact O-CA 3.31Å; H1176-P1194 WeakPolarHBondContact O-CA 3.21Å; H1176-W1195 HydrophobicContact CB-CD2 3.85Å; H1176-W1195 HydrophobicContact CB-CE3 4.48Å; H1176-W1195 HydrophobicContact CB-CG 4.26Å; H1176-W1195 HydrophobicContact CB-CH2 4.08Å; H1176-W1195 HydrophobicContact CB-CZ2 3.41Å; H1176-W1195 VanDerWaalsContact CB-CZ2 3.41Å; H1176-W1195 AromaticContact CD2-CH2 3.38Å; H1176-W1195 WeakPolarHBondContact CD2-CH2 3.45Å; H1176-W1195 AromaticContact CD2-CZ2 3.66Å; H1176-W1195 AromaticContact CD2-CZ3 3.73Å; H1176-W1195 AromaticContact CG-CE2 3.85Å; H1176-W1195 AromaticContact CG-CH2 3.68Å; H1176-W1195 AromaticContact CG-CZ2 3.44Å; H1176-W1195 VanDerWaalsContact CG-CZ2 3.44Å; H1176-W1195 PolarHBondContact N-O 3.09Å; H1176-W1195 AromaticContact NE2-CH2 3.82Å; H1176-W1195 PolarHBondContact O-N 3.39Å; H1176-E1202 IonicContact CE1-OE1 3.35Å; H1176-E1202 PolarHBondContact CE1-OE1 2.76Å; H1176-E1202 IonicContact CE1-OE2 3.38Å; H1176-E1202 IonicContact NE2-OE1 3.73Å; H1176-E1202 IonicContact NE2-OE2 3.52Å; H1176-E1202 PolarHBondContact NE2-OE2 3.05Å
1177	G	86.5	Confident	87.3	Confident	43 Å²	43	60.9 Å²	60.9	44%	0.443	33%	0.333	S	S	.	.	S	Bend	trans	90.1	-170.2	-176	0	0	0	0	0	113
1178	D	87.2	Confident	87.4	Confident	67 Å²	67	62.5 Å²	62.5	36%	0.358	34%	0.34	S	S	.	.			trans	-78.6	126	-178	-69.6	-59.2	0	0	0	111.1	Q1180 G1191 W1192	D1178-Q1180 VanDerWaalsContact C-N 3.29Å; D1178-Q1180 PolarHBondContact O-N 2.87Å; D1178-G1191 WeakPolarHBondContact OD2-CA 3.14Å; D1178-W1192 PolarHBondContact OD2-N 2.98Å
1179	Q	86.7	Confident	87.6	Confident	104 Å²	104	62 Å²	62	49%	0.486	34%	0.337	S	S	.	.	S	Bend	trans	-72.3	-23.6	-176.5	-165.3	-178.6	-14	0	0	112.6	T1166 F1167 L1175	T1166-Q1179 CarbonylContact C-O 3.47Å; T1166-Q1179 WeakPolarHBondContact CA-O 3.33Å; T1166-Q1179 HydrophobicContact CG2-CG 4.04Å; F1167-Q1179 PolarHBondContact N-O 2.79Å; F1167-Q1179 WeakPolarHBondContact O-CG 3.26Å; L1175-Q1179 HydrophobicContact CD2-CB 4.14Å; L1175-Q1179 HydrophobicContact CD2-CG 3.77Å
1180	Q	90.1	Very high	87.6	Confident	113 Å²	113	67 Å²	67	53%	0.528	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	141.5	-174.2	-68.1	-176.8	-12.5	0	0	112	T1164 V1165 T1166 D1178	T1164-Q1180 HydrophobicContact CG2-CB 4.16Å; T1164-Q1180 HydrophobicContact CG2-CG 4.45Å; V1165-Q1180 WeakPolarHBondContact O-CA 3.24Å; T1166-Q1180 HydrophobicContact CG2-CG 4.2Å; D1178-Q1180 VanDerWaalsContact C-N 3.29Å; D1178-Q1180 PolarHBondContact O-N 2.87Å
1181	R	89.3	Confident	87.6	Confident	19 Å²	19	66.2 Å²	66.2	7%	0.072	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	131.5	171.2	-64.3	-70.5	-166.8	134	9.2	109	L1144 T1164 V1165 F1167 W1188 S1189 G1191 W1192	L1144-R1181 HydrophobicContact CD1-CB 3.99Å; L1144-R1181 HydrophobicContact CD1-CG 4.14Å; T1164-R1181 CarbonylContact C-O 3.59Å; T1164-R1181 WeakPolarHBondContact CA-O 3.2Å; V1165-R1181 PolarHBondContact N-O 2.99Å; V1165-R1181 PolarHBondContact O-N 2.77Å; F1167-R1181 HydrophobicContact CD2-CG 4.39Å; F1167-R1181 HydrophobicContact CE2-CB 4.12Å; F1167-R1181 HydrophobicContact CE2-CG 3.64Å; R1181-W1188 HydrophobicContact CB-CE3 3.79Å; R1181-W1188 HydrophobicContact CB-CZ3 4.23Å; R1181-S1189 WeakPolarHBondContact CA-OG 3.27Å; R1181-S1189 WeakPolarHBondContact CD-O 3.31Å; R1181-S1189 PolarHBondContact NH1-O 2.72Å; R1181-G1191 VanDerWaalsContact CZ-O 3.26Å; R1181-G1191 PolarHBondContact NH1-O 2.69Å; R1181-G1191 PolarHBondContact NH2-O 3.48Å; R1181-W1192 PolarHBondContact NH2-O 3.32Å
1182	T	91.8	Very high	87.8	Confident	38 Å²	38	71 Å²	71	23%	0.233	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	132.7	177.2	-53.1	0	0	0	0	109.7	V1163 T1164 I1184 S1189	V1163-T1182 WeakPolarHBondContact O-CA 3.4Å; T1164-T1182 WeakPolarHBondContact CG2-OG1 3.45Å; T1164-T1182 VanDerWaalsContact OG1-CG2 3.32Å; T1164-T1182 WeakPolarHBondContact OG1-CG2 3.45Å; T1164-T1182 PolarHBondContact OG1-OG1 2.87Å; T1182-I1184 HydrophobicContact CG2-CD1 4.28Å; T1182-I1184 HydrophobicContact CG2-CG1 3.91Å; T1182-S1189 PolarHBondContact N-OG 2.82Å; T1182-S1189 PolarHBondContact O-N 2.81Å
1183	C	91.5	Very high	87.9	Confident	0 Å²	0	72 Å²	72	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	118.4	172.8	176	0	0	0	0	108.7	C1141 L1160 D1161 G1162 V1163 W1188	C1141-C1183 HydrophobicContact CB-CB 3.84Å; C1141-C1183 WeakPolarHBondContact CB-SG 3.43Å; C1141-C1183 PolarHBondContact N-SG 2.76Å; C1141-C1183 WeakPolarHBondContact SG-CA 3.11Å; C1141-C1183 WeakPolarHBondContact SG-CB 3.3Å; C1141-C1183 CovalentContact SG-SG 2.01Å; C1141-C1183 PolarHBondContact SG-SG 3.16Å; L1160-C1183 VanDerWaalsContact O-CB 3.31Å; L1160-C1183 WeakPolarHBondContact O-CB 3.46Å; L1160-C1183 PolarHBondContact O-SG 2.89Å; D1161-C1183 VanDerWaalsContact CA-SG 3.52Å; D1161-C1183 PolarHBondContact N-SG 3.4Å; G1162-C1183 PolarHBondContact N-O 3.1Å; V1163-C1183 PolarHBondContact O-N 2.67Å; C1183-W1188 HydrophobicContact CB-CD2 4.4Å; C1183-W1188 HydrophobicContact CB-CE3 3.99Å; C1183-W1188 HydrophobicContact CB-CH2 3.66Å; C1183-W1188 HydrophobicContact CB-CZ2 4.04Å; C1183-W1188 HydrophobicContact CB-CZ3 3.65Å; C1183-W1188 VanDerWaalsContact N-CZ3 3.31Å
1184	I	92.2	Very high	88	Confident	106 Å²	106	70.4 Å²	70.4	54%	0.544	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	115.3	-178.5	-57.8	164.2	0	0	0	108.4	D1161 T1182 G1186 T1187	D1161-I1184 WeakPolarHBondContact OD1-CA 3.2Å; T1182-I1184 HydrophobicContact CG2-CD1 4.28Å; T1182-I1184 HydrophobicContact CG2-CG1 3.91Å; I1184-G1186 VanDerWaalsContact C-N 3.28Å; I1184-G1186 PolarHBondContact O-N 3.18Å; I1184-T1187 PolarHBondContact N-O 3.49Å; I1184-T1187 PolarHBondContact O-N 3.07Å
1185	N	89.6	Confident	88.2	Confident	125 Å²	125	70.8 Å²	70.8	67%	0.668	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	45.9	178.2	-164	30.2	0	0	0	113.2	D1161 T1187	D1161-N1185 PolarHBondContact OD1-N 3.4Å; N1185-T1187 VanDerWaalsContact C-N 3.28Å; N1185-T1187 PolarHBondContact O-N 2.98Å
1186	G	87.9	Confident	88.3	Confident	28 Å²	28	69.6 Å²	69.6	29%	0.289	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.2	3.2	178.4	0	0	0	0	0	115.2	C1141 I1184	C1141-G1186 WeakPolarHBondContact CA-O 3.32Å; C1141-G1186 WeakPolarHBondContact SG-CA 3.4Å; I1184-G1186 VanDerWaalsContact C-N 3.28Å; I1184-G1186 PolarHBondContact O-N 3.18Å
1187	T	91.2	Very high	88.3	Confident	100 Å²	100	70.7 Å²	70.7	61%	0.613	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.1	139.4	173.5	-50.3	0	0	0	0	111.5	C1141 I1184 N1185	C1141-T1187 PolarHBondContact SG-N 3.26Å; C1141-T1187 PolarHBondContact SG-O 3.25Å; I1184-T1187 PolarHBondContact N-O 3.49Å; I1184-T1187 PolarHBondContact O-N 3.07Å; N1185-T1187 VanDerWaalsContact C-N 3.28Å; N1185-T1187 PolarHBondContact O-N 2.98Å
1188	W	89.9	Confident	88.3	Confident	36 Å²	36	73.8 Å²	73.8	14%	0.136	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	142.3	173.4	-71.7	105.1	0	0	0	112	C1141 G1142 L1144 Y1159 V1165 R1181 C1183	C1141-W1188 HydrophobicContact CB-CD2 3.95Å; C1141-W1188 HydrophobicContact CB-CG 4.05Å; C1141-W1188 HydrophobicContact CB-CZ2 3.75Å; C1141-W1188 PolarHBondContact O-NE1 2.84Å; G1142-W1188 PolarHBondContact O-NE1 3.44Å; L1144-W1188 HydrophobicContact CD1-CD2 3.71Å; L1144-W1188 HydrophobicContact CD1-CE3 3.9Å; L1144-W1188 HydrophobicContact CD1-CG 4.24Å; L1144-W1188 HydrophobicContact CD1-CH2 4.34Å; L1144-W1188 HydrophobicContact CD1-CZ2 4.2Å; L1144-W1188 HydrophobicContact CD1-CZ3 4.18Å; L1144-W1188 HydrophobicContact CD2-CB 4.5Å; L1144-W1188 HydrophobicContact CD2-CD2 4.08Å; L1144-W1188 HydrophobicContact CD2-CG 3.78Å; L1144-W1188 HydrophobicContact CG-CD2 3.99Å; L1144-W1188 HydrophobicContact CG-CG 4.22Å; L1144-W1188 HydrophobicContact CG-CZ2 4.25Å; Y1159-W1188 AromaticContact CD1-CH2 3.78Å; Y1159-W1188 HydrophobicContact CD1-CH2 3.78Å; Y1159-W1188 AromaticContact CD1-CZ2 3.32Å; Y1159-W1188 HydrophobicContact CD1-CZ2 3.32Å; Y1159-W1188 HydrophobicContact CE1-CZ2 4.28Å; Y1159-W1188 AromaticContact CG-CZ2 3.98Å; Y1159-W1188 HydrophobicContact CG-CZ2 3.98Å; V1165-W1188 HydrophobicContact CB-CZ3 4.5Å; V1165-W1188 HydrophobicContact CG2-CH2 3.74Å; V1165-W1188 HydrophobicContact CG2-CZ3 3.95Å; R1181-W1188 HydrophobicContact CB-CE3 3.79Å; R1181-W1188 HydrophobicContact CB-CZ3 4.23Å; C1183-W1188 HydrophobicContact CB-CD2 4.4Å; C1183-W1188 HydrophobicContact CB-CE3 3.99Å; C1183-W1188 HydrophobicContact CB-CH2 3.66Å; C1183-W1188 HydrophobicContact CB-CZ2 4.04Å; C1183-W1188 HydrophobicContact CB-CZ3 3.65Å; C1183-W1188 VanDerWaalsContact N-CZ3 3.31Å
1189	S	90.8	Very high	88.1	Confident	26 Å²	26	76 Å²	76	18%	0.182	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-54	141.1	172.4	65.2	0	0	0	0	111.4	R1181 T1182	R1181-S1189 WeakPolarHBondContact CA-OG 3.27Å; R1181-S1189 WeakPolarHBondContact CD-O 3.31Å; R1181-S1189 PolarHBondContact NH1-O 2.72Å; T1182-S1189 PolarHBondContact N-OG 2.82Å; T1182-S1189 PolarHBondContact O-N 2.81Å
1190	P	87.7	Confident	88	Confident	127 Å²	127	77 Å²	77	83%	0.825	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-62.2	147.7	178.7	27.5	-34.4	0	0	0	110.3
1191	G	84.9	Confident	87.8	Confident	32 Å²	32	76.9 Å²	76.9	33%	0.33	38%	0.378	S	S	.	.			trans	170.5	166.6	-179.5	0	0	0	0	0	112	D1178 R1181	D1178-G1191 WeakPolarHBondContact OD2-CA 3.14Å; R1181-G1191 VanDerWaalsContact CZ-O 3.26Å; R1181-G1191 PolarHBondContact NH1-O 2.69Å; R1181-G1191 PolarHBondContact NH2-O 3.48Å
1192	W	83.9	Confident	87.6	Confident	208 Å²	208	76.7 Å²	76.7	79%	0.788	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-76.3	146.1	171.6	-70.4	88	0	0	0	110.6	D1178 R1181	D1178-W1192 PolarHBondContact OD2-N 2.98Å; R1181-W1192 PolarHBondContact NH2-O 3.32Å
1193	W	83.2	Confident	87.3	Confident	136 Å²	136	80.6 Å²	80.6	52%	0.515	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-66.7	130.3	176.5	-72.5	98.4	0	0	0	109.9	L1144 Q1145	L1144-W1193 HydrophobicContact CB-CZ3 4.33Å; L1144-W1193 HydrophobicContact CD2-CH2 3.85Å; L1144-W1193 HydrophobicContact CD2-CZ3 3.95Å; Q1145-W1193 WeakPolarHBondContact O-CZ3 2.93Å
1194	P	86.7	Confident	87.1	Confident	2 Å²	2	83.4 Å²	83.4	1%	0.013	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-67.7	139	176.3	28.6	-34.6	0	0	0	110.3	N1147 V1150 F1167 L1175 H1176	N1147-P1194 PolarHBondContact ND2-O 2.72Å; N1147-P1194 VanDerWaalsContact ND2-O 3.12Å; V1150-P1194 HydrophobicContact CG1-CB 4.39Å; V1150-P1194 HydrophobicContact CG1-CG 4.36Å; F1167-P1194 HydrophobicContact CB-CB 3.84Å; F1167-P1194 HydrophobicContact CB-CG 3.88Å; F1167-P1194 HydrophobicContact CD1-CG 3.75Å; F1167-P1194 HydrophobicContact CD2-CB 4.42Å; F1167-P1194 HydrophobicContact CD2-CG 3.72Å; F1167-P1194 HydrophobicContact CE1-CG 4.17Å; F1167-P1194 HydrophobicContact CE2-CG 4.16Å; F1167-P1194 HydrophobicContact CG-CB 4.03Å; F1167-P1194 HydrophobicContact CG-CG 3.49Å; F1167-P1194 VanDerWaalsContact CG-CG 3.49Å; F1167-P1194 HydrophobicContact CZ-CG 4.36Å; L1175-P1194 HydrophobicContact CD1-CB 4.06Å; H1176-P1194 VanDerWaalsContact O-CA 3.31Å; H1176-P1194 WeakPolarHBondContact O-CA 3.21Å
1195	W	88.1	Confident	86.9	Confident	91 Å²	91	82.5 Å²	82.5	35%	0.345	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	153.5	173.2	60.4	-80.5	0	0	0	110.4	N1147 H1176 R1197	N1147-W1195 HydrophobicContact CB-CB 4.33Å; H1176-W1195 HydrophobicContact CB-CD2 3.85Å; H1176-W1195 HydrophobicContact CB-CE3 4.48Å; H1176-W1195 HydrophobicContact CB-CG 4.26Å; H1176-W1195 HydrophobicContact CB-CH2 4.08Å; H1176-W1195 HydrophobicContact CB-CZ2 3.41Å; H1176-W1195 VanDerWaalsContact CB-CZ2 3.41Å; H1176-W1195 AromaticContact CD2-CH2 3.38Å; H1176-W1195 WeakPolarHBondContact CD2-CH2 3.45Å; H1176-W1195 AromaticContact CD2-CZ2 3.66Å; H1176-W1195 AromaticContact CD2-CZ3 3.73Å; H1176-W1195 AromaticContact CG-CE2 3.85Å; H1176-W1195 AromaticContact CG-CH2 3.68Å; H1176-W1195 AromaticContact CG-CZ2 3.44Å; H1176-W1195 VanDerWaalsContact CG-CZ2 3.44Å; H1176-W1195 PolarHBondContact N-O 3.09Å; H1176-W1195 AromaticContact NE2-CH2 3.82Å; H1176-W1195 PolarHBondContact O-N 3.39Å; W1195-R1197 HydrophobicContact CE3-CB 4.46Å; W1195-R1197 VanDerWaalsContact CH2-NH2 3.3Å; W1195-R1197 HydrophobicContact CZ3-CB 3.81Å; W1195-R1197 HydrophobicContact CZ3-CG 4.46Å
1196	C	88.5	Confident	86.8	Confident	17 Å²	17	80.9 Å²	80.9	12%	0.115	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	131.1	-174.8	-66.6	0	0	0	0	109.7	G1149 V1150 C1169 Y1173 F1174	G1149-C1196 PolarHBondContact O-SG 3.25Å; V1150-C1196 VanDerWaalsContact CA-SG 3.56Å; V1150-C1196 HydrophobicContact CG2-CB 4.34Å; V1150-C1196 WeakPolarHBondContact CG2-SG 3.5Å; C1169-C1196 VanDerWaalsContact CA-SG 3.51Å; C1169-C1196 HydrophobicContact CB-CB 3.99Å; C1169-C1196 WeakPolarHBondContact CB-SG 3.35Å; C1169-C1196 VanDerWaalsContact SG-CA 3.56Å; C1169-C1196 WeakPolarHBondContact SG-CB 3.15Å; C1169-C1196 CovalentContact SG-SG 2.02Å; C1169-C1196 PolarHBondContact SG-SG 3.14Å; Y1173-C1196 HydrophobicContact CD1-CB 3.91Å; Y1173-C1196 HydrophobicContact CG-CB 4.06Å; F1174-C1196 WeakPolarHBondContact O-CA 2.93Å
1197	R	87.8	Confident	86.8	Confident	66 Å²	66	88.6 Å²	88.6	25%	0.249	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	144.4	170.6	-168	177.3	-74.4	155.6	-11.5	110.5	Y1173 F1174 W1195 R1199 E1201 E1202	Y1173-R1197 CarbonylContact C-O 3.57Å; Y1173-R1197 WeakPolarHBondContact CA-O 3.25Å; Y1173-R1197 WeakPolarHBondContact CB-O 3.39Å; F1174-R1197 PolarHBondContact N-O 2.99Å; F1174-R1197 PolarHBondContact O-N 2.92Å; W1195-R1197 HydrophobicContact CE3-CB 4.46Å; W1195-R1197 VanDerWaalsContact CH2-NH2 3.3Å; W1195-R1197 HydrophobicContact CZ3-CB 3.81Å; W1195-R1197 HydrophobicContact CZ3-CG 4.46Å; R1197-R1199 PolarHBondContact O-N 2.99Å; R1197-E1201 HydrophobicContact CG-CB 4.09Å; R1197-E1202 WeakPolarHBondContact CD-OE2 3.49Å; R1197-E1202 IonicContact CZ-OE2 2.75Å; R1197-E1202 IonicContact NE-OE2 3.15Å; R1197-E1202 IonicContact NH1-OE2 3.12Å; R1197-E1202 PolarHBondContact NH1-OE2 3.47Å
1198	W	84.7	Confident	86.8	Confident	109 Å²	109	90.1 Å²	90.1	41%	0.413	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.8	134.4	170.6	-75.7	92.3	0	0	0	111.1	E1172 Y1173 D1200 E1201 E1202	E1172-W1198 HydrophobicContact CB-CE3 4.5Å; E1172-W1198 HydrophobicContact CB-CZ3 4.21Å; Y1173-W1198 HydrophobicContact CD1-CG 4.36Å; Y1173-W1198 AromaticContact CE1-CD1 3.74Å; Y1173-W1198 AromaticContact CE1-CD2 3.97Å; Y1173-W1198 HydrophobicContact CE1-CD2 3.97Å; Y1173-W1198 AromaticContact CE1-CE2 3.74Å; Y1173-W1198 AromaticContact CE1-CG 3.97Å; Y1173-W1198 HydrophobicContact CE1-CG 3.97Å; Y1173-W1198 HydrophobicContact CE1-CZ2 4.37Å; Y1173-W1198 AromaticContact CE1-NE1 3.56Å; Y1173-W1198 HydrophobicContact CE2-CZ2 4.48Å; Y1173-W1198 AromaticContact CZ-CE2 3.61Å; Y1173-W1198 AromaticContact CZ-CZ2 3.77Å; Y1173-W1198 AromaticContact CZ-NE1 3.84Å; Y1173-W1198 VanDerWaalsContact OH-CE2 3.29Å; Y1173-W1198 WeakPolarHBondContact OH-CZ2 3.24Å; W1198-D1200 VanDerWaalsContact C-N 3.26Å; W1198-D1200 PolarHBondContact O-N 2.98Å; W1198-E1201 HydrophobicContact CB-CB 4.14Å; W1198-E1201 HydrophobicContact CB-CG 3.95Å; W1198-E1201 PolarHBondContact O-N 3.35Å; W1198-E1202 WeakPolarHBondContact O-CB 3.24Å; W1198-E1202 PolarHBondContact O-N 2.62Å
1199	R	83.9	Confident	86.8	Confident	114 Å²	114	91.7 Å²	91.7	43%	0.43	43%	0.428	S	S	.	.	H	α-helix	trans	-58.7	-39.4	179.3	-83	174.4	156.5	-162.8	-10	112.1	P1171 E1172 F1174 R1197 E1202 Y1203	P1171-R1199 WeakPolarHBondContact O-CD 3.38Å; P1171-R1199 PolarHBondContact O-NE 2.86Å; P1171-R1199 PolarHBondContact O-NH1 3.43Å; E1172-R1199 VanDerWaalsContact O-CB 3.32Å; E1172-R1199 WeakPolarHBondContact O-CB 3.19Å; E1172-R1199 VanDerWaalsContact O-CG 3.27Å; E1172-R1199 WeakPolarHBondContact O-CG 3.3Å; E1172-R1199 PolarHBondContact O-N 3.21Å; F1174-R1199 HydrophobicContact CB-CG 4.49Å; R1197-R1199 PolarHBondContact O-N 2.99Å; R1199-E1202 PolarHBondContact O-N 3.2Å; R1199-Y1203 HydrophobicContact CB-CD2 4.31Å; R1199-Y1203 HydrophobicContact CB-CE2 4.01Å; R1199-Y1203 WeakPolarHBondContact O-CB 3.5Å; R1199-Y1203 WeakPolarHBondContact O-CD2 3.44Å; R1199-Y1203 PolarHBondContact O-N 3.43Å
1200	D	85.3	Confident	86.8	Confident	123 Å²	123	92 Å²	92	66%	0.658	44%	0.435	S	S	*	.	H	α-helix	trans	-65.3	-42.2	179.9	-62.5	-20.7	0	0	0	112.1	W1198 Y1203 A1204	W1198-D1200 VanDerWaalsContact C-N 3.26Å; W1198-D1200 PolarHBondContact O-N 2.98Å; D1200-Y1203 PolarHBondContact O-N 3.12Å; D1200-A1204 VanDerWaalsContact O-CB 3.3Å; D1200-A1204 WeakPolarHBondContact O-CB 3.46Å; D1200-A1204 PolarHBondContact O-N 3.06Å
1201	E	84.2	Confident	87	Confident	111 Å²	111	90.5 Å²	90.5	52%	0.519	42%	0.419	S	S	.	.	H	α-helix	trans	-63.6	-42.6	173	-68.9	-179	169	0	0	111.5	R1197 W1198 A1204 L1205	R1197-E1201 HydrophobicContact CG-CB 4.09Å; W1198-E1201 HydrophobicContact CB-CB 4.14Å; W1198-E1201 HydrophobicContact CB-CG 3.95Å; W1198-E1201 PolarHBondContact O-N 3.35Å; E1201-A1204 PolarHBondContact O-N 3.44Å; E1201-L1205 WeakPolarHBondContact O-CB 3.18Å; E1201-L1205 PolarHBondContact O-N 3.02Å
1202	E	85.1	Confident	87.4	Confident	15 Å²	15	92.3 Å²	92.3	7%	0.07	42%	0.421	C	S	.	.	H	α-helix	trans	-65	-41.8	178.4	-173.5	67.3	-162.3	0	0	111.5	F1174 H1176 R1197 W1198 R1199 L1205 K1206	F1174-E1202 HydrophobicContact CB-CB 4.39Å; F1174-E1202 HydrophobicContact CB-CG 4.11Å; F1174-E1202 HydrophobicContact CD1-CG 4.21Å; F1174-E1202 HydrophobicContact CG-CG 4.11Å; H1176-E1202 IonicContact CE1-OE1 3.35Å; H1176-E1202 PolarHBondContact CE1-OE1 2.76Å; H1176-E1202 IonicContact CE1-OE2 3.38Å; H1176-E1202 IonicContact NE2-OE1 3.73Å; H1176-E1202 IonicContact NE2-OE2 3.52Å; H1176-E1202 PolarHBondContact NE2-OE2 3.05Å; R1197-E1202 WeakPolarHBondContact CD-OE2 3.49Å; R1197-E1202 IonicContact CZ-OE2 2.75Å; R1197-E1202 IonicContact NE-OE2 3.15Å; R1197-E1202 IonicContact NH1-OE2 3.12Å; R1197-E1202 PolarHBondContact NH1-OE2 3.47Å; W1198-E1202 WeakPolarHBondContact O-CB 3.24Å; W1198-E1202 PolarHBondContact O-N 2.62Å; R1199-E1202 PolarHBondContact O-N 3.2Å; E1202-L1205 PolarHBondContact O-N 2.86Å; E1202-K1206 HydrophobicContact CG-CD 4.33Å; E1202-K1206 WeakPolarHBondContact O-CB 3.39Å; E1202-K1206 VanDerWaalsContact O-CG 3.29Å; E1202-K1206 WeakPolarHBondContact O-CG 3.26Å; E1202-K1206 PolarHBondContact O-N 3.38Å; E1202-K1206 WeakPolarHBondContact OE1-CE 3.49Å; E1202-K1206 IonicContact OE1-NZ 3.57Å
1203	Y	86.9	Confident	87.8	Confident	121 Å²	121	86.2 Å²	86.2	48%	0.475	41%	0.406	S	S	.	.	H	α-helix	trans	-64.2	-45.7	173.5	-72	-53.6	0	0	0	111.2	R1199 D1200 L1205 K1206 W1207	R1199-Y1203 HydrophobicContact CB-CD2 4.31Å; R1199-Y1203 HydrophobicContact CB-CE2 4.01Å; R1199-Y1203 WeakPolarHBondContact O-CB 3.5Å; R1199-Y1203 WeakPolarHBondContact O-CD2 3.44Å; R1199-Y1203 PolarHBondContact O-N 3.43Å; D1200-Y1203 PolarHBondContact O-N 3.12Å; Y1203-L1205 VanDerWaalsContact C-N 3.3Å; Y1203-L1205 PolarHBondContact O-N 3.37Å; Y1203-K1206 PolarHBondContact O-N 3.12Å; Y1203-W1207 PolarHBondContact O-N 3.46Å
1204	A	87.4	Confident	88.1	Confident	58 Å²	58	83 Å²	83	48%	0.479	40%	0.404	S	S	.	.	H	α-helix	trans	-58.7	-42.6	176.8	0	0	0	0	0	111.6	D1200 E1201 W1207 F1208	D1200-A1204 VanDerWaalsContact O-CB 3.3Å; D1200-A1204 WeakPolarHBondContact O-CB 3.46Å; D1200-A1204 PolarHBondContact O-N 3.06Å; E1201-A1204 PolarHBondContact O-N 3.44Å; A1204-W1207 PolarHBondContact O-N 2.81Å; A1204-F1208 VanDerWaalsContact O-CB 3.25Å; A1204-F1208 WeakPolarHBondContact O-CB 3.39Å; A1204-F1208 PolarHBondContact O-N 2.58Å
1205	L	87.3	Confident	88.4	Confident	87 Å²	87	88.3 Å²	88.3	46%	0.455	43%	0.432	S	S	.	.	H	α-helix	trans	-67.3	-40.7	178.1	-146.1	106.8	0	0	0	112.2	E1201 E1202 Y1203 F1208 T1209	E1201-L1205 WeakPolarHBondContact O-CB 3.18Å; E1201-L1205 PolarHBondContact O-N 3.02Å; E1202-L1205 PolarHBondContact O-N 2.86Å; Y1203-L1205 VanDerWaalsContact C-N 3.3Å; Y1203-L1205 PolarHBondContact O-N 3.37Å; L1205-F1208 PolarHBondContact O-N 2.93Å; L1205-T1209 WeakPolarHBondContact O-CB 3.44Å; L1205-T1209 WeakPolarHBondContact O-CG2 3.45Å; L1205-T1209 PolarHBondContact O-N 3.07Å; L1205-T1209 PolarHBondContact O-OG1 3.3Å
1206	K	87.7	Confident	88.6	Confident	92 Å²	92	89.6 Å²	89.6	40%	0.4	45%	0.445	S	S	.	.	H	α-helix	trans	-63.4	-42.3	175.1	-76.9	172.1	179.6	166	0	112	E1202 Y1203 T1209 G1210	E1202-K1206 HydrophobicContact CG-CD 4.33Å; E1202-K1206 WeakPolarHBondContact O-CB 3.39Å; E1202-K1206 VanDerWaalsContact O-CG 3.29Å; E1202-K1206 WeakPolarHBondContact O-CG 3.26Å; E1202-K1206 PolarHBondContact O-N 3.38Å; E1202-K1206 WeakPolarHBondContact OE1-CE 3.49Å; E1202-K1206 IonicContact OE1-NZ 3.57Å; Y1203-K1206 PolarHBondContact O-N 3.12Å; K1206-T1209 WeakPolarHBondContact CA-OG1 3.43Å; K1206-T1209 PolarHBondContact O-OG1 2.82Å; K1206-G1210 PolarHBondContact O-N 2.89Å
1207	W	89	Confident	88.8	Confident	190 Å²	190	93.3 Å²	93.3	72%	0.72	46%	0.463	S	S	*	.	H	α-helix	trans	-65.1	-46.3	173.7	-80.9	111.6	0	0	0	111.9	Y1203 A1204 T1209 G1210 I1211	Y1203-W1207 PolarHBondContact O-N 3.46Å; A1204-W1207 PolarHBondContact O-N 2.81Å; W1207-T1209 PolarHBondContact O-N 2.93Å; W1207-G1210 PolarHBondContact O-N 3.06Å; W1207-I1211 VanDerWaalsContact O-CG1 3.27Å; W1207-I1211 WeakPolarHBondContact O-CG1 3.47Å; W1207-I1211 PolarHBondContact O-N 2.8Å
1208	F	90.7	Very high	89	Confident	132 Å²	132	95 Å²	95	58%	0.579	48%	0.476	S	S	*	.	H	α-helix	trans	-62.3	-45	-179.7	-171	-104.1	0	0	0	112.2	A1204 L1205 I1211 I1212	A1204-F1208 VanDerWaalsContact O-CB 3.25Å; A1204-F1208 WeakPolarHBondContact O-CB 3.39Å; A1204-F1208 PolarHBondContact O-N 2.58Å; L1205-F1208 PolarHBondContact O-N 2.93Å; F1208-I1211 PolarHBondContact O-N 3.33Å; F1208-I1212 HydrophobicContact CD1-CD1 3.66Å; F1208-I1212 HydrophobicContact CE1-CD1 3.18Å; F1208-I1212 HydrophobicContact CE1-CG1 4.31Å; F1208-I1212 HydrophobicContact CE2-CD1 4.32Å; F1208-I1212 HydrophobicContact CG-CD1 4.42Å; F1208-I1212 HydrophobicContact CZ-CD1 3.56Å; F1208-I1212 HydrophobicContact CZ-CG1 4.48Å; F1208-I1212 WeakPolarHBondContact O-CG1 3.46Å; F1208-I1212 PolarHBondContact O-N 3.38Å
1209	T	89	Confident	89.4	Confident	69 Å²	69	91.6 Å²	91.6	42%	0.423	48%	0.475	S	S	.	.	H	α-helix	trans	-64.2	-42.1	174.7	47.2	0	0	0	0	112.1	L1205 K1206 W1207 I1211 I1212 V1213	L1205-T1209 WeakPolarHBondContact O-CB 3.44Å; L1205-T1209 WeakPolarHBondContact O-CG2 3.45Å; L1205-T1209 PolarHBondContact O-N 3.07Å; L1205-T1209 PolarHBondContact O-OG1 3.3Å; K1206-T1209 WeakPolarHBondContact CA-OG1 3.43Å; K1206-T1209 PolarHBondContact O-OG1 2.82Å; W1207-T1209 PolarHBondContact O-N 2.93Å; T1209-I1211 PolarHBondContact O-N 3.14Å; T1209-I1212 PolarHBondContact O-N 2.94Å; T1209-V1213 WeakPolarHBondContact O-CB 3.06Å; T1209-V1213 VanDerWaalsContact O-CG2 3.3Å; T1209-V1213 WeakPolarHBondContact O-CG2 3.49Å; T1209-V1213 PolarHBondContact O-N 3.08Å
1210	G	91.6	Very high	89.7	Confident	33 Å²	33	88.4 Å²	88.4	34%	0.34	47%	0.473	S	S	.	.	H	α-helix	trans	-59.1	-42.4	174.3	0	0	0	0	0	113.3	K1206 W1207 S1214	K1206-G1210 PolarHBondContact O-N 2.89Å; W1207-G1210 PolarHBondContact O-N 3.06Å; G1210-S1214 VanDerWaalsContact O-CB 3.32Å; G1210-S1214 WeakPolarHBondContact O-CB 3.42Å; G1210-S1214 PolarHBondContact O-N 3.26Å; G1210-S1214 PolarHBondContact O-OG 3.42Å
1211	I	92.2	Very high	90	Very high	94 Å²	94	87.5 Å²	87.5	48%	0.482	47%	0.467	S	S	.	.	H	α-helix	trans	-65.7	-48.2	176.5	-67.6	163.9	0	0	0	110.7	W1207 F1208 T1209 S1214 L1215	W1207-I1211 VanDerWaalsContact O-CG1 3.27Å; W1207-I1211 WeakPolarHBondContact O-CG1 3.47Å; W1207-I1211 PolarHBondContact O-N 2.8Å; F1208-I1211 PolarHBondContact O-N 3.33Å; T1209-I1211 PolarHBondContact O-N 3.14Å; I1211-S1214 PolarHBondContact O-N 2.89Å; I1211-L1215 HydrophobicContact CG2-CD1 3.96Å; I1211-L1215 HydrophobicContact CG2-CG 4.45Å; I1211-L1215 WeakPolarHBondContact O-CG 3.38Å; I1211-L1215 PolarHBondContact O-N 3.14Å
1212	I	92	Very high	90.3	Very high	71 Å²	71	86.4 Å²	86.4	36%	0.364	46%	0.464	S	S	.	.	H	α-helix	trans	-62.6	-46.1	-179.9	-73.5	179.3	0	0	0	111.7	F1208 T1209 S1214 L1215 L1216	F1208-I1212 HydrophobicContact CD1-CD1 3.66Å; F1208-I1212 HydrophobicContact CE1-CD1 3.18Å; F1208-I1212 HydrophobicContact CE1-CG1 4.31Å; F1208-I1212 HydrophobicContact CE2-CD1 4.32Å; F1208-I1212 HydrophobicContact CG-CD1 4.42Å; F1208-I1212 HydrophobicContact CZ-CD1 3.56Å; F1208-I1212 HydrophobicContact CZ-CG1 4.48Å; F1208-I1212 WeakPolarHBondContact O-CG1 3.46Å; F1208-I1212 PolarHBondContact O-N 3.38Å; T1209-I1212 PolarHBondContact O-N 2.94Å; I1212-S1214 VanDerWaalsContact C-N 3.31Å; I1212-S1214 PolarHBondContact O-N 3.31Å; I1212-L1215 PolarHBondContact O-N 3.02Å; I1212-L1216 HydrophobicContact CG2-CD1 3.89Å; I1212-L1216 HydrophobicContact CG2-CG 4.38Å; I1212-L1216 WeakPolarHBondContact O-CB 3.32Å; I1212-L1216 WeakPolarHBondContact O-CG 3.34Å; I1212-L1216 PolarHBondContact O-N 2.8Å
1213	V	92.2	Very high	90.4	Very high	79 Å²	79	88.3 Å²	88.3	48%	0.479	48%	0.482	S	S	.	.	H	α-helix	trans	-63.1	-41.1	178.7	172.9	0	0	0	0	110.3	T1209 L1215 L1216 I1217	T1209-V1213 WeakPolarHBondContact O-CB 3.06Å; T1209-V1213 VanDerWaalsContact O-CG2 3.3Å; T1209-V1213 WeakPolarHBondContact O-CG2 3.49Å; T1209-V1213 PolarHBondContact O-N 3.08Å; V1213-L1215 PolarHBondContact O-N 3.15Å; V1213-L1216 PolarHBondContact O-N 3.38Å; V1213-I1217 HydrophobicContact CG1-CD1 3.75Å; V1213-I1217 HydrophobicContact CG1-CG1 4.33Å; V1213-I1217 WeakPolarHBondContact O-CB 3.23Å; V1213-I1217 VanDerWaalsContact O-CG1 3.26Å; V1213-I1217 WeakPolarHBondContact O-CG1 3.26Å; V1213-I1217 PolarHBondContact O-N 3.14Å
1214	S	91.1	Very high	90.5	Very high	69 Å²	69	87.6 Å²	87.6	48%	0.483	49%	0.486	S	S	.	.	H	α-helix	trans	-61.7	-43.5	175.6	-59.5	0	0	0	0	111.9	G1210 I1211 I1212 I1217 L1218	G1210-S1214 VanDerWaalsContact O-CB 3.32Å; G1210-S1214 WeakPolarHBondContact O-CB 3.42Å; G1210-S1214 PolarHBondContact O-N 3.26Å; G1210-S1214 PolarHBondContact O-OG 3.42Å; I1211-S1214 PolarHBondContact O-N 2.89Å; I1212-S1214 VanDerWaalsContact C-N 3.31Å; I1212-S1214 PolarHBondContact O-N 3.31Å; S1214-I1217 PolarHBondContact O-N 3.21Å; S1214-L1218 WeakPolarHBondContact O-CB 3.49Å; S1214-L1218 PolarHBondContact O-N 2.86Å
1215	L	92.2	Very high	90.5	Very high	113 Å²	113	91.9 Å²	91.9	59%	0.592	49%	0.494	S	S	*	.	H	α-helix	trans	-65	-39.1	175.8	-73	172.4	0	0	0	112.4	I1211 I1212 V1213 L1218 G1219	I1211-L1215 HydrophobicContact CG2-CD1 3.96Å; I1211-L1215 HydrophobicContact CG2-CG 4.45Å; I1211-L1215 WeakPolarHBondContact O-CG 3.38Å; I1211-L1215 PolarHBondContact O-N 3.14Å; I1212-L1215 PolarHBondContact O-N 3.02Å; V1213-L1215 PolarHBondContact O-N 3.15Å; L1215-L1218 PolarHBondContact O-N 3.31Å; L1215-G1219 PolarHBondContact O-N 2.82Å
1216	L	91.9	Very high	90.4	Very high	119 Å²	119	92.9 Å²	92.9	62%	0.623	50%	0.499	S	S	*	.	H	α-helix	trans	-66.2	-41.3	175.3	-77.6	171.2	0	0	0	111.9	I1212 V1213 G1219 A1220	I1212-L1216 HydrophobicContact CG2-CD1 3.89Å; I1212-L1216 HydrophobicContact CG2-CG 4.38Å; I1212-L1216 WeakPolarHBondContact O-CB 3.32Å; I1212-L1216 WeakPolarHBondContact O-CG 3.34Å; I1212-L1216 PolarHBondContact O-N 2.8Å; V1213-L1216 PolarHBondContact O-N 3.38Å; L1216-G1219 PolarHBondContact O-N 3.19Å; L1216-A1220 WeakPolarHBondContact O-CB 3.32Å; L1216-A1220 PolarHBondContact O-N 2.81Å
1217	I	93.1	Very high	90.2	Very high	94 Å²	94	95.8 Å²	95.8	48%	0.482	51%	0.509	S	S	.	.	H	α-helix	trans	-64.3	-45.6	175.3	-69	167.8	0	0	0	110.2	V1213 S1214 G1219 A1220 I1221	V1213-I1217 HydrophobicContact CG1-CD1 3.75Å; V1213-I1217 HydrophobicContact CG1-CG1 4.33Å; V1213-I1217 WeakPolarHBondContact O-CB 3.23Å; V1213-I1217 VanDerWaalsContact O-CG1 3.26Å; V1213-I1217 WeakPolarHBondContact O-CG1 3.26Å; V1213-I1217 PolarHBondContact O-N 3.14Å; S1214-I1217 PolarHBondContact O-N 3.21Å; I1217-G1219 VanDerWaalsContact C-N 3.34Å; I1217-G1219 PolarHBondContact O-N 3.35Å; I1217-A1220 PolarHBondContact O-N 3.23Å; I1217-I1221 HydrophobicContact CG2-CD1 3.82Å; I1217-I1221 HydrophobicContact CG2-CG1 4.43Å; I1217-I1221 VanDerWaalsContact O-CG1 3.29Å; I1217-I1221 WeakPolarHBondContact O-CG1 3.38Å; I1217-I1221 PolarHBondContact O-N 2.87Å
1218	L	92.3	Very high	89.9	Confident	101 Å²	101	90 Å²	90	53%	0.529	50%	0.497	S	S	.	.	H	α-helix	trans	-60.5	-44.2	175.2	-117.3	142.3	0	0	0	111.3	S1214 L1215 A1220 I1221 I1222	S1214-L1218 WeakPolarHBondContact O-CB 3.49Å; S1214-L1218 PolarHBondContact O-N 2.86Å; L1215-L1218 PolarHBondContact O-N 3.31Å; L1218-A1220 PolarHBondContact O-N 2.89Å; L1218-I1221 PolarHBondContact O-N 3.08Å; L1218-I1222 HydrophobicContact CD2-CD1 3.98Å; L1218-I1222 WeakPolarHBondContact O-CB 2.95Å; L1218-I1222 WeakPolarHBondContact O-CD1 3.42Å; L1218-I1222 WeakPolarHBondContact O-CG1 3.27Å; L1218-I1222 PolarHBondContact O-N 3.11Å
1219	G	92	Very high	89.4	Confident	38 Å²	38	87.1 Å²	87.1	39%	0.392	49%	0.487	S	S	.	.	H	α-helix	trans	-59.9	-42.5	174.4	0	0	0	0	0	112.6	L1215 L1216 I1217 I1222 A1223	L1215-G1219 PolarHBondContact O-N 2.82Å; L1216-G1219 PolarHBondContact O-N 3.19Å; I1217-G1219 VanDerWaalsContact C-N 3.34Å; I1217-G1219 PolarHBondContact O-N 3.35Å; G1219-I1222 PolarHBondContact O-N 2.92Å; G1219-A1223 VanDerWaalsContact O-CB 3.27Å; G1219-A1223 WeakPolarHBondContact O-CB 3.37Å; G1219-A1223 PolarHBondContact O-N 2.85Å
1220	A	90.8	Very high	88.8	Confident	48 Å²	48	86.5 Å²	86.5	40%	0.397	49%	0.485	S	S	.	.	H	α-helix	trans	-66.7	-42.3	176.2	0	0	0	0	0	112.1	L1216 I1217 L1218 A1223 I1224	L1216-A1220 WeakPolarHBondContact O-CB 3.32Å; L1216-A1220 PolarHBondContact O-N 2.81Å; I1217-A1220 PolarHBondContact O-N 3.23Å; L1218-A1220 PolarHBondContact O-N 2.89Å; A1220-A1223 PolarHBondContact O-N 2.76Å; A1220-I1224 WeakPolarHBondContact O-CB 3.27Å; A1220-I1224 WeakPolarHBondContact O-CG1 3.4Å; A1220-I1224 PolarHBondContact O-N 3.44Å
1221	I	92.1	Very high	88.1	Confident	103 Å²	103	88 Å²	88	53%	0.528	49%	0.486	S	S	.	.	H	α-helix	trans	-62.7	-45.7	175.6	-68.4	167.1	0	0	0	110.4	I1217 L1218 A1223 I1224 F1225	I1217-I1221 HydrophobicContact CG2-CD1 3.82Å; I1217-I1221 HydrophobicContact CG2-CG1 4.43Å; I1217-I1221 VanDerWaalsContact O-CG1 3.29Å; I1217-I1221 WeakPolarHBondContact O-CG1 3.38Å; I1217-I1221 PolarHBondContact O-N 2.87Å; L1218-I1221 PolarHBondContact O-N 3.08Å; I1221-A1223 VanDerWaalsContact C-N 3.34Å; I1221-A1223 PolarHBondContact O-N 2.79Å; I1221-I1224 PolarHBondContact O-N 2.86Å; I1221-F1225 WeakPolarHBondContact O-CB 3.31Å; I1221-F1225 PolarHBondContact O-N 3.29Å
1222	I	89.5	Confident	87.2	Confident	89 Å²	89	89.9 Å²	89.9	46%	0.456	49%	0.49	S	S	.	.	H	α-helix	trans	-61	-45.3	176.1	-68.8	165.7	0	0	0	110	L1218 G1219 I1224 F1225 L1226	L1218-I1222 HydrophobicContact CD2-CD1 3.98Å; L1218-I1222 WeakPolarHBondContact O-CB 2.95Å; L1218-I1222 WeakPolarHBondContact O-CD1 3.42Å; L1218-I1222 WeakPolarHBondContact O-CG1 3.27Å; L1218-I1222 PolarHBondContact O-N 3.11Å; G1219-I1222 PolarHBondContact O-N 2.92Å; I1222-I1224 PolarHBondContact O-N 2.95Å; I1222-F1225 PolarHBondContact O-N 3.16Å; I1222-L1226 HydrophobicContact CG2-CD1 3.82Å; I1222-L1226 HydrophobicContact CG2-CG 4.28Å; I1222-L1226 WeakPolarHBondContact O-CB 3.37Å; I1222-L1226 VanDerWaalsContact O-CG 3.23Å; I1222-L1226 WeakPolarHBondContact O-CG 3.42Å; I1222-L1226 PolarHBondContact O-N 2.9Å
1223	A	87.3	Confident	86.1	Confident	55 Å²	55	90.6 Å²	90.6	46%	0.455	49%	0.494	S	S	.	.	H	α-helix	trans	-62.4	-42.7	177.4	0	0	0	0	0	112.4	G1219 A1220 I1221 L1226 Y1227	G1219-A1223 VanDerWaalsContact O-CB 3.27Å; G1219-A1223 WeakPolarHBondContact O-CB 3.37Å; G1219-A1223 PolarHBondContact O-N 2.85Å; A1220-A1223 PolarHBondContact O-N 2.76Å; I1221-A1223 VanDerWaalsContact C-N 3.34Å; I1221-A1223 PolarHBondContact O-N 2.79Å; A1223-L1226 PolarHBondContact O-N 3.44Å; A1223-Y1227 VanDerWaalsContact O-CB 3.24Å; A1223-Y1227 WeakPolarHBondContact O-CB 3.43Å; A1223-Y1227 PolarHBondContact O-N 3.38Å
1224	I	89.6	Confident	85	Confident	106 Å²	106	92.3 Å²	92.3	54%	0.544	50%	0.497	S	S	.	.	H	α-helix	trans	-63.5	-42.8	175.1	-69.9	164.5	0	0	0	110.5	A1220 I1221 I1222 Y1227 C1228	A1220-I1224 WeakPolarHBondContact O-CB 3.27Å; A1220-I1224 WeakPolarHBondContact O-CG1 3.4Å; A1220-I1224 PolarHBondContact O-N 3.44Å; I1221-I1224 PolarHBondContact O-N 2.86Å; I1222-I1224 PolarHBondContact O-N 2.95Å; I1224-Y1227 PolarHBondContact O-N 3.22Å; I1224-C1228 WeakPolarHBondContact O-CB 3.45Å; I1224-C1228 PolarHBondContact O-N 3.21Å; I1224-C1228 PolarHBondContact O-SG 3.04Å
1225	F	87.7	Confident	83.7	Confident	147 Å²	147	96 Å²	96	65%	0.645	51%	0.505	S	S	*	.	H	α-helix	trans	-64.8	-44.9	178.7	-163.6	-89.4	0	0	0	111.3	I1221 I1222 Y1227 C1228 N1229	I1221-F1225 WeakPolarHBondContact O-CB 3.31Å; I1221-F1225 PolarHBondContact O-N 3.29Å; I1222-F1225 PolarHBondContact O-N 3.16Å; F1225-Y1227 VanDerWaalsContact C-N 3.33Å; F1225-Y1227 PolarHBondContact O-N 3.07Å; F1225-C1228 PolarHBondContact O-N 3.41Å; F1225-N1229 VanDerWaalsContact O-CB 3.29Å; F1225-N1229 WeakPolarHBondContact O-CB 3.38Å; F1225-N1229 PolarHBondContact O-N 3.48Å
1226	L	84.1	Confident	82.1	Confident	109 Å²	109	95.5 Å²	95.5	57%	0.571	50%	0.502	S	S	*	.	H	α-helix	trans	-62.4	-40.1	174.5	-70.2	173.6	0	0	0	111.6	I1222 A1223 N1229 S1230	I1222-L1226 HydrophobicContact CG2-CD1 3.82Å; I1222-L1226 HydrophobicContact CG2-CG 4.28Å; I1222-L1226 WeakPolarHBondContact O-CB 3.37Å; I1222-L1226 VanDerWaalsContact O-CG 3.23Å; I1222-L1226 WeakPolarHBondContact O-CG 3.42Å; I1222-L1226 PolarHBondContact O-N 2.9Å; A1223-L1226 PolarHBondContact O-N 3.44Å; L1226-N1229 PolarHBondContact O-N 3.41Å; L1226-S1230 VanDerWaalsContact O-CB 3.3Å; L1226-S1230 WeakPolarHBondContact O-CB 3.41Å; L1226-S1230 PolarHBondContact O-N 3Å
1227	Y	83.8	Confident	80.6	Confident	153 Å²	153	97.9 Å²	97.9	60%	0.6	51%	0.507	S	S	*	.	H	α-helix	trans	-66.9	-44.2	176.3	-175.6	-104.8	0	0	0	112.3	A1223 I1224 F1225 N1229 S1230 L1231	A1223-Y1227 VanDerWaalsContact O-CB 3.24Å; A1223-Y1227 WeakPolarHBondContact O-CB 3.43Å; A1223-Y1227 PolarHBondContact O-N 3.38Å; I1224-Y1227 PolarHBondContact O-N 3.22Å; F1225-Y1227 VanDerWaalsContact C-N 3.33Å; F1225-Y1227 PolarHBondContact O-N 3.07Å; Y1227-N1229 VanDerWaalsContact C-N 3.33Å; Y1227-N1229 PolarHBondContact O-N 3.41Å; Y1227-S1230 WeakPolarHBondContact O-CB 3.39Å; Y1227-S1230 PolarHBondContact O-N 2.93Å; Y1227-L1231 HydrophobicContact CD1-CD1 3.75Å; Y1227-L1231 HydrophobicContact CE1-CD1 3.29Å; Y1227-L1231 HydrophobicContact CE1-CG 4.16Å; Y1227-L1231 PolarHBondContact O-N 2.77Å
1228	C	81.9	Confident	78.9	Confident	69 Å²	69	101 Å²	101	47%	0.466	52%	0.52	S	S	.	.	H	α-helix	trans	-63.4	-39.3	174.6	-69.8	0	0	0	0	111.7	I1224 F1225 L1231 K1232	I1224-C1228 WeakPolarHBondContact O-CB 3.45Å; I1224-C1228 PolarHBondContact O-N 3.21Å; I1224-C1228 PolarHBondContact O-SG 3.04Å; F1225-C1228 PolarHBondContact O-N 3.41Å; C1228-L1231 PolarHBondContact O-N 2.88Å; C1228-K1232 WeakPolarHBondContact O-CB 3.32Å; C1228-K1232 PolarHBondContact O-N 3.01Å
1229	N	80.2	Confident	77.1	Confident	71 Å²	71	107 Å²	107	38%	0.38	54%	0.536	S	S	.	.	H	α-helix	trans	-68.8	-38.6	177.1	-159.7	27.1	0	0	0	111.6	F1225 L1226 Y1227 K1232 N1233	F1225-N1229 VanDerWaalsContact O-CB 3.29Å; F1225-N1229 WeakPolarHBondContact O-CB 3.38Å; F1225-N1229 PolarHBondContact O-N 3.48Å; L1226-N1229 PolarHBondContact O-N 3.41Å; Y1227-N1229 VanDerWaalsContact C-N 3.33Å; Y1227-N1229 PolarHBondContact O-N 3.41Å; N1229-K1232 PolarHBondContact O-N 3.09Å; N1229-N1233 WeakPolarHBondContact O-CB 3.36Å; N1229-N1233 PolarHBondContact O-N 3.47Å
1230	S	77.6	Confident	75.2	Confident	55 Å²	55	107.6 Å²	107.6	39%	0.385	54%	0.541	S	S	.	.	H	α-helix	trans	-59.1	-49.1	170.1	162	0	0	0	0	111.9	L1226 Y1227 K1232 N1233 Q1234	L1226-S1230 VanDerWaalsContact O-CB 3.3Å; L1226-S1230 WeakPolarHBondContact O-CB 3.41Å; L1226-S1230 PolarHBondContact O-N 3Å; Y1227-S1230 WeakPolarHBondContact O-CB 3.39Å; Y1227-S1230 PolarHBondContact O-N 2.93Å; S1230-K1232 VanDerWaalsContact C-N 3.34Å; S1230-K1232 PolarHBondContact O-N 3.18Å; S1230-N1233 CarbonylContact O-C 3.45Å; S1230-N1233 PolarHBondContact O-N 3Å; S1230-Q1234 PolarHBondContact O-N 2.78Å
1231	L	75.9	Confident	72.8	Confident	66 Å²	66	115.4 Å²	115.4	35%	0.346	56%	0.561	S	S	.	*	H	α-helix	trans	-61.6	-39.8	175.5	-84.1	168.5	0	0	0	112.4	Y1227 C1228 Q1234 K1235	Y1227-L1231 HydrophobicContact CD1-CD1 3.75Å; Y1227-L1231 HydrophobicContact CE1-CD1 3.29Å; Y1227-L1231 HydrophobicContact CE1-CG 4.16Å; Y1227-L1231 PolarHBondContact O-N 2.77Å; C1228-L1231 PolarHBondContact O-N 2.88Å; L1231-Q1234 PolarHBondContact O-N 3.47Å; L1231-K1235 PolarHBondContact O-N 3.18Å
1232	K	73.9	Confident	70.9	Confident	133 Å²	133	115.6 Å²	115.6	58%	0.578	57%	0.568	S	S	*	*	H	α-helix	trans	-62.2	-44.8	174.1	-172.7	-176.8	178.6	-176.8	0	110.8	C1228 N1229 S1230 K1235 L1236	C1228-K1232 WeakPolarHBondContact O-CB 3.32Å; C1228-K1232 PolarHBondContact O-N 3.01Å; N1229-K1232 PolarHBondContact O-N 3.09Å; S1230-K1232 VanDerWaalsContact C-N 3.34Å; S1230-K1232 PolarHBondContact O-N 3.18Å; K1232-K1235 PolarHBondContact O-N 3.13Å; K1232-L1236 HydrophobicContact CG-CD1 4.15Å; K1232-L1236 WeakPolarHBondContact O-CB 3.35Å; K1232-L1236 WeakPolarHBondContact O-CG 3.27Å; K1232-L1236 PolarHBondContact O-N 3.33Å
1233	N	69.1	Low	68.6	Low	85 Å²	85	121 Å²	121	46%	0.455	58%	0.584	S	S	.	*	H	α-helix	trans	-65.6	-36.3	176.1	-77.1	-17.6	0	0	0	112.4	N1229 S1230 L1236 K1237	N1229-N1233 WeakPolarHBondContact O-CB 3.36Å; N1229-N1233 PolarHBondContact O-N 3.47Å; S1230-N1233 CarbonylContact O-C 3.45Å; S1230-N1233 PolarHBondContact O-N 3Å; N1233-L1236 PolarHBondContact O-N 2.86Å; N1233-K1237 WeakPolarHBondContact O-CB 3.42Å; N1233-K1237 WeakPolarHBondContact O-CG 3.16Å; N1233-K1237 PolarHBondContact O-N 3.45Å
1234	Q	68.3	Low	66.6	Low	115 Å²	115	123.3 Å²	123.3	54%	0.537	60%	0.604	S	S	.	*	H	α-helix	trans	-66.6	-44.2	172.4	-78.2	-174.1	-12	0	0	112	S1230 L1231 L1236 K1237 Q1238	S1230-Q1234 PolarHBondContact O-N 2.78Å; L1231-Q1234 PolarHBondContact O-N 3.47Å; Q1234-L1236 VanDerWaalsContact C-N 3.34Å; Q1234-L1236 PolarHBondContact O-N 3.18Å; Q1234-K1237 PolarHBondContact O-N 3.24Å; Q1234-Q1238 PolarHBondContact O-N 3.41Å
1235	K	63.8	Low	64.4	Low	148 Å²	148	125 Å²	125	64%	0.643	61%	0.613	S	S	*	*	H	α-helix	trans	-63.8	-37.7	174.1	-82.8	-173	177.2	178.3	0	112.4	L1231 K1232 Q1238 R1239	L1231-K1235 PolarHBondContact O-N 3.18Å; K1232-K1235 PolarHBondContact O-N 3.13Å; K1235-Q1238 PolarHBondContact O-N 3.23Å; K1235-R1239 PolarHBondContact O-N 3.36Å
1236	L	60.3	Low	62.3	Low	101 Å²	101	121.4 Å²	121.4	53%	0.529	62%	0.616	S	S	.	*	H	α-helix	trans	-65.6	-38.5	173	-83.8	162.4	0	0	0	111.6	K1232 N1233 Q1234 G1240	K1232-L1236 HydrophobicContact CG-CD1 4.15Å; K1232-L1236 WeakPolarHBondContact O-CB 3.35Å; K1232-L1236 WeakPolarHBondContact O-CG 3.27Å; K1232-L1236 PolarHBondContact O-N 3.33Å; N1233-L1236 PolarHBondContact O-N 2.86Å; Q1234-L1236 VanDerWaalsContact C-N 3.34Å; Q1234-L1236 PolarHBondContact O-N 3.18Å; L1236-G1240 VanDerWaalsContact O-CA 3.29Å; L1236-G1240 WeakPolarHBondContact O-CA 3.23Å; L1236-G1240 PolarHBondContact O-N 3.26Å
1237	K	60.3	Low	60.1	Low	170 Å²	170	131.6 Å²	131.6	74%	0.739	65%	0.647	S	S	*	*	H	α-helix	trans	-66.9	-35.6	171.7	-80.9	-177.7	175.9	-179.3	0	112.8	N1233 Q1234 G1240 R1241	N1233-K1237 WeakPolarHBondContact O-CB 3.42Å; N1233-K1237 WeakPolarHBondContact O-CG 3.16Å; N1233-K1237 PolarHBondContact O-N 3.45Å; Q1234-K1237 PolarHBondContact O-N 3.24Å; K1237-G1240 CarbonylContact O-C 3.5Å; K1237-R1241 PolarHBondContact O-N 3.49Å
1238	Q	57.5	Low	58.9	Low	159 Å²	159	130.5 Å²	130.5	74%	0.743	65%	0.649	S	S	*	*	H	α-helix	trans	-72.2	-39.2	176	-78.2	-175.6	-11.8	0	0	112.7	Q1234 K1235	Q1234-Q1238 PolarHBondContact O-N 3.41Å; K1235-Q1238 PolarHBondContact O-N 3.23Å
1239	R	53.9	Low	57.7	Low	228 Å²	228	133.7 Å²	133.7	86%	0.86	66%	0.659	S	S	*	*	H	α-helix	trans	-74.9	-28	172.4	-75.5	-174.9	173.6	-179.6	-2.5	112.8	K1235 R1241	K1235-R1239 PolarHBondContact O-N 3.36Å; R1239-R1241 VanDerWaalsContact C-N 3.32Å
1240	G	51	Low	56.5	Low	50 Å²	50	137.2 Å²	137.2	52%	0.515	68%	0.675	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.7	16	-179.6	0	0	0	0	0	114.2	L1236 K1237 P1242	L1236-G1240 VanDerWaalsContact O-CA 3.29Å; L1236-G1240 WeakPolarHBondContact O-CA 3.23Å; L1236-G1240 PolarHBondContact O-N 3.26Å; K1237-G1240 CarbonylContact O-C 3.5Å; G1240-P1242 WeakPolarHBondContact O-CD 2.93Å
1241	R	41.8	Very low	55.2	Low	212 Å²	212	142.1 Å²	142.1	80%	0.8	69%	0.692	S	S	*	*			trans	-86.1	89.4	152.1	-97.6	-176.1	173	172.5	-1.9	107	K1237 R1239 Y1243	K1237-R1241 PolarHBondContact O-N 3.49Å; R1239-R1241 VanDerWaalsContact C-N 3.32Å; R1241-Y1243 PolarHBondContact O-N 3.25Å; R1241-Y1243 VanDerWaalsContact O-N 3.15Å
1242	P	50.8	Low	53.9	Low	106 Å²	106	146.8 Å²	146.8	69%	0.688	71%	0.713	S	S	*	*			trans	-55.5	125.2	160.9	26.4	-33.2	0	0	0	106	G1240 A1244	G1240-P1242 WeakPolarHBondContact O-CD 2.93Å; P1242-A1244 PolarHBondContact O-N 3.17Å
1243	Y	42.8	Very low	52.6	Low	203 Å²	203	147.7 Å²	147.7	80%	0.796	72%	0.722	S	S	*	*			trans	-47.6	90.9	153.1	-78.3	-95.4	0	0	0	107.5	R1241 I1245	R1241-Y1243 PolarHBondContact O-N 3.25Å; R1241-Y1243 VanDerWaalsContact O-N 3.15Å; Y1243-I1245 HydrophobicContact CD1-CD1 3.59Å; Y1243-I1245 HydrophobicContact CD1-CG1 4.12Å; Y1243-I1245 HydrophobicContact CE1-CD1 4.41Å; Y1243-I1245 HydrophobicContact CG-CD1 4.27Å; Y1243-I1245 PolarHBondContact O-N 3.05Å
1244	A	45.4	Very low	51.4	Low	104 Å²	104	152.2 Å²	152.2	86%	0.86	74%	0.741	S	S	*	*			trans	-74.3	70.8	158	0	0	0	0	0	106.3	P1242	P1242-A1244 PolarHBondContact O-N 3.17Å
1245	I	41.8	Very low	50.1	Low	142 Å²	142	155.1 Å²	155.1	73%	0.728	76%	0.757	S	S	*	*			trans	-86	124.9	155.9	-69.2	170	0	0	0	104.6	Y1243	Y1243-I1245 HydrophobicContact CD1-CD1 3.59Å; Y1243-I1245 HydrophobicContact CD1-CG1 4.12Å; Y1243-I1245 HydrophobicContact CE1-CD1 4.41Å; Y1243-I1245 HydrophobicContact CG-CD1 4.27Å; Y1243-I1245 PolarHBondContact O-N 3.05Å
1246	G	44.3	Very low	49	Very low	70 Å²	70	155.7 Å²	155.7	72%	0.722	77%	0.767	S	S	*	*			trans	110	77.4	156.6	0	0	0	0	0	116.2
1247	R	37.7	Very low	47.9	Very low	323 Å²	323	160.6 Å²	160.6	100%	1.219	79%	0.788	S	S	*	*				-176.3	0	100.9	-110	-177	178.3	-178.6	-0.2	110.7

Retrieved 1,247 of 1,247 residues in 905.2 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).