A0A087X9R2_POEFO Loading...

Ubiquitin carboxyl-terminal hydrolase 16

Specifically deubiquitinates 'Lys-120' of histone H2A (H2AK119Ub), a specific tag for epigenetic transcriptional repression, thereby acting as a coactivator. Deubiquitination of histone H2A is a prerequisite for subsequent phosphorylation at 'Ser-11' of histone H3 (H3S10ph), and is required for chromosome segregation when cells enter into mitosis. Regulates Hox gene expression via histone H2A deubiquitination. Prefers nucleosomal substrates. Does not deubiquitinate histone H2B.

AlphaFold DB , UniProt , Accession A0A087X9R2, Species POEFO (Poecilia formosa, Amazon molly), Gene USP16, Length 835 aa.

						>A0A087X9R2_POEFO|A0A087X9R2|USP16
MGKKRGKDRSCREDEDVEFTGPSCRHIRKGTDQTLIKKLPAVSDWTRCQECKPEDNKENISMTKSEESEEETVPLWMCLKCGHRGCGRNSENQHAIKHYETPRSDPHCLVVGLDNWSVWCYMCDDEVQYSGTGQLAQLLTILKKQFSTDPMKRPQKRVKEDVDLMEIKPETEAVNTEESEDNENKDGSNRRKKNIKKENAVKPQNHSAPEESCSVPVKGLSNLGNTCFFNAVLQNLSQTQLLRQILNKVTEEKMSLDIKPDASLNLEPILVQLDQPGSLTLAMCKLLNEIQESKRGVVTPRELFTQVCKKAARFKGFQQQDSQELLRYLLDGMRAEELKRVSMGIAESLKQSSKVTDEDKIKAAVKEYEKNGVPKNFVDQVFGGEMTSTIMCQQCKTVSVVTEMFLDLSLPVSDEAYRKKKTQKVLPRTSESSQDERNGSDLIRENDDSTTGGSSKYQQKKAKKQAKKQAKKRQHKLETRITLGNLTSPSNADGDQIDVTEDAKDTENADQMPHEEVSLNEQDPKPVCEFEQDQNVEQENGEDKDSPSDDVSLADSSVSNRFTVLSEEQHSHDSTSCNETSNTDLEGELDTQLADQLQQVTLNDAFIEDLDSMDPAEESEDEVEYTIINQDPELAFNTLSTRTSPEKQECSVQSCLFQFTEVETLTQNNSLLCVACTKRHKKGEKTGGSKKNIYTDALKQMLISSPPSVLTLHMKRFQQNGYSICKVNRHVQFPLILDLAPYCAAKCKNISEGDTQILYSLYGVVEHSGTMRSGHYTAYVKTRPDSLKSSSNGKQGETDLPRGSWFHISDTSVQPVSESKVQSCQAYLLFYERIL
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.3	Very low	30.5	Very low	244 Å²	244	169.6 Å²	169.6	100%	1.202	88%	0.878	S	S	*	*				0	123.6	0	-77.1	-71.7	-116.3	0	0	109.3
2	G	38.7	Very low	30.3	Very low	82 Å²	82	175 Å²	175	85%	0.845	88%	0.879	S	S	*	*			trans	55.4	115.5	159.2	0	0	0	0	0	120.8
3	K	30.8	Very low	30.9	Very low	225 Å²	225	175.9 Å²	175.9	98%	0.978	88%	0.878	S	S	*	*			trans	-126.6	154.6	149	-93.4	-171.1	174.6	-178.4	0	110.5
4	K	32.2	Very low	30.6	Very low	175 Å²	175	174.6 Å²	174.6	76%	0.761	88%	0.876	S	S	*	*			trans	-105.5	149.5	-168.4	-77.5	174.6	173.6	171.3	0	112.1
5	R	30.1	Very low	30.7	Very low	228 Å²	228	175.5 Å²	175.5	86%	0.86	88%	0.876	S	S	*	*			trans	59.2	139.8	149.3	-62	162	179.4	-175.9	-5.5	117.2
6	G	29.6	Very low	30.5	Very low	78 Å²	78	174.8 Å²	174.8	80%	0.804	88%	0.876	S	S	*	*			cis	112.2	108.4	-3.7	0	0	0	0	0	114.3
7	K	26.5	Very low	30.7	Very low	205 Å²	205	172.1 Å²	172.1	89%	0.891	87%	0.871	S	S	*	*			trans	-167.4	155.2	156.5	-152.6	166.8	-174.7	177.6	0	111.7
8	D	28.5	Very low	30.8	Very low	146 Å²	146	171.9 Å²	171.9	78%	0.781	87%	0.866	S	S	*	*			trans	-93.8	156.2	-166.5	-36.2	-96	0	0	0	115.6
9	R	26.9	Very low	31.2	Very low	252 Å²	252	174.2 Å²	174.2	95%	0.951	87%	0.87	S	S	*	*				-170	158	124.1	-103.3	168.1	-179.7	-171.4	-2.4	111.2
10	S	30.7	Very low	31.7	Very low	118 Å²	118	171.4 Å²	171.4	83%	0.825	86%	0.863	S	S	*	*			trans	-100.1	158.9	-165.3	52.5	0	0	0	0	114.7
11	C	26.4	Very low	32.4	Very low	113 Å²	113	166.2 Å²	166.2	76%	0.764	85%	0.852	S	S	*	*			trans	-160.9	129.2	141.6	-135.2	0	0	0	0	111.9
12	R	28.4	Very low	33	Very low	234 Å²	234	161.3 Å²	161.3	88%	0.883	84%	0.839	S	S	*	*			trans	34.5	145.6	151.8	-65.4	179.3	176.3	164.5	-1.2	122.3
13	E	37.3	Very low	34.3	Very low	187 Å²	187	161.8 Å²	161.8	87%	0.874	83%	0.829	S	S	*	*			trans	-89.7	137	175.7	-61.6	152.6	151.8	0	0	110.7
14	D	27.6	Very low	36.6	Very low	158 Å²	158	152 Å²	152	85%	0.845	79%	0.789	S	S	*	*			trans	-143.2	117.4	161.5	-80.6	-57.8	0	0	0	106.1
15	E	31	Very low	38.9	Very low	188 Å²	188	154.7 Å²	154.7	88%	0.879	79%	0.794	S	S	*	*			trans	-106.1	100	175.3	-74.5	-161.5	146.6	0	0	110.8
16	D	28.9	Very low	41.4	Very low	164 Å²	164	145.9 Å²	145.9	88%	0.877	76%	0.763	S	S	*	*			trans	-70.2	131.1	166.3	-84.9	-50.6	0	0	0	110.7
17	V	33.2	Very low	43.9	Very low	129 Å²	129	143.4 Å²	143.4	78%	0.782	73%	0.731	S	S	*	*			trans	-115.4	108.8	174	-178.9	0	0	0	0	109.9
18	E	33.4	Very low	46.4	Very low	169 Å²	169	143.9 Å²	143.9	79%	0.79	73%	0.727	S	S	*	*			trans	-71.4	135.8	-176	-67.7	-171.2	112.2	0	0	113.9	T20	E18-T20 PolarHBondContact O-N 3.11Å
19	F	36.9	Very low	48.8	Very low	215 Å²	215	143.5 Å²	143.5	94%	0.943	72%	0.718	S	S	*	*			trans	-76.3	106.5	164.9	-83.5	-98.5	0	0	0	111
20	T	42.1	Very low	51.2	Low	118 Å²	118	131.5 Å²	131.5	72%	0.724	67%	0.673	S	S	*	*			trans	-131.3	100.1	170	54.6	0	0	0	0	113.6	E18	E18-T20 PolarHBondContact O-N 3.11Å
21	G	45.9	Very low	53.6	Low	62 Å²	62	126.5 Å²	126.5	64%	0.639	64%	0.638	S	S	*	*			trans	-74.9	162.9	157.9	0	0	0	0	0	111.6	S23	G21-S23 PolarHBondContact O-N 2.98Å
22	P	47.7	Very low	56.1	Low	142 Å²	142	123.4 Å²	123.4	92%	0.922	61%	0.613	S	S	*	*			trans	-73.1	84.8	-173.8	30.4	-36	0	0	0	112.7
23	S	66.3	Low	58.2	Low	92 Å²	92	114.4 Å²	114.4	64%	0.643	58%	0.581	S	S	*	*			trans	-68.8	132.9	169.4	62	0	0	0	0	111.5	G21 R25	G21-S23 PolarHBondContact O-N 2.98Å; S23-R25 PolarHBondContact O-N 2.63Å; S23-R25 VanDerWaalsContact O-N 3.07Å
24	C	78.3	Confident	59.9	Low	19 Å²	19	109.3 Å²	109.3	13%	0.128	56%	0.563	C	S	.	*			trans	-62.8	113.7	-178.5	176.6	0	0	0	0	111.3	H26 I27 V127	C24-H26 PolarHBondContact O-N 2.73Å; C24-I27 HydrophobicContact CB-CD1 4.08Å; C24-I27 HydrophobicContact CB-CG1 4.06Å; C24-I27 WeakPolarHBondContact O-CD1 3.39Å; C24-I27 VanDerWaalsContact O-CG1 3.25Å; C24-I27 WeakPolarHBondContact O-CG1 3.45Å; C24-I27 PolarHBondContact O-N 3.45Å; C24-I27 VanDerWaalsContact O-N 3.09Å; C24-V127 HydrophobicContact CB-CB 4.35Å; C24-V127 HydrophobicContact CB-CG1 3.66Å; C24-V127 HydrophobicContact CB-CG2 3.85Å
25	R	81.1	Confident	61.8	Low	232 Å²	232	105.4 Å²	105.4	88%	0.875	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-14.6	-176.8	-62.3	-177.4	-180	-172.2	-0.5	113.5	S23	S23-R25 PolarHBondContact O-N 2.63Å; S23-R25 VanDerWaalsContact O-N 3.07Å
26	H	83.8	Confident	63.7	Low	42 Å²	42	96.5 Å²	96.5	19%	0.194	50%	0.5	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-12.7	178.6	-56	119.5	0	0	0	114.4	C24 R28 K29 G30 M122 C123	C24-H26 PolarHBondContact O-N 2.73Å; H26-R28 VanDerWaalsContact C-N 3.3Å; H26-R28 PolarHBondContact O-N 3.08Å; H26-K29 WeakPolarHBondContact O-CA 3.33Å; H26-K29 PolarHBondContact O-N 3.42Å; H26-G30 PolarHBondContact O-N 3.49Å; H26-M122 VanDerWaalsContact CE1-CB 3.48Å; H26-M122 WeakPolarHBondContact CE1-CB 3.33Å; H26-C123 PolarHBondContact ND1-SG 3.24Å
27	I	82	Confident	65.5	Low	27 Å²	27	93.7 Å²	93.7	14%	0.138	48%	0.48	C	S	.	.	H	α-helix	trans	-50.4	-46.9	-178.8	-67.5	165.6	0	0	0	112	C24 K29 T31 V127 L135	C24-I27 HydrophobicContact CB-CD1 4.08Å; C24-I27 HydrophobicContact CB-CG1 4.06Å; C24-I27 WeakPolarHBondContact O-CD1 3.39Å; C24-I27 VanDerWaalsContact O-CG1 3.25Å; C24-I27 WeakPolarHBondContact O-CG1 3.45Å; C24-I27 PolarHBondContact O-N 3.45Å; C24-I27 VanDerWaalsContact O-N 3.09Å; I27-K29 VanDerWaalsContact C-N 3.27Å; I27-K29 PolarHBondContact O-N 2.9Å; I27-T31 WeakPolarHBondContact O-CG2 3.42Å; I27-T31 PolarHBondContact O-OG1 3.02Å; I27-T31 VanDerWaalsContact O-OG1 3.08Å; I27-V127 HydrophobicContact CD1-CG1 3.75Å; I27-V127 HydrophobicContact CG1-CG1 3.95Å; I27-L135 HydrophobicContact CD1-CD2 4.37Å; I27-L135 HydrophobicContact CG1-CD2 4.33Å; I27-L135 HydrophobicContact CG2-CB 4.27Å
28	R	77.4	Confident	67.1	Low	215 Å²	215	95 Å²	95	81%	0.811	48%	0.476	S	S	*	.	H	α-helix	trans	-71.6	-15.5	179.4	-64.9	-174.1	-176.5	177.3	3.3	114.7	H26	H26-R28 VanDerWaalsContact C-N 3.3Å; H26-R28 PolarHBondContact O-N 3.08Å
29	K	78.7	Confident	68.5	Low	137 Å²	137	88.8 Å²	88.8	60%	0.596	45%	0.447	S	S	*	.	H	α-helix	trans	-102.1	-31	-178.7	-69.8	-172.3	176.4	-176	0	113.2	H26 I27 K80 P106	H26-K29 WeakPolarHBondContact O-CA 3.33Å; H26-K29 PolarHBondContact O-N 3.42Å; I27-K29 VanDerWaalsContact C-N 3.27Å; I27-K29 PolarHBondContact O-N 2.9Å; K29-K80 WeakPolarHBondContact O-CE 3.43Å; K29-K80 PolarHBondContact O-NZ 2.95Å; K29-P106 HydrophobicContact CB-CG 4.42Å
30	G	77.3	Confident	69.5	Low	0 Å²	0	82.4 Å²	82.4	0%	0	43%	0.428	C	S	.	.	H	α-helix	trans	-97.2	6.3	-176.6	0	0	0	0	0	115.4	H26 L79 K80	H26-G30 PolarHBondContact O-N 3.49Å; G30-L79 CarbonylContact O-C 3.58Å; G30-K80 PolarHBondContact O-N 2.86Å
31	T	81.1	Confident	70.2	Confident	14 Å²	14	80.1 Å²	80.1	9%	0.086	42%	0.421	C	S	.	.			trans	-125.5	139.3	178.5	71.4	0	0	0	0	113.2	I27 L79 L109 L135 L138	I27-T31 WeakPolarHBondContact O-CG2 3.42Å; I27-T31 PolarHBondContact O-OG1 3.02Å; I27-T31 VanDerWaalsContact O-OG1 3.08Å; T31-L79 WeakPolarHBondContact CA-O 3.17Å; T31-L79 HydrophobicContact CG2-CB 4Å; T31-L79 HydrophobicContact CG2-CD1 4.31Å; T31-L109 HydrophobicContact CG2-CD1 3.91Å; T31-L135 HydrophobicContact CG2-CD1 4.44Å; T31-L138 HydrophobicContact CG2-CD1 3.95Å
32	D	79.9	Confident	70.4	Confident	47 Å²	47	83.8 Å²	83.8	25%	0.251	43%	0.431	S	S	.	.			trans	-130.5	111.7	170.3	-171	-37.6	0	0	0	110.9	T34 L35 I36 L79 K80	D32-T34 VanDerWaalsContact C-N 3.31Å; D32-T34 PolarHBondContact O-N 3.34Å; D32-T34 WeakPolarHBondContact OD1-CA 3.04Å; D32-T34 WeakPolarHBondContact OD1-CB 3.4Å; D32-T34 PolarHBondContact OD1-N 2.9Å; D32-T34 PolarHBondContact OD1-OG1 3.18Å; D32-L35 HydrophobicContact CB-CB 4.25Å; D32-L35 HydrophobicContact CB-CD1 4.19Å; D32-L35 HydrophobicContact CB-CG 4.33Å; D32-L35 PolarHBondContact OD1-N 2.94Å; D32-I36 PolarHBondContact O-N 2.95Å; D32-L79 PolarHBondContact N-O 3.12Å; D32-K80 HydrophobicContact CB-CG 4.42Å
33	Q	71.4	Confident	70.8	Confident	45 Å²	45	78.9 Å²	78.9	21%	0.21	40%	0.399	C	S	.	.	H	α-helix	trans	-69.5	-26.2	178.7	-56.9	-153.4	-9.4	0	0	113.8	K37 L138	Q33-K37 VanDerWaalsContact O-CB 3.31Å; Q33-K37 WeakPolarHBondContact O-CB 3.49Å; Q33-K37 VanDerWaalsContact O-CD 3.23Å; Q33-K37 WeakPolarHBondContact O-CD 3.29Å; Q33-K37 WeakPolarHBondContact O-CG 3.36Å; Q33-K37 PolarHBondContact O-N 3.23Å; Q33-L138 HydrophobicContact CB-CD2 4.09Å; Q33-L138 HydrophobicContact CG-CD1 4.14Å; Q33-L138 HydrophobicContact CG-CD2 3.7Å; Q33-L138 HydrophobicContact CG-CG 3.85Å
34	T	74.1	Confident	70.7	Confident	81 Å²	81	80.2 Å²	80.2	50%	0.497	40%	0.399	S	S	.	.	H	α-helix	trans	-81.2	-32.6	-174.8	77.6	0	0	0	0	111.9	D32 K38	D32-T34 VanDerWaalsContact C-N 3.31Å; D32-T34 PolarHBondContact O-N 3.34Å; D32-T34 WeakPolarHBondContact OD1-CA 3.04Å; D32-T34 WeakPolarHBondContact OD1-CB 3.4Å; D32-T34 PolarHBondContact OD1-N 2.9Å; D32-T34 PolarHBondContact OD1-OG1 3.18Å; T34-K38 VanDerWaalsContact O-CD 3.27Å; T34-K38 WeakPolarHBondContact O-CD 3.36Å; T34-K38 VanDerWaalsContact O-CG 3.22Å; T34-K38 WeakPolarHBondContact O-CG 3.31Å
35	L	67.9	Low	70.2	Confident	76 Å²	76	81.1 Å²	81.1	40%	0.398	40%	0.4	S	S	.	.	H	α-helix	trans	-77.5	-44.3	174.3	-65.8	176.4	0	0	0	111	D32 K37 K38 K80	D32-L35 HydrophobicContact CB-CB 4.25Å; D32-L35 HydrophobicContact CB-CD1 4.19Å; D32-L35 HydrophobicContact CB-CG 4.33Å; D32-L35 PolarHBondContact OD1-N 2.94Å; L35-K37 VanDerWaalsContact C-N 3.34Å; L35-K37 PolarHBondContact O-N 3.03Å; L35-K38 PolarHBondContact O-N 3.2Å; L35-K80 WeakPolarHBondContact CD1-O 3.22Å
36	I	69.9	Low	69.8	Low	0 Å²	0	75.4 Å²	75.4	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-55.7	-46.6	173.4	-77.8	170.5	0	0	0	111.7	D32 K38 L39 L79 L138 L142	D32-I36 PolarHBondContact O-N 2.95Å; I36-K38 PolarHBondContact O-N 2.65Å; I36-K38 VanDerWaalsContact O-N 3.09Å; I36-L39 WeakPolarHBondContact O-CG 3.49Å; I36-L39 PolarHBondContact O-N 3.06Å; I36-L79 HydrophobicContact CD1-CB 4.47Å; I36-L79 HydrophobicContact CD1-CD2 4.11Å; I36-L79 WeakPolarHBondContact CD1-O 3.43Å; I36-L138 HydrophobicContact CB-CD2 4.37Å; I36-L138 HydrophobicContact CD1-CD2 3.66Å; I36-L138 HydrophobicContact CG2-CD2 4.28Å; I36-L142 HydrophobicContact CD1-CD1 4.25Å; I36-L142 HydrophobicContact CG2-CD1 4.44Å; I36-L142 HydrophobicContact CG2-CD2 3.54Å; I36-L142 HydrophobicContact CG2-CG 3.86Å
37	K	66.9	Low	69.6	Low	106 Å²	106	81 Å²	81	46%	0.461	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-8.9	179.1	-73.4	168	-172.1	163	0	114.3	Q33 L35 I141	Q33-K37 VanDerWaalsContact O-CB 3.31Å; Q33-K37 WeakPolarHBondContact O-CB 3.49Å; Q33-K37 VanDerWaalsContact O-CD 3.23Å; Q33-K37 WeakPolarHBondContact O-CD 3.29Å; Q33-K37 WeakPolarHBondContact O-CG 3.36Å; Q33-K37 PolarHBondContact O-N 3.23Å; L35-K37 VanDerWaalsContact C-N 3.34Å; L35-K37 PolarHBondContact O-N 3.03Å; K37-I141 HydrophobicContact CG-CG2 4.4Å
38	K	66.1	Low	69.5	Low	157 Å²	157	80.5 Å²	80.5	68%	0.683	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	0.3	178.3	-72.3	171.1	-174.2	172.1	0	113.6	T34 L35 I36	T34-K38 VanDerWaalsContact O-CD 3.27Å; T34-K38 WeakPolarHBondContact O-CD 3.36Å; T34-K38 VanDerWaalsContact O-CG 3.22Å; T34-K38 WeakPolarHBondContact O-CG 3.31Å; L35-K38 PolarHBondContact O-N 3.2Å; I36-K38 PolarHBondContact O-N 2.65Å; I36-K38 VanDerWaalsContact O-N 3.09Å
39	L	63.9	Low	69.7	Low	37 Å²	37	75.1 Å²	75.1	19%	0.194	39%	0.393	C	S	.	.	S	Bend	trans	-64	138.4	178.3	-66.7	171.7	0	0	0	111	I36 A41 W45 M77	I36-L39 WeakPolarHBondContact O-CG 3.49Å; I36-L39 PolarHBondContact O-N 3.06Å; L39-A41 PolarHBondContact O-N 3.3Å; L39-W45 HydrophobicContact CD1-CH2 4.4Å; L39-M77 HydrophobicContact CD1-SD 4.34Å
40	P	58.6	Low	69.7	Low	82 Å²	82	73 Å²	73	53%	0.532	39%	0.385	S	S	.	.			trans	-67	126.1	179.6	-18.4	31.5	0	0	0	111.3	V42 S43	P40-V42 PolarHBondContact O-N 3.4Å; P40-S43 PolarHBondContact O-OG 3.4Å
41	A	55.4	Low	69.9	Low	70 Å²	70	75.7 Å²	75.7	58%	0.579	40%	0.404	S	S	*	.	S	Bend	trans	-64	-10.6	179.3	0	0	0	0	0	114.4	L39	L39-A41 PolarHBondContact O-N 3.3Å
42	V	50.3	Low	69.2	Low	139 Å²	139	84.1 Å²	84.1	84%	0.842	44%	0.439	S	S	*	.	S	Bend	trans	-114.9	66.9	176.7	-166.9	0	0	0	0	108.8	P40	P40-V42 PolarHBondContact O-N 3.4Å
43	S	56.8	Low	68	Low	38 Å²	38	86 Å²	86	27%	0.266	45%	0.454	S	S	.	.	S	Bend	trans	-123.9	130.8	175.1	-55.1	0	0	0	0	108.1	P40 W45	P40-S43 PolarHBondContact O-OG 3.4Å; S43-W45 PolarHBondContact O-N 3.17Å; S43-W45 PolarHBondContact O-NE1 3.19Å
44	D	63.2	Low	66.6	Low	121 Å²	121	93.1 Å²	93.1	65%	0.647	49%	0.488	S	S	*	.			trans	-66.8	96.1	179.8	-64.5	-33.3	0	0	0	110.6	T46 R84	D44-T46 PolarHBondContact O-N 3.4Å; D44-R84 PolarHBondContact O-NH1 2.92Å; D44-R84 PolarHBondContact O-NH2 2.76Å
45	W	68.9	Low	64.7	Low	37 Å²	37	96.2 Å²	96.2	14%	0.14	50%	0.501	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-15.5	-174.5	-64.8	86.4	0	0	0	113.6	L39 S43 R47 M77 L113 L142 F146	L39-W45 HydrophobicContact CD1-CH2 4.4Å; S43-W45 PolarHBondContact O-N 3.17Å; S43-W45 PolarHBondContact O-NE1 3.19Å; W45-R47 PolarHBondContact O-N 3.11Å; W45-M77 HydrophobicContact CH2-SD 4.42Å; W45-M77 HydrophobicContact CZ3-CE 4.07Å; W45-M77 HydrophobicContact CZ3-SD 3.65Å; W45-L113 HydrophobicContact CE3-CD1 4.42Å; W45-L113 HydrophobicContact CE3-CD2 4.24Å; W45-L113 HydrophobicContact CZ3-CD2 4.47Å; W45-L142 HydrophobicContact CH2-CD2 4.44Å; W45-F146 HydrophobicContact CB-CD2 4.14Å; W45-F146 HydrophobicContact CB-CE2 3.76Å; W45-F146 HydrophobicContact CD2-CD2 4.1Å; W45-F146 HydrophobicContact CE3-CD2 4.15Å; W45-F146 HydrophobicContact CG-CD2 4.09Å; W45-F146 HydrophobicContact CG-CE2 4.23Å
46	T	73.2	Confident	63.1	Low	113 Å²	113	99.6 Å²	99.6	69%	0.693	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	4.9	-174.7	51.6	0	0	0	0	114.8	D44 L75	D44-T46 PolarHBondContact O-N 3.4Å; T46-L75 WeakPolarHBondContact O-CD1 3.46Å
47	R	78.1	Confident	61.3	Low	160 Å²	160	109.7 Å²	109.7	60%	0.604	56%	0.563	S	S	*	*	S	Bend	trans	-134.4	136.5	-179.6	-71.5	-176.1	137.8	170	-6.1	113.6	W45 R84	W45-R47 PolarHBondContact O-N 3.11Å; R47-R84 PolarHBondContact O-NE 2.86Å; R47-R84 PolarHBondContact O-NH2 3.36Å
48	C	80.9	Confident	59.9	Low	16 Å²	16	113.1 Å²	113.1	11%	0.108	58%	0.581	C	S	.	*			trans	-59.9	144.1	165.8	178.2	0	0	0	0	110.1	E50 C51 L75 R84 C86	C48-E50 VanDerWaalsContact C-N 3.31Å; C48-E50 PolarHBondContact O-N 3.14Å; C48-C51 HydrophobicContact CB-CB 4.17Å; C48-L75 HydrophobicContact CB-CD2 3.72Å; C48-R84 WeakPolarHBondContact CA-O 3.36Å; C48-R84 PolarHBondContact SG-O 3.18Å; C48-C86 HydrophobicContact CB-CB 4.43Å; C48-C86 PolarHBondContact SG-N 3.34Å
49	Q	81.3	Confident	58.1	Low	101 Å²	101	112.3 Å²	112.3	47%	0.472	58%	0.584	S	S	.	*	S	Bend	trans	-78.5	-12.2	-177.7	-73.5	169.4	-24.6	0	0	114.1	H83 R84	Q49-H83 VanDerWaalsContact OE1-CA 3.32Å; Q49-H83 PolarHBondContact OE1-ND1 2.86Å; Q49-R84 HydrophobicContact CG-CB 4.33Å; Q49-R84 PolarHBondContact N-O 2.87Å
50	E	78.3	Confident	56.7	Low	92 Å²	92	117.5 Å²	117.5	43%	0.43	61%	0.611	S	S	.	*	S	Bend	trans	-120.5	-15.2	-172.7	-66.3	179	-175.4	0	0	113.7	C48 K52 H83 H94	C48-E50 VanDerWaalsContact C-N 3.31Å; C48-E50 PolarHBondContact O-N 3.14Å; E50-K52 PolarHBondContact O-N 3.47Å; E50-H83 IonicContact OE1-CE1 3.29Å; E50-H83 PolarHBondContact OE1-CE1 3.29Å; E50-H83 IonicContact OE1-NE2 2.77Å; E50-H94 HydrophobicContact CB-CB 4.45Å; E50-H94 IonicContact OE2-CD2 2.71Å; E50-H94 PolarHBondContact OE2-CD2 3.11Å; E50-H94 IonicContact OE2-CG 2.69Å
51	C	81	Confident	55.1	Low	58 Å²	58	119.2 Å²	119.2	39%	0.392	62%	0.624	S	S	.	*	P	Polyproline II helix	trans	-70.8	124.8	170	-62.2	0	0	0	0	110.3	C48 H94	C48-C51 HydrophobicContact CB-CB 4.17Å; C51-H94 PolarHBondContact SG-ND1 3.48Å
52	K	67.6	Low	54.2	Low	190 Å²	190	124.5 Å²	124.5	83%	0.826	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-70.1	141.9	171.9	-63.8	178	-177.4	174	0	110	E50	E50-K52 PolarHBondContact O-N 3.47Å
53	P	53.4	Low	53.1	Low	87 Å²	87	124.9 Å²	124.9	57%	0.565	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-68.7	141.6	159.3	31.8	-32.6	0	0	0	109
54	E	42.8	Very low	51.9	Low	195 Å²	195	133 Å²	133	91%	0.911	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-89.7	123.3	172.9	-60.5	-151.7	136.9	0	0	110.6
55	D	33.4	Very low	50.2	Low	146 Å²	146	131.9 Å²	131.9	78%	0.781	68%	0.675	S	S	*	*			trans	-91.6	107.8	176.2	-81.3	-51.4	0	0	0	111
56	N	35.9	Very low	48.4	Very low	147 Å²	147	138.7 Å²	138.7	79%	0.786	71%	0.708	S	S	*	*			trans	44	126.7	153	-69.6	-36.4	0	0	0	120.7
57	K	30.6	Very low	46.4	Very low	212 Å²	212	143 Å²	143	92%	0.922	72%	0.72	S	S	*	*				-158.5	123.8	129.9	-112.5	154.7	-167.9	168.9	0	114
58	E	38.3	Very low	44	Very low	178 Å²	178	140.5 Å²	140.5	83%	0.832	73%	0.727	S	S	*	*			trans	-76.3	138.6	163.8	-56.1	172	129.4	0	0	109.8
59	N	28.4	Very low	41.8	Very low	139 Å²	139	145.9 Å²	145.9	74%	0.743	75%	0.751	S	S	*	*				172.5	120.5	126.7	-96.1	-69.3	0	0	0	114
60	I	33.5	Very low	39.8	Very low	147 Å²	147	150.3 Å²	150.3	75%	0.754	77%	0.771	S	S	*	*			trans	47.2	105.2	135	-51.3	170.7	0	0	0	118.7
61	S	27	Very low	38.2	Very low	117 Å²	117	153.9 Å²	153.9	82%	0.818	79%	0.788	S	S	*	*				168.7	164.7	107.9	49.5	0	0	0	0	113.3
62	M	36.4	Very low	37	Very low	182 Å²	182	157.6 Å²	157.6	90%	0.897	81%	0.81	S	S	*	*			trans	-86.9	129	-178	-63.2	164.3	57.4	0	0	113.2
63	T	25.6	Very low	36.9	Very low	146 Å²	146	152.4 Å²	152.4	90%	0.896	79%	0.793	S	S	*	*			trans	-159.6	162.8	141.2	10.9	0	0	0	0	111.5
64	K	33.1	Very low	37.9	Very low	208 Å²	208	150 Å²	150	90%	0.904	78%	0.778	S	S	*	*			trans	-68.6	138.8	179.2	-62.7	175	173.3	-176.7	0	113
65	S	27.4	Very low	40	Very low	99 Å²	99	142 Å²	142	69%	0.692	74%	0.741	S	S	*	*			trans	-176.9	144.6	131	49.2	0	0	0	0	111.4
66	E	30.8	Very low	42.5	Very low	179 Å²	179	136.6 Å²	136.6	84%	0.836	71%	0.71	S	S	*	*			trans	42.7	115.1	152.2	-72.1	140.1	-131.3	0	0	120.3	S68	E66-S68 PolarHBondContact O-N 3.2Å; E66-S68 VanDerWaalsContact O-N 3.11Å
67	E	29.8	Very low	45	Very low	203 Å²	203	129.6 Å²	129.6	95%	0.949	67%	0.673	S	S	*	*			trans	-77.3	88.4	167.5	-67.2	-177.6	139.9	0	0	110.8
68	S	29	Very low	47.8	Very low	109 Å²	109	119.6 Å²	119.6	76%	0.762	63%	0.629	S	S	*	*			trans	-78.5	117.7	164.3	58.2	0	0	0	0	110.1	E66	E66-S68 PolarHBondContact O-N 3.2Å; E66-S68 VanDerWaalsContact O-N 3.11Å
69	E	34.6	Very low	50.1	Low	128 Å²	128	111.1 Å²	111.1	60%	0.598	59%	0.589	S	S	*	*			trans	-71.8	132.1	173.6	-57	-152.8	105.4	0	0	111.2	E71 K794	E69-E71 PolarHBondContact O-N 2.97Å; E69-K794 WeakPolarHBondContact OE1-CD 3.48Å; E69-K794 WeakPolarHBondContact OE1-CE 3.43Å; E69-K794 IonicContact OE1-NZ 2.63Å; E69-K794 PolarHBondContact OE1-NZ 3.04Å
70	E	39.3	Very low	52.7	Low	194 Å²	194	105.4 Å²	105.4	91%	0.907	56%	0.558	S	S	*	*			trans	-71.3	93.1	172.7	-68	-173	151.4	0	0	110.4	T72	E70-T72 PolarHBondContact O-N 3.12Å
71	E	44.8	Very low	55.2	Low	167 Å²	167	100.2 Å²	100.2	78%	0.78	53%	0.534	S	S	*	.			trans	-58.7	125.8	174.4	-70	-167.1	145.1	0	0	111.5	E69 V73	E69-E71 PolarHBondContact O-N 2.97Å; E71-V73 PolarHBondContact O-N 3.1Å
72	T	54.6	Low	57.8	Low	137 Å²	137	94.9 Å²	94.9	84%	0.84	50%	0.498	S	S	*	.			trans	-71.2	103.1	175.1	54	0	0	0	0	110.5	E70	E70-T72 PolarHBondContact O-N 3.12Å
73	V	66.6	Low	60.1	Low	80 Å²	80	87.1 Å²	87.1	49%	0.485	46%	0.459	S	S	.	.			trans	-54.7	118.8	-173.6	177.9	0	0	0	0	112.5	E71 L75 C86	E71-V73 PolarHBondContact O-N 3.1Å; V73-L75 PolarHBondContact O-N 3.03Å; V73-C86 HydrophobicContact CG1-CB 3.68Å
74	P	74.9	Confident	63.1	Low	38 Å²	38	81.2 Å²	81.2	25%	0.247	42%	0.421	C	S	.	.			trans	-67.6	134.7	-176.1	25.3	-33.9	0	0	0	112	G87	P74-G87 PolarHBondContact O-N 2.75Å
75	L	85.6	Confident	65.6	Low	27 Å²	27	71.3 Å²	71.3	14%	0.141	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	127.4	-175.2	-69.3	177.2	0	0	0	112.3	T46 C48 V73 L113	T46-L75 WeakPolarHBondContact O-CD1 3.46Å; C48-L75 HydrophobicContact CB-CD2 3.72Å; V73-L75 PolarHBondContact O-N 3.03Å; L75-L113 HydrophobicContact CB-CD1 4.26Å; L75-L113 PolarHBondContact O-N 3Å
76	W	87.4	Confident	68.5	Low	31 Å²	31	66.7 Å²	66.7	12%	0.117	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	131.3	-174.9	-68.3	79.2	0	0	0	110.7	R84 G85 A95 V110 V111 S117 W119	W76-R84 WeakPolarHBondContact O-CA 3.41Å; W76-G85 PolarHBondContact N-O 2.95Å; W76-G85 PolarHBondContact O-N 2.87Å; W76-A95 HydrophobicContact CB-CB 3.82Å; W76-V110 HydrophobicContact CB-CB 4.31Å; W76-V110 HydrophobicContact CD2-CG2 4.29Å; W76-V110 HydrophobicContact CE3-CB 4.02Å; W76-V110 HydrophobicContact CE3-CG2 3.48Å; W76-V110 VanDerWaalsContact CE3-CG2 3.48Å; W76-V110 HydrophobicContact CZ3-CG2 4.09Å; W76-V111 WeakPolarHBondContact CA-O 3.08Å; W76-S117 WeakPolarHBondContact CH2-OG 3.39Å; W76-W119 HydrophobicContact CE3-CB 4.48Å; W76-W119 HydrophobicContact CH2-CB 4.23Å; W76-W119 HydrophobicContact CZ3-CB 3.77Å
77	M	87.2	Confident	70.8	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.005	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	129.2	-179.2	-179.5	-179.5	58.6	0	0	112	L39 W45 L79 H83 R84 V110 V111 L113 L142	L39-M77 HydrophobicContact CD1-SD 4.34Å; W45-M77 HydrophobicContact CH2-SD 4.42Å; W45-M77 HydrophobicContact CZ3-CE 4.07Å; W45-M77 HydrophobicContact CZ3-SD 3.65Å; M77-L79 PolarHBondContact O-N 3.31Å; M77-H83 CarbonylContact C-O 3.5Å; M77-H83 VanDerWaalsContact CA-O 3.29Å; M77-H83 WeakPolarHBondContact CA-O 3.27Å; M77-R84 HydrophobicContact CB-CG 4.33Å; M77-R84 HydrophobicContact CG-CG 4.16Å; M77-V110 CarbonylContact O-C 3.56Å; M77-V110 WeakPolarHBondContact O-CA 3.38Å; M77-V111 HydrophobicContact CB-CG1 4.09Å; M77-V111 HydrophobicContact CE-CG1 3.73Å; M77-V111 PolarHBondContact N-O 3.31Å; M77-V111 PolarHBondContact O-N 2.88Å; M77-L113 HydrophobicContact CB-CD2 4.03Å; M77-L113 HydrophobicContact CB-CG 4.31Å; M77-L113 HydrophobicContact CE-CD2 3.98Å; M77-L113 HydrophobicContact SD-CD2 4.47Å; M77-L142 HydrophobicContact CE-CD1 3.59Å; M77-L142 HydrophobicContact CE-CD2 3.7Å; M77-L142 HydrophobicContact CE-CG 4.23Å
78	C	89.1	Confident	72.8	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.007	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	120.5	176.5	-178.8	0	0	0	0	111.9	K80 C81 G82 H83 V110	C78-K80 PolarHBondContact O-N 3.5Å; C78-K80 VanDerWaalsContact O-N 3.09Å; C78-C81 PolarHBondContact O-N 2.93Å; C78-G82 WeakPolarHBondContact O-CA 3.37Å; C78-G82 PolarHBondContact O-N 3.28Å; C78-H83 PolarHBondContact N-O 3.46Å; C78-V110 HydrophobicContact CB-CG1 4.43Å
79	L	86.8	Confident	74.7	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-1.6	-178	-69.4	177	0	0	0	114.3	G30 T31 D32 I36 M77 L109 V111 V118 L135 L139 L142	G30-L79 CarbonylContact O-C 3.58Å; T31-L79 WeakPolarHBondContact CA-O 3.17Å; T31-L79 HydrophobicContact CG2-CB 4Å; T31-L79 HydrophobicContact CG2-CD1 4.31Å; D32-L79 PolarHBondContact N-O 3.12Å; I36-L79 HydrophobicContact CD1-CB 4.47Å; I36-L79 HydrophobicContact CD1-CD2 4.11Å; I36-L79 WeakPolarHBondContact CD1-O 3.43Å; M77-L79 PolarHBondContact O-N 3.31Å; L79-L109 HydrophobicContact CB-CB 4.39Å; L79-L109 HydrophobicContact CD1-CB 4.39Å; L79-L109 PolarHBondContact N-O 2.9Å; L79-V111 HydrophobicContact CD1-CB 4.38Å; L79-V111 HydrophobicContact CD2-CB 3.99Å; L79-V111 HydrophobicContact CD2-CG1 3.61Å; L79-V111 HydrophobicContact CG-CB 4.23Å; L79-V111 HydrophobicContact CG-CG1 4.19Å; L79-V118 HydrophobicContact CD1-CG1 3.87Å; L79-V118 HydrophobicContact CD1-CG2 4.28Å; L79-L135 HydrophobicContact CD1-CD1 3.71Å; L79-L139 HydrophobicContact CD2-CD2 4.47Å; L79-L142 HydrophobicContact CD2-CD1 3.71Å
80	K	84.2	Confident	76.7	Confident	20 Å²	20	48.2 Å²	48.2	9%	0.087	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-27.2	175.5	-161.7	161.2	-177.1	166.3	0	114.3	K29 G30 D32 L35 C78 D105 P106	K29-K80 WeakPolarHBondContact O-CE 3.43Å; K29-K80 PolarHBondContact O-NZ 2.95Å; G30-K80 PolarHBondContact O-N 2.86Å; D32-K80 HydrophobicContact CB-CG 4.42Å; L35-K80 WeakPolarHBondContact CD1-O 3.22Å; C78-K80 PolarHBondContact O-N 3.5Å; C78-K80 VanDerWaalsContact O-N 3.09Å; K80-D105 WeakPolarHBondContact CE-OD1 3.39Å; K80-D105 VanDerWaalsContact NZ-CG 3.31Å; K80-D105 IonicContact NZ-OD1 3.25Å; K80-D105 PolarHBondContact NZ-OD1 3.14Å; K80-P106 WeakPolarHBondContact CD-O 3.37Å; K80-P106 PolarHBondContact NZ-O 2.69Å
81	C	84.8	Confident	78.2	Confident	37 Å²	37	47.7 Å²	47.7	25%	0.25	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-141.5	-8	-172.2	66.9	0	0	0	0	115.5	C78 H83 H98 H107	C78-C81 PolarHBondContact O-N 2.93Å; C81-H83 VanDerWaalsContact C-N 3.28Å; C81-H83 PolarHBondContact O-N 3.45Å; C81-H98 PolarHBondContact SG-NE2 3.41Å; C81-H98 VanDerWaalsContact SG-NE2 3.35Å; C81-H107 PolarHBondContact SG-CE1 3.35Å; C81-H107 PolarHBondContact SG-ND1 3.43Å
82	G	81.9	Confident	79.7	Confident	6 Å²	6	43.1 Å²	43.1	6%	0.062	23%	0.228	C	C	.	.			trans	73.9	9.4	-178.3	0	0	0	0	0	115.6	C78 R84	C78-G82 WeakPolarHBondContact O-CA 3.37Å; C78-G82 PolarHBondContact O-N 3.28Å; G82-R84 WeakPolarHBondContact O-CG 3.37Å
83	H	85.1	Confident	81.1	Confident	18 Å²	18	40.4 Å²	40.4	8%	0.083	21%	0.206	C	C	.	.			trans	-62.5	143.8	169.9	171.2	82.1	0	0	0	111	Q49 E50 M77 C78 C81 H98	Q49-H83 VanDerWaalsContact OE1-CA 3.32Å; Q49-H83 PolarHBondContact OE1-ND1 2.86Å; E50-H83 IonicContact OE1-CE1 3.29Å; E50-H83 PolarHBondContact OE1-CE1 3.29Å; E50-H83 IonicContact OE1-NE2 2.77Å; M77-H83 CarbonylContact C-O 3.5Å; M77-H83 VanDerWaalsContact CA-O 3.29Å; M77-H83 WeakPolarHBondContact CA-O 3.27Å; C78-H83 PolarHBondContact N-O 3.46Å; C81-H83 VanDerWaalsContact C-N 3.28Å; C81-H83 PolarHBondContact O-N 3.45Å; H83-H98 WeakPolarHBondContact CB-NE2 3.13Å; H83-H98 AromaticContact CD2-CD2 3.83Å; H83-H98 AromaticContact CD2-CE1 2.99Å; H83-H98 PolarHBondContact CD2-CE1 3.2Å; H83-H98 AromaticContact CD2-CG 3.23Å; H83-H98 AromaticContact CD2-ND1 3.09Å; H83-H98 PolarHBondContact CD2-ND1 3Å; H83-H98 AromaticContact CE1-CE1 3.24Å; H83-H98 PolarHBondContact CE1-CE1 3.26Å; H83-H98 AromaticContact CE1-ND1 3.93Å; H83-H98 AromaticContact CG-CE1 3.04Å; H83-H98 AromaticContact CG-CG 3.82Å; H83-H98 AromaticContact CG-ND1 3.22Å; H83-H98 AromaticContact CG-NE2 3.43Å; H83-H98 AromaticContact ND1-CE1 3.22Å; H83-H98 PolarHBondContact ND1-CE1 3.36Å; H83-H98 AromaticContact ND1-ND1 3.77Å; H83-H98 AromaticContact NE2-CE1 3.13Å; H83-H98 PolarHBondContact NE2-CE1 3.09Å; H83-H98 AromaticContact NE2-CG 3.78Å; H83-H98 AromaticContact NE2-ND1 3.59Å
84	R	88	Confident	82.1	Confident	22 Å²	22	37.6 Å²	37.6	8%	0.083	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	106.2	-173	-51.2	178.6	-49.3	-159.7	12.3	111.8	D44 R47 C48 Q49 W76 M77 G82	D44-R84 PolarHBondContact O-NH1 2.92Å; D44-R84 PolarHBondContact O-NH2 2.76Å; R47-R84 PolarHBondContact O-NE 2.86Å; R47-R84 PolarHBondContact O-NH2 3.36Å; C48-R84 WeakPolarHBondContact CA-O 3.36Å; C48-R84 PolarHBondContact SG-O 3.18Å; Q49-R84 HydrophobicContact CG-CB 4.33Å; Q49-R84 PolarHBondContact N-O 2.87Å; W76-R84 WeakPolarHBondContact O-CA 3.41Å; M77-R84 HydrophobicContact CB-CG 4.33Å; M77-R84 HydrophobicContact CG-CG 4.16Å; G82-R84 WeakPolarHBondContact O-CG 3.37Å
85	G	85.6	Confident	82.6	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	157.5	178.4	0	0	0	0	0	112.7	W76	W76-G85 PolarHBondContact N-O 2.95Å; W76-G85 PolarHBondContact O-N 2.87Å
86	C	87.7	Confident	82.6	Confident	2 Å²	2	35.7 Å²	35.7	1%	0.014	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	148.3	165.2	55.8	0	0	0	0	111	C48 V73 S90 Q93 H94 A95	C48-C86 HydrophobicContact CB-CB 4.43Å; C48-C86 PolarHBondContact SG-N 3.34Å; V73-C86 HydrophobicContact CG1-CB 3.68Å; C86-S90 VanDerWaalsContact CB-OG 3.31Å; C86-S90 WeakPolarHBondContact CB-OG 3.45Å; C86-S90 PolarHBondContact SG-OG 3.47Å; C86-Q93 CarbonylContact O-C 3.45Å; C86-H94 PolarHBondContact O-N 2.98Å; C86-H94 PolarHBondContact SG-N 3.33Å; C86-H94 VanDerWaalsContact SG-N 3.4Å; C86-H94 PolarHBondContact SG-ND1 3.45Å; C86-A95 WeakPolarHBondContact O-CB 3.29Å; C86-A95 PolarHBondContact O-N 3.33Å; C86-A95 VanDerWaalsContact O-N 3.14Å
87	G	79.1	Confident	82.5	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.189	C	C	.	.			trans	-73.4	-179.3	-169.8	0	0	0	0	0	116	P74 N89 S90	P74-G87 PolarHBondContact O-N 2.75Å; G87-N89 VanDerWaalsContact C-N 3.28Å; G87-N89 PolarHBondContact O-N 3Å; G87-S90 WeakPolarHBondContact O-CB 3.35Å; G87-S90 PolarHBondContact O-N 3.42Å; G87-S90 PolarHBondContact O-OG 3.43Å
88	R	71.9	Confident	82.5	Confident	77 Å²	77	39.5 Å²	39.5	29%	0.291	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-36.1	-173.8	-39.6	-170.8	102	173.7	1.5	112.7	S90 Q93 I96 W119 D124	R88-S90 VanDerWaalsContact C-N 3.26Å; R88-S90 PolarHBondContact O-N 2.96Å; R88-Q93 PolarHBondContact O-NE2 2.84Å; R88-I96 HydrophobicContact CB-CD1 4.19Å; R88-I96 HydrophobicContact CG-CD1 4.06Å; R88-W119 VanDerWaalsContact NH1-NE1 3.2Å; R88-D124 IonicContact CZ-OD1 3.15Å; R88-D124 IonicContact NH1-OD1 3.51Å; R88-D124 PolarHBondContact NH1-OD1 2.79Å; R88-D124 IonicContact NH2-OD1 2.87Å; R88-D124 PolarHBondContact NH2-OD1 3.17Å; R88-D124 IonicContact NH2-OD2 2.85Å
89	N	69.8	Low	82.4	Confident	142 Å²	142	42.5 Å²	42.5	76%	0.759	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-10.5	179.6	-55.2	53.6	0	0	0	113.3	G87	G87-N89 VanDerWaalsContact C-N 3.28Å; G87-N89 PolarHBondContact O-N 3Å
90	S	75.4	Confident	82.3	Confident	13 Å²	13	48.7 Å²	48.7	9%	0.091	23%	0.234	C	C	.	.	S	Bend	trans	-84.3	142.1	176	73.8	0	0	0	0	111.1	C86 G87 R88 N92 Q93	C86-S90 VanDerWaalsContact CB-OG 3.31Å; C86-S90 WeakPolarHBondContact CB-OG 3.45Å; C86-S90 PolarHBondContact SG-OG 3.47Å; G87-S90 WeakPolarHBondContact O-CB 3.35Å; G87-S90 PolarHBondContact O-N 3.42Å; G87-S90 PolarHBondContact O-OG 3.43Å; R88-S90 VanDerWaalsContact C-N 3.26Å; R88-S90 PolarHBondContact O-N 2.96Å; S90-N92 PolarHBondContact O-N 2.89Å; S90-N92 VanDerWaalsContact O-N 3.08Å; S90-Q93 WeakPolarHBondContact O-CG 3.29Å; S90-Q93 PolarHBondContact O-N 3.15Å; S90-Q93 PolarHBondContact OG-N 3.46Å
91	E	72	Confident	82.3	Confident	183 Å²	183	50.6 Å²	50.6	86%	0.855	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.5	-37.1	177.2	-174.6	-173.3	-152.2	0	0	113.1
92	N	75.6	Confident	81.9	Confident	71 Å²	71	54.9 Å²	54.9	38%	0.38	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-16.4	-172.9	-78.9	-77.1	0	0	0	115.2	S90 H94 K97	S90-N92 PolarHBondContact O-N 2.89Å; S90-N92 VanDerWaalsContact O-N 3.08Å; N92-H94 PolarHBondContact O-N 2.95Å; N92-K97 WeakPolarHBondContact O-CD 3.32Å; N92-K97 WeakPolarHBondContact O-CE 3.48Å; N92-K97 PolarHBondContact O-NZ 3.24Å
93	Q	85.1	Confident	81.9	Confident	80 Å²	80	59.9 Å²	59.9	37%	0.374	29%	0.292	S	S	.	.			trans	43.1	35.1	173	-55.9	-169.3	-9.4	0	0	116.7	C86 R88 S90 A95 I96 K97	C86-Q93 CarbonylContact O-C 3.45Å; R88-Q93 PolarHBondContact O-NE2 2.84Å; S90-Q93 WeakPolarHBondContact O-CG 3.29Å; S90-Q93 PolarHBondContact O-N 3.15Å; S90-Q93 PolarHBondContact OG-N 3.46Å; Q93-A95 PolarHBondContact O-N 3.43Å; Q93-I96 HydrophobicContact CB-CB 4.45Å; Q93-I96 HydrophobicContact CB-CD1 4.35Å; Q93-I96 PolarHBondContact O-N 3.47Å; Q93-K97 PolarHBondContact O-N 2.75Å
94	H	86.7	Confident	81.4	Confident	20 Å²	20	65 Å²	65	9%	0.093	33%	0.33	C	S	.	.	H	α-helix	trans	-56.2	-29.9	-172.7	-66.9	125.1	0	0	0	113.4	E50 C51 C86 N92 I96 K97 H98	E50-H94 HydrophobicContact CB-CB 4.45Å; E50-H94 IonicContact OE2-CD2 2.71Å; E50-H94 PolarHBondContact OE2-CD2 3.11Å; E50-H94 IonicContact OE2-CG 2.69Å; C51-H94 PolarHBondContact SG-ND1 3.48Å; C86-H94 PolarHBondContact O-N 2.98Å; C86-H94 PolarHBondContact SG-N 3.33Å; C86-H94 VanDerWaalsContact SG-N 3.4Å; C86-H94 PolarHBondContact SG-ND1 3.45Å; N92-H94 PolarHBondContact O-N 2.95Å; H94-I96 VanDerWaalsContact C-N 3.33Å; H94-I96 PolarHBondContact O-N 3.22Å; H94-K97 PolarHBondContact O-N 2.99Å; H94-H98 VanDerWaalsContact O-CB 3.29Å; H94-H98 WeakPolarHBondContact O-CB 3.12Å; H94-H98 PolarHBondContact O-N 3.13Å
95	A	85.9	Confident	80.9	Confident	3 Å²	3	68 Å²	68	3%	0.025	35%	0.347	C	S	.	.	H	α-helix	trans	-65.5	-32.9	176.7	0	0	0	0	0	113.6	W76 C86 Q93 Y121	W76-A95 HydrophobicContact CB-CB 3.82Å; C86-A95 WeakPolarHBondContact O-CB 3.29Å; C86-A95 PolarHBondContact O-N 3.33Å; C86-A95 VanDerWaalsContact O-N 3.14Å; Q93-A95 PolarHBondContact O-N 3.43Å; A95-Y121 WeakPolarHBondContact CB-OH 3.5Å; A95-Y121 WeakPolarHBondContact O-CE2 3.39Å
96	I	86.3	Confident	80.6	Confident	22 Å²	22	70.6 Å²	70.6	11%	0.113	36%	0.364	C	S	.	.	H	α-helix	trans	-76.2	-49.9	174.5	-65.2	171.5	0	0	0	109.7	R88 Q93 H94 H98 Y99 E100 Y121	R88-I96 HydrophobicContact CB-CD1 4.19Å; R88-I96 HydrophobicContact CG-CD1 4.06Å; Q93-I96 HydrophobicContact CB-CB 4.45Å; Q93-I96 HydrophobicContact CB-CD1 4.35Å; Q93-I96 PolarHBondContact O-N 3.47Å; H94-I96 VanDerWaalsContact C-N 3.33Å; H94-I96 PolarHBondContact O-N 3.22Å; I96-H98 PolarHBondContact O-N 3.09Å; I96-H98 VanDerWaalsContact O-N 3.15Å; I96-Y99 WeakPolarHBondContact O-CA 3.48Å; I96-Y99 WeakPolarHBondContact O-CB 3.45Å; I96-Y99 PolarHBondContact O-N 2.92Å; I96-E100 HydrophobicContact CG2-CG 4.11Å; I96-E100 PolarHBondContact O-N 3.07Å; I96-Y121 HydrophobicContact CG1-CE1 4.02Å
97	K	85.3	Confident	80.6	Confident	92 Å²	92	71.6 Å²	71.6	40%	0.4	37%	0.369	S	S	.	.	H	α-helix	trans	-54.9	-36.5	178.5	-67	173.5	178.4	165.8	0	112.3	N92 Q93 H94 Y99 E100 T101	N92-K97 WeakPolarHBondContact O-CD 3.32Å; N92-K97 WeakPolarHBondContact O-CE 3.48Å; N92-K97 PolarHBondContact O-NZ 3.24Å; Q93-K97 PolarHBondContact O-N 2.75Å; H94-K97 PolarHBondContact O-N 2.99Å; K97-Y99 VanDerWaalsContact C-N 3.34Å; K97-Y99 PolarHBondContact O-N 2.94Å; K97-E100 PolarHBondContact O-N 3.27Å; K97-T101 PolarHBondContact O-N 3.49Å; K97-T101 PolarHBondContact O-OG1 3.4Å
98	H	86.5	Confident	80.9	Confident	20 Å²	20	71.7 Å²	71.7	9%	0.093	37%	0.369	C	S	.	.	H	α-helix	trans	-63.1	-36.1	175.1	-179.4	83.3	0	0	0	114	C81 H83 H94 I96 R103 H107	C81-H98 PolarHBondContact SG-NE2 3.41Å; C81-H98 VanDerWaalsContact SG-NE2 3.35Å; H83-H98 WeakPolarHBondContact CB-NE2 3.13Å; H83-H98 AromaticContact CD2-CD2 3.83Å; H83-H98 AromaticContact CD2-CE1 2.99Å; H83-H98 PolarHBondContact CD2-CE1 3.2Å; H83-H98 AromaticContact CD2-CG 3.23Å; H83-H98 AromaticContact CD2-ND1 3.09Å; H83-H98 PolarHBondContact CD2-ND1 3Å; H83-H98 AromaticContact CE1-CE1 3.24Å; H83-H98 PolarHBondContact CE1-CE1 3.26Å; H83-H98 AromaticContact CE1-ND1 3.93Å; H83-H98 AromaticContact CG-CE1 3.04Å; H83-H98 AromaticContact CG-CG 3.82Å; H83-H98 AromaticContact CG-ND1 3.22Å; H83-H98 AromaticContact CG-NE2 3.43Å; H83-H98 AromaticContact ND1-CE1 3.22Å; H83-H98 PolarHBondContact ND1-CE1 3.36Å; H83-H98 AromaticContact ND1-ND1 3.77Å; H83-H98 AromaticContact NE2-CE1 3.13Å; H83-H98 PolarHBondContact NE2-CE1 3.09Å; H83-H98 AromaticContact NE2-CG 3.78Å; H83-H98 AromaticContact NE2-ND1 3.59Å; H94-H98 VanDerWaalsContact O-CB 3.29Å; H94-H98 WeakPolarHBondContact O-CB 3.12Å; H94-H98 PolarHBondContact O-N 3.13Å; I96-H98 PolarHBondContact O-N 3.09Å; I96-H98 VanDerWaalsContact O-N 3.15Å; H98-R103 PolarHBondContact ND1-NH2 2.88Å; H98-H107 AromaticContact CD2-ND1 3.77Å; H98-H107 AromaticContact NE2-ND1 3.89Å
99	Y	85.6	Confident	81.7	Confident	65 Å²	65	68 Å²	68	26%	0.255	36%	0.355	S	S	.	.	H	α-helix	trans	-76.2	-40	175.8	156.7	-106.2	0	0	0	112	I96 K97 T101 C108 Y121 M122	I96-Y99 WeakPolarHBondContact O-CA 3.48Å; I96-Y99 WeakPolarHBondContact O-CB 3.45Å; I96-Y99 PolarHBondContact O-N 2.92Å; K97-Y99 VanDerWaalsContact C-N 3.34Å; K97-Y99 PolarHBondContact O-N 2.94Å; Y99-T101 VanDerWaalsContact C-N 3.26Å; Y99-T101 PolarHBondContact O-N 3.32Å; Y99-C108 HydrophobicContact CD2-CB 4.2Å; Y99-C108 HydrophobicContact CE2-CB 3.87Å; Y99-Y121 AromaticContact CD1-CD2 3.94Å; Y99-Y121 HydrophobicContact CD1-CD2 3.94Å; Y99-Y121 AromaticContact CD1-CG 3.96Å; Y99-Y121 HydrophobicContact CD1-CG 3.96Å; Y99-Y121 HydrophobicContact CD2-CD2 4.21Å; Y99-Y121 VanDerWaalsContact CE1-CB 3.46Å; Y99-Y121 HydrophobicContact CE1-CG 4.34Å; Y99-Y121 AromaticContact CG-CD2 3.64Å; Y99-Y121 HydrophobicContact CG-CD2 3.64Å; Y99-Y121 HydrophobicContact CG-CG 4.09Å; Y99-Y121 PolarHBondContact OH-O 3.48Å; Y99-M122 HydrophobicContact CE2-CG 4.07Å; Y99-M122 HydrophobicContact CE2-SD 4.34Å; Y99-M122 PolarHBondContact OH-SD 3.4Å; Y99-M122 VanDerWaalsContact OH-SD 3.33Å
100	E	85.4	Confident	82.6	Confident	130 Å²	130	61.4 Å²	61.4	61%	0.607	32%	0.32	S	S	*	.	H	α-helix	trans	-69.5	-22.3	176.8	-66.1	177.3	148.4	0	0	113.1	I96 K97 P102	I96-E100 HydrophobicContact CG2-CG 4.11Å; I96-E100 PolarHBondContact O-N 3.07Å; K97-E100 PolarHBondContact O-N 3.27Å; E100-P102 WeakPolarHBondContact O-CD 3.29Å
101	T	84.5	Confident	83.2	Confident	60 Å²	60	60.8 Å²	60.8	37%	0.368	32%	0.315	S	S	.	.	S	Bend	trans	-58.6	117.9	175.5	-60.8	0	0	0	0	110.4	K97 Y99 R103	K97-T101 PolarHBondContact O-N 3.49Å; K97-T101 PolarHBondContact O-OG1 3.4Å; Y99-T101 VanDerWaalsContact C-N 3.26Å; Y99-T101 PolarHBondContact O-N 3.32Å; T101-R103 WeakPolarHBondContact O-CG 3.42Å; T101-R103 PolarHBondContact O-N 3.04Å
102	P	77.3	Confident	84	Confident	127 Å²	127	52 Å²	52	83%	0.825	28%	0.275	S	S	*	.			trans	-66.7	124.7	-175.9	25.5	-33.7	0	0	0	111.6	E100	E100-P102 WeakPolarHBondContact O-CD 3.29Å
103	R	81.9	Confident	84.2	Confident	111 Å²	111	49.2 Å²	49.2	42%	0.419	26%	0.259	S	S	.	.			trans	-137.1	163.4	-178.6	-64.3	171.2	-161.7	-84	-1.7	109.5	H98 T101 D105	H98-R103 PolarHBondContact ND1-NH2 2.88Å; T101-R103 WeakPolarHBondContact O-CG 3.42Å; T101-R103 PolarHBondContact O-N 3.04Å; R103-D105 PolarHBondContact O-N 3.22Å
104	S	73.1	Confident	83.9	Confident	126 Å²	126	49.7 Å²	49.7	88%	0.881	27%	0.265	S	S	*	.	S	Bend	trans	-64.8	-14.5	173.1	55.7	0	0	0	0	114
105	D	78	Confident	83.5	Confident	84 Å²	84	53.2 Å²	53.2	45%	0.449	28%	0.284	S	S	.	.	S	Bend	trans	-140.8	132.8	-168.1	-111.6	-58.9	0	0	0	109.9	K80 R103 H107	K80-D105 WeakPolarHBondContact CE-OD1 3.39Å; K80-D105 VanDerWaalsContact NZ-CG 3.31Å; K80-D105 IonicContact NZ-OD1 3.25Å; K80-D105 PolarHBondContact NZ-OD1 3.14Å; R103-D105 PolarHBondContact O-N 3.22Å; D105-H107 PolarHBondContact O-CD2 3.07Å; D105-H107 VanDerWaalsContact O-CD2 3.28Å; D105-H107 PolarHBondContact O-N 2.95Å
106	P	79.2	Confident	83.4	Confident	55 Å²	55	54.6 Å²	54.6	36%	0.357	29%	0.289	S	S	.	.			trans	-74.7	126.5	-174.8	27.8	-34.6	0	0	0	111.7	K29 K80 C108	K29-P106 HydrophobicContact CB-CG 4.42Å; K80-P106 WeakPolarHBondContact CD-O 3.37Å; K80-P106 PolarHBondContact NZ-O 2.69Å; P106-C108 VanDerWaalsContact C-N 3.28Å; P106-C108 HydrophobicContact CB-CB 4.46Å; P106-C108 PolarHBondContact O-N 3.4Å
107	H	87.4	Confident	83.5	Confident	23 Å²	23	54.3 Å²	54.3	11%	0.106	29%	0.289	C	S	.	.			trans	-94.2	46	177.2	-78.3	-146	0	0	0	111.2	C81 H98 D105 L109	C81-H107 PolarHBondContact SG-CE1 3.35Å; C81-H107 PolarHBondContact SG-ND1 3.43Å; H98-H107 AromaticContact CD2-ND1 3.77Å; H98-H107 AromaticContact NE2-ND1 3.89Å; D105-H107 PolarHBondContact O-CD2 3.07Å; D105-H107 VanDerWaalsContact O-CD2 3.28Å; D105-H107 PolarHBondContact O-N 2.95Å; H107-L109 PolarHBondContact O-N 3.38Å
108	C	86.7	Confident	83.6	Confident	1 Å²	1	50 Å²	50	1%	0.007	27%	0.27	C	S	.	.			trans	-86.3	7.8	-162.4	58.4	0	0	0	0	116.8	Y99 P106 C120 Y121 M122	Y99-C108 HydrophobicContact CD2-CB 4.2Å; Y99-C108 HydrophobicContact CE2-CB 3.87Å; P106-C108 VanDerWaalsContact C-N 3.28Å; P106-C108 HydrophobicContact CB-CB 4.46Å; P106-C108 PolarHBondContact O-N 3.4Å; C108-C120 WeakPolarHBondContact O-CA 3.5Å; C108-C120 PolarHBondContact O-SG 3.42Å; C108-Y121 PolarHBondContact O-N 3.45Å; C108-Y121 VanDerWaalsContact O-N 3.14Å; C108-M122 HydrophobicContact CB-CB 4.03Å; C108-M122 HydrophobicContact CB-CG 3.29Å
109	L	88.1	Confident	83.8	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	131.4	179.2	-72.3	169	0	0	0	111	T31 L79 H107 V118 W119 C120 V127	T31-L109 HydrophobicContact CG2-CD1 3.91Å; L79-L109 HydrophobicContact CB-CB 4.39Å; L79-L109 HydrophobicContact CD1-CB 4.39Å; L79-L109 PolarHBondContact N-O 2.9Å; H107-L109 PolarHBondContact O-N 3.38Å; L109-V118 HydrophobicContact CD2-CG1 4.12Å; L109-W119 WeakPolarHBondContact CA-O 3.41Å; L109-C120 HydrophobicContact CD2-CB 3.52Å; L109-V127 HydrophobicContact CD2-CG2 3.8Å
110	V	88.5	Confident	84	Confident	3 Å²	3	48.6 Å²	48.6	2%	0.018	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	152.9	176	-69.8	0	0	0	0	110.6	W76 M77 C78 V118 W119 Y121	W76-V110 HydrophobicContact CB-CB 4.31Å; W76-V110 HydrophobicContact CD2-CG2 4.29Å; W76-V110 HydrophobicContact CE3-CB 4.02Å; W76-V110 HydrophobicContact CE3-CG2 3.48Å; W76-V110 VanDerWaalsContact CE3-CG2 3.48Å; W76-V110 HydrophobicContact CZ3-CG2 4.09Å; M77-V110 CarbonylContact O-C 3.56Å; M77-V110 WeakPolarHBondContact O-CA 3.38Å; C78-V110 HydrophobicContact CB-CG1 4.43Å; V110-V118 CarbonylContact O-C 3.47Å; V110-V118 VanDerWaalsContact O-CA 3.31Å; V110-V118 WeakPolarHBondContact O-CA 3.3Å; V110-W119 HydrophobicContact CG2-CB 3.86Å; V110-W119 PolarHBondContact N-O 2.87Å; V110-W119 VanDerWaalsContact N-O 3.13Å; V110-W119 PolarHBondContact O-N 3.38Å; V110-Y121 HydrophobicContact CB-CE2 4.42Å; V110-Y121 HydrophobicContact CG1-CE2 3.67Å; V110-Y121 HydrophobicContact CG2-CE1 4.39Å; V110-Y121 HydrophobicContact CG2-CE2 3.8Å
111	V	88.8	Confident	84.1	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	136.7	171.4	61.1	0	0	0	0	110	W76 M77 L79 W116 S117 V118 L139 L142	W76-V111 WeakPolarHBondContact CA-O 3.08Å; M77-V111 HydrophobicContact CB-CG1 4.09Å; M77-V111 HydrophobicContact CE-CG1 3.73Å; M77-V111 PolarHBondContact N-O 3.31Å; M77-V111 PolarHBondContact O-N 2.88Å; L79-V111 HydrophobicContact CD1-CB 4.38Å; L79-V111 HydrophobicContact CD2-CB 3.99Å; L79-V111 HydrophobicContact CD2-CG1 3.61Å; L79-V111 HydrophobicContact CG-CB 4.23Å; L79-V111 HydrophobicContact CG-CG1 4.19Å; V111-W116 HydrophobicContact CG2-CE3 4.01Å; V111-S117 VanDerWaalsContact CA-O 3.3Å; V111-S117 WeakPolarHBondContact CA-O 3.48Å; V111-S117 WeakPolarHBondContact CG2-O 3.45Å; V111-V118 HydrophobicContact CB-CG2 4.35Å; V111-V118 HydrophobicContact CG2-CG2 4.27Å; V111-L139 HydrophobicContact CB-CD2 4.13Å; V111-L139 HydrophobicContact CG2-CD2 3.54Å; V111-L142 HydrophobicContact CG1-CD1 4.48Å
112	G	87.5	Confident	84	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	124.5	168.3	0	0	0	0	0	110.2	D114 W116 S117	G112-D114 VanDerWaalsContact C-OD1 3.29Å; G112-D114 WeakPolarHBondContact CA-OD1 3.47Å; G112-D114 PolarHBondContact O-N 3Å; G112-W116 VanDerWaalsContact O-CA 3.22Å; G112-W116 WeakPolarHBondContact O-CA 3.48Å; G112-W116 PolarHBondContact O-N 3.01Å; G112-S117 PolarHBondContact N-O 3.42Å
113	L	81.2	Confident	84.4	Confident	11 Å²	11	42 Å²	42	6%	0.058	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-17.1	-179	-65.3	178.2	0	0	0	113	W45 L75 M77 W116 F146	W45-L113 HydrophobicContact CE3-CD1 4.42Å; W45-L113 HydrophobicContact CE3-CD2 4.24Å; W45-L113 HydrophobicContact CZ3-CD2 4.47Å; L75-L113 HydrophobicContact CB-CD1 4.26Å; L75-L113 PolarHBondContact O-N 3Å; M77-L113 HydrophobicContact CB-CD2 4.03Å; M77-L113 HydrophobicContact CB-CG 4.31Å; M77-L113 HydrophobicContact CE-CD2 3.98Å; M77-L113 HydrophobicContact SD-CD2 4.47Å; L113-W116 PolarHBondContact O-NE1 2.88Å; L113-F146 HydrophobicContact CB-CE2 4.45Å
114	D	77.7	Confident	84.5	Confident	91 Å²	91	41.3 Å²	41.3	49%	0.487	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-62.6	176.7	52	-11.8	0	0	0	112.2	G112	G112-D114 VanDerWaalsContact C-OD1 3.29Å; G112-D114 WeakPolarHBondContact CA-OD1 3.47Å; G112-D114 PolarHBondContact O-N 3Å
115	N	79	Confident	85	Confident	93 Å²	93	40.1 Å²	40.1	50%	0.497	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104	-11.2	-169.2	61	32.6	0	0	0	113.8	S117	N115-S117 PolarHBondContact O-N 3.27Å; N115-S117 WeakPolarHBondContact OD1-CB 3.5Å; N115-S117 PolarHBondContact OD1-N 3.08Å; N115-S117 PolarHBondContact OD1-OG 2.99Å
116	W	84.2	Confident	85.4	Confident	32 Å²	32	40.8 Å²	40.8	12%	0.121	21%	0.213	C	C	.	.			trans	61	19.6	-177.8	-59.7	81.1	0	0	0	115.6	V111 G112 L113 L139 L142 K143 F146	V111-W116 HydrophobicContact CG2-CE3 4.01Å; G112-W116 VanDerWaalsContact O-CA 3.22Å; G112-W116 WeakPolarHBondContact O-CA 3.48Å; G112-W116 PolarHBondContact O-N 3.01Å; L113-W116 PolarHBondContact O-NE1 2.88Å; W116-L139 HydrophobicContact CE3-CD2 4.23Å; W116-L142 HydrophobicContact CH2-CB 3.97Å; W116-L142 HydrophobicContact CZ3-CB 3.63Å; W116-K143 HydrophobicContact CD2-CD 4.1Å; W116-K143 HydrophobicContact CD2-CG 3.67Å; W116-K143 HydrophobicContact CE3-CD 4.22Å; W116-K143 HydrophobicContact CE3-CG 3.61Å; W116-K143 HydrophobicContact CG-CD 4.43Å; W116-K143 HydrophobicContact CG-CG 4.47Å; W116-K143 HydrophobicContact CH2-CB 4.3Å; W116-K143 HydrophobicContact CH2-CG 3.65Å; W116-K143 HydrophobicContact CZ2-CB 4.5Å; W116-K143 HydrophobicContact CZ2-CG 3.71Å; W116-K143 HydrophobicContact CZ3-CB 4.5Å; W116-K143 HydrophobicContact CZ3-CG 3.6Å; W116-F146 HydrophobicContact CH2-CB 4.16Å; W116-F146 HydrophobicContact CZ2-CB 4.01Å; W116-F146 HydrophobicContact CZ2-CD1 4.37Å; W116-F146 HydrophobicContact CZ2-CD2 4.34Å; W116-F146 HydrophobicContact CZ2-CG 4.01Å
117	S	87.3	Confident	85.6	Confident	17 Å²	17	38.4 Å²	38.4	12%	0.119	20%	0.198	C	C	.	.			trans	-60.3	155.5	161.5	64.8	0	0	0	0	110.6	W76 V111 G112 N115 E126	W76-S117 WeakPolarHBondContact CH2-OG 3.39Å; V111-S117 VanDerWaalsContact CA-O 3.3Å; V111-S117 WeakPolarHBondContact CA-O 3.48Å; V111-S117 WeakPolarHBondContact CG2-O 3.45Å; G112-S117 PolarHBondContact N-O 3.42Å; N115-S117 PolarHBondContact O-N 3.27Å; N115-S117 WeakPolarHBondContact OD1-CB 3.5Å; N115-S117 PolarHBondContact OD1-N 3.08Å; N115-S117 PolarHBondContact OD1-OG 2.99Å; S117-E126 WeakPolarHBondContact CB-OE1 3.32Å
118	V	88.7	Confident	85.1	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	115	176	177.6	0	0	0	0	109.5	L79 L109 V110 V111 V127 Y129 L135 L139	L79-V118 HydrophobicContact CD1-CG1 3.87Å; L79-V118 HydrophobicContact CD1-CG2 4.28Å; L109-V118 HydrophobicContact CD2-CG1 4.12Å; V110-V118 CarbonylContact O-C 3.47Å; V110-V118 VanDerWaalsContact O-CA 3.31Å; V110-V118 WeakPolarHBondContact O-CA 3.3Å; V111-V118 HydrophobicContact CB-CG2 4.35Å; V111-V118 HydrophobicContact CG2-CG2 4.27Å; V118-V127 HydrophobicContact CB-CB 4.31Å; V118-V127 HydrophobicContact CG1-CB 4.11Å; V118-V127 HydrophobicContact CG1-CG2 4.39Å; V118-V127 WeakPolarHBondContact O-CB 3.48Å; V118-V127 PolarHBondContact O-N 3.05Å; V118-Y129 HydrophobicContact CG2-CD1 4.46Å; V118-Y129 HydrophobicContact CG2-CE1 4.03Å; V118-L135 HydrophobicContact CB-CD2 4.41Å; V118-L135 HydrophobicContact CG1-CD1 4.48Å; V118-L135 HydrophobicContact CG1-CD2 4.1Å; V118-L135 HydrophobicContact CG2-CD1 4.29Å; V118-L135 HydrophobicContact CG2-CD2 4.33Å; V118-L139 HydrophobicContact CG2-CD1 3.8Å; V118-L139 HydrophobicContact CG2-CD2 4.04Å
119	W	88.8	Confident	84.6	Confident	56 Å²	56	49.9 Å²	49.9	21%	0.212	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	143.7	178.7	-164.2	-90.8	0	0	0	111.9	W76 R88 L109 V110 Y121 D124 E126	W76-W119 HydrophobicContact CE3-CB 4.48Å; W76-W119 HydrophobicContact CH2-CB 4.23Å; W76-W119 HydrophobicContact CZ3-CB 3.77Å; R88-W119 VanDerWaalsContact NH1-NE1 3.2Å; L109-W119 WeakPolarHBondContact CA-O 3.41Å; V110-W119 HydrophobicContact CG2-CB 3.86Å; V110-W119 PolarHBondContact N-O 2.87Å; V110-W119 VanDerWaalsContact N-O 3.13Å; V110-W119 PolarHBondContact O-N 3.38Å; W119-Y121 AromaticContact CD1-CD1 3.44Å; W119-Y121 VanDerWaalsContact CD1-CD1 3.44Å; W119-Y121 AromaticContact CD1-CE1 3.64Å; W119-Y121 AromaticContact NE1-CD1 3.88Å; W119-D124 VanDerWaalsContact CZ2-O 3.31Å; W119-D124 WeakPolarHBondContact CZ2-O 3.32Å; W119-D124 WeakPolarHBondContact CZ2-OD1 3.22Å; W119-D124 PolarHBondContact NE1-OD1 3.18Å; W119-E126 HydrophobicContact CE3-CB 4.01Å; W119-E126 HydrophobicContact CZ3-CB 3.98Å
120	C	90.9	Very high	83.6	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	106.3	171.4	-168.2	0	0	0	0	113	C108 L109 M122 C123 D124 D125 V127	C108-C120 WeakPolarHBondContact O-CA 3.5Å; C108-C120 PolarHBondContact O-SG 3.42Å; L109-C120 HydrophobicContact CD2-CB 3.52Å; C120-M122 PolarHBondContact O-N 2.97Å; C120-C123 HydrophobicContact CB-CB 4.19Å; C120-C123 PolarHBondContact O-N 3.48Å; C120-D124 WeakPolarHBondContact O-CA 3.45Å; C120-D124 PolarHBondContact O-N 3.02Å; C120-D125 PolarHBondContact N-O 3.35Å; C120-V127 HydrophobicContact CB-CG2 3.54Å
121	Y	86.5	Confident	82.4	Confident	17 Å²	17	57.5 Å²	57.5	7%	0.067	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-10.5	177.3	-58.5	-50.7	0	0	0	114.7	A95 I96 Y99 C108 V110 W119	A95-Y121 WeakPolarHBondContact CB-OH 3.5Å; A95-Y121 WeakPolarHBondContact O-CE2 3.39Å; I96-Y121 HydrophobicContact CG1-CE1 4.02Å; Y99-Y121 AromaticContact CD1-CD2 3.94Å; Y99-Y121 HydrophobicContact CD1-CD2 3.94Å; Y99-Y121 AromaticContact CD1-CG 3.96Å; Y99-Y121 HydrophobicContact CD1-CG 3.96Å; Y99-Y121 HydrophobicContact CD2-CD2 4.21Å; Y99-Y121 VanDerWaalsContact CE1-CB 3.46Å; Y99-Y121 HydrophobicContact CE1-CG 4.34Å; Y99-Y121 AromaticContact CG-CD2 3.64Å; Y99-Y121 HydrophobicContact CG-CD2 3.64Å; Y99-Y121 HydrophobicContact CG-CG 4.09Å; Y99-Y121 PolarHBondContact OH-O 3.48Å; C108-Y121 PolarHBondContact O-N 3.45Å; C108-Y121 VanDerWaalsContact O-N 3.14Å; V110-Y121 HydrophobicContact CB-CE2 4.42Å; V110-Y121 HydrophobicContact CG1-CE2 3.67Å; V110-Y121 HydrophobicContact CG2-CE1 4.39Å; V110-Y121 HydrophobicContact CG2-CE2 3.8Å; W119-Y121 AromaticContact CD1-CD1 3.44Å; W119-Y121 VanDerWaalsContact CD1-CD1 3.44Å; W119-Y121 AromaticContact CD1-CE1 3.64Å; W119-Y121 AromaticContact NE1-CD1 3.88Å
122	M	84.3	Confident	80.8	Confident	96 Å²	96	63.9 Å²	63.9	47%	0.473	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-14.2	172.8	-76	-76.5	-48.5	0	0	113.8	H26 Y99 C108 C120	H26-M122 VanDerWaalsContact CE1-CB 3.48Å; H26-M122 WeakPolarHBondContact CE1-CB 3.33Å; Y99-M122 HydrophobicContact CE2-CG 4.07Å; Y99-M122 HydrophobicContact CE2-SD 4.34Å; Y99-M122 PolarHBondContact OH-SD 3.4Å; Y99-M122 VanDerWaalsContact OH-SD 3.33Å; C108-M122 HydrophobicContact CB-CB 4.03Å; C108-M122 HydrophobicContact CB-CG 3.29Å; C120-M122 PolarHBondContact O-N 2.97Å
123	C	85.4	Confident	80.1	Confident	65 Å²	65	65.2 Å²	65.2	44%	0.439	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-19.3	169.9	-63.8	0	0	0	0	112.2	H26 C120 D125	H26-C123 PolarHBondContact ND1-SG 3.24Å; C120-C123 HydrophobicContact CB-CB 4.19Å; C120-C123 PolarHBondContact O-N 3.48Å; C123-D125 VanDerWaalsContact C-N 3.3Å; C123-D125 HydrophobicContact CB-CB 4.23Å
124	D	83.7	Confident	79.6	Confident	97 Å²	97	68.5 Å²	68.5	52%	0.519	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.4	46.6	-163	-150.7	20.2	0	0	0	114.3	R88 W119 C120	R88-D124 IonicContact CZ-OD1 3.15Å; R88-D124 IonicContact NH1-OD1 3.51Å; R88-D124 PolarHBondContact NH1-OD1 2.79Å; R88-D124 IonicContact NH2-OD1 2.87Å; R88-D124 PolarHBondContact NH2-OD1 3.17Å; R88-D124 IonicContact NH2-OD2 2.85Å; W119-D124 VanDerWaalsContact CZ2-O 3.31Å; W119-D124 WeakPolarHBondContact CZ2-O 3.32Å; W119-D124 WeakPolarHBondContact CZ2-OD1 3.22Å; W119-D124 PolarHBondContact NE1-OD1 3.18Å; C120-D124 WeakPolarHBondContact O-CA 3.45Å; C120-D124 PolarHBondContact O-N 3.02Å
125	D	83.3	Confident	79.7	Confident	102 Å²	102	64.4 Å²	64.4	55%	0.545	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	162.8	-176.3	-164.4	9.3	0	0	0	111.2	C120 C123	C120-D125 PolarHBondContact N-O 3.35Å; C123-D125 VanDerWaalsContact C-N 3.3Å; C123-D125 HydrophobicContact CB-CB 4.23Å
126	E	85.8	Confident	79.8	Confident	97 Å²	97	60.3 Å²	60.3	45%	0.453	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	132.1	173.7	-164.6	-176.3	171.5	0	0	111	S117 W119 Q128	S117-E126 WeakPolarHBondContact CB-OE1 3.32Å; W119-E126 HydrophobicContact CE3-CB 4.01Å; W119-E126 HydrophobicContact CZ3-CB 3.98Å; E126-Q128 PolarHBondContact O-N 3.43Å
127	V	83.8	Confident	79.5	Confident	5 Å²	5	64.4 Å²	64.4	3%	0.03	36%	0.359	C	S	.	.			trans	-85.5	95.4	-178.4	-178.4	0	0	0	0	110.1	C24 I27 L109 V118 C120 Y129 L135	C24-V127 HydrophobicContact CB-CB 4.35Å; C24-V127 HydrophobicContact CB-CG1 3.66Å; C24-V127 HydrophobicContact CB-CG2 3.85Å; I27-V127 HydrophobicContact CD1-CG1 3.75Å; I27-V127 HydrophobicContact CG1-CG1 3.95Å; L109-V127 HydrophobicContact CD2-CG2 3.8Å; V118-V127 HydrophobicContact CB-CB 4.31Å; V118-V127 HydrophobicContact CG1-CB 4.11Å; V118-V127 HydrophobicContact CG1-CG2 4.39Å; V118-V127 WeakPolarHBondContact O-CB 3.48Å; V118-V127 PolarHBondContact O-N 3.05Å; C120-V127 HydrophobicContact CB-CG2 3.54Å; V127-Y129 WeakPolarHBondContact O-CD1 3.26Å; V127-Y129 PolarHBondContact O-N 2.94Å; V127-L135 HydrophobicContact CG1-CD2 3.96Å
128	Q	77.8	Confident	79	Confident	180 Å²	180	63.6 Å²	63.6	84%	0.841	35%	0.354	S	S	*	.			trans	-59.5	132.8	165.4	-62.2	-172	0.9	0	0	110.7	E126	E126-Q128 PolarHBondContact O-N 3.43Å
129	Y	74.9	Confident	78.8	Confident	86 Å²	86	63.8 Å²	63.8	34%	0.337	36%	0.355	S	S	.	.			trans	-138.5	134.7	177.7	62.5	-93.6	0	0	0	111.8	V118 V127 L135 A136 L139	V118-Y129 HydrophobicContact CG2-CD1 4.46Å; V118-Y129 HydrophobicContact CG2-CE1 4.03Å; V127-Y129 WeakPolarHBondContact O-CD1 3.26Å; V127-Y129 PolarHBondContact O-N 2.94Å; Y129-L135 HydrophobicContact CD1-CD2 3.79Å; Y129-L135 HydrophobicContact CD1-CG 4.16Å; Y129-L135 HydrophobicContact CG-CD2 4.02Å; Y129-L135 HydrophobicContact CG-CG 4.17Å; Y129-A136 HydrophobicContact CD2-CB 4.06Å; Y129-A136 HydrophobicContact CE2-CB 4.33Å; Y129-L139 HydrophobicContact CD1-CD1 4.22Å; Y129-L139 HydrophobicContact CD2-CD1 4.41Å; Y129-L139 HydrophobicContact CE1-CD1 3.52Å; Y129-L139 HydrophobicContact CE2-CD1 3.73Å; Y129-L139 WeakPolarHBondContact OH-CD1 3.29Å
130	S	67.3	Low	78.4	Confident	88 Å²	88	65.7 Å²	65.7	62%	0.615	37%	0.372	S	S	*	.			trans	-67.7	149.6	172.4	-47	0	0	0	0	111.1	T132	S130-T132 PolarHBondContact O-N 3.32Å
131	G	63.2	Low	77.8	Confident	74 Å²	74	68.1 Å²	68.1	76%	0.763	39%	0.385	S	S	*	.	S	Bend	trans	-58.7	-18.4	177.5	0	0	0	0	0	114.8	A136	G131-A136 VanDerWaalsContact O-CB 3.3Å; G131-A136 WeakPolarHBondContact O-CB 3.33Å
132	T	56.1	Low	77.4	Confident	135 Å²	135	67.3 Å²	67.3	83%	0.828	38%	0.382	S	S	*	.	S	Bend	trans	-106.4	89.4	174.5	40.9	0	0	0	0	111.2	S130	S130-T132 PolarHBondContact O-N 3.32Å
133	G	73.4	Confident	77.2	Confident	28 Å²	28	67 Å²	67	29%	0.289	38%	0.378	S	S	.	.	S	Bend	trans	-173.3	169.2	177	0	0	0	0	0	115.1	L135 A136 Q137	G133-L135 PolarHBondContact O-N 2.97Å; G133-A136 PolarHBondContact O-N 2.73Å; G133-Q137 WeakPolarHBondContact O-CG 3.45Å; G133-Q137 PolarHBondContact O-N 2.95Å
134	Q	69.9	Low	76.8	Confident	79 Å²	79	71.7 Å²	71.7	37%	0.369	39%	0.39	S	S	.	.	H	α-helix	trans	-56.4	-36.3	-179.6	-178.2	-179.4	-12.2	0	0	112.7	L138	Q134-L138 PolarHBondContact O-N 2.87Å
135	L	78.9	Confident	76.3	Confident	5 Å²	5	69.5 Å²	69.5	3%	0.026	38%	0.377	C	S	.	.	H	α-helix	trans	-74.5	-45.1	177.8	-176.7	53.5	0	0	0	111.7	I27 T31 L79 V118 V127 Y129 G133 Q137 L138 L139	I27-L135 HydrophobicContact CD1-CD2 4.37Å; I27-L135 HydrophobicContact CG1-CD2 4.33Å; I27-L135 HydrophobicContact CG2-CB 4.27Å; T31-L135 HydrophobicContact CG2-CD1 4.44Å; L79-L135 HydrophobicContact CD1-CD1 3.71Å; V118-L135 HydrophobicContact CB-CD2 4.41Å; V118-L135 HydrophobicContact CG1-CD1 4.48Å; V118-L135 HydrophobicContact CG1-CD2 4.1Å; V118-L135 HydrophobicContact CG2-CD1 4.29Å; V118-L135 HydrophobicContact CG2-CD2 4.33Å; V127-L135 HydrophobicContact CG1-CD2 3.96Å; Y129-L135 HydrophobicContact CD1-CD2 3.79Å; Y129-L135 HydrophobicContact CD1-CG 4.16Å; Y129-L135 HydrophobicContact CG-CD2 4.02Å; Y129-L135 HydrophobicContact CG-CG 4.17Å; G133-L135 PolarHBondContact O-N 2.97Å; L135-Q137 VanDerWaalsContact C-N 3.32Å; L135-Q137 PolarHBondContact O-N 3.24Å; L135-L138 WeakPolarHBondContact O-CB 3.47Å; L135-L138 PolarHBondContact O-N 2.68Å; L135-L138 VanDerWaalsContact O-N 3.14Å; L135-L139 HydrophobicContact CD1-CD1 4.07Å; L135-L139 HydrophobicContact CD1-CG 4.16Å; L135-L139 HydrophobicContact CG-CD1 3.98Å; L135-L139 VanDerWaalsContact O-CG 3.29Å; L135-L139 WeakPolarHBondContact O-CG 3.4Å; L135-L139 PolarHBondContact O-N 3.29Å
136	A	80.9	Confident	75.5	Confident	8 Å²	8	68.7 Å²	68.7	7%	0.066	37%	0.369	C	S	.	.	H	α-helix	trans	-60.1	-40	175.1	0	0	0	0	0	112.7	Y129 G131 G133 L139 T140	Y129-A136 HydrophobicContact CD2-CB 4.06Å; Y129-A136 HydrophobicContact CE2-CB 4.33Å; G131-A136 VanDerWaalsContact O-CB 3.3Å; G131-A136 WeakPolarHBondContact O-CB 3.33Å; G133-A136 PolarHBondContact O-N 2.73Å; A136-L139 PolarHBondContact O-N 3.14Å; A136-T140 WeakPolarHBondContact O-CB 3.47Å; A136-T140 PolarHBondContact O-N 2.78Å; A136-T140 PolarHBondContact O-OG1 3.19Å
137	Q	78.1	Confident	74.4	Confident	118 Å²	118	68.7 Å²	68.7	55%	0.551	38%	0.38	S	S	*	.	H	α-helix	trans	-62	-44.4	172.8	-71.5	176.6	-3.1	0	0	112.4	G133 L135 T140 I141	G133-Q137 WeakPolarHBondContact O-CG 3.45Å; G133-Q137 PolarHBondContact O-N 2.95Å; L135-Q137 VanDerWaalsContact C-N 3.32Å; L135-Q137 PolarHBondContact O-N 3.24Å; Q137-T140 PolarHBondContact O-N 3.44Å; Q137-I141 WeakPolarHBondContact O-CD1 3.31Å; Q137-I141 VanDerWaalsContact O-CG1 3.3Å; Q137-I141 WeakPolarHBondContact O-CG1 3.3Å; Q137-I141 PolarHBondContact O-N 2.98Å; Q137-I141 VanDerWaalsContact O-N 3.07Å
138	L	78.3	Confident	72.9	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	40%	0.404	C	S	.	.	H	α-helix	trans	-58.7	-48.8	175.3	-93	170.7	0	0	0	112.3	T31 Q33 I36 Q134 L135 T140 I141 L142	T31-L138 HydrophobicContact CG2-CD1 3.95Å; Q33-L138 HydrophobicContact CB-CD2 4.09Å; Q33-L138 HydrophobicContact CG-CD1 4.14Å; Q33-L138 HydrophobicContact CG-CD2 3.7Å; Q33-L138 HydrophobicContact CG-CG 3.85Å; I36-L138 HydrophobicContact CB-CD2 4.37Å; I36-L138 HydrophobicContact CD1-CD2 3.66Å; I36-L138 HydrophobicContact CG2-CD2 4.28Å; Q134-L138 PolarHBondContact O-N 2.87Å; L135-L138 WeakPolarHBondContact O-CB 3.47Å; L135-L138 PolarHBondContact O-N 2.68Å; L135-L138 VanDerWaalsContact O-N 3.14Å; L138-T140 VanDerWaalsContact C-N 3.31Å; L138-T140 PolarHBondContact O-N 2.89Å; L138-I141 PolarHBondContact O-N 2.87Å; L138-L142 PolarHBondContact O-N 2.85Å
139	L	82.7	Confident	70.8	Confident	4 Å²	4	70.2 Å²	70.2	2%	0.021	40%	0.397	C	S	.	.	H	α-helix	trans	-66.9	-33.9	-179.6	-63.9	168.2	0	0	0	111.6	L79 V111 W116 V118 Y129 L135 A136 L142 K143	L79-L139 HydrophobicContact CD2-CD2 4.47Å; V111-L139 HydrophobicContact CB-CD2 4.13Å; V111-L139 HydrophobicContact CG2-CD2 3.54Å; W116-L139 HydrophobicContact CE3-CD2 4.23Å; V118-L139 HydrophobicContact CG2-CD1 3.8Å; V118-L139 HydrophobicContact CG2-CD2 4.04Å; Y129-L139 HydrophobicContact CD1-CD1 4.22Å; Y129-L139 HydrophobicContact CD2-CD1 4.41Å; Y129-L139 HydrophobicContact CE1-CD1 3.52Å; Y129-L139 HydrophobicContact CE2-CD1 3.73Å; Y129-L139 WeakPolarHBondContact OH-CD1 3.29Å; L135-L139 HydrophobicContact CD1-CD1 4.07Å; L135-L139 HydrophobicContact CD1-CG 4.16Å; L135-L139 HydrophobicContact CG-CD1 3.98Å; L135-L139 VanDerWaalsContact O-CG 3.29Å; L135-L139 WeakPolarHBondContact O-CG 3.4Å; L135-L139 PolarHBondContact O-N 3.29Å; A136-L139 PolarHBondContact O-N 3.14Å; L139-L142 PolarHBondContact O-N 2.92Å; L139-K143 WeakPolarHBondContact O-CB 3.49Å; L139-K143 VanDerWaalsContact O-CG 3.29Å; L139-K143 WeakPolarHBondContact O-CG 3.42Å; L139-K143 PolarHBondContact O-N 3.37Å
140	T	81.4	Confident	69.1	Low	95 Å²	95	71.6 Å²	71.6	58%	0.583	42%	0.417	S	S	*	.	H	α-helix	trans	-64.9	-39.7	173.5	-57.9	0	0	0	0	111.7	A136 Q137 L138 K144	A136-T140 WeakPolarHBondContact O-CB 3.47Å; A136-T140 PolarHBondContact O-N 2.78Å; A136-T140 PolarHBondContact O-OG1 3.19Å; Q137-T140 PolarHBondContact O-N 3.44Å; L138-T140 VanDerWaalsContact C-N 3.31Å; L138-T140 PolarHBondContact O-N 2.89Å; T140-K144 WeakPolarHBondContact O-CB 3.2Å; T140-K144 PolarHBondContact O-N 2.89Å; T140-K144 VanDerWaalsContact O-N 3.1Å
141	I	78.4	Confident	67.6	Low	51 Å²	51	74.5 Å²	74.5	26%	0.262	42%	0.422	S	S	.	.	H	α-helix	trans	-66.2	-44.5	175.2	-68	159.7	0	0	0	110.8	K37 Q137 L138 K144 Q145	K37-I141 HydrophobicContact CG-CG2 4.4Å; Q137-I141 WeakPolarHBondContact O-CD1 3.31Å; Q137-I141 VanDerWaalsContact O-CG1 3.3Å; Q137-I141 WeakPolarHBondContact O-CG1 3.3Å; Q137-I141 PolarHBondContact O-N 2.98Å; Q137-I141 VanDerWaalsContact O-N 3.07Å; L138-I141 PolarHBondContact O-N 2.87Å; I141-K144 PolarHBondContact O-N 3.28Å; I141-Q145 PolarHBondContact O-N 3.26Å; I141-Q145 VanDerWaalsContact O-N 3.13Å
142	L	78.2	Confident	65.8	Low	1 Å²	1	80.9 Å²	80.9	1%	0.005	43%	0.429	C	S	.	.	H	α-helix	trans	-64.3	-47.2	177.3	-76.4	172.7	0	0	0	112.3	I36 W45 M77 L79 V111 W116 L138 L139 K144 Q145 F146	I36-L142 HydrophobicContact CD1-CD1 4.25Å; I36-L142 HydrophobicContact CG2-CD1 4.44Å; I36-L142 HydrophobicContact CG2-CD2 3.54Å; I36-L142 HydrophobicContact CG2-CG 3.86Å; W45-L142 HydrophobicContact CH2-CD2 4.44Å; M77-L142 HydrophobicContact CE-CD1 3.59Å; M77-L142 HydrophobicContact CE-CD2 3.7Å; M77-L142 HydrophobicContact CE-CG 4.23Å; L79-L142 HydrophobicContact CD2-CD1 3.71Å; V111-L142 HydrophobicContact CG1-CD1 4.48Å; W116-L142 HydrophobicContact CH2-CB 3.97Å; W116-L142 HydrophobicContact CZ3-CB 3.63Å; L138-L142 PolarHBondContact O-N 2.85Å; L139-L142 PolarHBondContact O-N 2.92Å; L142-K144 PolarHBondContact O-N 2.82Å; L142-Q145 PolarHBondContact O-N 2.97Å; L142-F146 PolarHBondContact O-N 2.91Å
143	K	79.6	Confident	64.4	Low	90 Å²	90	85.7 Å²	85.7	39%	0.391	43%	0.432	S	S	.	.	H	α-helix	trans	-53.8	-43.7	173.7	-76.9	178.6	176.2	-176.2	0	111	W116 L139 Q145 F146 S147	W116-K143 HydrophobicContact CD2-CD 4.1Å; W116-K143 HydrophobicContact CD2-CG 3.67Å; W116-K143 HydrophobicContact CE3-CD 4.22Å; W116-K143 HydrophobicContact CE3-CG 3.61Å; W116-K143 HydrophobicContact CG-CD 4.43Å; W116-K143 HydrophobicContact CG-CG 4.47Å; W116-K143 HydrophobicContact CH2-CB 4.3Å; W116-K143 HydrophobicContact CH2-CG 3.65Å; W116-K143 HydrophobicContact CZ2-CB 4.5Å; W116-K143 HydrophobicContact CZ2-CG 3.71Å; W116-K143 HydrophobicContact CZ3-CB 4.5Å; W116-K143 HydrophobicContact CZ3-CG 3.6Å; L139-K143 WeakPolarHBondContact O-CB 3.49Å; L139-K143 VanDerWaalsContact O-CG 3.29Å; L139-K143 WeakPolarHBondContact O-CG 3.42Å; L139-K143 PolarHBondContact O-N 3.37Å; K143-Q145 VanDerWaalsContact C-N 3.34Å; K143-Q145 PolarHBondContact O-N 3.48Å; K143-F146 PolarHBondContact O-N 3.16Å; K143-S147 PolarHBondContact O-N 3.42Å; K143-S147 PolarHBondContact O-OG 3.49Å; K143-S147 VanDerWaalsContact O-OG 3.09Å
144	K	78.1	Confident	62.1	Low	162 Å²	162	90.5 Å²	90.5	70%	0.704	46%	0.458	S	S	*	.	H	α-helix	trans	-65.2	-30.2	177.5	-172.5	169.6	-178.4	173.5	0	114.2	T140 I141 L142	T140-K144 WeakPolarHBondContact O-CB 3.2Å; T140-K144 PolarHBondContact O-N 2.89Å; T140-K144 VanDerWaalsContact O-N 3.1Å; I141-K144 PolarHBondContact O-N 3.28Å; L142-K144 PolarHBondContact O-N 2.82Å
145	Q	72.4	Confident	60.1	Low	52 Å²	52	96.1 Å²	96.1	24%	0.243	48%	0.484	C	S	.	.	H	α-helix	trans	-82.6	-29	173.6	-72.3	-170.6	-23.2	0	0	113	I141 L142 K143 T148	I141-Q145 PolarHBondContact O-N 3.26Å; I141-Q145 VanDerWaalsContact O-N 3.13Å; L142-Q145 PolarHBondContact O-N 2.97Å; K143-Q145 VanDerWaalsContact C-N 3.34Å; K143-Q145 PolarHBondContact O-N 3.48Å; Q145-T148 PolarHBondContact O-OG1 3.35Å
146	F	66.4	Low	57.5	Low	85 Å²	85	105.4 Å²	105.4	37%	0.373	52%	0.524	S	S	.	.	H	α-helix	trans	-70.3	-32.7	173.8	-164.8	-89.1	0	0	0	111.9	W45 L113 W116 L142 K143 T148	W45-F146 HydrophobicContact CB-CD2 4.14Å; W45-F146 HydrophobicContact CB-CE2 3.76Å; W45-F146 HydrophobicContact CD2-CD2 4.1Å; W45-F146 HydrophobicContact CE3-CD2 4.15Å; W45-F146 HydrophobicContact CG-CD2 4.09Å; W45-F146 HydrophobicContact CG-CE2 4.23Å; L113-F146 HydrophobicContact CB-CE2 4.45Å; W116-F146 HydrophobicContact CH2-CB 4.16Å; W116-F146 HydrophobicContact CZ2-CB 4.01Å; W116-F146 HydrophobicContact CZ2-CD1 4.37Å; W116-F146 HydrophobicContact CZ2-CD2 4.34Å; W116-F146 HydrophobicContact CZ2-CG 4.01Å; L142-F146 PolarHBondContact O-N 2.91Å; K143-F146 PolarHBondContact O-N 3.16Å; F146-T148 VanDerWaalsContact C-N 3.33Å; F146-T148 PolarHBondContact O-N 3.28Å
147	S	63.3	Low	54.7	Low	97 Å²	97	116.4 Å²	116.4	68%	0.678	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	1.3	178	-55.4	0	0	0	0	115.7	K143 D149	K143-S147 PolarHBondContact O-N 3.42Å; K143-S147 PolarHBondContact O-OG 3.49Å; K143-S147 VanDerWaalsContact O-OG 3.09Å; S147-D149 PolarHBondContact O-N 3.13Å
148	T	50.7	Low	52	Low	89 Å²	89	116.4 Å²	116.4	55%	0.546	57%	0.572	S	S	.	*			trans	-94	66.7	178.4	46.3	0	0	0	0	112.9	Q145 F146	Q145-T148 PolarHBondContact O-OG1 3.35Å; F146-T148 VanDerWaalsContact C-N 3.33Å; F146-T148 PolarHBondContact O-N 3.28Å
149	D	35	Very low	49.4	Very low	127 Å²	127	125.3 Å²	125.3	68%	0.679	61%	0.61	S	S	*	*			trans	-75.7	126	171.3	-178.7	43.9	0	0	0	111.1	S147 M151	S147-D149 PolarHBondContact O-N 3.13Å; D149-M151 PolarHBondContact O-N 2.92Å
150	P	39.3	Very low	46.5	Very low	116 Å²	116	133.7 Å²	133.7	75%	0.753	65%	0.65	S	S	*	*			trans	-80	35.8	-169.5	32	-37.6	0	0	0	115.7
151	M	35	Very low	43.7	Very low	149 Å²	149	135.2 Å²	135.2	73%	0.734	65%	0.654	S	S	*	*			trans	-119.2	73.7	-175.8	-83.2	-66	168.2	0	0	115.5	D149	D149-M151 PolarHBondContact O-N 2.92Å
152	K	26.3	Very low	41.1	Very low	207 Å²	207	138 Å²	138	90%	0.9	67%	0.673	S	S	*	*			trans	177.7	93.2	140.7	-98	154.2	-173.1	173.3	0	111.6
153	R	25.3	Very low	38.4	Very low	237 Å²	237	144.4 Å²	144.4	89%	0.894	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-95.5	121.8	157.7	-76.2	-175.9	175.9	-179.9	-0.4	108.6	Q155	R153-Q155 PolarHBondContact O-N 2.83Å
154	P	25.9	Very low	35.7	Very low	129 Å²	129	146.8 Å²	146.8	84%	0.838	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-60	127.7	166.5	-21	33.2	0	0	0	109.7
155	Q	27.1	Very low	33	Very low	196 Å²	196	146.6 Å²	146.6	92%	0.916	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-76	147.1	177	-70.3	-173.5	-11.2	0	0	111	R153	R153-Q155 PolarHBondContact O-N 2.83Å
156	K	24.7	Very low	30.6	Very low	200 Å²	200	151.4 Å²	151.4	87%	0.87	75%	0.75	S	S	*	*			trans	-115.1	102	-177.4	-178.8	-174.8	-179.6	-178.3	0	110.2
157	R	21.7	Very low	28.4	Very low	239 Å²	239	154.6 Å²	154.6	90%	0.902	77%	0.769	S	S	*	*			trans	175.1	142.9	170.5	-98.3	154	-163.3	-110.2	4.5	106.7
158	V	21.4	Very low	26.5	Very low	118 Å²	118	157.5 Å²	157.5	72%	0.715	77%	0.77	S	S	*	*			cis	-132.6	156.7	-2.7	-175.3	0	0	0	0	108.1
159	K	24.7	Very low	25.2	Very low	187 Å²	187	159.3 Å²	159.3	81%	0.813	78%	0.783	S	S	*	*			trans	-127.2	129.4	157.5	-110.6	-159.8	175.3	-160.7	0	107.2
160	E	22.5	Very low	24.5	Very low	181 Å²	181	159.9 Å²	159.9	85%	0.846	78%	0.782	S	S	*	*			trans	-170.9	135.8	166.6	-105.9	157.3	-144.6	0	0	107.1
161	D	22.4	Very low	23.6	Very low	126 Å²	126	160.2 Å²	160.2	67%	0.674	78%	0.782	S	S	*	*			cis	-144.1	-142.3	-44.3	-134.5	49	0	0	0	108.8
162	V	23	Very low	22.9	Very low	110 Å²	110	161.8 Å²	161.8	67%	0.667	79%	0.787	S	S	*	*			cis	-153.5	161	11.1	-144.7	0	0	0	0	109
163	D	21.6	Very low	22.6	Very low	135 Å²	135	156.4 Å²	156.4	72%	0.722	78%	0.782	S	S	*	*			trans	65.8	147.3	154.8	-70.8	-19.6	0	0	0	119.1
164	L	22.6	Very low	22.5	Very low	141 Å²	141	151.6 Å²	151.6	74%	0.738	78%	0.778	S	S	*	*			cis	-149.2	179.4	3	-124.7	165.5	0	0	0	111.9
165	M	22.3	Very low	22.3	Very low	157 Å²	157	151.5 Å²	151.5	77%	0.773	77%	0.771	S	S	*	*			trans	-55.3	176.2	177.3	-73.4	161.3	147.3	0	0	116.1
166	E	21.2	Very low	22.1	Very low	154 Å²	154	147.4 Å²	147.4	72%	0.72	76%	0.759	S	S	*	*			cis	171.4	172.3	-28.4	-166.3	-179.8	-145.7	0	0	106.3
167	I	20.9	Very low	22.1	Very low	152 Å²	152	144.6 Å²	144.6	78%	0.779	75%	0.749	S	S	*	*			trans	86.3	151.8	162.6	-54.8	178.7	0	0	0	117.7
168	K	23.8	Very low	22.3	Very low	157 Å²	157	140.8 Å²	140.8	68%	0.683	74%	0.742	S	S	*	*			trans	-69.9	175.5	-172.7	-50.3	176.4	168.9	-170.5	0	114.8	E170	K168-E170 IonicContact NZ-OE2 3.27Å; K168-E170 PolarHBondContact NZ-OE2 2.98Å
169	P	23.3	Very low	22.4	Very low	128 Å²	128	140.4 Å²	140.4	83%	0.831	74%	0.744	S	S	*	*				-135.8	173.1	92.9	40	-30.9	0	0	0	115.8
170	E	19.9	Very low	22.5	Very low	139 Å²	139	139.6 Å²	139.6	65%	0.65	74%	0.743	S	S	*	*			trans	-112.1	-172.5	166	-71	169	98.9	0	0	109.4	K168	K168-E170 IonicContact NZ-OE2 3.27Å; K168-E170 PolarHBondContact NZ-OE2 2.98Å
171	T	20.2	Very low	22.7	Very low	123 Å²	123	137.3 Å²	137.3	76%	0.755	74%	0.737	S	S	*	*			trans	81.4	108.2	162.7	57.4	0	0	0	0	121.7
172	E	20.3	Very low	22.9	Very low	181 Å²	181	135.9 Å²	135.9	85%	0.846	73%	0.729	S	S	*	*				79.4	130.4	120.9	-65.7	-176.4	178.6	0	0	124.7
173	A	21	Very low	23	Very low	95 Å²	95	139.9 Å²	139.9	79%	0.785	74%	0.741	S	S	*	*			trans	67.3	149.3	149.4	0	0	0	0	0	118.2
174	V	21.8	Very low	23.3	Very low	135 Å²	135	139.6 Å²	139.6	82%	0.818	74%	0.739	S	S	*	*			cis	-138.2	169	30.8	166.9	0	0	0	0	112.3
175	N	22	Very low	23.6	Very low	127 Å²	127	141.8 Å²	141.8	68%	0.679	74%	0.743	S	S	*	*			trans	-57	178	172.9	-49.3	-1.4	0	0	0	112.9
176	T	23.1	Very low	23.8	Very low	110 Å²	110	141.9 Å²	141.9	68%	0.675	75%	0.746	S	S	*	*			cis	-157.8	134.6	49.1	18.2	0	0	0	0	111.1
177	E	24.8	Very low	24.1	Very low	142 Å²	142	137.7 Å²	137.7	66%	0.664	74%	0.744	S	S	*	*				70.2	141.8	92.8	-70.8	166.6	-149.3	0	0	114.8
178	E	25.1	Very low	24.4	Very low	159 Å²	159	135.1 Å²	135.1	74%	0.743	74%	0.74	S	S	*	*			cis	-168.8	156.5	-22.8	-132.9	166.1	-156.3	0	0	111
179	S	24.4	Very low	24.5	Very low	110 Å²	110	133.7 Å²	133.7	77%	0.769	74%	0.74	S	S	*	*			trans	176.6	122.4	148.9	17.5	0	0	0	0	108.1
180	E	26.3	Very low	24.7	Very low	170 Å²	170	136.6 Å²	136.6	79%	0.794	73%	0.734	S	S	*	*				70.2	136.8	51.4	-67.1	-159.8	150.1	0	0	114
181	D	26.8	Very low	25	Very low	132 Å²	132	139.1 Å²	139.1	71%	0.706	74%	0.737	S	S	*	*			cis	-169.7	162.3	-16.1	-161.7	30.2	0	0	0	107.1
182	N	25.8	Very low	25.3	Very low	97 Å²	97	141.9 Å²	141.9	52%	0.519	74%	0.739	S	S	.	*			cis	-147.6	171.4	-1.5	-154.4	-62.1	0	0	0	107.8
183	E	26.8	Very low	25.5	Very low	194 Å²	194	141.4 Å²	141.4	91%	0.907	73%	0.734	S	S	*	*				-174.8	158.7	116.7	-101.2	-172.1	-175.6	0	0	112.4
184	N	26.9	Very low	25.6	Very low	128 Å²	128	143 Å²	143	68%	0.684	73%	0.73	S	S	*	*			trans	-155.5	165.9	-147.8	-152.1	-32.9	0	0	0	113.8
185	K	30.1	Very low	25.8	Very low	188 Å²	188	143.2 Å²	143.2	82%	0.817	73%	0.725	S	S	*	*			trans	70.6	153.3	169.6	-67.1	173	-177.7	169	0	116.9
186	D	26.1	Very low	25.9	Very low	159 Å²	159	146.9 Å²	146.9	85%	0.85	74%	0.735	S	S	*	*			cis	-167.9	176.4	-19.9	-175.7	5.9	0	0	0	106.4
187	G	26.8	Very low	25.9	Very low	65 Å²	65	150.8 Å²	150.8	67%	0.67	74%	0.742	S	S	*	*			trans	144.9	25.4	158.1	0	0	0	0	0	124.2
188	S	26.8	Very low	25.8	Very low	98 Å²	98	150.8 Å²	150.8	69%	0.685	74%	0.742	S	S	*	*			trans	53.8	122.2	139.5	-156.5	0	0	0	0	123.6
189	N	25.8	Very low	25.7	Very low	128 Å²	128	149.7 Å²	149.7	68%	0.684	74%	0.742	S	S	*	*			trans	71	154.1	150.2	-76.9	-64.3	0	0	0	119.7
190	R	28.9	Very low	25.5	Very low	188 Å²	188	149.3 Å²	149.3	71%	0.709	75%	0.745	S	S	*	*			cis	-155.3	126.9	4	-136.4	157.3	-159.8	-157.1	7.1	115.5
191	R	26.3	Very low	25.6	Very low	192 Å²	192	147.5 Å²	147.5	73%	0.725	75%	0.745	S	S	*	*			trans	58.7	119.8	143.4	-72.1	178.3	175.3	-177.5	-1.8	123.8
192	K	25.1	Very low	25.5	Very low	182 Å²	182	150.3 Å²	150.3	79%	0.791	75%	0.751	S	S	*	*				73.7	140.8	129.5	-70.4	-178.1	178.8	-174.7	0	119.7
193	K	24.2	Very low	25.4	Very low	170 Å²	170	151.5 Å²	151.5	74%	0.739	76%	0.764	S	S	*	*			cis	-167.1	165.8	-14.6	-154.4	-172.5	180	-168.9	0	110.3
194	N	23.7	Very low	25.5	Very low	129 Å²	129	149.9 Å²	149.9	69%	0.69	76%	0.756	S	S	*	*			trans	99.3	103.5	169	-55.1	-12	0	0	0	113.4
195	I	25.3	Very low	25.3	Very low	140 Å²	140	151.6 Å²	151.6	72%	0.718	77%	0.766	S	S	*	*				74.4	120.7	73.3	-65.7	161.2	0	0	0	110.2
196	K	24.2	Very low	25.6	Very low	204 Å²	204	150.9 Å²	150.9	89%	0.887	77%	0.765	S	S	*	*			cis	-114.7	168.2	22.4	-60.4	175	-179.7	174.8	0	113.9
197	K	22.7	Very low	25.5	Very low	191 Å²	191	148.6 Å²	148.6	83%	0.83	76%	0.761	S	S	*	*			trans	-136.9	160.6	168.1	-154.2	-179.1	-176	-173.2	0	109.6
198	E	23.1	Very low	25.5	Very low	142 Å²	142	149.8 Å²	149.8	66%	0.664	77%	0.765	S	S	*	*			trans	-79.2	158.1	179.1	-32.2	96.8	122.1	0	0	112.8
199	N	22.9	Very low	25.7	Very low	137 Å²	137	150.8 Å²	150.8	73%	0.733	77%	0.769	S	S	*	*				159.1	140.6	110.9	-89.7	-59.5	0	0	0	113
200	A	21.8	Very low	25.9	Very low	101 Å²	101	154 Å²	154	84%	0.835	78%	0.78	S	S	*	*			trans	-159.1	89.4	162.2	0	0	0	0	0	109.8
201	V	27.3	Very low	26.3	Very low	132 Å²	132	153.8 Å²	153.8	80%	0.8	79%	0.787	S	S	*	*			trans	-70	143	172.8	176	0	0	0	0	109.8
202	K	24.6	Very low	26.6	Very low	192 Å²	192	148.5 Å²	148.5	84%	0.835	78%	0.779	S	S	*	*			trans	-135.2	153.5	162.5	-94.8	-170.3	174.8	-176.5	0	110.4
203	P	24.9	Very low	27.7	Very low	121 Å²	121	143.1 Å²	143.1	79%	0.786	76%	0.764	S	S	*	*			trans	-78.8	157.7	-156.4	30.9	-37.1	0	0	0	114.1
204	Q	27	Very low	29.6	Very low	161 Å²	161	137.7 Å²	137.7	75%	0.752	75%	0.748	S	S	*	*			trans	-66.1	147.6	165.8	-66.6	165.1	-55.3	0	0	110.7
205	N	23.4	Very low	32.2	Very low	164 Å²	164	132.1 Å²	132.1	88%	0.877	72%	0.718	S	S	*	*			trans	-136.1	132.1	151.7	-105.6	-15.6	0	0	0	106.2
206	H	37	Very low	35	Very low	173 Å²	173	127.8 Å²	127.8	80%	0.801	70%	0.699	S	S	*	*			trans	-83	129.9	-178.6	-70	-104	0	0	0	110.6
207	S	24.2	Very low	38.2	Very low	110 Å²	110	119.3 Å²	119.3	77%	0.769	66%	0.664	S	S	*	*			trans	-140.1	128.5	163.4	55.8	0	0	0	0	107.5
208	A	27.2	Very low	41.5	Very low	91 Å²	91	111.1 Å²	111.1	75%	0.752	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-61.8	147.4	178.1	0	0	0	0	0	110.9	E210	A208-E210 PolarHBondContact O-N 2.82Å
209	P	30.2	Very low	44.9	Very low	119 Å²	119	104.4 Å²	104.4	77%	0.773	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-70.9	126.6	174.3	29.6	-32.9	0	0	0	110.3
210	E	31	Very low	48.4	Very low	194 Å²	194	97.9 Å²	97.9	91%	0.907	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-74.2	122.7	166	-62.7	179.9	151.1	0	0	108.4	A208 S212	A208-E210 PolarHBondContact O-N 2.82Å; E210-S212 PolarHBondContact O-N 3.41Å
211	E	35.5	Very low	51.9	Low	184 Å²	184	94.2 Å²	94.2	86%	0.86	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-73.9	119.3	-174.2	-64.3	-171	121.4	0	0	112.6
212	S	34.4	Very low	55	Low	81 Å²	81	90.6 Å²	90.6	57%	0.566	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-86.8	130.2	166.4	59.9	0	0	0	0	110.4	E210	E210-S212 PolarHBondContact O-N 3.41Å
213	C	47.5	Very low	58.1	Low	70 Å²	70	83.8 Å²	83.8	47%	0.473	48%	0.479	S	S	.	.			trans	-95.9	-9.1	-160.3	-155.2	0	0	0	0	114.9	V215 D785	C213-V215 PolarHBondContact O-N 2.98Å; C213-D785 PolarHBondContact N-OD1 3.14Å; C213-D785 VanDerWaalsContact N-OD1 3.14Å
214	S	64.1	Low	61	Low	56 Å²	56	80.2 Å²	80.2	39%	0.392	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-73.2	117.1	176.7	65.6	0	0	0	0	112.7	P216 D785	S214-P216 WeakPolarHBondContact O-CD 3.38Å; S214-D785 PolarHBondContact N-OD1 2.69Å; S214-D785 PolarHBondContact OG-OD2 3.02Å
215	V	77.8	Confident	64.1	Low	11 Å²	11	75.2 Å²	75.2	7%	0.067	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-84.4	116.3	172.6	-177.5	0	0	0	0	109.7	C213 Q238	C213-V215 PolarHBondContact O-N 2.98Å; V215-Q238 PolarHBondContact O-NE2 2.95Å
216	P	85.4	Confident	67.4	Low	49 Å²	49	67.5 Å²	67.5	32%	0.318	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-71.4	139.8	-179.6	29.5	-35.2	0	0	0	112	S214	S214-P216 WeakPolarHBondContact O-CD 3.38Å
217	V	89.9	Confident	70.2	Confident	27 Å²	27	59.5 Å²	59.5	16%	0.164	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-79.8	130.2	170.2	-175.7	0	0	0	0	109.2	V780 T782 F806 I808 V813	V217-V780 HydrophobicContact CG1-CG2 4.33Å; V217-V780 HydrophobicContact CG2-CG2 3.81Å; V217-T782 HydrophobicContact CG2-CG2 3.43Å; V217-T782 VanDerWaalsContact CG2-CG2 3.43Å; V217-F806 HydrophobicContact CB-CG 4.43Å; V217-F806 HydrophobicContact CG1-CB 4.24Å; V217-F806 HydrophobicContact CG2-CB 4.43Å; V217-F806 HydrophobicContact CG2-CD2 3.86Å; V217-F806 HydrophobicContact CG2-CE2 4.39Å; V217-F806 HydrophobicContact CG2-CG 4.19Å; V217-I808 HydrophobicContact CG1-CD1 3.81Å; V217-I808 HydrophobicContact CG1-CG1 3.71Å; V217-V813 HydrophobicContact CB-CG1 4.26Å; V217-V813 HydrophobicContact CG1-CG1 3.61Å; V217-V813 HydrophobicContact CG1-CG2 4.15Å
218	K	92.4	Very high	73.6	Confident	19 Å²	19	54.4 Å²	54.4	8%	0.083	33%	0.329	C	S	.	.			trans	-135.8	149.9	-179.5	-68.2	173.7	-169.1	160.9	0	109.6	Q234 I290 Q291 S293 V298	K218-Q234 PolarHBondContact O-NE2 3.08Å; K218-I290 VanDerWaalsContact CD-O 3.31Å; K218-I290 WeakPolarHBondContact CD-O 3.22Å; K218-I290 WeakPolarHBondContact CE-O 3.49Å; K218-I290 PolarHBondContact NZ-O 2.84Å; K218-Q291 PolarHBondContact NZ-O 3.06Å; K218-S293 WeakPolarHBondContact CE-O 3.34Å; K218-S293 PolarHBondContact NZ-O 2.85Å; K218-V298 HydrophobicContact CD-CG2 4.29Å
219	G	94.4	Very high	76.9	Confident	0 Å²	0	50 Å²	50	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	152.9	174.4	0	0	0	0	0	111.7	G296 V297 V298 D810	G219-G296 PolarHBondContact N-O 3.39Å; G219-V297 CarbonylContact O-C 3.53Å; G219-V297 VanDerWaalsContact O-CA 3.3Å; G219-V297 WeakPolarHBondContact O-CA 3.15Å; G219-V298 PolarHBondContact O-N 2.94Å; G219-D810 CarbonylContact C-O 3.48Å; G219-D810 VanDerWaalsContact CA-O 3.29Å; G219-D810 WeakPolarHBondContact CA-O 3.45Å
220	L	96.1	Very high	80	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	128.7	170	-70.5	171	0	0	0	110.1	N222 N230 L233 Q234 I290 V298 P300 D810 T811	L220-N222 PolarHBondContact O-N 2.84Å; L220-N230 HydrophobicContact CB-CB 4.06Å; L220-N230 HydrophobicContact CD1-CB 4.2Å; L220-N230 PolarHBondContact O-ND2 3.02Å; L220-L233 HydrophobicContact CD1-CB 3.73Å; L220-L233 HydrophobicContact CD1-CD1 4.19Å; L220-Q234 HydrophobicContact CD1-CG 4.33Å; L220-I290 HydrophobicContact CD2-CD1 4.29Å; L220-V298 CarbonylContact C-O 3.6Å; L220-V298 WeakPolarHBondContact CA-O 3.47Å; L220-V298 HydrophobicContact CD2-CB 4.03Å; L220-V298 HydrophobicContact CD2-CG1 4.01Å; L220-P300 HydrophobicContact CB-CG 4.44Å; L220-P300 HydrophobicContact CD2-CB 4.32Å; L220-P300 HydrophobicContact CD2-CG 4.08Å; L220-D810 PolarHBondContact N-O 3.3Å; L220-D810 CarbonylContact O-C 3.02Å; L220-D810 WeakPolarHBondContact O-CA 3.35Å; L220-T811 PolarHBondContact O-N 3.06Å
221	S	94.9	Very high	83.2	Confident	24 Å²	24	35.5 Å²	35.5	17%	0.168	22%	0.216	C	C	.	.			trans	-58.1	124.6	174.1	-60.6	0	0	0	0	110.4	N230 V297 V298 T299	S221-N230 PolarHBondContact O-ND2 2.62Å; S221-V297 WeakPolarHBondContact OG-CG1 3.28Å; S221-V298 PolarHBondContact N-O 2.95Å; S221-V298 PolarHBondContact OG-O 2.8Å; S221-T299 WeakPolarHBondContact CB-OG1 3.29Å; S221-T299 PolarHBondContact OG-OG1 3.31Å
222	N	92.4	Very high	86.1	Confident	57 Å²	57	26.7 Å²	26.7	31%	0.305	18%	0.175	S	C	.	.			trans	-73.4	127.7	168.3	-166.1	-29	0	0	0	109	L220 G224 T226 D810	L220-N222 PolarHBondContact O-N 2.84Å; N222-G224 PolarHBondContact OD1-N 3.41Å; N222-G224 PolarHBondContact OD1-O 3.07Å; N222-G224 VanDerWaalsContact OD1-O 3.04Å; N222-T226 PolarHBondContact OD1-N 2.9Å; N222-T226 PolarHBondContact OD1-OG1 3.16Å; N222-D810 HydrophobicContact CB-CB 4.07Å; N222-D810 PolarHBondContact ND2-OD2 2.94Å
223	L	89.6	Confident	89.1	Confident	48 Å²	48	23 Å²	23	25%	0.251	15%	0.149	S	C	.	.			trans	-94.8	5.6	-178	-51.8	175.6	0	0	0	112.6	T226 T299 R301 F304 F317	L223-T226 HydrophobicContact CB-CG2 3.81Å; L223-T226 HydrophobicContact CG-CG2 4.48Å; L223-T226 PolarHBondContact N-OG1 2.72Å; L223-T299 HydrophobicContact CD2-CG2 3.91Å; L223-R301 HydrophobicContact CD1-CB 4.26Å; L223-F304 HydrophobicContact CD1-CB 4.08Å; L223-F304 HydrophobicContact CD1-CD1 4.22Å; L223-F304 HydrophobicContact CD1-CG 4.25Å; L223-F317 HydrophobicContact CB-CE1 4.36Å; L223-F317 WeakPolarHBondContact O-CD1 3.41Å; L223-F317 VanDerWaalsContact O-CE1 3.23Å; L223-F317 WeakPolarHBondContact O-CE1 3.27Å
224	G	87.7	Confident	91.4	Very high	46 Å²	46	19.9 Å²	19.9	47%	0.474	13%	0.127	S	C	.	.	S	Bend	trans	155.2	-88.6	179.9	0	0	0	0	0	110.3	N222	N222-G224 PolarHBondContact OD1-N 3.41Å; N222-G224 PolarHBondContact OD1-O 3.07Å; N222-G224 VanDerWaalsContact OD1-O 3.04Å
225	N	90.8	Very high	92.9	Very high	57 Å²	57	17.2 Å²	17.2	31%	0.305	11%	0.108	S	C	.	.	S	Bend	trans	-113.2	28.4	170.2	-79	-63.6	0	0	0	112.1	C227 F228 F317 Q319	N225-C227 PolarHBondContact O-N 2.85Å; N225-C227 VanDerWaalsContact O-N 3.09Å; N225-F228 WeakPolarHBondContact O-CD1 3.46Å; N225-F228 VanDerWaalsContact O-CE1 3.31Å; N225-F228 WeakPolarHBondContact O-CE1 3.43Å; N225-F317 WeakPolarHBondContact CB-O 3.28Å; N225-F317 PolarHBondContact ND2-O 3.31Å; N225-Q319 HydrophobicContact CB-CG 3.9Å; N225-Q319 PolarHBondContact OD1-NE2 3.47Å; N225-Q319 VanDerWaalsContact OD1-NE2 3.11Å
226	T	93.8	Very high	93.8	Very high	1 Å²	1	16.8 Å²	16.8	1%	0.006	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	21.3	-168.9	66.9	0	0	0	0	114.6	N222 L223 F228 F229 N230 F304	N222-T226 PolarHBondContact OD1-N 2.9Å; N222-T226 PolarHBondContact OD1-OG1 3.16Å; L223-T226 HydrophobicContact CB-CG2 3.81Å; L223-T226 HydrophobicContact CG-CG2 4.48Å; L223-T226 PolarHBondContact N-OG1 2.72Å; T226-F228 VanDerWaalsContact C-N 3.32Å; T226-F228 PolarHBondContact O-N 3.35Å; T226-F229 WeakPolarHBondContact O-CB 3.49Å; T226-F229 PolarHBondContact O-N 3.09Å; T226-F229 VanDerWaalsContact O-N 3.11Å; T226-N230 PolarHBondContact O-N 2.86Å; T226-F304 HydrophobicContact CG2-CD2 4.22Å; T226-F304 HydrophobicContact CG2-CE1 4.12Å; T226-F304 HydrophobicContact CG2-CE2 3.79Å; T226-F304 HydrophobicContact CG2-CZ 3.73Å
227	C	94.9	Very high	94.2	Very high	5 Å²	5	14.5 Å²	14.5	3%	0.034	9%	0.091	C	C	.	.	H	α-helix	trans	-65.7	-33.1	178.4	60.8	0	0	0	0	112.7	N225 F229 N230 A231 H775 D810	N225-C227 PolarHBondContact O-N 2.85Å; N225-C227 VanDerWaalsContact O-N 3.09Å; C227-F229 PolarHBondContact O-N 3.47Å; C227-N230 PolarHBondContact O-N 3.32Å; C227-A231 VanDerWaalsContact O-CB 3.29Å; C227-A231 WeakPolarHBondContact O-CB 3.27Å; C227-A231 PolarHBondContact O-N 2.94Å; C227-H775 VanDerWaalsContact CB-CE1 3.41Å; C227-H775 WeakPolarHBondContact CB-CE1 3.02Å; C227-H775 WeakPolarHBondContact CB-ND1 3.39Å; C227-H775 PolarHBondContact SG-ND1 3.16Å; C227-D810 WeakPolarHBondContact CA-OD1 3.41Å
228	F	95.2	Very high	94.3	Very high	3 Å²	3	13.9 Å²	13.9	1%	0.013	9%	0.086	C	C	.	.	H	α-helix	trans	-59.2	-34.6	171.8	71	-87.9	0	0	0	112	N225 T226 V232 F304 F314 Q320 L325 Y776	N225-F228 WeakPolarHBondContact O-CD1 3.46Å; N225-F228 VanDerWaalsContact O-CE1 3.31Å; N225-F228 WeakPolarHBondContact O-CE1 3.43Å; T226-F228 VanDerWaalsContact C-N 3.32Å; T226-F228 PolarHBondContact O-N 3.35Å; F228-V232 WeakPolarHBondContact O-CG2 3.43Å; F228-F304 HydrophobicContact CZ-CE2 4.27Å; F228-F314 AromaticContact CE2-CD1 3.67Å; F228-F314 HydrophobicContact CE2-CD1 3.67Å; F228-F314 AromaticContact CE2-CE1 3.94Å; F228-F314 HydrophobicContact CE2-CE1 3.94Å; F228-F314 AromaticContact CZ-CD1 3.93Å; F228-F314 HydrophobicContact CZ-CD1 3.93Å; F228-Q320 WeakPolarHBondContact CB-O 3.22Å; F228-Q320 HydrophobicContact CD1-CB 4.29Å; F228-Q320 HydrophobicContact CD2-CB 4.11Å; F228-Q320 HydrophobicContact CE1-CB 4.03Å; F228-Q320 HydrophobicContact CE2-CB 3.85Å; F228-Q320 HydrophobicContact CG-CB 4.36Å; F228-Q320 HydrophobicContact CZ-CB 3.81Å; F228-Q320 HydrophobicContact CZ-CG 4.26Å; F228-L325 HydrophobicContact CD2-CB 4.07Å; F228-L325 HydrophobicContact CD2-CD2 3.59Å; F228-L325 HydrophobicContact CD2-CG 4.34Å; F228-L325 HydrophobicContact CE2-CB 4.21Å; F228-L325 HydrophobicContact CE2-CD1 4.28Å; F228-L325 HydrophobicContact CE2-CD2 3.79Å; F228-L325 HydrophobicContact CE2-CG 4.3Å; F228-Y776 HydrophobicContact CB-CD2 3.52Å; F228-Y776 HydrophobicContact CB-CE2 3.7Å; F228-Y776 HydrophobicContact CB-CG 4.24Å
229	F	96.1	Very high	94.3	Very high	0 Å²	0	13 Å²	13	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-79.6	-47.9	177.3	173.7	-105.9	0	0	0	112.2	T226 C227 A231 V232 L233 P300 L303 F304 V307 L325	T226-F229 WeakPolarHBondContact O-CB 3.49Å; T226-F229 PolarHBondContact O-N 3.09Å; T226-F229 VanDerWaalsContact O-N 3.11Å; C227-F229 PolarHBondContact O-N 3.47Å; F229-A231 VanDerWaalsContact C-N 3.33Å; F229-A231 PolarHBondContact O-N 3.04Å; F229-V232 PolarHBondContact O-N 2.93Å; F229-L233 HydrophobicContact CD1-CD1 3.69Å; F229-L233 HydrophobicContact CD2-CD1 4.16Å; F229-L233 HydrophobicContact CD2-CG 4.44Å; F229-L233 HydrophobicContact CE1-CD1 3.37Å; F229-L233 HydrophobicContact CE2-CD1 3.84Å; F229-L233 HydrophobicContact CE2-CG 4.32Å; F229-L233 HydrophobicContact CG-CD1 4.09Å; F229-L233 HydrophobicContact CZ-CD1 3.45Å; F229-L233 VanDerWaalsContact CZ-CD1 3.45Å; F229-L233 HydrophobicContact CZ-CG 4.39Å; F229-L233 WeakPolarHBondContact O-CG 3.08Å; F229-L233 PolarHBondContact O-N 3.25Å; F229-P300 HydrophobicContact CD1-CG 4.34Å; F229-P300 HydrophobicContact CE1-CB 3.78Å; F229-P300 HydrophobicContact CE1-CG 3.76Å; F229-P300 HydrophobicContact CZ-CB 4.38Å; F229-L303 HydrophobicContact CE2-CD2 4.41Å; F229-L303 HydrophobicContact CE2-CG 4.3Å; F229-L303 HydrophobicContact CZ-CB 4.26Å; F229-L303 HydrophobicContact CZ-CD2 4.18Å; F229-L303 HydrophobicContact CZ-CG 4.02Å; F229-F304 HydrophobicContact CB-CD2 4.44Å; F229-F304 HydrophobicContact CD1-CB 4.44Å; F229-F304 AromaticContact CD1-CD2 3.75Å; F229-F304 HydrophobicContact CD1-CD2 3.75Å; F229-F304 HydrophobicContact CD1-CG 4.47Å; F229-F304 AromaticContact CD2-CD2 3.96Å; F229-F304 HydrophobicContact CD2-CD2 3.96Å; F229-F304 HydrophobicContact CE1-CB 3.65Å; F229-F304 AromaticContact CE1-CD2 3.78Å; F229-F304 HydrophobicContact CE1-CD2 3.78Å; F229-F304 HydrophobicContact CE1-CG 4.14Å; F229-F304 HydrophobicContact CE2-CB 4.43Å; F229-F304 HydrophobicContact CE2-CD2 4.03Å; F229-F304 AromaticContact CG-CD2 3.83Å; F229-F304 HydrophobicContact CG-CD2 3.83Å; F229-F304 HydrophobicContact CG-CE2 4.36Å; F229-F304 HydrophobicContact CZ-CB 3.65Å; F229-F304 AromaticContact CZ-CD2 3.92Å; F229-F304 HydrophobicContact CZ-CD2 3.92Å; F229-F304 HydrophobicContact CZ-CG 4.3Å; F229-V307 HydrophobicContact CE2-CG2 4.29Å; F229-L325 HydrophobicContact CB-CD2 3.66Å; F229-L325 HydrophobicContact CD2-CD1 4.11Å; F229-L325 HydrophobicContact CD2-CD2 3.72Å; F229-L325 HydrophobicContact CD2-CG 4.48Å; F229-L325 HydrophobicContact CG-CD2 4.17Å
230	N	96.3	Very high	94.1	Very high	3 Å²	3	14.8 Å²	14.8	2%	0.016	9%	0.091	C	C	.	.	H	α-helix	trans	-59.6	-42.7	177.7	-69.8	-16	0	0	0	111.6	L220 S221 T226 C227 V232 L233 Q234 D810	L220-N230 HydrophobicContact CB-CB 4.06Å; L220-N230 HydrophobicContact CD1-CB 4.2Å; L220-N230 PolarHBondContact O-ND2 3.02Å; S221-N230 PolarHBondContact O-ND2 2.62Å; T226-N230 PolarHBondContact O-N 2.86Å; C227-N230 PolarHBondContact O-N 3.32Å; N230-V232 PolarHBondContact O-N 2.88Å; N230-L233 PolarHBondContact O-N 2.83Å; N230-Q234 VanDerWaalsContact O-CG 3.32Å; N230-Q234 WeakPolarHBondContact O-CG 3.4Å; N230-Q234 PolarHBondContact O-N 2.86Å; N230-D810 WeakPolarHBondContact CB-OD1 3.35Å; N230-D810 PolarHBondContact ND2-OD1 3.16Å
231	A	97.3	Very high	93.8	Very high	4 Å²	4	17.2 Å²	17.2	3%	0.033	10%	0.103	C	C	.	.	H	α-helix	trans	-64.5	-37.9	179.4	0	0	0	0	0	113.1	C227 F229 N235 V765 A778	C227-A231 VanDerWaalsContact O-CB 3.29Å; C227-A231 WeakPolarHBondContact O-CB 3.27Å; C227-A231 PolarHBondContact O-N 2.94Å; F229-A231 VanDerWaalsContact C-N 3.33Å; F229-A231 PolarHBondContact O-N 3.04Å; A231-N235 PolarHBondContact O-ND2 3.33Å; A231-V765 HydrophobicContact CB-CG1 4Å; A231-V765 HydrophobicContact CB-CG2 4.2Å; A231-A778 HydrophobicContact CB-CB 4.39Å
232	V	97.3	Very high	93.7	Very high	0 Å²	0	16 Å²	16	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-67.3	-46.9	174.2	171.8	0	0	0	0	110.8	F228 F229 N230 Q234 N235 L236 S322 L325 L326 L828	F228-V232 WeakPolarHBondContact O-CG2 3.43Å; F229-V232 PolarHBondContact O-N 2.93Å; N230-V232 PolarHBondContact O-N 2.88Å; V232-Q234 VanDerWaalsContact C-N 3.34Å; V232-Q234 PolarHBondContact O-N 2.85Å; V232-N235 PolarHBondContact O-N 2.97Å; V232-L236 HydrophobicContact CG1-CD1 3.77Å; V232-L236 HydrophobicContact CG1-CG 4.16Å; V232-L236 WeakPolarHBondContact O-CG 3.22Å; V232-L236 PolarHBondContact O-N 3.15Å; V232-S322 VanDerWaalsContact CG2-O 3.32Å; V232-S322 WeakPolarHBondContact CG2-O 3.38Å; V232-L325 HydrophobicContact CB-CD2 4.45Å; V232-L325 HydrophobicContact CG2-CD2 4.4Å; V232-L326 HydrophobicContact CG1-CB 4.14Å; V232-L326 HydrophobicContact CG1-CD1 3.83Å; V232-L326 HydrophobicContact CG1-CG 4.5Å; V232-L828 HydrophobicContact CG2-CD1 4.35Å
233	L	96.7	Very high	93.5	Very high	4 Å²	4	14.1 Å²	14.1	2%	0.021	8%	0.084	C	C	.	.	H	α-helix	trans	-62.5	-36.4	-179	-71.3	176.3	0	0	0	113.5	L220 F229 N230 N235 L236 S237 M283 L286 P300 L303 L329	L220-L233 HydrophobicContact CD1-CB 3.73Å; L220-L233 HydrophobicContact CD1-CD1 4.19Å; F229-L233 HydrophobicContact CD1-CD1 3.69Å; F229-L233 HydrophobicContact CD2-CD1 4.16Å; F229-L233 HydrophobicContact CD2-CG 4.44Å; F229-L233 HydrophobicContact CE1-CD1 3.37Å; F229-L233 HydrophobicContact CE2-CD1 3.84Å; F229-L233 HydrophobicContact CE2-CG 4.32Å; F229-L233 HydrophobicContact CG-CD1 4.09Å; F229-L233 HydrophobicContact CZ-CD1 3.45Å; F229-L233 VanDerWaalsContact CZ-CD1 3.45Å; F229-L233 HydrophobicContact CZ-CG 4.39Å; F229-L233 WeakPolarHBondContact O-CG 3.08Å; F229-L233 PolarHBondContact O-N 3.25Å; N230-L233 PolarHBondContact O-N 2.83Å; L233-N235 VanDerWaalsContact C-N 3.32Å; L233-N235 PolarHBondContact O-N 2.87Å; L233-L236 PolarHBondContact O-N 3.24Å; L233-S237 VanDerWaalsContact O-CB 3.28Å; L233-S237 WeakPolarHBondContact O-CB 3.45Å; L233-S237 PolarHBondContact O-N 3.2Å; L233-M283 HydrophobicContact CD2-CE 4.34Å; L233-M283 HydrophobicContact CD2-SD 4.1Å; L233-L286 HydrophobicContact CD1-CD2 3.8Å; L233-L286 HydrophobicContact CD2-CD2 4.21Å; L233-P300 HydrophobicContact CD1-CB 3.99Å; L233-P300 HydrophobicContact CD1-CG 4.36Å; L233-L303 HydrophobicContact CD1-CD2 4.32Å; L233-L303 HydrophobicContact CD2-CD2 3.58Å; L233-L329 HydrophobicContact CD2-CD2 4.34Å
234	Q	95.8	Very high	93.5	Very high	4 Å²	4	16.6 Å²	16.6	2%	0.019	9%	0.094	C	C	.	.	H	α-helix	trans	-56.4	-48.3	174.3	-73.5	-64.3	-20.3	0	0	111.3	K218 L220 N230 V232 S237 A778 V780 I808	K218-Q234 PolarHBondContact O-NE2 3.08Å; L220-Q234 HydrophobicContact CD1-CG 4.33Å; N230-Q234 VanDerWaalsContact O-CG 3.32Å; N230-Q234 WeakPolarHBondContact O-CG 3.4Å; N230-Q234 PolarHBondContact O-N 2.86Å; V232-Q234 VanDerWaalsContact C-N 3.34Å; V232-Q234 PolarHBondContact O-N 2.85Å; Q234-S237 PolarHBondContact O-N 3.38Å; Q234-S237 PolarHBondContact O-OG 2.78Å; Q234-A778 HydrophobicContact CB-CB 3.67Å; Q234-A778 HydrophobicContact CG-CB 4.19Å; Q234-V780 HydrophobicContact CB-CG1 4.22Å; Q234-I808 HydrophobicContact CG-CB 4.12Å; Q234-I808 HydrophobicContact CG-CG1 4.43Å; Q234-I808 HydrophobicContact CG-CG2 3.95Å
235	N	96.3	Very high	93.5	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-65	-48.5	178.4	-72.5	-80.3	0	0	0	111.6	A231 V232 L233 S237 Q238 T239 G763 V764 V765 F830	A231-N235 PolarHBondContact O-ND2 3.33Å; V232-N235 PolarHBondContact O-N 2.97Å; L233-N235 VanDerWaalsContact C-N 3.32Å; L233-N235 PolarHBondContact O-N 2.87Å; N235-S237 PolarHBondContact O-N 2.98Å; N235-Q238 PolarHBondContact O-N 3.44Å; N235-T239 PolarHBondContact O-N 3.19Å; N235-T239 PolarHBondContact O-OG1 2.74Å; N235-G763 WeakPolarHBondContact OD1-CA 3.21Å; N235-V764 PolarHBondContact ND2-O 3.46Å; N235-V764 VanDerWaalsContact ND2-O 3.17Å; N235-V764 PolarHBondContact OD1-N 3.31Å; N235-V764 PolarHBondContact OD1-O 2.98Å; N235-V765 VanDerWaalsContact ND2-CG2 3.32Å; N235-V765 WeakPolarHBondContact ND2-CG2 3.34Å; N235-F830 HydrophobicContact CB-CD2 3.56Å; N235-F830 HydrophobicContact CB-CE2 3.51Å; N235-F830 HydrophobicContact CB-CG 4.12Å; N235-F830 HydrophobicContact CB-CZ 4.03Å
236	L	95.7	Very high	93.5	Very high	1 Å²	1	12.7 Å²	12.7	1%	0.005	6%	0.062	C	C	.	.	H	α-helix	trans	-60.7	-29.3	176.5	-66.9	179	0	0	0	113.1	V232 L233 Q238 T239 L242 M283 L326 L329 F382 F830	V232-L236 HydrophobicContact CG1-CD1 3.77Å; V232-L236 HydrophobicContact CG1-CG 4.16Å; V232-L236 WeakPolarHBondContact O-CG 3.22Å; V232-L236 PolarHBondContact O-N 3.15Å; L233-L236 PolarHBondContact O-N 3.24Å; L236-Q238 VanDerWaalsContact C-N 3.28Å; L236-Q238 PolarHBondContact O-N 3.03Å; L236-T239 WeakPolarHBondContact O-CB 3.11Å; L236-T239 PolarHBondContact O-N 3.37Å; L236-T239 PolarHBondContact O-OG1 3.03Å; L236-L242 HydrophobicContact CB-CD2 4.41Å; L236-L242 HydrophobicContact CD2-CD2 4.25Å; L236-M283 HydrophobicContact CB-CE 3.84Å; L236-M283 HydrophobicContact CD1-CE 3.92Å; L236-L326 HydrophobicContact CD1-CD1 4.01Å; L236-L326 HydrophobicContact CD2-CD1 4.07Å; L236-L326 HydrophobicContact CG-CD1 4.38Å; L236-L329 HydrophobicContact CD1-CD2 3.7Å; L236-F382 HydrophobicContact CD2-CE1 4.23Å; L236-F382 HydrophobicContact CD2-CE2 4.38Å; L236-F382 HydrophobicContact CD2-CZ 3.58Å; L236-F830 HydrophobicContact CD2-CE1 4.46Å
237	S	93.8	Very high	93.1	Very high	1 Å²	1	15.1 Å²	15.1	1%	0.007	8%	0.075	C	C	.	.	H	α-helix	trans	-69.5	-24.7	-179.5	79.5	0	0	0	0	114.3	L233 Q234 N235 R243	L233-S237 VanDerWaalsContact O-CB 3.28Å; L233-S237 WeakPolarHBondContact O-CB 3.45Å; L233-S237 PolarHBondContact O-N 3.2Å; Q234-S237 PolarHBondContact O-N 3.38Å; Q234-S237 PolarHBondContact O-OG 2.78Å; N235-S237 PolarHBondContact O-N 2.98Å; S237-R243 PolarHBondContact O-NH2 3.09Å
238	Q	92.6	Very high	92.6	Very high	14 Å²	14	20.9 Å²	20.9	7%	0.065	10%	0.099	C	C	.	.	H	α-helix	trans	-94.5	-8.8	178.7	-62.5	-64.4	-40.4	0	0	112.6	V215 N235 L236 Q240 Y762 V780	V215-Q238 PolarHBondContact O-NE2 2.95Å; N235-Q238 PolarHBondContact O-N 3.44Å; L236-Q238 VanDerWaalsContact C-N 3.28Å; L236-Q238 PolarHBondContact O-N 3.03Å; Q238-Q240 PolarHBondContact O-N 3.29Å; Q238-Y762 HydrophobicContact CB-CD2 4.25Å; Q238-Y762 HydrophobicContact CB-CE2 4.41Å; Q238-V780 HydrophobicContact CG-CB 4.03Å; Q238-V780 HydrophobicContact CG-CG1 4.46Å; Q238-V780 HydrophobicContact CG-CG2 4.01Å
239	T	93.7	Very high	91.8	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.1	C	C	.	.			trans	-66.8	93.3	172.9	-49.9	0	0	0	0	110.4	N235 L236 L241 L242 R243 V381 F382 V709 Y762	N235-T239 PolarHBondContact O-N 3.19Å; N235-T239 PolarHBondContact O-OG1 2.74Å; L236-T239 WeakPolarHBondContact O-CB 3.11Å; L236-T239 PolarHBondContact O-N 3.37Å; L236-T239 PolarHBondContact O-OG1 3.03Å; T239-L241 PolarHBondContact O-N 2.66Å; T239-L242 HydrophobicContact CG2-CB 3.7Å; T239-L242 PolarHBondContact O-N 2.83Å; T239-R243 PolarHBondContact O-N 2.88Å; T239-V381 HydrophobicContact CG2-CG1 4.02Å; T239-F382 HydrophobicContact CG2-CZ 4.2Å; T239-V709 HydrophobicContact CG2-CG1 4.3Å; T239-V709 HydrophobicContact CG2-CG2 3.77Å; T239-Y762 PolarHBondContact OG1-OH 2.86Å
240	Q	88.8	Confident	90.9	Very high	39 Å²	39	22.8 Å²	22.8	18%	0.182	11%	0.111	C	C	.	.	H	α-helix	trans	-61.3	-41.9	-171.6	-71.7	-170	-44.7	0	0	112.9	Q238 L242 R243 Q244 R783	Q238-Q240 PolarHBondContact O-N 3.29Å; Q240-L242 VanDerWaalsContact C-N 3.35Å; Q240-L242 PolarHBondContact O-N 3.4Å; Q240-R243 PolarHBondContact O-N 3.07Å; Q240-Q244 WeakPolarHBondContact O-CG 3.2Å; Q240-Q244 PolarHBondContact O-N 3.27Å; Q240-R783 VanDerWaalsContact OE1-CD 3.27Å
241	L	90.9	Very high	90	Very high	50 Å²	50	28.5 Å²	28.5	26%	0.262	14%	0.138	S	C	.	.	H	α-helix	trans	-61.9	-40.1	179.3	-173.8	65.1	0	0	0	112.5	T239 R243 Q244 I245 V381 S708	T239-L241 PolarHBondContact O-N 2.66Å; L241-R243 PolarHBondContact O-N 3.26Å; L241-Q244 PolarHBondContact O-N 3.46Å; L241-I245 HydrophobicContact CD1-CD1 3.96Å; L241-I245 HydrophobicContact CD1-CG1 4.37Å; L241-I245 HydrophobicContact CG-CD1 3.88Å; L241-I245 WeakPolarHBondContact O-CG1 3.32Å; L241-I245 PolarHBondContact O-N 3.13Å; L241-V381 HydrophobicContact CD2-CG2 4.25Å; L241-V381 HydrophobicContact CG-CG2 4.13Å; L241-S708 VanDerWaalsContact CD2-CB 3.46Å
242	L	92	Very high	88.1	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-61.3	-45.2	176.6	179.7	62.4	0	0	0	111.3	L236 T239 Q240 I245 L246 M283 V381 F382	L236-L242 HydrophobicContact CB-CD2 4.41Å; L236-L242 HydrophobicContact CD2-CD2 4.25Å; T239-L242 HydrophobicContact CG2-CB 3.7Å; T239-L242 PolarHBondContact O-N 2.83Å; Q240-L242 VanDerWaalsContact C-N 3.35Å; Q240-L242 PolarHBondContact O-N 3.4Å; L242-I245 PolarHBondContact O-N 3.33Å; L242-L246 HydrophobicContact CD1-CD1 3.84Å; L242-L246 HydrophobicContact CD1-CG 4.04Å; L242-L246 HydrophobicContact CG-CD1 3.85Å; L242-L246 HydrophobicContact CG-CG 4.4Å; L242-L246 VanDerWaalsContact O-CB 3.3Å; L242-L246 WeakPolarHBondContact O-CB 3.41Å; L242-L246 WeakPolarHBondContact O-CG 3.43Å; L242-L246 PolarHBondContact O-N 3.09Å; L242-M283 HydrophobicContact CD2-CE 4.19Å; L242-V381 HydrophobicContact CB-CG1 4.25Å; L242-V381 HydrophobicContact CB-CG2 4.36Å; L242-V381 HydrophobicContact CD1-CG2 4.34Å; L242-F382 HydrophobicContact CD1-CE2 4.27Å; L242-F382 HydrophobicContact CD2-CE2 4.15Å; L242-F382 HydrophobicContact CD2-CZ 4.19Å
243	R	89	Confident	86.4	Confident	17 Å²	17	43.1 Å²	43.1	6%	0.064	20%	0.203	C	C	.	.	H	α-helix	trans	-62.3	-46	176.7	179.8	-177	-65.3	-82.9	-8	111.7	S237 T239 Q240 L241 I245 L246 N247 L287	S237-R243 PolarHBondContact O-NH2 3.09Å; T239-R243 PolarHBondContact O-N 2.88Å; Q240-R243 PolarHBondContact O-N 3.07Å; L241-R243 PolarHBondContact O-N 3.26Å; R243-I245 VanDerWaalsContact C-N 3.34Å; R243-I245 PolarHBondContact O-N 2.98Å; R243-L246 PolarHBondContact O-N 3.01Å; R243-N247 PolarHBondContact O-N 2.84Å; R243-N247 VanDerWaalsContact O-N 3.07Å; R243-L287 PolarHBondContact NH1-O 3.37Å; R243-L287 PolarHBondContact NH2-O 2.61Å
244	Q	88.6	Confident	85.3	Confident	100 Å²	100	45.5 Å²	45.5	47%	0.467	22%	0.215	S	C	.	.	H	α-helix	trans	-62.9	-36.6	179.6	-74.3	176.3	-4.7	0	0	113.1	Q240 L241 K248	Q240-Q244 WeakPolarHBondContact O-CG 3.2Å; Q240-Q244 PolarHBondContact O-N 3.27Å; L241-Q244 PolarHBondContact O-N 3.46Å; Q244-K248 WeakPolarHBondContact O-CD 3.45Å; Q244-K248 WeakPolarHBondContact O-CG 3.47Å
245	I	88.9	Confident	84.2	Confident	21 Å²	21	48.8 Å²	48.8	11%	0.108	24%	0.238	C	C	.	.	H	α-helix	trans	-80.6	-42.9	177.8	-58.5	165.1	0	0	0	110.9	L241 L242 R243 N247 K248 V249 F377 Q380 V381	L241-I245 HydrophobicContact CD1-CD1 3.96Å; L241-I245 HydrophobicContact CD1-CG1 4.37Å; L241-I245 HydrophobicContact CG-CD1 3.88Å; L241-I245 WeakPolarHBondContact O-CG1 3.32Å; L241-I245 PolarHBondContact O-N 3.13Å; L242-I245 PolarHBondContact O-N 3.33Å; R243-I245 VanDerWaalsContact C-N 3.34Å; R243-I245 PolarHBondContact O-N 2.98Å; I245-N247 VanDerWaalsContact C-N 3.32Å; I245-N247 PolarHBondContact O-N 3.28Å; I245-K248 PolarHBondContact O-N 2.99Å; I245-K248 VanDerWaalsContact O-N 3.15Å; I245-V249 HydrophobicContact CG2-CG2 3.94Å; I245-V249 WeakPolarHBondContact O-CG2 3.18Å; I245-V249 PolarHBondContact O-N 2.9Å; I245-F377 HydrophobicContact CG2-CB 3.51Å; I245-F377 HydrophobicContact CG2-CG 4.43Å; I245-Q380 HydrophobicContact CD1-CB 4.27Å; I245-V381 HydrophobicContact CD1-CG2 3.83Å
246	L	88.8	Confident	83.2	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-58.7	-41.7	178.5	-79.3	175.2	0	0	0	112.6	L242 R243 K248 V249 T250 T280 M283 L287 F377	L242-L246 HydrophobicContact CD1-CD1 3.84Å; L242-L246 HydrophobicContact CD1-CG 4.04Å; L242-L246 HydrophobicContact CG-CD1 3.85Å; L242-L246 HydrophobicContact CG-CG 4.4Å; L242-L246 VanDerWaalsContact O-CB 3.3Å; L242-L246 WeakPolarHBondContact O-CB 3.41Å; L242-L246 WeakPolarHBondContact O-CG 3.43Å; L242-L246 PolarHBondContact O-N 3.09Å; R243-L246 PolarHBondContact O-N 3.01Å; L246-K248 VanDerWaalsContact C-N 3.34Å; L246-K248 PolarHBondContact O-N 3.46Å; L246-V249 PolarHBondContact O-N 3.19Å; L246-T250 PolarHBondContact O-N 3.17Å; L246-T250 PolarHBondContact O-OG1 3.33Å; L246-T280 HydrophobicContact CD2-CG2 3.76Å; L246-M283 HydrophobicContact CD1-CG 3.95Å; L246-L287 HydrophobicContact CD1-CD1 3.68Å; L246-F377 HydrophobicContact CD2-CD2 4.3Å; L246-F377 HydrophobicContact CD2-CE2 3.72Å; L246-F377 HydrophobicContact CD2-CZ 3.97Å
247	N	86	Confident	82	Confident	51 Å²	51	53.9 Å²	53.9	27%	0.273	27%	0.265	S	S	.	.	H	α-helix	trans	-58.5	-45.6	176.5	-79	-2.4	0	0	0	111.5	R243 I245 T250 E251 N288	R243-N247 PolarHBondContact O-N 2.84Å; R243-N247 VanDerWaalsContact O-N 3.07Å; I245-N247 VanDerWaalsContact C-N 3.32Å; I245-N247 PolarHBondContact O-N 3.28Å; N247-T250 PolarHBondContact O-N 2.54Å; N247-T250 PolarHBondContact O-OG1 3.29Å; N247-E251 PolarHBondContact O-N 3.39Å; N247-N288 PolarHBondContact OD1-ND2 2.96Å; N247-N288 VanDerWaalsContact OD1-ND2 3.08Å; N247-N288 PolarHBondContact OD1-OD1 3.11Å
248	K	84.2	Confident	81.2	Confident	126 Å²	126	53.9 Å²	53.9	55%	0.548	27%	0.265	S	S	.	.	H	α-helix	trans	-63.8	-43.3	176.3	-66.1	171.7	-176.1	178.6	0	112.9	Q244 I245 L246 T250 E251	Q244-K248 WeakPolarHBondContact O-CD 3.45Å; Q244-K248 WeakPolarHBondContact O-CG 3.47Å; I245-K248 PolarHBondContact O-N 2.99Å; I245-K248 VanDerWaalsContact O-N 3.15Å; L246-K248 VanDerWaalsContact C-N 3.34Å; L246-K248 PolarHBondContact O-N 3.46Å; K248-T250 PolarHBondContact O-N 3.46Å; K248-E251 WeakPolarHBondContact O-CB 3.31Å; K248-E251 PolarHBondContact O-N 3.07Å; K248-E251 VanDerWaalsContact O-N 3.07Å
249	V	79.9	Confident	80.1	Confident	4 Å²	4	59.3 Å²	59.3	2%	0.024	29%	0.289	C	S	.	.	H	α-helix	trans	-65.8	-23.9	178.6	172.3	0	0	0	0	111.8	I245 L246 M254 P276 F377	I245-V249 HydrophobicContact CG2-CG2 3.94Å; I245-V249 WeakPolarHBondContact O-CG2 3.18Å; I245-V249 PolarHBondContact O-N 2.9Å; L246-V249 PolarHBondContact O-N 3.19Å; V249-M254 HydrophobicContact CG2-SD 4.11Å; V249-P276 HydrophobicContact CG1-CB 4.13Å; V249-P276 HydrophobicContact CG1-CG 4.31Å; V249-F377 HydrophobicContact CG1-CD1 4.25Å; V249-F377 HydrophobicContact CG1-CE1 4.16Å; V249-F377 HydrophobicContact CG2-CD1 4.11Å
250	T	76.9	Confident	78.8	Confident	39 Å²	39	60.1 Å²	60.1	24%	0.239	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	0.5	172.5	52.8	0	0	0	0	115.5	L246 N247 K248 P276 L281 C284	L246-T250 PolarHBondContact O-N 3.17Å; L246-T250 PolarHBondContact O-OG1 3.33Å; N247-T250 PolarHBondContact O-N 2.54Å; N247-T250 PolarHBondContact O-OG1 3.29Å; K248-T250 PolarHBondContact O-N 3.46Å; T250-P276 HydrophobicContact CG2-CG 3.83Å; T250-L281 HydrophobicContact CG2-CD2 3.99Å; T250-C284 HydrophobicContact CG2-CB 3.75Å; T250-C284 PolarHBondContact OG1-SG 2.85Å; T250-C284 VanDerWaalsContact OG1-SG 3.42Å
251	E	75.9	Confident	77.6	Confident	123 Å²	123	63.9 Å²	63.9	58%	0.575	32%	0.315	S	S	*	.	S	Bend	trans	-68.9	132	171	-66.7	176.2	-146.4	0	0	110.1	N247 K248 K253 M254	N247-E251 PolarHBondContact O-N 3.39Å; K248-E251 WeakPolarHBondContact O-CB 3.31Å; K248-E251 PolarHBondContact O-N 3.07Å; K248-E251 VanDerWaalsContact O-N 3.07Å; E251-K253 PolarHBondContact O-N 3.01Å; E251-M254 PolarHBondContact O-N 3.04Å
252	E	58.4	Low	76	Confident	150 Å²	150	66.6 Å²	66.6	70%	0.701	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-8.3	-163.9	-60.4	-172.1	140.8	0	0	115.9
253	K	61.8	Low	74.4	Confident	162 Å²	162	71.4 Å²	71.4	70%	0.704	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-144.7	56.5	-179.3	-65.8	-168.1	178.4	-172.9	0	112.3	E251 S255	E251-K253 PolarHBondContact O-N 3.01Å; K253-S255 PolarHBondContact O-N 3.14Å
254	M	73.7	Confident	73	Confident	54 Å²	54	73.1 Å²	73.1	27%	0.266	39%	0.389	S	S	.	.			trans	-66.9	122.1	168.1	-175.6	173.7	175.8	0	0	110.1	V249 E251 L256 L273	V249-M254 HydrophobicContact CG2-SD 4.11Å; E251-M254 PolarHBondContact O-N 3.04Å; M254-L256 HydrophobicContact CE-CD1 4.29Å; M254-L273 PolarHBondContact O-N 3.09Å
255	S	72.8	Confident	71.5	Confident	73 Å²	73	76.6 Å²	76.6	51%	0.51	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	142.1	168.6	56.9	0	0	0	0	111	K253 V271	K253-S255 PolarHBondContact O-N 3.14Å; S255-V271 CarbonylContact C-O 3.53Å; S255-V271 VanDerWaalsContact CA-O 3.31Å; S255-V271 WeakPolarHBondContact CA-O 3.34Å
256	L	74	Confident	70.4	Confident	23 Å²	23	77.3 Å²	77.3	12%	0.12	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	114.8	-177	-164.9	72.3	0	0	0	109.1	M254 I258 V271 L273 V341 P374	M254-L256 HydrophobicContact CE-CD1 4.29Å; L256-I258 HydrophobicContact CD2-CD1 4.22Å; L256-I258 HydrophobicContact CD2-CG1 4.08Å; L256-I258 HydrophobicContact CG-CG1 4.18Å; L256-I258 PolarHBondContact O-N 2.68Å; L256-V271 HydrophobicContact CB-CB 4.38Å; L256-V271 PolarHBondContact N-O 3.47Å; L256-V271 PolarHBondContact O-N 2.79Å; L256-L273 HydrophobicContact CB-CD1 4.3Å; L256-V341 HydrophobicContact CD2-CG1 4.13Å; L256-V341 HydrophobicContact CD2-CG2 4.21Å; L256-P374 HydrophobicContact CD1-CG 3.79Å; L256-P374 HydrophobicContact CD2-CG 4.43Å; L256-P374 HydrophobicContact CG-CG 4.33Å
257	D	71	Confident	69.4	Low	84 Å²	84	84.8 Å²	84.8	45%	0.449	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	91	-179.2	-175.7	-3.5	0	0	0	109.1	K259 L270	D257-K259 VanDerWaalsContact CG-NZ 3.27Å; D257-K259 PolarHBondContact O-N 2.88Å; D257-K259 WeakPolarHBondContact OD1-CE 3.24Å; D257-K259 IonicContact OD1-NZ 2.73Å; D257-K259 PolarHBondContact OD1-NZ 3.46Å; D257-K259 WeakPolarHBondContact OD2-CE 3.47Å; D257-K259 IonicContact OD2-NZ 2.67Å; D257-K259 PolarHBondContact OD2-NZ 3.46Å; D257-L270 HydrophobicContact CB-CD1 4.19Å
258	I	77.1	Confident	68.9	Low	1 Å²	1	86.6 Å²	86.6	1%	0.005	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	106.9	-176.9	-61.4	-179	0	0	0	108.5	L256 P260 P268 I269 V271 I345 Y368 V373	L256-I258 HydrophobicContact CD2-CD1 4.22Å; L256-I258 HydrophobicContact CD2-CG1 4.08Å; L256-I258 HydrophobicContact CG-CG1 4.18Å; L256-I258 PolarHBondContact O-N 2.68Å; I258-P260 WeakPolarHBondContact O-CD 3.48Å; I258-P268 VanDerWaalsContact O-CA 3.32Å; I258-P268 WeakPolarHBondContact O-CA 3.39Å; I258-I269 WeakPolarHBondContact CB-O 3.38Å; I258-I269 PolarHBondContact N-O 3.42Å; I258-I269 PolarHBondContact O-N 3.37Å; I258-V271 HydrophobicContact CD1-CB 4.35Å; I258-V271 HydrophobicContact CD1-CG2 3.58Å; I258-V271 HydrophobicContact CG1-CG2 4.31Å; I258-I345 HydrophobicContact CD1-CD1 3.8Å; I258-I345 HydrophobicContact CD1-CG1 3.54Å; I258-Y368 HydrophobicContact CG2-CD1 3.9Å; I258-V373 HydrophobicContact CD1-CG2 4.04Å
259	K	70.6	Confident	68.6	Low	129 Å²	129	81.5 Å²	81.5	56%	0.561	44%	0.442	S	S	*	.			trans	-109.5	97.2	176.6	-79.9	162.6	177.3	150.2	0	109.3	D257 P268	D257-K259 VanDerWaalsContact CG-NZ 3.27Å; D257-K259 PolarHBondContact O-N 2.88Å; D257-K259 WeakPolarHBondContact OD1-CE 3.24Å; D257-K259 IonicContact OD1-NZ 2.73Å; D257-K259 PolarHBondContact OD1-NZ 3.46Å; D257-K259 WeakPolarHBondContact OD2-CE 3.47Å; D257-K259 IonicContact OD2-NZ 2.67Å; D257-K259 PolarHBondContact OD2-NZ 3.46Å; K259-P268 HydrophobicContact CG-CB 4.06Å; K259-P268 HydrophobicContact CG-CG 4.44Å
260	P	65.9	Low	68.5	Low	16 Å²	16	87 Å²	87	10%	0.104	47%	0.47	C	S	.	.			trans	-63.6	155	171.1	29.7	-35	0	0	0	110.3	I258 L266 Y368	I258-P260 WeakPolarHBondContact O-CD 3.48Å; P260-L266 HydrophobicContact CB-CB 3.86Å; P260-L266 HydrophobicContact CB-CD1 4.01Å; P260-L266 HydrophobicContact CG-CB 3.5Å; P260-L266 WeakPolarHBondContact CG-O 3.34Å; P260-Y368 HydrophobicContact CG-CE1 4.12Å
261	D	63.2	Low	68.7	Low	118 Å²	118	85.1 Å²	85.1	63%	0.631	46%	0.459	S	S	*	.			trans	-62.4	138.9	-179.5	-127.8	-24.6	0	0	0	111.5	S263 L264	D261-S263 PolarHBondContact O-N 2.98Å; D261-L264 PolarHBondContact O-N 3.2Å
262	A	57.2	Low	68.9	Low	107 Å²	107	85 Å²	85	88%	0.884	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	3.9	-169.1	0	0	0	0	0	115.2
263	S	57.7	Low	70.1	Confident	101 Å²	101	77.9 Å²	77.9	71%	0.706	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-10.3	170	53.2	0	0	0	0	113.3	D261	D261-S263 PolarHBondContact O-N 2.98Å
264	L	59.3	Low	71.1	Confident	54 Å²	54	74.9 Å²	74.9	28%	0.283	42%	0.417	S	S	.	.	S	Bend	trans	-103.9	146.2	-180	-59.7	172.6	0	0	0	110.9	D261 L266 N371	D261-L264 PolarHBondContact O-N 3.2Å; L264-L266 HydrophobicContact CB-CD1 4.28Å; L264-L266 HydrophobicContact CB-CG 4.25Å; L264-L266 HydrophobicContact CD1-CD1 4.28Å; L264-L266 PolarHBondContact O-N 3.33Å; L264-N371 HydrophobicContact CD1-CB 3.36Å
265	N	58.8	Low	71.6	Confident	173 Å²	173	78 Å²	78	93%	0.925	43%	0.431	S	S	*	.	S	Bend	trans	-82.6	42.7	179.5	-60.5	-68.8	0	0	0	112.1
266	L	64.5	Low	72.3	Confident	35 Å²	35	74.9 Å²	74.9	18%	0.183	41%	0.409	C	S	.	.			trans	-110.6	134.3	-177.3	-63.1	175.9	0	0	0	109.4	P260 L264 E367 Y368	P260-L266 HydrophobicContact CB-CB 3.86Å; P260-L266 HydrophobicContact CB-CD1 4.01Å; P260-L266 HydrophobicContact CG-CB 3.5Å; P260-L266 WeakPolarHBondContact CG-O 3.34Å; L264-L266 HydrophobicContact CB-CD1 4.28Å; L264-L266 HydrophobicContact CB-CG 4.25Å; L264-L266 HydrophobicContact CD1-CD1 4.28Å; L264-L266 PolarHBondContact O-N 3.33Å; L266-E367 HydrophobicContact CD1-CG 4.07Å; L266-Y368 HydrophobicContact CB-CE1 3.91Å; L266-Y368 HydrophobicContact CD1-CD1 4.4Å; L266-Y368 HydrophobicContact CD1-CE1 4.26Å; L266-Y368 HydrophobicContact CD2-CE2 4.16Å; L266-Y368 HydrophobicContact CG-CE1 4.46Å
267	E	68.1	Low	73	Confident	158 Å²	158	74.8 Å²	74.8	74%	0.738	41%	0.413	S	S	*	.			trans	-83.1	146.7	177.9	-63.6	-171.4	156.9	0	0	110.5	I269 Y368	E267-I269 PolarHBondContact O-N 3.45Å; E267-Y368 PolarHBondContact O-OH 3.01Å
268	P	76.3	Confident	74.1	Confident	89 Å²	89	73.7 Å²	73.7	58%	0.578	41%	0.413	S	S	*	.			trans	-62.6	132.8	173.3	-23.5	34.8	0	0	0	112.2	I258 K259	I258-P268 VanDerWaalsContact O-CA 3.32Å; I258-P268 WeakPolarHBondContact O-CA 3.39Å; K259-P268 HydrophobicContact CG-CB 4.06Å; K259-P268 HydrophobicContact CG-CG 4.44Å
269	I	77	Confident	74.9	Confident	19 Å²	19	73.9 Å²	73.9	10%	0.097	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	124.8	-178.7	-57.1	-176.3	0	0	0	109.9	I258 E267 V271 L349 Y368	I258-I269 WeakPolarHBondContact CB-O 3.38Å; I258-I269 PolarHBondContact N-O 3.42Å; I258-I269 PolarHBondContact O-N 3.37Å; E267-I269 PolarHBondContact O-N 3.45Å; I269-V271 HydrophobicContact CG2-CG2 3.79Å; I269-V271 PolarHBondContact O-N 2.85Å; I269-L349 HydrophobicContact CD1-CD2 3.57Å; I269-L349 HydrophobicContact CD1-CG 4.12Å; I269-Y368 HydrophobicContact CD1-CD2 4.38Å; I269-Y368 HydrophobicContact CD1-CE1 3.91Å; I269-Y368 HydrophobicContact CD1-CE2 3.77Å; I269-Y368 HydrophobicContact CG1-CE1 4.17Å
270	L	78.4	Confident	76.1	Confident	118 Å²	118	67.7 Å²	67.7	62%	0.618	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.6	100	166.7	-174.3	69	0	0	0	109.2	D257	D257-L270 HydrophobicContact CB-CD1 4.19Å
271	V	80.9	Confident	77.4	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	132.5	177.2	172.8	0	0	0	0	109.8	S255 L256 I258 I269 L273 I345	S255-V271 CarbonylContact C-O 3.53Å; S255-V271 VanDerWaalsContact CA-O 3.31Å; S255-V271 WeakPolarHBondContact CA-O 3.34Å; L256-V271 HydrophobicContact CB-CB 4.38Å; L256-V271 PolarHBondContact N-O 3.47Å; L256-V271 PolarHBondContact O-N 2.79Å; I258-V271 HydrophobicContact CD1-CB 4.35Å; I258-V271 HydrophobicContact CD1-CG2 3.58Å; I258-V271 HydrophobicContact CG1-CG2 4.31Å; I269-V271 HydrophobicContact CG2-CG2 3.79Å; I269-V271 PolarHBondContact O-N 2.85Å; V271-L273 HydrophobicContact CG1-CD2 3.59Å; V271-L273 HydrophobicContact CG1-CG 4.28Å; V271-I345 HydrophobicContact CG2-CG1 3.97Å
272	Q	80.9	Confident	78.9	Confident	120 Å²	120	63.1 Å²	63.1	56%	0.561	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92	136.1	163.6	-165.1	-174.8	-75.3	0	0	108.9
273	L	83.3	Confident	80.7	Confident	2 Å²	2	58 Å²	58	1%	0.01	32%	0.32	C	S	.	.			trans	-109.7	143.3	176.1	-54.6	174.1	0	0	0	109.9	M254 L256 V271 R340 V341	M254-L273 PolarHBondContact O-N 3.09Å; L256-L273 HydrophobicContact CB-CD1 4.3Å; V271-L273 HydrophobicContact CG1-CD2 3.59Å; V271-L273 HydrophobicContact CG1-CG 4.28Å; L273-R340 HydrophobicContact CB-CG 4.38Å; L273-R340 HydrophobicContact CD2-CG 4.23Å; L273-V341 HydrophobicContact CD1-CG2 4.29Å; L273-V341 HydrophobicContact CD2-CG2 4.3Å
274	D	82.8	Confident	82.4	Confident	99 Å²	99	53.5 Å²	53.5	53%	0.529	29%	0.288	S	S	.	.			trans	-72.4	-144.7	179.9	-70.3	-44.9	0	0	0	112.6	R340	D274-R340 VanDerWaalsContact O-CZ 3.31Å; D274-R340 PolarHBondContact O-NH1 2.95Å; D274-R340 PolarHBondContact O-NH2 3.21Å
275	Q	83.8	Confident	84	Confident	119 Å²	119	57.5 Å²	57.5	56%	0.556	30%	0.303	S	S	*	.	S	Bend	trans	-81.2	146.5	161.8	-63.7	-168.3	14	0	0	111.3	R340	Q275-R340 PolarHBondContact O-NH1 3.2Å; Q275-R340 VanDerWaalsContact O-NH1 3.14Å
276	P	87.3	Confident	85.7	Confident	7 Å²	7	49.7 Å²	49.7	5%	0.045	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-68.6	168	177.2	27.1	-33	0	0	0	112.3	V249 T250 T280 L281	V249-P276 HydrophobicContact CG1-CB 4.13Å; V249-P276 HydrophobicContact CG1-CG 4.31Å; T250-P276 HydrophobicContact CG2-CG 3.83Å; P276-T280 HydrophobicContact CB-CG2 4.03Å; P276-L281 HydrophobicContact CG-CD2 3.9Å; P276-L281 HydrophobicContact CG-CG 4.1Å; P276-L281 WeakPolarHBondContact O-CD1 3.24Å; P276-L281 WeakPolarHBondContact O-CG 3.48Å
277	G	89.1	Confident	87	Confident	21 Å²	21	48.1 Å²	48.1	22%	0.216	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-65.2	166.2	-173.3	0	0	0	0	0	115	L279 T280 L281 E336	G277-L279 VanDerWaalsContact C-N 3.34Å; G277-L279 PolarHBondContact O-N 2.83Å; G277-T280 PolarHBondContact O-N 3.43Å; G277-L281 WeakPolarHBondContact O-CB 3.35Å; G277-L281 WeakPolarHBondContact O-CG 3.29Å; G277-L281 PolarHBondContact O-N 2.75Å; G277-E336 VanDerWaalsContact C-CD 3.43Å; G277-E336 VanDerWaalsContact C-OE1 3.28Å; G277-E336 VanDerWaalsContact CA-OE2 3.29Å; G277-E336 WeakPolarHBondContact CA-OE2 3.45Å
278	S	93.9	Very high	88.1	Confident	62 Å²	62	42.3 Å²	42.3	43%	0.434	23%	0.227	S	C	.	.	H	α-helix	trans	-59.9	-35.8	-172.9	62.1	0	0	0	0	114.9	A282 E336	S278-A282 VanDerWaalsContact O-CB 3.3Å; S278-A282 WeakPolarHBondContact O-CB 3.43Å; S278-A282 PolarHBondContact O-N 3.21Å; S278-A282 VanDerWaalsContact O-N 3.1Å; S278-E336 PolarHBondContact N-OE1 3.09Å; S278-E336 PolarHBondContact OG-OE1 3.2Å
279	L	94.7	Very high	88.8	Confident	4 Å²	4	41.8 Å²	41.8	2%	0.021	22%	0.217	C	C	.	.	H	α-helix	trans	-73.4	-44.5	177.6	-179.6	70.1	0	0	0	110.2	G277 A282 M283 L303 Q306 V307 L329 M333 E336	G277-L279 VanDerWaalsContact C-N 3.34Å; G277-L279 PolarHBondContact O-N 2.83Å; L279-A282 PolarHBondContact O-N 2.66Å; L279-M283 PolarHBondContact O-N 3.35Å; L279-L303 HydrophobicContact CD1-CD1 3.71Å; L279-Q306 HydrophobicContact CB-CB 4.42Å; L279-Q306 HydrophobicContact CD1-CB 3.85Å; L279-V307 HydrophobicContact CD1-CG2 3.62Å; L279-L329 HydrophobicContact CD1-CD1 4.05Å; L279-L329 HydrophobicContact CD2-CD1 4.3Å; L279-L329 HydrophobicContact CG-CD1 4.23Å; L279-M333 HydrophobicContact CD2-CG 4.08Å; L279-M333 HydrophobicContact CG-CG 4.17Å; L279-E336 WeakPolarHBondContact CB-OE1 3.42Å; L279-E336 WeakPolarHBondContact CB-OE2 3.34Å; L279-E336 PolarHBondContact N-OE1 2.98Å; L279-E336 PolarHBondContact N-OE2 3.2Å
280	T	94	Very high	89.5	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.3	-44.7	178.4	-52.9	0	0	0	0	111.4	L246 P276 G277 M283 C284 E336 F377	L246-T280 HydrophobicContact CD2-CG2 3.76Å; P276-T280 HydrophobicContact CB-CG2 4.03Å; G277-T280 PolarHBondContact O-N 3.43Å; T280-M283 PolarHBondContact O-N 2.94Å; T280-C284 PolarHBondContact O-N 2.88Å; T280-E336 WeakPolarHBondContact CB-OE2 3.47Å; T280-E336 PolarHBondContact N-OE2 3.43Å; T280-E336 PolarHBondContact OG1-OE2 2.87Å; T280-F377 HydrophobicContact CG2-CE1 4.15Å; T280-F377 HydrophobicContact CG2-CZ 3.67Å
281	L	93.2	Very high	89.9	Confident	34 Å²	34	38.4 Å²	38.4	18%	0.178	20%	0.198	C	C	.	.	H	α-helix	trans	-61.6	-41.5	172.3	-77.1	172.9	0	0	0	112.3	T250 P276 G277 M283 K285	T250-L281 HydrophobicContact CG2-CD2 3.99Å; P276-L281 HydrophobicContact CG-CD2 3.9Å; P276-L281 HydrophobicContact CG-CG 4.1Å; P276-L281 WeakPolarHBondContact O-CD1 3.24Å; P276-L281 WeakPolarHBondContact O-CG 3.48Å; G277-L281 WeakPolarHBondContact O-CB 3.35Å; G277-L281 WeakPolarHBondContact O-CG 3.29Å; G277-L281 PolarHBondContact O-N 2.75Å; L281-M283 VanDerWaalsContact C-N 3.32Å; L281-K285 WeakPolarHBondContact O-CB 3.31Å; L281-K285 WeakPolarHBondContact O-CD 3.29Å; L281-K285 WeakPolarHBondContact O-CG 3.42Å; L281-K285 PolarHBondContact O-N 2.96Å
282	A	95.4	Very high	90.3	Very high	4 Å²	4	45.6 Å²	45.6	3%	0.033	23%	0.231	C	C	.	.	H	α-helix	trans	-66.9	-34.4	177.1	0	0	0	0	0	112.3	S278 L279 L286 E302 L303 Q306	S278-A282 VanDerWaalsContact O-CB 3.3Å; S278-A282 WeakPolarHBondContact O-CB 3.43Å; S278-A282 PolarHBondContact O-N 3.21Å; S278-A282 VanDerWaalsContact O-N 3.1Å; L279-A282 PolarHBondContact O-N 2.66Å; A282-L286 WeakPolarHBondContact O-CB 3.49Å; A282-L286 PolarHBondContact O-N 3.36Å; A282-E302 HydrophobicContact CB-CG 4.11Å; A282-L303 HydrophobicContact CB-CB 4.25Å; A282-L303 HydrophobicContact CB-CD1 4.03Å; A282-Q306 HydrophobicContact CB-CG 3.92Å
283	M	95.3	Very high	90.5	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-66.9	-50.6	174.6	-175.6	60.6	174.4	0	0	111.1	L233 L236 L242 L246 L279 T280 L281 K285 L286 L287 L303 M333	L233-M283 HydrophobicContact CD2-CE 4.34Å; L233-M283 HydrophobicContact CD2-SD 4.1Å; L236-M283 HydrophobicContact CB-CE 3.84Å; L236-M283 HydrophobicContact CD1-CE 3.92Å; L242-M283 HydrophobicContact CD2-CE 4.19Å; L246-M283 HydrophobicContact CD1-CG 3.95Å; L279-M283 PolarHBondContact O-N 3.35Å; T280-M283 PolarHBondContact O-N 2.94Å; L281-M283 VanDerWaalsContact C-N 3.32Å; M283-K285 PolarHBondContact O-N 2.77Å; M283-L286 PolarHBondContact O-N 3.18Å; M283-L287 HydrophobicContact CE-CD1 4.29Å; M283-L287 HydrophobicContact CE-CD2 4.1Å; M283-L287 HydrophobicContact CE-CG 4.25Å; M283-L287 WeakPolarHBondContact O-CG 3.19Å; M283-L287 PolarHBondContact O-N 2.94Å; M283-L287 HydrophobicContact SD-CG 4.49Å; M283-L303 HydrophobicContact CB-CD1 4.13Å; M283-L303 HydrophobicContact SD-CD2 3.57Å; M283-L303 VanDerWaalsContact SD-CD2 3.57Å; M283-M333 HydrophobicContact CB-SD 3.94Å; M283-M333 HydrophobicContact CG-SD 3.92Å
284	C	93.5	Very high	90.2	Very high	5 Å²	5	51.4 Å²	51.4	3%	0.034	26%	0.258	C	S	.	.	H	α-helix	trans	-58.2	-46.9	176.9	-175.2	0	0	0	0	111.9	T250 T280 L286 L287 N288	T250-C284 HydrophobicContact CG2-CB 3.75Å; T250-C284 PolarHBondContact OG1-SG 2.85Å; T250-C284 VanDerWaalsContact OG1-SG 3.42Å; T280-C284 PolarHBondContact O-N 2.88Å; C284-L286 VanDerWaalsContact C-N 3.34Å; C284-L286 PolarHBondContact O-N 2.95Å; C284-L287 PolarHBondContact O-N 2.92Å; C284-N288 PolarHBondContact O-N 3.34Å
285	K	92.8	Very high	89.9	Confident	138 Å²	138	55.8 Å²	55.8	60%	0.6	27%	0.267	S	S	*	.	H	α-helix	trans	-57.1	-43.9	175.6	-74	168	-175.5	174.1	0	112.5	L281 M283 N288 E289	L281-K285 WeakPolarHBondContact O-CB 3.31Å; L281-K285 WeakPolarHBondContact O-CD 3.29Å; L281-K285 WeakPolarHBondContact O-CG 3.42Å; L281-K285 PolarHBondContact O-N 2.96Å; M283-K285 PolarHBondContact O-N 2.77Å; K285-N288 PolarHBondContact O-N 2.7Å; K285-E289 PolarHBondContact O-N 3.05Å
286	L	94.1	Very high	89.8	Confident	9 Å²	9	52.9 Å²	52.9	5%	0.047	27%	0.268	C	S	.	.	H	α-helix	trans	-66.2	-43	177.1	178.7	62.9	0	0	0	112.1	L233 A282 M283 C284 N288 E289 I290 V298 P300 L303	L233-L286 HydrophobicContact CD1-CD2 3.8Å; L233-L286 HydrophobicContact CD2-CD2 4.21Å; A282-L286 WeakPolarHBondContact O-CB 3.49Å; A282-L286 PolarHBondContact O-N 3.36Å; M283-L286 PolarHBondContact O-N 3.18Å; C284-L286 VanDerWaalsContact C-N 3.34Å; C284-L286 PolarHBondContact O-N 2.95Å; L286-N288 VanDerWaalsContact C-N 3.27Å; L286-N288 PolarHBondContact O-N 3.41Å; L286-E289 PolarHBondContact O-N 2.97Å; L286-I290 HydrophobicContact CD1-CD1 4.16Å; L286-I290 HydrophobicContact CD1-CG1 4.32Å; L286-I290 HydrophobicContact CG-CD1 3.96Å; L286-I290 VanDerWaalsContact O-CG1 3.28Å; L286-I290 WeakPolarHBondContact O-CG1 3.47Å; L286-I290 PolarHBondContact O-N 3.03Å; L286-V298 HydrophobicContact CD1-CG1 3.54Å; L286-P300 HydrophobicContact CD1-CB 3.88Å; L286-P300 HydrophobicContact CD2-CB 3.65Å; L286-P300 HydrophobicContact CG-CB 4.45Å; L286-L303 HydrophobicContact CD2-CB 4.23Å; L286-L303 HydrophobicContact CD2-CD2 3.53Å
287	L	92.8	Very high	90	Very high	3 Å²	3	55 Å²	55	2%	0.016	28%	0.281	C	S	.	.	H	α-helix	trans	-60	-39.6	177.5	-71.2	-173.2	0	0	0	111.7	R243 L246 M283 C284 I290 Q291	R243-L287 PolarHBondContact NH1-O 3.37Å; R243-L287 PolarHBondContact NH2-O 2.61Å; L246-L287 HydrophobicContact CD1-CD1 3.68Å; M283-L287 HydrophobicContact CE-CD1 4.29Å; M283-L287 HydrophobicContact CE-CD2 4.1Å; M283-L287 HydrophobicContact CE-CG 4.25Å; M283-L287 WeakPolarHBondContact O-CG 3.19Å; M283-L287 PolarHBondContact O-N 2.94Å; M283-L287 HydrophobicContact SD-CG 4.49Å; C284-L287 PolarHBondContact O-N 2.92Å; L287-I290 PolarHBondContact O-N 3.15Å; L287-Q291 PolarHBondContact O-N 3.43Å
288	N	90.7	Very high	90.2	Very high	36 Å²	36	54 Å²	54	19%	0.193	27%	0.271	C	S	.	.	H	α-helix	trans	-76.8	-34.6	179.4	-66.2	-20.9	0	0	0	111.9	N247 C284 K285 L286 I290 Q291 E292	N247-N288 PolarHBondContact OD1-ND2 2.96Å; N247-N288 VanDerWaalsContact OD1-ND2 3.08Å; N247-N288 PolarHBondContact OD1-OD1 3.11Å; C284-N288 PolarHBondContact O-N 3.34Å; K285-N288 PolarHBondContact O-N 2.7Å; L286-N288 VanDerWaalsContact C-N 3.27Å; L286-N288 PolarHBondContact O-N 3.41Å; N288-I290 VanDerWaalsContact C-N 3.34Å; N288-I290 PolarHBondContact O-N 2.87Å; N288-Q291 PolarHBondContact O-N 2.73Å; N288-E292 WeakPolarHBondContact O-CB 3.45Å; N288-E292 PolarHBondContact O-N 2.69Å
289	E	92	Very high	90.2	Very high	77 Å²	77	54.4 Å²	54.4	36%	0.36	27%	0.271	S	S	.	.	H	α-helix	trans	-60.1	-42.7	167.6	-167.5	-172.3	164.4	0	0	111.7	K285 L286 Q291 S293 V298	K285-E289 PolarHBondContact O-N 3.05Å; L286-E289 PolarHBondContact O-N 2.97Å; E289-Q291 PolarHBondContact O-N 3.28Å; E289-S293 WeakPolarHBondContact O-CB 3.14Å; E289-S293 PolarHBondContact O-N 3.44Å; E289-V298 HydrophobicContact CB-CG1 4.44Å; E289-V298 HydrophobicContact CG-CG1 4.1Å; E289-V298 HydrophobicContact CG-CG2 4.11Å
290	I	90.9	Very high	90.2	Very high	4 Å²	4	54.3 Å²	54.3	2%	0.021	27%	0.271	C	S	.	.	H	α-helix	trans	-60.8	-29	174.6	-69.5	167.7	0	0	0	111.5	K218 L220 L286 L287 N288 V298	K218-I290 VanDerWaalsContact CD-O 3.31Å; K218-I290 WeakPolarHBondContact CD-O 3.22Å; K218-I290 WeakPolarHBondContact CE-O 3.49Å; K218-I290 PolarHBondContact NZ-O 2.84Å; L220-I290 HydrophobicContact CD2-CD1 4.29Å; L286-I290 HydrophobicContact CD1-CD1 4.16Å; L286-I290 HydrophobicContact CD1-CG1 4.32Å; L286-I290 HydrophobicContact CG-CD1 3.96Å; L286-I290 VanDerWaalsContact O-CG1 3.28Å; L286-I290 WeakPolarHBondContact O-CG1 3.47Å; L286-I290 PolarHBondContact O-N 3.03Å; L287-I290 PolarHBondContact O-N 3.15Å; N288-I290 VanDerWaalsContact C-N 3.34Å; N288-I290 PolarHBondContact O-N 2.87Å; I290-V298 HydrophobicContact CG1-CB 4.35Å; I290-V298 HydrophobicContact CG1-CG1 4.07Å; I290-V298 HydrophobicContact CG1-CG2 4.36Å
291	Q	87.6	Confident	90.2	Very high	63 Å²	63	62.9 Å²	62.9	29%	0.294	30%	0.303	S	S	.	.	H	α-helix	trans	-81.3	-59.6	174.9	-168.6	165.5	-17.2	0	0	111.6	K218 L287 N288 E289	K218-Q291 PolarHBondContact NZ-O 3.06Å; L287-Q291 PolarHBondContact O-N 3.43Å; N288-Q291 PolarHBondContact O-N 2.73Å; E289-Q291 PolarHBondContact O-N 3.28Å
292	E	88	Confident	90.2	Very high	151 Å²	151	66.3 Å²	66.3	71%	0.706	32%	0.318	S	S	*	.	H	α-helix	trans	-75.4	-30.2	-168.9	-64.7	175.4	-158.5	0	0	115.3	N288 K294	N288-E292 WeakPolarHBondContact O-CB 3.45Å; N288-E292 PolarHBondContact O-N 2.69Å; E292-K294 PolarHBondContact O-N 2.93Å
293	S	84.4	Confident	90.2	Very high	26 Å²	26	66.2 Å²	66.2	18%	0.182	32%	0.317	C	S	.	.			trans	-61.7	129.9	-168.7	179.8	0	0	0	0	112.7	K218 E289 R295	K218-S293 WeakPolarHBondContact CE-O 3.34Å; K218-S293 PolarHBondContact NZ-O 2.85Å; E289-S293 WeakPolarHBondContact O-CB 3.14Å; E289-S293 PolarHBondContact O-N 3.44Å; S293-R295 PolarHBondContact O-N 3.47Å; S293-R295 PolarHBondContact OG-N 3.3Å
294	K	78.1	Confident	90.2	Very high	218 Å²	218	66.8 Å²	66.8	95%	0.948	32%	0.319	S	S	*	.	S	Bend	trans	-80	2.4	173.6	-64.1	178.2	-177.9	173.9	0	113.2	E292	E292-K294 PolarHBondContact O-N 2.93Å
295	R	75.9	Confident	90.2	Very high	191 Å²	191	69.2 Å²	69.2	72%	0.721	33%	0.334	S	S	*	.	S	Bend	trans	-92.2	140.7	175.3	-59.5	176.5	177.3	167.6	-1	109.3	S293 V297	S293-R295 PolarHBondContact O-N 3.47Å; S293-R295 PolarHBondContact OG-N 3.3Å; R295-V297 PolarHBondContact O-N 2.74Å
296	G	81.4	Confident	90.2	Very high	57 Å²	57	63.6 Å²	63.6	59%	0.588	31%	0.31	S	S	*	.	S	Bend	trans	-71.3	-9.3	175.9	0	0	0	0	0	114.6	G219	G219-G296 PolarHBondContact N-O 3.39Å
297	V	91.5	Very high	90.2	Very high	52 Å²	52	63.3 Å²	63.3	32%	0.315	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	137.7	178.5	-178.9	0	0	0	0	109.8	G219 S221 R295 T811	G219-V297 CarbonylContact O-C 3.53Å; G219-V297 VanDerWaalsContact O-CA 3.3Å; G219-V297 WeakPolarHBondContact O-CA 3.15Å; S221-V297 WeakPolarHBondContact OG-CG1 3.28Å; R295-V297 PolarHBondContact O-N 2.74Å; V297-T811 HydrophobicContact CG1-CG2 3.84Å; V297-T811 HydrophobicContact CG2-CG2 4.33Å
298	V	94.4	Very high	90.2	Very high	1 Å²	1	64.1 Å²	64.1	1%	0.006	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	151.1	175.8	166.4	0	0	0	0	109.4	K218 G219 L220 S221 L286 E289 I290	K218-V298 HydrophobicContact CD-CG2 4.29Å; G219-V298 PolarHBondContact O-N 2.94Å; L220-V298 CarbonylContact C-O 3.6Å; L220-V298 WeakPolarHBondContact CA-O 3.47Å; L220-V298 HydrophobicContact CD2-CB 4.03Å; L220-V298 HydrophobicContact CD2-CG1 4.01Å; S221-V298 PolarHBondContact N-O 2.95Å; S221-V298 PolarHBondContact OG-O 2.8Å; L286-V298 HydrophobicContact CD1-CG1 3.54Å; E289-V298 HydrophobicContact CB-CG1 4.44Å; E289-V298 HydrophobicContact CG-CG1 4.1Å; E289-V298 HydrophobicContact CG-CG2 4.11Å; I290-V298 HydrophobicContact CG1-CB 4.35Å; I290-V298 HydrophobicContact CG1-CG1 4.07Å; I290-V298 HydrophobicContact CG1-CG2 4.36Å
299	T	94.4	Very high	90.2	Very high	69 Å²	69	69.2 Å²	69.2	42%	0.423	34%	0.335	S	S	.	.			trans	-119.8	98.1	-173.1	-61.7	0	0	0	0	111	S221 L223 R301	S221-T299 WeakPolarHBondContact CB-OG1 3.29Å; S221-T299 PolarHBondContact OG-OG1 3.31Å; L223-T299 HydrophobicContact CD2-CG2 3.91Å; T299-R301 HydrophobicContact CG2-CB 4.31Å; T299-R301 PolarHBondContact O-N 3.38Å
300	P	93.9	Very high	90	Very high	3 Å²	3	70.3 Å²	70.3	2%	0.019	34%	0.338	C	S	.	.			trans	-79.2	37.3	-167	34.6	-38.6	0	0	0	114.5	L220 F229 L233 L286 E302 F304	L220-P300 HydrophobicContact CB-CG 4.44Å; L220-P300 HydrophobicContact CD2-CB 4.32Å; L220-P300 HydrophobicContact CD2-CG 4.08Å; F229-P300 HydrophobicContact CD1-CG 4.34Å; F229-P300 HydrophobicContact CE1-CB 3.78Å; F229-P300 HydrophobicContact CE1-CG 3.76Å; F229-P300 HydrophobicContact CZ-CB 4.38Å; L233-P300 HydrophobicContact CD1-CB 3.99Å; L233-P300 HydrophobicContact CD1-CG 4.36Å; L286-P300 HydrophobicContact CD1-CB 3.88Å; L286-P300 HydrophobicContact CD2-CB 3.65Å; L286-P300 HydrophobicContact CG-CB 4.45Å; P300-E302 PolarHBondContact O-N 2.84Å; P300-F304 WeakPolarHBondContact O-CB 3.33Å; P300-F304 PolarHBondContact O-N 2.6Å
301	R	93.3	Very high	89.9	Confident	179 Å²	179	70.5 Å²	70.5	68%	0.675	34%	0.341	S	S	*	.	H	α-helix	trans	-64.5	-39.5	-171.7	-174.9	-177.4	-178	-146.4	0.9	113.4	L223 T299 T305	L223-R301 HydrophobicContact CD1-CB 4.26Å; T299-R301 HydrophobicContact CG2-CB 4.31Å; T299-R301 PolarHBondContact O-N 3.38Å; R301-T305 WeakPolarHBondContact O-CB 3.49Å; R301-T305 PolarHBondContact O-N 3.22Å; R301-T305 PolarHBondContact O-OG1 3.37Å
302	E	94.4	Very high	89.9	Confident	106 Å²	106	71 Å²	71	50%	0.495	36%	0.355	S	S	.	.	H	α-helix	trans	-65.7	-53.7	-178.8	-178.2	54.8	-149.5	0	0	110.6	A282 P300 F304 T305 Q306	A282-E302 HydrophobicContact CB-CG 4.11Å; P300-E302 PolarHBondContact O-N 2.84Å; E302-F304 VanDerWaalsContact C-N 3.34Å; E302-F304 PolarHBondContact O-N 3.19Å; E302-T305 WeakPolarHBondContact O-CA 3.29Å; E302-T305 WeakPolarHBondContact O-CB 3.36Å; E302-T305 PolarHBondContact O-N 3.07Å; E302-Q306 WeakPolarHBondContact O-CG 3.33Å; E302-Q306 PolarHBondContact O-N 2.86Å; E302-Q306 PolarHBondContact OE1-NE2 2.82Å
303	L	95.3	Very high	89.9	Confident	2 Å²	2	68.5 Å²	68.5	1%	0.01	34%	0.34	C	S	.	.	H	α-helix	trans	-58.4	-44.3	177.1	-179.2	61.8	0	0	0	112.2	F229 L233 L279 A282 M283 L286 T305 Q306 V307 L329	F229-L303 HydrophobicContact CE2-CD2 4.41Å; F229-L303 HydrophobicContact CE2-CG 4.3Å; F229-L303 HydrophobicContact CZ-CB 4.26Å; F229-L303 HydrophobicContact CZ-CD2 4.18Å; F229-L303 HydrophobicContact CZ-CG 4.02Å; L233-L303 HydrophobicContact CD1-CD2 4.32Å; L233-L303 HydrophobicContact CD2-CD2 3.58Å; L279-L303 HydrophobicContact CD1-CD1 3.71Å; A282-L303 HydrophobicContact CB-CB 4.25Å; A282-L303 HydrophobicContact CB-CD1 4.03Å; M283-L303 HydrophobicContact CB-CD1 4.13Å; M283-L303 HydrophobicContact SD-CD2 3.57Å; M283-L303 VanDerWaalsContact SD-CD2 3.57Å; L286-L303 HydrophobicContact CD2-CB 4.23Å; L286-L303 HydrophobicContact CD2-CD2 3.53Å; L303-T305 PolarHBondContact O-N 3.1Å; L303-Q306 PolarHBondContact O-N 2.86Å; L303-V307 HydrophobicContact CD1-CG2 4.48Å; L303-V307 WeakPolarHBondContact O-CG2 3.35Å; L303-V307 PolarHBondContact O-N 2.83Å; L303-L329 HydrophobicContact CD1-CD1 4.2Å
304	F	94.1	Very high	90.1	Very high	12 Å²	12	67.4 Å²	67.4	5%	0.053	33%	0.331	C	S	.	.	H	α-helix	trans	-60.2	-36.5	176.9	-170.1	-107	0	0	0	112.1	L223 T226 F228 F229 P300 E302 C308 F317	L223-F304 HydrophobicContact CD1-CB 4.08Å; L223-F304 HydrophobicContact CD1-CD1 4.22Å; L223-F304 HydrophobicContact CD1-CG 4.25Å; T226-F304 HydrophobicContact CG2-CD2 4.22Å; T226-F304 HydrophobicContact CG2-CE1 4.12Å; T226-F304 HydrophobicContact CG2-CE2 3.79Å; T226-F304 HydrophobicContact CG2-CZ 3.73Å; F228-F304 HydrophobicContact CZ-CE2 4.27Å; F229-F304 HydrophobicContact CB-CD2 4.44Å; F229-F304 HydrophobicContact CD1-CB 4.44Å; F229-F304 AromaticContact CD1-CD2 3.75Å; F229-F304 HydrophobicContact CD1-CD2 3.75Å; F229-F304 HydrophobicContact CD1-CG 4.47Å; F229-F304 AromaticContact CD2-CD2 3.96Å; F229-F304 HydrophobicContact CD2-CD2 3.96Å; F229-F304 HydrophobicContact CE1-CB 3.65Å; F229-F304 AromaticContact CE1-CD2 3.78Å; F229-F304 HydrophobicContact CE1-CD2 3.78Å; F229-F304 HydrophobicContact CE1-CG 4.14Å; F229-F304 HydrophobicContact CE2-CB 4.43Å; F229-F304 HydrophobicContact CE2-CD2 4.03Å; F229-F304 AromaticContact CG-CD2 3.83Å; F229-F304 HydrophobicContact CG-CD2 3.83Å; F229-F304 HydrophobicContact CG-CE2 4.36Å; F229-F304 HydrophobicContact CZ-CB 3.65Å; F229-F304 AromaticContact CZ-CD2 3.92Å; F229-F304 HydrophobicContact CZ-CD2 3.92Å; F229-F304 HydrophobicContact CZ-CG 4.3Å; P300-F304 WeakPolarHBondContact O-CB 3.33Å; P300-F304 PolarHBondContact O-N 2.6Å; E302-F304 VanDerWaalsContact C-N 3.34Å; E302-F304 PolarHBondContact O-N 3.19Å; F304-C308 VanDerWaalsContact CE1-SG 3.57Å; F304-C308 WeakPolarHBondContact O-CB 3.21Å; F304-C308 PolarHBondContact O-N 3.4Å; F304-C308 PolarHBondContact O-SG 2.97Å; F304-F317 HydrophobicContact CE1-CD1 4.44Å; F304-F317 HydrophobicContact CE1-CE1 4.17Å
305	T	93.7	Very high	90.2	Very high	57 Å²	57	64.3 Å²	64.3	35%	0.35	32%	0.318	S	S	.	.	H	α-helix	trans	-67.9	-41.5	177	-60.4	0	0	0	0	111.3	R301 E302 L303 C308 K309	R301-T305 WeakPolarHBondContact O-CB 3.49Å; R301-T305 PolarHBondContact O-N 3.22Å; R301-T305 PolarHBondContact O-OG1 3.37Å; E302-T305 WeakPolarHBondContact O-CA 3.29Å; E302-T305 WeakPolarHBondContact O-CB 3.36Å; E302-T305 PolarHBondContact O-N 3.07Å; L303-T305 PolarHBondContact O-N 3.1Å; T305-C308 PolarHBondContact O-N 2.69Å; T305-K309 WeakPolarHBondContact O-CG 3.32Å; T305-K309 PolarHBondContact O-N 3.45Å; T305-K309 VanDerWaalsContact O-N 3.13Å
306	Q	94.3	Very high	90.3	Very high	19 Å²	19	57.8 Å²	57.8	9%	0.089	31%	0.31	C	S	.	.	H	α-helix	trans	-67.7	-40.1	175.7	-57.3	-62.4	-5.6	0	0	111.9	L279 A282 E302 L303 C308 K309 K310	L279-Q306 HydrophobicContact CB-CB 4.42Å; L279-Q306 HydrophobicContact CD1-CB 3.85Å; A282-Q306 HydrophobicContact CB-CG 3.92Å; E302-Q306 WeakPolarHBondContact O-CG 3.33Å; E302-Q306 PolarHBondContact O-N 2.86Å; E302-Q306 PolarHBondContact OE1-NE2 2.82Å; L303-Q306 PolarHBondContact O-N 2.86Å; Q306-C308 VanDerWaalsContact C-N 3.34Å; Q306-C308 PolarHBondContact O-N 2.97Å; Q306-K309 VanDerWaalsContact CD-NZ 3.34Å; Q306-K309 WeakPolarHBondContact O-CB 3.32Å; Q306-K309 PolarHBondContact O-N 2.94Å; Q306-K309 VanDerWaalsContact O-N 3.16Å; Q306-K310 PolarHBondContact O-N 3.21Å; Q306-K310 VanDerWaalsContact O-N 3.08Å
307	V	93.4	Very high	90.1	Very high	3 Å²	3	60.2 Å²	60.2	2%	0.018	31%	0.305	C	S	.	.	H	α-helix	trans	-58	-45.1	171.2	171.2	0	0	0	0	111.1	F229 L279 L303 K309 K310 A311 F314 L325 L329	F229-V307 HydrophobicContact CE2-CG2 4.29Å; L279-V307 HydrophobicContact CD1-CG2 3.62Å; L303-V307 HydrophobicContact CD1-CG2 4.48Å; L303-V307 WeakPolarHBondContact O-CG2 3.35Å; L303-V307 PolarHBondContact O-N 2.83Å; V307-K309 VanDerWaalsContact C-N 3.27Å; V307-K309 PolarHBondContact O-N 2.71Å; V307-K310 PolarHBondContact O-N 2.76Å; V307-K310 VanDerWaalsContact O-N 3.15Å; V307-A311 PolarHBondContact O-N 2.79Å; V307-F314 HydrophobicContact CG1-CD2 3.84Å; V307-F314 HydrophobicContact CG1-CE2 4.4Å; V307-F314 HydrophobicContact CG1-CG 4.34Å; V307-L325 HydrophobicContact CG1-CD1 3.81Å; V307-L329 HydrophobicContact CG2-CD1 4.12Å
308	C	92.2	Very high	89.9	Confident	21 Å²	21	63.8 Å²	63.8	14%	0.142	32%	0.318	C	S	.	.	H	α-helix	trans	-68.3	-19.6	178.7	-70.1	0	0	0	0	114.4	F304 T305 Q306	F304-C308 VanDerWaalsContact CE1-SG 3.57Å; F304-C308 WeakPolarHBondContact O-CB 3.21Å; F304-C308 PolarHBondContact O-N 3.4Å; F304-C308 PolarHBondContact O-SG 2.97Å; T305-C308 PolarHBondContact O-N 2.69Å; Q306-C308 VanDerWaalsContact C-N 3.34Å; Q306-C308 PolarHBondContact O-N 2.97Å
309	K	91.4	Very high	89.6	Confident	142 Å²	142	67.5 Å²	67.5	62%	0.617	34%	0.336	S	S	*	.	H	α-helix	trans	-77	-42.8	168	-67	175.7	-161.9	165	0	111.4	T305 Q306 V307	T305-K309 WeakPolarHBondContact O-CG 3.32Å; T305-K309 PolarHBondContact O-N 3.45Å; T305-K309 VanDerWaalsContact O-N 3.13Å; Q306-K309 VanDerWaalsContact CD-NZ 3.34Å; Q306-K309 WeakPolarHBondContact O-CB 3.32Å; Q306-K309 PolarHBondContact O-N 2.94Å; Q306-K309 VanDerWaalsContact O-N 3.16Å; V307-K309 VanDerWaalsContact C-N 3.27Å; V307-K309 PolarHBondContact O-N 2.71Å
310	K	87.8	Confident	89.5	Confident	100 Å²	100	66 Å²	66	44%	0.435	32%	0.323	S	S	.	.	H	α-helix	trans	-74	-29.3	-177.6	-168.2	63.5	174.2	178.7	0	112.8	Q306 V307	Q306-K310 PolarHBondContact O-N 3.21Å; Q306-K310 VanDerWaalsContact O-N 3.08Å; V307-K310 PolarHBondContact O-N 2.76Å; V307-K310 VanDerWaalsContact O-N 3.15Å
311	A	89	Confident	89.4	Confident	8 Å²	8	67.4 Å²	67.4	7%	0.066	33%	0.331	C	S	.	.			trans	-141.9	96.7	177	0	0	0	0	0	110.6	V307 R313 F314 Y328	V307-A311 PolarHBondContact O-N 2.79Å; A311-R313 HydrophobicContact CB-CG 4.43Å; A311-R313 PolarHBondContact O-N 2.88Å; A311-F314 HydrophobicContact CB-CD2 3.73Å; A311-F314 HydrophobicContact CB-CE2 3.73Å; A311-F314 WeakPolarHBondContact O-CD2 3.36Å; A311-F314 PolarHBondContact O-N 2.97Å; A311-Y328 HydrophobicContact CB-CD1 3.65Å; A311-Y328 HydrophobicContact CB-CE1 3.96Å; A311-Y328 HydrophobicContact CB-CG 4.01Å
312	A	87.3	Confident	89.5	Confident	73 Å²	73	58.9 Å²	58.9	60%	0.603	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-59	-21.3	-173	0	0	0	0	0	114.6	F314 K315	A312-F314 PolarHBondContact O-N 3.1Å; A312-K315 WeakPolarHBondContact O-CB 3.29Å; A312-K315 PolarHBondContact O-N 3.39Å
313	R	87.6	Confident	89.6	Confident	99 Å²	99	54.9 Å²	54.9	37%	0.374	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-58.8	-23.7	177.1	69.1	-171.9	-58.9	171.8	-3.4	115.4	A311 K315 Q320 E324 Y328	A311-R313 HydrophobicContact CB-CG 4.43Å; A311-R313 PolarHBondContact O-N 2.88Å; R313-K315 VanDerWaalsContact C-N 3.33Å; R313-Q320 PolarHBondContact O-NE2 3.05Å; R313-E324 IonicContact CZ-OE1 3Å; R313-E324 IonicContact CZ-OE2 3.13Å; R313-E324 IonicContact NE-OE2 3.58Å; R313-E324 VanDerWaalsContact NH1-CD 3.31Å; R313-E324 IonicContact NH1-OE1 2.77Å; R313-E324 PolarHBondContact NH1-OE1 3.32Å; R313-E324 IonicContact NH1-OE2 3.68Å; R313-E324 IonicContact NH2-OE1 2.74Å; R313-E324 PolarHBondContact NH2-OE1 3.19Å; R313-E324 IonicContact NH2-OE2 2.73Å; R313-E324 PolarHBondContact NH2-OE2 2.94Å; R313-Y328 PolarHBondContact NH1-OH 2.9Å
314	F	88.1	Confident	89.5	Confident	3 Å²	3	57.1 Å²	57.1	1%	0.013	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-83.7	-10.7	176.8	-58.7	-69.2	0	0	0	112.9	F228 V307 A311 A312 Q320 L325 Y328	F228-F314 AromaticContact CE2-CD1 3.67Å; F228-F314 HydrophobicContact CE2-CD1 3.67Å; F228-F314 AromaticContact CE2-CE1 3.94Å; F228-F314 HydrophobicContact CE2-CE1 3.94Å; F228-F314 AromaticContact CZ-CD1 3.93Å; F228-F314 HydrophobicContact CZ-CD1 3.93Å; V307-F314 HydrophobicContact CG1-CD2 3.84Å; V307-F314 HydrophobicContact CG1-CE2 4.4Å; V307-F314 HydrophobicContact CG1-CG 4.34Å; A311-F314 HydrophobicContact CB-CD2 3.73Å; A311-F314 HydrophobicContact CB-CE2 3.73Å; A311-F314 WeakPolarHBondContact O-CD2 3.36Å; A311-F314 PolarHBondContact O-N 2.97Å; A312-F314 PolarHBondContact O-N 3.1Å; F314-Q320 HydrophobicContact CD1-CB 3.99Å; F314-Q320 HydrophobicContact CD1-CG 3.9Å; F314-Q320 HydrophobicContact CE1-CB 3.95Å; F314-Q320 HydrophobicContact CE1-CG 4.24Å; F314-L325 HydrophobicContact CD1-CD1 4.43Å; F314-L325 HydrophobicContact CE1-CB 4Å; F314-L325 HydrophobicContact CE1-CD1 4.19Å; F314-L325 HydrophobicContact CE2-CD1 4.36Å; F314-L325 HydrophobicContact CZ-CB 4.07Å; F314-L325 HydrophobicContact CZ-CD1 4.17Å; F314-Y328 AromaticContact CE2-CD2 3.63Å; F314-Y328 HydrophobicContact CE2-CD2 3.63Å; F314-Y328 HydrophobicContact CE2-CE2 4.28Å; F314-Y328 AromaticContact CE2-CG 3.9Å; F314-Y328 HydrophobicContact CE2-CG 3.9Å; F314-Y328 AromaticContact CZ-CD2 3.68Å; F314-Y328 HydrophobicContact CZ-CD2 3.68Å; F314-Y328 HydrophobicContact CZ-CE2 4.28Å; F314-Y328 HydrophobicContact CZ-CG 4.36Å
315	K	81.6	Confident	89.6	Confident	154 Å²	154	56.6 Å²	56.6	67%	0.67	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	144.6	174.6	-164.4	178.9	178.6	-178	0	110	A312 R313	A312-K315 WeakPolarHBondContact O-CB 3.29Å; A312-K315 PolarHBondContact O-N 3.39Å; R313-K315 VanDerWaalsContact C-N 3.33Å
316	G	77	Confident	89.7	Confident	54 Å²	54	54 Å²	54	56%	0.557	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.5	10.2	177.3	0	0	0	0	0	115.8	Q318	G316-Q318 PolarHBondContact O-N 3.01Å; G316-Q318 VanDerWaalsContact O-N 3.15Å
317	F	78.1	Confident	89.8	Confident	107 Å²	107	58 Å²	58	47%	0.469	29%	0.286	S	S	.	.			trans	56	32.4	169.9	-50.3	-80.9	0	0	0	115.1	L223 N225 F304	L223-F317 HydrophobicContact CB-CE1 4.36Å; L223-F317 WeakPolarHBondContact O-CD1 3.41Å; L223-F317 VanDerWaalsContact O-CE1 3.23Å; L223-F317 WeakPolarHBondContact O-CE1 3.27Å; N225-F317 WeakPolarHBondContact CB-O 3.28Å; N225-F317 PolarHBondContact ND2-O 3.31Å; F304-F317 HydrophobicContact CE1-CD1 4.44Å; F304-F317 HydrophobicContact CE1-CE1 4.17Å
318	Q	85.9	Confident	89.8	Confident	128 Å²	128	61.8 Å²	61.8	60%	0.598	30%	0.301	S	S	*	.			trans	-72.1	160.8	169.1	-64	-175.7	-3.4	0	0	110.8	G316	G316-Q318 PolarHBondContact O-N 3.01Å; G316-Q318 VanDerWaalsContact O-N 3.15Å
319	Q	87.8	Confident	90	Very high	79 Å²	79	60.8 Å²	60.8	37%	0.369	30%	0.295	S	S	.	.			trans	-76.8	127.3	169.5	-65.9	-172.7	-21.9	0	0	108.5	N225 S773	N225-Q319 HydrophobicContact CB-CG 3.9Å; N225-Q319 PolarHBondContact OD1-NE2 3.47Å; N225-Q319 VanDerWaalsContact OD1-NE2 3.11Å; Q319-S773 VanDerWaalsContact OE1-CB 3.32Å; Q319-S773 PolarHBondContact OE1-OG 3.08Å
320	Q	92.3	Very high	90.2	Very high	36 Å²	36	54.2 Å²	54.2	17%	0.168	27%	0.266	C	S	.	.			trans	-130.8	168	-174.3	-66.2	-69.3	-0.1	0	0	110.4	F228 R313 F314	F228-Q320 WeakPolarHBondContact CB-O 3.22Å; F228-Q320 HydrophobicContact CD1-CB 4.29Å; F228-Q320 HydrophobicContact CD2-CB 4.11Å; F228-Q320 HydrophobicContact CE1-CB 4.03Å; F228-Q320 HydrophobicContact CE2-CB 3.85Å; F228-Q320 HydrophobicContact CG-CB 4.36Å; F228-Q320 HydrophobicContact CZ-CB 3.81Å; F228-Q320 HydrophobicContact CZ-CG 4.26Å; R313-Q320 PolarHBondContact O-NE2 3.05Å; F314-Q320 HydrophobicContact CD1-CB 3.99Å; F314-Q320 HydrophobicContact CD1-CG 3.9Å; F314-Q320 HydrophobicContact CE1-CB 3.95Å; F314-Q320 HydrophobicContact CE1-CG 4.24Å
321	D	93.5	Very high	90.5	Very high	33 Å²	33	51.8 Å²	51.8	18%	0.176	26%	0.258	C	S	.	.			trans	-81.9	139.4	-178.8	-166.2	-77.5	0	0	0	112.8	Q323 E324 L325 F717 Y776 Y827	D321-Q323 WeakPolarHBondContact OD1-CA 3.36Å; D321-Q323 WeakPolarHBondContact OD1-CB 3.38Å; D321-Q323 PolarHBondContact OD1-N 3.42Å; D321-E324 HydrophobicContact CB-CB 3.99Å; D321-E324 PolarHBondContact OD1-N 2.92Å; D321-L325 WeakPolarHBondContact O-CB 3.41Å; D321-L325 PolarHBondContact O-N 3.24Å; D321-F717 WeakPolarHBondContact OD2-CE2 3.29Å; D321-Y776 PolarHBondContact OD2-OH 3.13Å; D321-Y827 PolarHBondContact OD1-OH 3.34Å; D321-Y827 PolarHBondContact OD2-OH 3Å; D321-Y827 VanDerWaalsContact OD2-OH 3.12Å
322	S	95	Very high	90.8	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-79.3	-28.3	-177.8	69.5	0	0	0	0	113.9	V232 L326 Y776 Y827	V232-S322 VanDerWaalsContact CG2-O 3.32Å; V232-S322 WeakPolarHBondContact CG2-O 3.38Å; S322-L326 WeakPolarHBondContact O-CB 3.22Å; S322-L326 PolarHBondContact O-N 2.79Å; S322-L326 VanDerWaalsContact O-N 3.15Å; S322-Y776 VanDerWaalsContact OG-CE1 3.25Å; S322-Y776 WeakPolarHBondContact OG-CE1 3.47Å; S322-Y827 WeakPolarHBondContact OG-CD1 3.03Å; S322-Y827 VanDerWaalsContact OG-CE1 3.3Å; S322-Y827 WeakPolarHBondContact OG-CE1 3.33Å
323	Q	95.3	Very high	91.1	Very high	23 Å²	23	48 Å²	48	11%	0.107	23%	0.227	C	C	.	.	H	α-helix	trans	-72.8	-42	174.8	-171.9	-96.8	2.1	0	0	110.8	D321 L326 R327 D407 S409 H713 Y827 L828	D321-Q323 WeakPolarHBondContact OD1-CA 3.36Å; D321-Q323 WeakPolarHBondContact OD1-CB 3.38Å; D321-Q323 PolarHBondContact OD1-N 3.42Å; Q323-L326 WeakPolarHBondContact O-CB 3.33Å; Q323-L326 PolarHBondContact O-N 2.86Å; Q323-R327 VanDerWaalsContact NE2-NE 3.13Å; Q323-R327 PolarHBondContact O-N 2.93Å; Q323-R327 VanDerWaalsContact O-N 3.11Å; Q323-D407 PolarHBondContact NE2-OD2 3.28Å; Q323-S409 PolarHBondContact NE2-OG 3.28Å; Q323-H713 HydrophobicContact CG-CB 3.88Å; Q323-Y827 HydrophobicContact CB-CE1 4.14Å; Q323-Y827 WeakPolarHBondContact CB-OH 3.5Å; Q323-L828 HydrophobicContact CB-CD2 3.91Å; Q323-L828 HydrophobicContact CG-CD2 3.94Å
324	E	94.6	Very high	91.4	Very high	49 Å²	49	46 Å²	46	23%	0.229	22%	0.219	C	C	.	.	H	α-helix	trans	-63.6	-46.2	177.9	-174.6	175.6	-124.8	0	0	111.3	R313 D321 L326 R327 Y328	R313-E324 IonicContact CZ-OE1 3Å; R313-E324 IonicContact CZ-OE2 3.13Å; R313-E324 IonicContact NE-OE2 3.58Å; R313-E324 VanDerWaalsContact NH1-CD 3.31Å; R313-E324 IonicContact NH1-OE1 2.77Å; R313-E324 PolarHBondContact NH1-OE1 3.32Å; R313-E324 IonicContact NH1-OE2 3.68Å; R313-E324 IonicContact NH2-OE1 2.74Å; R313-E324 PolarHBondContact NH2-OE1 3.19Å; R313-E324 IonicContact NH2-OE2 2.73Å; R313-E324 PolarHBondContact NH2-OE2 2.94Å; D321-E324 HydrophobicContact CB-CB 3.99Å; D321-E324 PolarHBondContact OD1-N 2.92Å; E324-L326 VanDerWaalsContact C-N 3.33Å; E324-L326 PolarHBondContact O-N 2.85Å; E324-R327 PolarHBondContact O-N 2.69Å; E324-Y328 HydrophobicContact CG-CD2 3.93Å; E324-Y328 HydrophobicContact CG-CE2 3.7Å; E324-Y328 VanDerWaalsContact O-CD2 3.29Å; E324-Y328 WeakPolarHBondContact O-CD2 3.31Å; E324-Y328 PolarHBondContact O-N 2.89Å
325	L	95.7	Very high	91.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-54.7	-46.6	170.8	169.4	71.6	0	0	0	112.3	F228 F229 V232 V307 F314 D321 R327 Y328 L329	F228-L325 HydrophobicContact CD2-CB 4.07Å; F228-L325 HydrophobicContact CD2-CD2 3.59Å; F228-L325 HydrophobicContact CD2-CG 4.34Å; F228-L325 HydrophobicContact CE2-CB 4.21Å; F228-L325 HydrophobicContact CE2-CD1 4.28Å; F228-L325 HydrophobicContact CE2-CD2 3.79Å; F228-L325 HydrophobicContact CE2-CG 4.3Å; F229-L325 HydrophobicContact CB-CD2 3.66Å; F229-L325 HydrophobicContact CD2-CD1 4.11Å; F229-L325 HydrophobicContact CD2-CD2 3.72Å; F229-L325 HydrophobicContact CD2-CG 4.48Å; F229-L325 HydrophobicContact CG-CD2 4.17Å; V232-L325 HydrophobicContact CB-CD2 4.45Å; V232-L325 HydrophobicContact CG2-CD2 4.4Å; V307-L325 HydrophobicContact CG1-CD1 3.81Å; F314-L325 HydrophobicContact CD1-CD1 4.43Å; F314-L325 HydrophobicContact CE1-CB 4Å; F314-L325 HydrophobicContact CE1-CD1 4.19Å; F314-L325 HydrophobicContact CE2-CD1 4.36Å; F314-L325 HydrophobicContact CZ-CB 4.07Å; F314-L325 HydrophobicContact CZ-CD1 4.17Å; D321-L325 WeakPolarHBondContact O-CB 3.41Å; D321-L325 PolarHBondContact O-N 3.24Å; L325-R327 PolarHBondContact O-N 3.32Å; L325-Y328 PolarHBondContact O-N 2.94Å; L325-L329 WeakPolarHBondContact O-CB 3.42Å; L325-L329 PolarHBondContact O-N 2.77Å
326	L	96.6	Very high	92.1	Very high	4 Å²	4	41.7 Å²	41.7	2%	0.021	21%	0.207	C	C	.	.	H	α-helix	trans	-57.9	-41.5	-178.9	174	62.6	0	0	0	110.7	V232 L236 S322 Q323 E324 L329 L330 T711 L828 F830	V232-L326 HydrophobicContact CG1-CB 4.14Å; V232-L326 HydrophobicContact CG1-CD1 3.83Å; V232-L326 HydrophobicContact CG1-CG 4.5Å; L236-L326 HydrophobicContact CD1-CD1 4.01Å; L236-L326 HydrophobicContact CD2-CD1 4.07Å; L236-L326 HydrophobicContact CG-CD1 4.38Å; S322-L326 WeakPolarHBondContact O-CB 3.22Å; S322-L326 PolarHBondContact O-N 2.79Å; S322-L326 VanDerWaalsContact O-N 3.15Å; Q323-L326 WeakPolarHBondContact O-CB 3.33Å; Q323-L326 PolarHBondContact O-N 2.86Å; E324-L326 VanDerWaalsContact C-N 3.33Å; E324-L326 PolarHBondContact O-N 2.85Å; L326-L329 PolarHBondContact O-N 3.24Å; L326-L330 HydrophobicContact CD1-CD1 3.85Å; L326-L330 HydrophobicContact CD1-CG 3.92Å; L326-L330 HydrophobicContact CG-CD1 4.12Å; L326-L330 HydrophobicContact CG-CG 4.48Å; L326-L330 WeakPolarHBondContact O-CB 3.4Å; L326-L330 WeakPolarHBondContact O-CG 3.23Å; L326-L330 PolarHBondContact O-N 2.81Å; L326-T711 HydrophobicContact CD2-CG2 3.83Å; L326-L828 HydrophobicContact CD2-CD1 4.24Å; L326-F830 HydrophobicContact CD2-CE1 3.99Å; L326-F830 HydrophobicContact CD2-CZ 3.91Å
327	R	94.7	Very high	92.7	Very high	101 Å²	101	39.8 Å²	39.8	38%	0.381	18%	0.184	S	C	.	.	H	α-helix	trans	-61.2	-56	173	-72.2	-176.9	164.6	-151.5	-8.9	111.8	Q323 E324 L325 L329 L330 D331 D407	Q323-R327 VanDerWaalsContact NE2-NE 3.13Å; Q323-R327 PolarHBondContact O-N 2.93Å; Q323-R327 VanDerWaalsContact O-N 3.11Å; E324-R327 PolarHBondContact O-N 2.69Å; L325-R327 PolarHBondContact O-N 3.32Å; R327-L329 PolarHBondContact O-N 2.97Å; R327-L329 VanDerWaalsContact O-N 3.11Å; R327-L330 PolarHBondContact O-N 2.93Å; R327-L330 VanDerWaalsContact O-N 3.11Å; R327-D331 WeakPolarHBondContact O-CB 3.42Å; R327-D331 PolarHBondContact O-N 3.25Å; R327-D407 IonicContact CZ-OD1 3.36Å; R327-D407 IonicContact NE-OD1 3.69Å; R327-D407 PolarHBondContact NE-OD1 3.04Å; R327-D407 IonicContact NH2-OD1 3.37Å; R327-D407 PolarHBondContact NH2-OD1 3.31Å; R327-D407 IonicContact NH2-OD2 2.68Å
328	Y	95.2	Very high	93.3	Very high	83 Å²	83	39 Å²	39	33%	0.325	18%	0.184	S	C	.	.	H	α-helix	trans	-56.6	-31.4	178.7	-79.6	-73.7	0	0	0	113.8	A311 R313 F314 E324 L325 G332	A311-Y328 HydrophobicContact CB-CD1 3.65Å; A311-Y328 HydrophobicContact CB-CE1 3.96Å; A311-Y328 HydrophobicContact CB-CG 4.01Å; R313-Y328 PolarHBondContact NH1-OH 2.9Å; F314-Y328 AromaticContact CE2-CD2 3.63Å; F314-Y328 HydrophobicContact CE2-CD2 3.63Å; F314-Y328 HydrophobicContact CE2-CE2 4.28Å; F314-Y328 AromaticContact CE2-CG 3.9Å; F314-Y328 HydrophobicContact CE2-CG 3.9Å; F314-Y328 AromaticContact CZ-CD2 3.68Å; F314-Y328 HydrophobicContact CZ-CD2 3.68Å; F314-Y328 HydrophobicContact CZ-CE2 4.28Å; F314-Y328 HydrophobicContact CZ-CG 4.36Å; E324-Y328 HydrophobicContact CG-CD2 3.93Å; E324-Y328 HydrophobicContact CG-CE2 3.7Å; E324-Y328 VanDerWaalsContact O-CD2 3.29Å; E324-Y328 WeakPolarHBondContact O-CD2 3.31Å; E324-Y328 PolarHBondContact O-N 2.89Å; L325-Y328 PolarHBondContact O-N 2.94Å; Y328-G332 WeakPolarHBondContact O-CA 3.12Å; Y328-G332 PolarHBondContact O-N 3.32Å
329	L	96	Very high	93.5	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-72.9	-49.3	174.5	177.7	59	0	0	0	112.1	L233 L236 L279 L303 V307 L325 L326 R327 M333	L233-L329 HydrophobicContact CD2-CD2 4.34Å; L236-L329 HydrophobicContact CD1-CD2 3.7Å; L279-L329 HydrophobicContact CD1-CD1 4.05Å; L279-L329 HydrophobicContact CD2-CD1 4.3Å; L279-L329 HydrophobicContact CG-CD1 4.23Å; L303-L329 HydrophobicContact CD1-CD1 4.2Å; V307-L329 HydrophobicContact CG2-CD1 4.12Å; L325-L329 WeakPolarHBondContact O-CB 3.42Å; L325-L329 PolarHBondContact O-N 2.77Å; L326-L329 PolarHBondContact O-N 3.24Å; R327-L329 PolarHBondContact O-N 2.97Å; R327-L329 VanDerWaalsContact O-N 3.11Å; L329-M333 HydrophobicContact CD1-CE 4.39Å; L329-M333 HydrophobicContact CG-CE 4.22Å; L329-M333 WeakPolarHBondContact O-CG 3.3Å; L329-M333 PolarHBondContact O-N 3.47Å; L329-M333 VanDerWaalsContact O-N 3.09Å
330	L	95.6	Very high	93.5	Very high	3 Å²	3	37 Å²	37	2%	0.016	17%	0.172	C	C	.	.	H	α-helix	trans	-68.3	-47.4	-179.8	-67.7	-178.2	0	0	0	111.9	L326 R327 G332 M333 R334 V378 F382 L406	L326-L330 HydrophobicContact CD1-CD1 3.85Å; L326-L330 HydrophobicContact CD1-CG 3.92Å; L326-L330 HydrophobicContact CG-CD1 4.12Å; L326-L330 HydrophobicContact CG-CG 4.48Å; L326-L330 WeakPolarHBondContact O-CB 3.4Å; L326-L330 WeakPolarHBondContact O-CG 3.23Å; L326-L330 PolarHBondContact O-N 2.81Å; R327-L330 PolarHBondContact O-N 2.93Å; R327-L330 VanDerWaalsContact O-N 3.11Å; L330-G332 VanDerWaalsContact C-N 3.3Å; L330-G332 PolarHBondContact O-N 2.67Å; L330-M333 HydrophobicContact CD2-CE 3.86Å; L330-M333 PolarHBondContact O-N 3.18Å; L330-R334 WeakPolarHBondContact O-CB 3.35Å; L330-R334 PolarHBondContact O-N 3.27Å; L330-V378 HydrophobicContact CB-CG1 4Å; L330-V378 HydrophobicContact CD2-CG1 4.32Å; L330-F382 HydrophobicContact CD1-CB 4.48Å; L330-F382 HydrophobicContact CD1-CD2 3.98Å; L330-F382 HydrophobicContact CD1-CE2 4.37Å; L330-F382 HydrophobicContact CD1-CG 4.14Å; L330-F382 HydrophobicContact CD2-CD2 3.79Å; L330-F382 HydrophobicContact CD2-CE2 3.63Å; L330-F382 HydrophobicContact CD2-CZ 4.43Å; L330-L406 HydrophobicContact CB-CD1 3.86Å; L330-L406 HydrophobicContact CD1-CB 4.38Å; L330-L406 HydrophobicContact CD1-CD1 4.22Å
331	D	94.3	Very high	93.3	Very high	49 Å²	49	35.7 Å²	35.7	26%	0.262	17%	0.166	S	C	.	.	H	α-helix	trans	-66.5	-32.9	176.2	-68.9	-49.8	0	0	0	111.8	R327 R334 A335	R327-D331 WeakPolarHBondContact O-CB 3.42Å; R327-D331 PolarHBondContact O-N 3.25Å; D331-R334 PolarHBondContact O-N 2.86Å; D331-R334 IonicContact OD1-CZ 2.66Å; D331-R334 IonicContact OD1-NH1 3.59Å; D331-R334 PolarHBondContact OD1-NH1 2.94Å; D331-A335 VanDerWaalsContact O-CB 3.26Å; D331-A335 WeakPolarHBondContact O-CB 3.29Å; D331-A335 PolarHBondContact O-N 3.15Å
332	G	94.2	Very high	93.1	Very high	2 Å²	2	35.8 Å²	35.8	2%	0.021	17%	0.169	C	C	.	.	H	α-helix	trans	-59.8	-47.2	171.6	0	0	0	0	0	112.6	Y328 L330 E336	Y328-G332 WeakPolarHBondContact O-CA 3.12Å; Y328-G332 PolarHBondContact O-N 3.32Å; L330-G332 VanDerWaalsContact C-N 3.3Å; L330-G332 PolarHBondContact O-N 2.67Å; G332-E336 PolarHBondContact O-N 3.05Å; G332-E336 VanDerWaalsContact O-N 3.12Å
333	M	94.1	Very high	92.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-70	-41.3	175.7	-69.1	-174.9	-60	0	0	112	L279 M283 L329 L330 A335 E336 E337 F377 V378	L279-M333 HydrophobicContact CD2-CG 4.08Å; L279-M333 HydrophobicContact CG-CG 4.17Å; M283-M333 HydrophobicContact CB-SD 3.94Å; M283-M333 HydrophobicContact CG-SD 3.92Å; L329-M333 HydrophobicContact CD1-CE 4.39Å; L329-M333 HydrophobicContact CG-CE 4.22Å; L329-M333 WeakPolarHBondContact O-CG 3.3Å; L329-M333 PolarHBondContact O-N 3.47Å; L329-M333 VanDerWaalsContact O-N 3.09Å; L330-M333 HydrophobicContact CD2-CE 3.86Å; L330-M333 PolarHBondContact O-N 3.18Å; M333-A335 VanDerWaalsContact C-N 3.28Å; M333-A335 PolarHBondContact O-N 2.88Å; M333-E336 PolarHBondContact O-N 3.31Å; M333-E337 PolarHBondContact O-N 3.13Å; M333-F377 HydrophobicContact CB-CE2 4.29Å; M333-F377 HydrophobicContact CB-CZ 4.05Å; M333-V378 HydrophobicContact CB-CG2 4.12Å
334	R	93.1	Very high	92.3	Very high	58 Å²	58	39.1 Å²	39.1	22%	0.219	19%	0.187	C	C	.	.	H	α-helix	trans	-56	-44.1	175.7	-173.5	-163.1	-99.4	158.8	-19.5	110.6	L330 D331 E337 L338 N376 V378 D379	L330-R334 WeakPolarHBondContact O-CB 3.35Å; L330-R334 PolarHBondContact O-N 3.27Å; D331-R334 PolarHBondContact O-N 2.86Å; D331-R334 IonicContact OD1-CZ 2.66Å; D331-R334 IonicContact OD1-NH1 3.59Å; D331-R334 PolarHBondContact OD1-NH1 2.94Å; R334-E337 PolarHBondContact O-N 2.83Å; R334-L338 WeakPolarHBondContact O-CB 3.44Å; R334-L338 PolarHBondContact O-N 3.19Å; R334-N376 PolarHBondContact O-ND2 3.1Å; R334-V378 HydrophobicContact CB-CB 4.18Å; R334-V378 HydrophobicContact CB-CG1 4.38Å; R334-V378 HydrophobicContact CB-CG2 4.07Å; R334-D379 IonicContact CZ-OD1 2.75Å; R334-D379 IonicContact NE-OD1 3.96Å; R334-D379 PolarHBondContact NE-OD1 3.28Å; R334-D379 IonicContact NE-OD2 3.15Å; R334-D379 PolarHBondContact NE-OD2 3.26Å; R334-D379 IonicContact NH2-OD1 3.74Å; R334-D379 PolarHBondContact NH2-OD1 2.72Å; R334-D379 IonicContact NH2-OD2 3.18Å
335	A	92.9	Very high	91.9	Very high	33 Å²	33	36.8 Å²	36.8	27%	0.273	18%	0.177	S	C	.	.	H	α-helix	trans	-72.5	-34.2	178.9	0	0	0	0	0	113.8	D331 M333 K339	D331-A335 VanDerWaalsContact O-CB 3.26Å; D331-A335 WeakPolarHBondContact O-CB 3.29Å; D331-A335 PolarHBondContact O-N 3.15Å; M333-A335 VanDerWaalsContact C-N 3.28Å; M333-A335 PolarHBondContact O-N 2.88Å; A335-K339 WeakPolarHBondContact O-CB 3.45Å; A335-K339 PolarHBondContact O-N 3.43Å; A335-K339 VanDerWaalsContact O-N 3.14Å
336	E	92.9	Very high	91.5	Very high	33 Å²	33	37.8 Å²	37.8	15%	0.154	19%	0.185	C	C	.	.	H	α-helix	trans	-62.4	-45.4	170.5	-77.7	-171.5	153.1	0	0	111.1	G277 S278 L279 T280 G332 M333 R340	G277-E336 VanDerWaalsContact C-CD 3.43Å; G277-E336 VanDerWaalsContact C-OE1 3.28Å; G277-E336 VanDerWaalsContact CA-OE2 3.29Å; G277-E336 WeakPolarHBondContact CA-OE2 3.45Å; S278-E336 PolarHBondContact N-OE1 3.09Å; S278-E336 PolarHBondContact OG-OE1 3.2Å; L279-E336 WeakPolarHBondContact CB-OE1 3.42Å; L279-E336 WeakPolarHBondContact CB-OE2 3.34Å; L279-E336 PolarHBondContact N-OE1 2.98Å; L279-E336 PolarHBondContact N-OE2 3.2Å; T280-E336 WeakPolarHBondContact CB-OE2 3.47Å; T280-E336 PolarHBondContact N-OE2 3.43Å; T280-E336 PolarHBondContact OG1-OE2 2.87Å; G332-E336 PolarHBondContact O-N 3.05Å; G332-E336 VanDerWaalsContact O-N 3.12Å; M333-E336 PolarHBondContact O-N 3.31Å; E336-R340 VanDerWaalsContact O-CB 3.3Å; E336-R340 WeakPolarHBondContact O-CB 3.48Å; E336-R340 PolarHBondContact O-N 2.87Å
337	E	90.1	Very high	91	Very high	13 Å²	13	42 Å²	42	6%	0.061	20%	0.204	C	C	.	.	H	α-helix	trans	-68.3	-41.9	179.3	-172	66	-161.1	0	0	112.4	M333 R334 K339 R340 V341 F377	M333-E337 PolarHBondContact O-N 3.13Å; R334-E337 PolarHBondContact O-N 2.83Å; E337-K339 PolarHBondContact O-N 3.25Å; E337-R340 WeakPolarHBondContact O-CB 3.38Å; E337-R340 PolarHBondContact O-N 3.08Å; E337-R340 IonicContact OE1-NE 2.69Å; E337-R340 WeakPolarHBondContact OE2-CD 3.49Å; E337-R340 IonicContact OE2-NE 2.68Å; E337-R340 PolarHBondContact OE2-NE 3.04Å; E337-V341 WeakPolarHBondContact O-CG2 3.46Å; E337-V341 PolarHBondContact O-N 3.33Å; E337-F377 HydrophobicContact CB-CD1 4.17Å; E337-F377 HydrophobicContact CB-CE1 3.7Å; E337-F377 HydrophobicContact CG-CD1 3.7Å; E337-F377 HydrophobicContact CG-CE1 3.71Å; E337-F377 WeakPolarHBondContact OE2-CE1 3.39Å
338	L	89.8	Confident	90.6	Very high	92 Å²	92	38 Å²	38	48%	0.482	19%	0.192	S	C	.	.	H	α-helix	trans	-60.3	-46.9	176.5	-179.5	62.1	0	0	0	111.2	R334 R340 V341 S342	R334-L338 WeakPolarHBondContact O-CB 3.44Å; R334-L338 PolarHBondContact O-N 3.19Å; L338-R340 VanDerWaalsContact C-N 3.33Å; L338-R340 PolarHBondContact O-N 2.9Å; L338-V341 PolarHBondContact O-N 3.14Å; L338-S342 VanDerWaalsContact O-CB 3.29Å; L338-S342 WeakPolarHBondContact O-CB 3.25Å; L338-S342 PolarHBondContact O-N 2.78Å
339	K	89.8	Confident	90	Very high	143 Å²	143	34.8 Å²	34.8	62%	0.622	18%	0.18	S	C	*	.	H	α-helix	trans	-60.9	-41.9	176.4	-179.5	169.9	-179	170.3	0	112	A335 E337 S342 M343	A335-K339 WeakPolarHBondContact O-CB 3.45Å; A335-K339 PolarHBondContact O-N 3.43Å; A335-K339 VanDerWaalsContact O-N 3.14Å; E337-K339 PolarHBondContact O-N 3.25Å; K339-S342 PolarHBondContact O-N 3.29Å; K339-M343 HydrophobicContact CD-SD 4.47Å; K339-M343 HydrophobicContact CG-CG 4.44Å; K339-M343 HydrophobicContact CG-SD 3.94Å; K339-M343 WeakPolarHBondContact O-CB 3.14Å; K339-M343 VanDerWaalsContact O-CG 3.29Å; K339-M343 WeakPolarHBondContact O-CG 3.36Å; K339-M343 PolarHBondContact O-N 2.89Å
340	R	88.9	Confident	89.5	Confident	22 Å²	22	39.1 Å²	39.1	8%	0.083	20%	0.199	C	C	.	.	H	α-helix	trans	-59.8	-46.4	176.4	157.3	-175.3	179.1	71.8	-5.8	112.5	L273 D274 Q275 E336 E337 L338 G344	L273-R340 HydrophobicContact CB-CG 4.38Å; L273-R340 HydrophobicContact CD2-CG 4.23Å; D274-R340 VanDerWaalsContact O-CZ 3.31Å; D274-R340 PolarHBondContact O-NH1 2.95Å; D274-R340 PolarHBondContact O-NH2 3.21Å; Q275-R340 PolarHBondContact O-NH1 3.2Å; Q275-R340 VanDerWaalsContact O-NH1 3.14Å; E336-R340 VanDerWaalsContact O-CB 3.3Å; E336-R340 WeakPolarHBondContact O-CB 3.48Å; E336-R340 PolarHBondContact O-N 2.87Å; E337-R340 WeakPolarHBondContact O-CB 3.38Å; E337-R340 PolarHBondContact O-N 3.08Å; E337-R340 IonicContact OE1-NE 2.69Å; E337-R340 WeakPolarHBondContact OE2-CD 3.49Å; E337-R340 IonicContact OE2-NE 2.68Å; E337-R340 PolarHBondContact OE2-NE 3.04Å; L338-R340 VanDerWaalsContact C-N 3.33Å; L338-R340 PolarHBondContact O-N 2.9Å; R340-G344 PolarHBondContact O-N 3Å
341	V	87.8	Confident	88.8	Confident	8 Å²	8	46.3 Å²	46.3	5%	0.048	23%	0.232	C	C	.	.	H	α-helix	trans	-67.1	-45.4	176.6	172.7	0	0	0	0	110.8	L256 L273 E337 L338 M343 G344 I345 V373	L256-V341 HydrophobicContact CD2-CG1 4.13Å; L256-V341 HydrophobicContact CD2-CG2 4.21Å; L273-V341 HydrophobicContact CD1-CG2 4.29Å; L273-V341 HydrophobicContact CD2-CG2 4.3Å; E337-V341 WeakPolarHBondContact O-CG2 3.46Å; E337-V341 PolarHBondContact O-N 3.33Å; L338-V341 PolarHBondContact O-N 3.14Å; V341-M343 VanDerWaalsContact C-N 3.34Å; V341-M343 PolarHBondContact O-N 2.73Å; V341-G344 PolarHBondContact O-N 3.37Å; V341-G344 VanDerWaalsContact O-N 3.16Å; V341-I345 HydrophobicContact CG1-CD1 3.78Å; V341-I345 HydrophobicContact CG1-CG1 4.32Å; V341-I345 VanDerWaalsContact O-CG1 3.31Å; V341-I345 WeakPolarHBondContact O-CG1 3.5Å; V341-I345 PolarHBondContact O-N 3.25Å; V341-V373 HydrophobicContact CG1-CG1 4.04Å; V341-V373 HydrophobicContact CG1-CG2 3.91Å
342	S	88.6	Confident	87.8	Confident	34 Å²	34	48.2 Å²	48.2	24%	0.238	25%	0.25	C	C	.	.	H	α-helix	trans	-55.5	-46.5	177	-159.9	0	0	0	0	112.3	L338 K339 I345 A346 V365 E369	L338-S342 VanDerWaalsContact O-CB 3.29Å; L338-S342 WeakPolarHBondContact O-CB 3.25Å; L338-S342 PolarHBondContact O-N 2.78Å; K339-S342 PolarHBondContact O-N 3.29Å; S342-I345 PolarHBondContact O-N 3.07Å; S342-A346 WeakPolarHBondContact O-CB 3.37Å; S342-A346 PolarHBondContact O-N 3.25Å; S342-V365 WeakPolarHBondContact OG-CG1 3.46Å; S342-E369 WeakPolarHBondContact CB-OE1 3.43Å; S342-E369 PolarHBondContact OG-OE1 2.88Å
343	M	87.5	Confident	86.3	Confident	86 Å²	86	50 Å²	50	42%	0.424	26%	0.262	S	S	.	.	H	α-helix	trans	-62.4	-47	174.4	-74	174.5	56.3	0	0	112.2	K339 V341 I345 A346 E347	K339-M343 HydrophobicContact CD-SD 4.47Å; K339-M343 HydrophobicContact CG-CG 4.44Å; K339-M343 HydrophobicContact CG-SD 3.94Å; K339-M343 WeakPolarHBondContact O-CB 3.14Å; K339-M343 VanDerWaalsContact O-CG 3.29Å; K339-M343 WeakPolarHBondContact O-CG 3.36Å; K339-M343 PolarHBondContact O-N 2.89Å; V341-M343 VanDerWaalsContact C-N 3.34Å; V341-M343 PolarHBondContact O-N 2.73Å; M343-I345 VanDerWaalsContact C-N 3.34Å; M343-I345 PolarHBondContact O-N 2.88Å; M343-A346 PolarHBondContact O-N 2.98Å; M343-E347 PolarHBondContact O-N 3.35Å
344	G	86.1	Confident	84.5	Confident	7 Å²	7	60 Å²	60	7%	0.072	31%	0.305	C	S	.	.	H	α-helix	trans	-61.7	-38	178.3	0	0	0	0	0	113.6	R340 V341 S348	R340-G344 PolarHBondContact O-N 3Å; V341-G344 PolarHBondContact O-N 3.37Å; V341-G344 VanDerWaalsContact O-N 3.16Å; G344-S348 VanDerWaalsContact O-CB 3.31Å; G344-S348 WeakPolarHBondContact O-CB 3.25Å; G344-S348 PolarHBondContact O-N 3.36Å; G344-S348 PolarHBondContact O-OG 2.94Å
345	I	86.4	Confident	82.9	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-64	-48.4	172.7	-62.8	163.8	0	0	0	109.8	I258 V271 V341 S342 M343 E347 S348 L349 V365 Y368 E369 V373	I258-I345 HydrophobicContact CD1-CD1 3.8Å; I258-I345 HydrophobicContact CD1-CG1 3.54Å; V271-I345 HydrophobicContact CG2-CG1 3.97Å; V341-I345 HydrophobicContact CG1-CD1 3.78Å; V341-I345 HydrophobicContact CG1-CG1 4.32Å; V341-I345 VanDerWaalsContact O-CG1 3.31Å; V341-I345 WeakPolarHBondContact O-CG1 3.5Å; V341-I345 PolarHBondContact O-N 3.25Å; S342-I345 PolarHBondContact O-N 3.07Å; M343-I345 VanDerWaalsContact C-N 3.34Å; M343-I345 PolarHBondContact O-N 2.88Å; I345-E347 VanDerWaalsContact C-N 3.35Å; I345-E347 PolarHBondContact O-N 3.47Å; I345-S348 PolarHBondContact O-N 3.22Å; I345-L349 HydrophobicContact CG2-CD1 3.82Å; I345-L349 HydrophobicContact CG2-CG 4.29Å; I345-L349 WeakPolarHBondContact O-CB 3.47Å; I345-L349 WeakPolarHBondContact O-CG 3.49Å; I345-L349 PolarHBondContact O-N 2.67Å; I345-V365 HydrophobicContact CB-CG2 4.3Å; I345-V365 HydrophobicContact CG2-CB 4.44Å; I345-V365 HydrophobicContact CG2-CG2 3.86Å; I345-Y368 HydrophobicContact CG2-CD2 4.21Å; I345-Y368 HydrophobicContact CG2-CG 4.42Å; I345-E369 HydrophobicContact CD1-CG 4.26Å; I345-V373 HydrophobicContact CD1-CG2 3.71Å
346	A	86.8	Confident	81.5	Confident	20 Å²	20	65.1 Å²	65.1	17%	0.165	34%	0.34	C	S	.	.	H	α-helix	trans	-59.7	-42.6	-180	0	0	0	0	0	112.3	S342 M343 L349 K350 I361 V365	S342-A346 WeakPolarHBondContact O-CB 3.37Å; S342-A346 PolarHBondContact O-N 3.25Å; M343-A346 PolarHBondContact O-N 2.98Å; A346-L349 PolarHBondContact O-N 3.14Å; A346-K350 VanDerWaalsContact O-CG 3.25Å; A346-K350 WeakPolarHBondContact O-CG 3.46Å; A346-K350 PolarHBondContact O-N 3.49Å; A346-I361 HydrophobicContact CB-CG2 4.12Å; A346-V365 HydrophobicContact CB-CG2 3.95Å
347	E	86.5	Confident	80.9	Confident	92 Å²	92	66.3 Å²	66.3	43%	0.43	35%	0.347	S	S	.	.	H	α-helix	trans	-67.6	-40.6	175.9	-71.6	-172.8	-169.7	0	0	112.5	M343 I345 L349 K350 Q351	M343-E347 PolarHBondContact O-N 3.35Å; I345-E347 VanDerWaalsContact C-N 3.35Å; I345-E347 PolarHBondContact O-N 3.47Å; E347-L349 VanDerWaalsContact C-N 3.33Å; E347-L349 PolarHBondContact O-N 3.36Å; E347-K350 PolarHBondContact O-N 3.02Å; E347-Q351 WeakPolarHBondContact O-CG 3.44Å; E347-Q351 PolarHBondContact O-N 2.94Å
348	S	85.4	Confident	80.3	Confident	17 Å²	17	70.1 Å²	70.1	12%	0.119	37%	0.365	C	S	.	.	H	α-helix	trans	-63.7	-39.5	176.6	-56.9	0	0	0	0	111.6	G344 I345 Q351 S352	G344-S348 VanDerWaalsContact O-CB 3.31Å; G344-S348 WeakPolarHBondContact O-CB 3.25Å; G344-S348 PolarHBondContact O-N 3.36Å; G344-S348 PolarHBondContact O-OG 2.94Å; I345-S348 PolarHBondContact O-N 3.22Å; S348-Q351 PolarHBondContact O-N 3.31Å; S348-S352 PolarHBondContact O-N 3.21Å; S348-S352 PolarHBondContact O-OG 2.89Å
349	L	84.3	Confident	80	Confident	17 Å²	17	70.6 Å²	70.6	9%	0.089	37%	0.368	C	S	.	.	H	α-helix	trans	-67.2	-36.3	174.1	-73.2	172.1	0	0	0	113	I269 I345 A346 E347 Q351 S353 I361 A364 V365 Y368	I269-L349 HydrophobicContact CD1-CD2 3.57Å; I269-L349 HydrophobicContact CD1-CG 4.12Å; I345-L349 HydrophobicContact CG2-CD1 3.82Å; I345-L349 HydrophobicContact CG2-CG 4.29Å; I345-L349 WeakPolarHBondContact O-CB 3.47Å; I345-L349 WeakPolarHBondContact O-CG 3.49Å; I345-L349 PolarHBondContact O-N 2.67Å; A346-L349 PolarHBondContact O-N 3.14Å; E347-L349 VanDerWaalsContact C-N 3.33Å; E347-L349 PolarHBondContact O-N 3.36Å; L349-Q351 VanDerWaalsContact C-N 3.26Å; L349-Q351 PolarHBondContact O-N 2.98Å; L349-S353 WeakPolarHBondContact O-CA 3.25Å; L349-S353 WeakPolarHBondContact O-CB 3.35Å; L349-S353 PolarHBondContact O-N 3.42Å; L349-S353 PolarHBondContact O-OG 2.88Å; L349-I361 HydrophobicContact CD1-CG2 4.48Å; L349-A364 HydrophobicContact CD1-CB 3.91Å; L349-V365 HydrophobicContact CD1-CG2 3.99Å; L349-Y368 HydrophobicContact CD1-CD2 4.4Å; L349-Y368 HydrophobicContact CD1-CE2 4.42Å; L349-Y368 HydrophobicContact CD2-CE2 4.04Å
350	K	84.3	Confident	79.5	Confident	91 Å²	91	70.2 Å²	70.2	40%	0.396	37%	0.366	S	S	.	.	H	α-helix	trans	-70.4	-21.3	173.9	-71.7	174.6	-167.4	-161.5	0	113.1	A346 E347 E358 I361	A346-K350 VanDerWaalsContact O-CG 3.25Å; A346-K350 WeakPolarHBondContact O-CG 3.46Å; A346-K350 PolarHBondContact O-N 3.49Å; E347-K350 PolarHBondContact O-N 3.02Å; K350-E358 WeakPolarHBondContact CE-OE1 3.21Å; K350-E358 WeakPolarHBondContact CE-OE2 2.98Å; K350-E358 IonicContact NZ-OE1 2.74Å; K350-E358 PolarHBondContact NZ-OE1 3.26Å; K350-E358 IonicContact NZ-OE2 3.3Å; K350-E358 PolarHBondContact NZ-OE2 3.4Å; K350-I361 HydrophobicContact CD-CD1 4.3Å; K350-I361 HydrophobicContact CG-CD1 3.68Å
351	Q	80.9	Confident	79.2	Confident	154 Å²	154	69.5 Å²	69.5	72%	0.72	36%	0.364	S	S	*	.	H	α-helix	trans	-87.7	-42.4	174.8	-70.7	174.8	49.7	0	0	112.6	E347 S348 L349	E347-Q351 WeakPolarHBondContact O-CG 3.44Å; E347-Q351 PolarHBondContact O-N 2.94Å; S348-Q351 PolarHBondContact O-N 3.31Å; L349-Q351 VanDerWaalsContact C-N 3.26Å; L349-Q351 PolarHBondContact O-N 2.98Å
352	S	73.4	Confident	79	Confident	90 Å²	90	74.8 Å²	74.8	63%	0.629	39%	0.386	S	S	*	.	H	α-helix	trans	-76.9	-42.1	-179.5	64.7	0	0	0	0	112.6	S348	S348-S352 PolarHBondContact O-N 3.21Å; S348-S352 PolarHBondContact O-OG 2.89Å
353	S	62.5	Low	78.8	Confident	38 Å²	38	76 Å²	76	27%	0.266	40%	0.398	S	S	.	.	S	Bend	trans	-105.7	129.7	179	81.1	0	0	0	0	110.5	L349 V355	L349-S353 WeakPolarHBondContact O-CA 3.25Å; L349-S353 WeakPolarHBondContact O-CB 3.35Å; L349-S353 PolarHBondContact O-N 3.42Å; L349-S353 PolarHBondContact O-OG 2.88Å; S353-V355 PolarHBondContact O-N 3.46Å
354	K	57.7	Low	78.5	Confident	212 Å²	212	73.1 Å²	73.1	92%	0.922	39%	0.388	S	S	*	.			trans	-79	40.1	173.3	-64.1	-176.2	179.7	179.2	0	111.8
355	V	59.3	Low	78.4	Confident	61 Å²	61	73.1 Å²	73.1	37%	0.37	39%	0.387	S	S	.	.			trans	-96.2	117	-177.9	175.7	0	0	0	0	107.6	S353 D357	S353-V355 PolarHBondContact O-N 3.46Å; V355-D357 VanDerWaalsContact C-N 3.3Å; V355-D357 HydrophobicContact CG1-CB 3.72Å
356	T	63.4	Low	78.2	Confident	137 Å²	137	80.2 Å²	80.2	84%	0.84	42%	0.417	S	S	*	.			trans	-97.6	23.4	178.3	58.3	0	0	0	0	112.2
357	D	79.4	Confident	78	Confident	58 Å²	58	83.2 Å²	83.2	31%	0.31	43%	0.428	S	S	.	.			trans	-103.4	94	-174.3	-172.5	-40.8	0	0	0	108.4	V355 D359 K360 I361	V355-D357 VanDerWaalsContact C-N 3.3Å; V355-D357 HydrophobicContact CG1-CB 3.72Å; D357-D359 PolarHBondContact O-N 3.15Å; D357-D359 PolarHBondContact OD1-N 3.02Å; D357-K360 HydrophobicContact CB-CB 4.2Å; D357-K360 HydrophobicContact CB-CD 4.18Å; D357-K360 HydrophobicContact CB-CG 4.33Å; D357-K360 PolarHBondContact O-N 3.39Å; D357-K360 PolarHBondContact OD1-N 3.43Å; D357-K360 VanDerWaalsContact OD1-N 3.15Å; D357-K360 IonicContact OD1-NZ 2.61Å; D357-K360 IonicContact OD2-NZ 3.73Å; D357-K360 PolarHBondContact OD2-NZ 3.15Å; D357-I361 WeakPolarHBondContact O-CG1 3.38Å; D357-I361 PolarHBondContact O-N 3.44Å; D357-I361 VanDerWaalsContact O-N 3.1Å
358	E	78.1	Confident	77.7	Confident	93 Å²	93	79.6 Å²	79.6	44%	0.435	41%	0.411	S	S	.	.	H	α-helix	trans	-59	-31.7	-173.1	-67.1	-67.3	149.5	0	0	112.6	K350 I361 K362	K350-E358 WeakPolarHBondContact CE-OE1 3.21Å; K350-E358 WeakPolarHBondContact CE-OE2 2.98Å; K350-E358 IonicContact NZ-OE1 2.74Å; K350-E358 PolarHBondContact NZ-OE1 3.26Å; K350-E358 IonicContact NZ-OE2 3.3Å; K350-E358 PolarHBondContact NZ-OE2 3.4Å; E358-I361 PolarHBondContact O-N 2.91Å; E358-K362 VanDerWaalsContact O-CG 3.27Å; E358-K362 WeakPolarHBondContact O-CG 3.32Å; E358-K362 PolarHBondContact O-N 3.46Å
359	D	82.4	Confident	77.5	Confident	101 Å²	101	81.4 Å²	81.4	54%	0.54	42%	0.417	S	S	.	.	H	α-helix	trans	-77	-34.9	-178.6	-64.2	-37.1	0	0	0	112.2	D357 I361 K362 A363	D357-D359 PolarHBondContact O-N 3.15Å; D357-D359 PolarHBondContact OD1-N 3.02Å; D359-I361 VanDerWaalsContact C-N 3.28Å; D359-I361 PolarHBondContact O-N 3.35Å; D359-K362 PolarHBondContact O-N 3.07Å; D359-K362 WeakPolarHBondContact OD1-CD 3.34Å; D359-K362 WeakPolarHBondContact OD1-CE 3.3Å; D359-K362 IonicContact OD1-NZ 2.67Å; D359-K362 PolarHBondContact OD1-NZ 3.35Å; D359-A363 WeakPolarHBondContact O-CB 3.3Å; D359-A363 PolarHBondContact O-N 2.86Å
360	K	80.6	Confident	77.3	Confident	135 Å²	135	88.5 Å²	88.5	59%	0.587	45%	0.447	S	S	*	.	H	α-helix	trans	-63.1	-36.1	166.7	-72	-177.9	-178.4	62.7	0	112	D357 A364	D357-K360 HydrophobicContact CB-CB 4.2Å; D357-K360 HydrophobicContact CB-CD 4.18Å; D357-K360 HydrophobicContact CB-CG 4.33Å; D357-K360 PolarHBondContact O-N 3.39Å; D357-K360 PolarHBondContact OD1-N 3.43Å; D357-K360 VanDerWaalsContact OD1-N 3.15Å; D357-K360 IonicContact OD1-NZ 2.61Å; D357-K360 IonicContact OD2-NZ 3.73Å; D357-K360 PolarHBondContact OD2-NZ 3.15Å; K360-A364 WeakPolarHBondContact O-CB 3.33Å; K360-A364 PolarHBondContact O-N 3.35Å
361	I	81	Confident	76.6	Confident	8 Å²	8	87 Å²	87	4%	0.041	44%	0.444	C	S	.	.	H	α-helix	trans	-68.8	-46.7	176.5	-63.8	166.2	0	0	0	110.5	A346 L349 K350 D357 E358 D359 A363 A364 V365	A346-I361 HydrophobicContact CB-CG2 4.12Å; L349-I361 HydrophobicContact CD1-CG2 4.48Å; K350-I361 HydrophobicContact CD-CD1 4.3Å; K350-I361 HydrophobicContact CG-CD1 3.68Å; D357-I361 WeakPolarHBondContact O-CG1 3.38Å; D357-I361 PolarHBondContact O-N 3.44Å; D357-I361 VanDerWaalsContact O-N 3.1Å; E358-I361 PolarHBondContact O-N 2.91Å; D359-I361 VanDerWaalsContact C-N 3.28Å; D359-I361 PolarHBondContact O-N 3.35Å; I361-A363 VanDerWaalsContact C-N 3.3Å; I361-A363 PolarHBondContact O-N 3.48Å; I361-A364 PolarHBondContact O-N 3.04Å; I361-V365 HydrophobicContact CG2-CG2 4.15Å; I361-V365 WeakPolarHBondContact O-CB 3.48Å; I361-V365 WeakPolarHBondContact O-CG2 3.37Å; I361-V365 PolarHBondContact O-N 3.06Å
362	K	84.7	Confident	75.7	Confident	119 Å²	119	80.4 Å²	80.4	52%	0.517	42%	0.417	S	S	.	.	H	α-helix	trans	-55.9	-43.3	173.9	-69.3	167	-160	165.9	0	111.9	E358 D359 V365 K366	E358-K362 VanDerWaalsContact O-CG 3.27Å; E358-K362 WeakPolarHBondContact O-CG 3.32Å; E358-K362 PolarHBondContact O-N 3.46Å; D359-K362 PolarHBondContact O-N 3.07Å; D359-K362 WeakPolarHBondContact OD1-CD 3.34Å; D359-K362 WeakPolarHBondContact OD1-CE 3.3Å; D359-K362 IonicContact OD1-NZ 2.67Å; D359-K362 PolarHBondContact OD1-NZ 3.35Å; K362-V365 PolarHBondContact O-N 3.29Å; K362-K366 WeakPolarHBondContact O-CG 3.21Å; K362-K366 PolarHBondContact O-N 3.36Å
363	A	84.2	Confident	75.7	Confident	59 Å²	59	78.1 Å²	78.1	49%	0.488	40%	0.399	S	S	.	.	H	α-helix	trans	-63.5	-48.1	177.5	0	0	0	0	0	111.9	D359 I361 K366 E367	D359-A363 WeakPolarHBondContact O-CB 3.3Å; D359-A363 PolarHBondContact O-N 2.86Å; I361-A363 VanDerWaalsContact C-N 3.3Å; I361-A363 PolarHBondContact O-N 3.48Å; A363-K366 PolarHBondContact O-N 2.97Å; A363-E367 PolarHBondContact O-N 3.45Å; A363-E367 VanDerWaalsContact O-N 3.07Å
364	A	80.8	Confident	76.4	Confident	25 Å²	25	79.3 Å²	79.3	21%	0.207	41%	0.406	C	S	.	.	H	α-helix	trans	-62.5	-42.4	176.4	0	0	0	0	0	112.2	L349 K360 I361 K366 E367 Y368	L349-A364 HydrophobicContact CD1-CB 3.91Å; K360-A364 WeakPolarHBondContact O-CB 3.33Å; K360-A364 PolarHBondContact O-N 3.35Å; I361-A364 PolarHBondContact O-N 3.04Å; A364-K366 PolarHBondContact O-N 3.5Å; A364-E367 WeakPolarHBondContact O-CB 3.4Å; A364-E367 PolarHBondContact O-N 3.27Å; A364-Y368 WeakPolarHBondContact O-CD2 3.28Å; A364-Y368 PolarHBondContact O-N 3.35Å
365	V	83.6	Confident	77.5	Confident	8 Å²	8	73.5 Å²	73.5	5%	0.048	38%	0.381	C	S	.	.	H	α-helix	trans	-56.8	-49.9	175.3	169.2	0	0	0	0	110.7	S342 I345 A346 L349 I361 K362 E367 Y368 E369	S342-V365 WeakPolarHBondContact OG-CG1 3.46Å; I345-V365 HydrophobicContact CB-CG2 4.3Å; I345-V365 HydrophobicContact CG2-CB 4.44Å; I345-V365 HydrophobicContact CG2-CG2 3.86Å; A346-V365 HydrophobicContact CB-CG2 3.95Å; L349-V365 HydrophobicContact CD1-CG2 3.99Å; I361-V365 HydrophobicContact CG2-CG2 4.15Å; I361-V365 WeakPolarHBondContact O-CB 3.48Å; I361-V365 WeakPolarHBondContact O-CG2 3.37Å; I361-V365 PolarHBondContact O-N 3.06Å; K362-V365 PolarHBondContact O-N 3.29Å; V365-E367 PolarHBondContact O-N 3.07Å; V365-Y368 PolarHBondContact O-N 3.04Å; V365-E369 HydrophobicContact CG1-CG 4.29Å; V365-E369 VanDerWaalsContact CG1-OE1 3.29Å; V365-E369 WeakPolarHBondContact CG1-OE1 3.41Å; V365-E369 WeakPolarHBondContact O-CB 3.39Å; V365-E369 VanDerWaalsContact O-CG 3.28Å; V365-E369 WeakPolarHBondContact O-CG 3.37Å; V365-E369 PolarHBondContact O-N 3.41Å
366	K	84.1	Confident	78.9	Confident	149 Å²	149	71.8 Å²	71.8	65%	0.648	37%	0.369	S	S	*	.	H	α-helix	trans	-57.7	-34.8	174.4	-75.4	-176.4	175.5	-173.6	0	112.7	K362 A363 A364 K370	K362-K366 WeakPolarHBondContact O-CG 3.21Å; K362-K366 PolarHBondContact O-N 3.36Å; A363-K366 PolarHBondContact O-N 2.97Å; A364-K366 PolarHBondContact O-N 3.5Å; K366-K370 WeakPolarHBondContact O-CB 3.38Å; K366-K370 PolarHBondContact O-N 3.23Å
367	E	81.7	Confident	80.2	Confident	84 Å²	84	65.5 Å²	65.5	39%	0.393	33%	0.33	S	S	.	.	H	α-helix	trans	-73.4	-39.5	178.8	-156.8	-179.9	168.6	0	0	112.7	L266 A363 A364 V365 N371	L266-E367 HydrophobicContact CD1-CG 4.07Å; A363-E367 PolarHBondContact O-N 3.45Å; A363-E367 VanDerWaalsContact O-N 3.07Å; A364-E367 WeakPolarHBondContact O-CB 3.4Å; A364-E367 PolarHBondContact O-N 3.27Å; V365-E367 PolarHBondContact O-N 3.07Å; E367-N371 WeakPolarHBondContact CG-ND2 3.39Å; E367-N371 WeakPolarHBondContact O-CB 3.46Å; E367-N371 PolarHBondContact O-N 3.46Å; E367-N371 VanDerWaalsContact O-N 3.1Å; E367-N371 PolarHBondContact O-ND2 2.99Å
368	Y	80	Confident	80.9	Confident	15 Å²	15	62.8 Å²	62.8	6%	0.059	32%	0.316	C	S	.	.	H	α-helix	trans	-67.4	-40.9	170.9	-77.1	-74.9	0	0	0	111.9	I258 P260 L266 E267 I269 I345 L349 A364 V365 K370 N371 G372 V373	I258-Y368 HydrophobicContact CG2-CD1 3.9Å; P260-Y368 HydrophobicContact CG-CE1 4.12Å; L266-Y368 HydrophobicContact CB-CE1 3.91Å; L266-Y368 HydrophobicContact CD1-CD1 4.4Å; L266-Y368 HydrophobicContact CD1-CE1 4.26Å; L266-Y368 HydrophobicContact CD2-CE2 4.16Å; L266-Y368 HydrophobicContact CG-CE1 4.46Å; E267-Y368 PolarHBondContact O-OH 3.01Å; I269-Y368 HydrophobicContact CD1-CD2 4.38Å; I269-Y368 HydrophobicContact CD1-CE1 3.91Å; I269-Y368 HydrophobicContact CD1-CE2 3.77Å; I269-Y368 HydrophobicContact CG1-CE1 4.17Å; I345-Y368 HydrophobicContact CG2-CD2 4.21Å; I345-Y368 HydrophobicContact CG2-CG 4.42Å; L349-Y368 HydrophobicContact CD1-CD2 4.4Å; L349-Y368 HydrophobicContact CD1-CE2 4.42Å; L349-Y368 HydrophobicContact CD2-CE2 4.04Å; A364-Y368 WeakPolarHBondContact O-CD2 3.28Å; A364-Y368 PolarHBondContact O-N 3.35Å; V365-Y368 PolarHBondContact O-N 3.04Å; Y368-K370 VanDerWaalsContact C-N 3.34Å; Y368-K370 PolarHBondContact O-N 3.4Å; Y368-N371 PolarHBondContact O-N 2.7Å; Y368-G372 PolarHBondContact O-N 2.83Å; Y368-V373 PolarHBondContact O-N 3.25Å
369	E	81.7	Confident	81.6	Confident	56 Å²	56	59.6 Å²	59.6	26%	0.262	30%	0.302	S	S	.	.	H	α-helix	trans	-58.9	-42.8	174.7	-76.1	171.5	176.2	0	0	112	S342 I345 V365	S342-E369 WeakPolarHBondContact CB-OE1 3.43Å; S342-E369 PolarHBondContact OG-OE1 2.88Å; I345-E369 HydrophobicContact CD1-CG 4.26Å; V365-E369 HydrophobicContact CG1-CG 4.29Å; V365-E369 VanDerWaalsContact CG1-OE1 3.29Å; V365-E369 WeakPolarHBondContact CG1-OE1 3.41Å; V365-E369 WeakPolarHBondContact O-CB 3.39Å; V365-E369 VanDerWaalsContact O-CG 3.28Å; V365-E369 WeakPolarHBondContact O-CG 3.37Å; V365-E369 PolarHBondContact O-N 3.41Å
370	K	78.8	Confident	82	Confident	165 Å²	165	58.9 Å²	58.9	72%	0.717	30%	0.295	S	S	*	.	H	α-helix	trans	-72.6	-34.8	179.1	-171.2	173.8	-180	175.3	0	113.3	K366 Y368	K366-K370 WeakPolarHBondContact O-CB 3.38Å; K366-K370 PolarHBondContact O-N 3.23Å; Y368-K370 VanDerWaalsContact C-N 3.34Å; Y368-K370 PolarHBondContact O-N 3.4Å
371	N	70.8	Confident	82.7	Confident	61 Å²	61	52.5 Å²	52.5	33%	0.326	27%	0.267	S	S	.	.	H	α-helix	trans	-124.3	-2.8	-162.1	-54.6	-54.9	0	0	0	116.8	L264 E367 Y368	L264-N371 HydrophobicContact CD1-CB 3.36Å; E367-N371 WeakPolarHBondContact CG-ND2 3.39Å; E367-N371 WeakPolarHBondContact O-CB 3.46Å; E367-N371 PolarHBondContact O-N 3.46Å; E367-N371 VanDerWaalsContact O-N 3.1Å; E367-N371 PolarHBondContact O-ND2 2.99Å; Y368-N371 PolarHBondContact O-N 2.7Å
372	G	62.4	Low	83.4	Confident	15 Å²	15	52.1 Å²	52.1	16%	0.155	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-147.2	-15.7	-176.6	0	0	0	0	0	116.6	Y368	Y368-G372 PolarHBondContact O-N 2.83Å
373	V	73.7	Confident	83.9	Confident	42 Å²	42	46.6 Å²	46.6	26%	0.255	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-72.7	125.8	177.1	168.6	0	0	0	0	110.5	I258 V341 I345 Y368	I258-V373 HydrophobicContact CD1-CG2 4.04Å; V341-V373 HydrophobicContact CG1-CG1 4.04Å; V341-V373 HydrophobicContact CG1-CG2 3.91Å; I345-V373 HydrophobicContact CD1-CG2 3.71Å; Y368-V373 PolarHBondContact O-N 3.25Å
374	P	76.5	Confident	84.3	Confident	62 Å²	62	43.8 Å²	43.8	40%	0.403	22%	0.22	S	C	.	.	P	Polyproline II helix	trans	-66.7	151.5	174	28.9	-35.1	0	0	0	110.9	L256 N376	L256-P374 HydrophobicContact CD1-CG 3.79Å; L256-P374 HydrophobicContact CD2-CG 4.43Å; L256-P374 HydrophobicContact CG-CG 4.33Å; P374-N376 PolarHBondContact O-N 3.29Å
375	K	81.5	Confident	85	Confident	90 Å²	90	43.6 Å²	43.6	39%	0.391	21%	0.214	S	C	.	.	P	Polyproline II helix	trans	-48.6	134.1	-178.2	-69.6	-164	175.6	-165.2	0	111.6	D379 Q380 E385	K375-D379 HydrophobicContact CB-CB 4.28Å; K375-Q380 HydrophobicContact CB-CG 4.21Å; K375-Q380 WeakPolarHBondContact O-CG 3.28Å; K375-Q380 PolarHBondContact O-NE2 2.94Å; K375-E385 IonicContact NZ-OE1 2.66Å; K375-E385 PolarHBondContact NZ-OE1 2.99Å
376	N	88.5	Confident	85.5	Confident	25 Å²	25	43.6 Å²	43.6	13%	0.134	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-50.6	148.3	175.6	-172.9	-59	0	0	0	111.1	R334 P374 V378 D379 Q380	R334-N376 PolarHBondContact O-ND2 3.1Å; P374-N376 PolarHBondContact O-N 3.29Å; N376-V378 PolarHBondContact O-N 3.47Å; N376-V378 VanDerWaalsContact O-N 3.15Å; N376-V378 PolarHBondContact OD1-N 3.47Å; N376-D379 HydrophobicContact CB-CB 4.32Å; N376-D379 WeakPolarHBondContact CB-OD2 3.37Å; N376-D379 CarbonylContact O-C 3.51Å; N376-D379 WeakPolarHBondContact O-CA 3.37Å; N376-D379 WeakPolarHBondContact O-CB 3.49Å; N376-D379 PolarHBondContact O-N 3.49Å; N376-Q380 PolarHBondContact O-N 3.01Å
377	F	90.1	Very high	86	Confident	6 Å²	6	37.2 Å²	37.2	3%	0.026	19%	0.188	C	C	.	.	H	α-helix	trans	-58	-32.5	-179.3	68.5	-104.2	0	0	0	113.1	I245 L246 V249 T280 M333 E337 D379 Q380 V381	I245-F377 HydrophobicContact CG2-CB 3.51Å; I245-F377 HydrophobicContact CG2-CG 4.43Å; L246-F377 HydrophobicContact CD2-CD2 4.3Å; L246-F377 HydrophobicContact CD2-CE2 3.72Å; L246-F377 HydrophobicContact CD2-CZ 3.97Å; V249-F377 HydrophobicContact CG1-CD1 4.25Å; V249-F377 HydrophobicContact CG1-CE1 4.16Å; V249-F377 HydrophobicContact CG2-CD1 4.11Å; T280-F377 HydrophobicContact CG2-CE1 4.15Å; T280-F377 HydrophobicContact CG2-CZ 3.67Å; M333-F377 HydrophobicContact CB-CE2 4.29Å; M333-F377 HydrophobicContact CB-CZ 4.05Å; E337-F377 HydrophobicContact CB-CD1 4.17Å; E337-F377 HydrophobicContact CB-CE1 3.7Å; E337-F377 HydrophobicContact CG-CD1 3.7Å; E337-F377 HydrophobicContact CG-CE1 3.71Å; E337-F377 WeakPolarHBondContact OE2-CE1 3.39Å; F377-D379 VanDerWaalsContact C-N 3.29Å; F377-D379 PolarHBondContact O-N 2.94Å; F377-Q380 PolarHBondContact O-N 3.25Å; F377-V381 WeakPolarHBondContact O-CG2 3.29Å; F377-V381 PolarHBondContact O-N 3.47Å
378	V	93.4	Very high	86.5	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.006	17%	0.172	C	C	.	.	H	α-helix	trans	-63	-39.4	174.3	179.9	0	0	0	0	110.6	L330 M333 R334 N376 V381 F382 L406	L330-V378 HydrophobicContact CB-CG1 4Å; L330-V378 HydrophobicContact CD2-CG1 4.32Å; M333-V378 HydrophobicContact CB-CG2 4.12Å; R334-V378 HydrophobicContact CB-CB 4.18Å; R334-V378 HydrophobicContact CB-CG1 4.38Å; R334-V378 HydrophobicContact CB-CG2 4.07Å; N376-V378 PolarHBondContact O-N 3.47Å; N376-V378 VanDerWaalsContact O-N 3.15Å; N376-V378 PolarHBondContact OD1-N 3.47Å; V378-V381 PolarHBondContact O-N 2.61Å; V378-F382 PolarHBondContact O-N 2.92Å; V378-L406 HydrophobicContact CG1-CD1 4.23Å; V378-L406 HydrophobicContact CG1-CD2 3.88Å
379	D	92.4	Very high	87.2	Confident	26 Å²	26	33.7 Å²	33.7	14%	0.139	17%	0.173	C	C	.	.	H	α-helix	trans	-78.4	-27	179.7	-64.7	-47.9	0	0	0	113.3	R334 K375 N376 F377 V381 G383 M404	R334-D379 IonicContact CZ-OD1 2.75Å; R334-D379 IonicContact NE-OD1 3.96Å; R334-D379 PolarHBondContact NE-OD1 3.28Å; R334-D379 IonicContact NE-OD2 3.15Å; R334-D379 PolarHBondContact NE-OD2 3.26Å; R334-D379 IonicContact NH2-OD1 3.74Å; R334-D379 PolarHBondContact NH2-OD1 2.72Å; R334-D379 IonicContact NH2-OD2 3.18Å; K375-D379 HydrophobicContact CB-CB 4.28Å; N376-D379 HydrophobicContact CB-CB 4.32Å; N376-D379 WeakPolarHBondContact CB-OD2 3.37Å; N376-D379 CarbonylContact O-C 3.51Å; N376-D379 WeakPolarHBondContact O-CA 3.37Å; N376-D379 WeakPolarHBondContact O-CB 3.49Å; N376-D379 PolarHBondContact O-N 3.49Å; F377-D379 VanDerWaalsContact C-N 3.29Å; F377-D379 PolarHBondContact O-N 2.94Å; D379-V381 VanDerWaalsContact C-N 3.33Å; D379-G383 WeakPolarHBondContact O-CA 3.4Å; D379-G383 PolarHBondContact O-N 3.45Å; D379-M404 HydrophobicContact CB-CE 4.46Å
380	Q	91.8	Very high	87.7	Confident	86 Å²	86	32.5 Å²	32.5	40%	0.402	17%	0.169	S	C	.	.	H	α-helix	trans	-67.4	-34.4	170.3	-66.2	177.9	29.3	0	0	112.2	I245 K375 N376 F377 S708	I245-Q380 HydrophobicContact CD1-CB 4.27Å; K375-Q380 HydrophobicContact CB-CG 4.21Å; K375-Q380 WeakPolarHBondContact O-CG 3.28Å; K375-Q380 PolarHBondContact O-NE2 2.94Å; N376-Q380 PolarHBondContact O-N 3.01Å; F377-Q380 PolarHBondContact O-N 3.25Å; Q380-S708 WeakPolarHBondContact O-CB 3.48Å; Q380-S708 PolarHBondContact O-OG 2.89Å
381	V	94.3	Very high	88.3	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-84.8	-60.1	179.4	-177.7	0	0	0	0	111.1	T239 L241 L242 I245 F377 V378 D379 S708 V709	T239-V381 HydrophobicContact CG2-CG1 4.02Å; L241-V381 HydrophobicContact CD2-CG2 4.25Å; L241-V381 HydrophobicContact CG-CG2 4.13Å; L242-V381 HydrophobicContact CB-CG1 4.25Å; L242-V381 HydrophobicContact CB-CG2 4.36Å; L242-V381 HydrophobicContact CD1-CG2 4.34Å; I245-V381 HydrophobicContact CD1-CG2 3.83Å; F377-V381 WeakPolarHBondContact O-CG2 3.29Å; F377-V381 PolarHBondContact O-N 3.47Å; V378-V381 PolarHBondContact O-N 2.61Å; D379-V381 VanDerWaalsContact C-N 3.33Å; V381-S708 WeakPolarHBondContact O-CB 3.34Å; V381-S708 PolarHBondContact O-N 3.1Å; V381-V709 HydrophobicContact CG1-CB 4Å; V381-V709 HydrophobicContact CG1-CG2 3.63Å; V381-V709 WeakPolarHBondContact O-CB 3.46Å; V381-V709 PolarHBondContact O-N 2.76Å
382	F	96.2	Very high	89.3	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109	-9.7	-168.1	-58	-78	0	0	0	113.9	L236 T239 L242 L330 V378 G384 L406 P707 V709	L236-F382 HydrophobicContact CD2-CE1 4.23Å; L236-F382 HydrophobicContact CD2-CE2 4.38Å; L236-F382 HydrophobicContact CD2-CZ 3.58Å; T239-F382 HydrophobicContact CG2-CZ 4.2Å; L242-F382 HydrophobicContact CD1-CE2 4.27Å; L242-F382 HydrophobicContact CD2-CE2 4.15Å; L242-F382 HydrophobicContact CD2-CZ 4.19Å; L330-F382 HydrophobicContact CD1-CB 4.48Å; L330-F382 HydrophobicContact CD1-CD2 3.98Å; L330-F382 HydrophobicContact CD1-CE2 4.37Å; L330-F382 HydrophobicContact CD1-CG 4.14Å; L330-F382 HydrophobicContact CD2-CD2 3.79Å; L330-F382 HydrophobicContact CD2-CE2 3.63Å; L330-F382 HydrophobicContact CD2-CZ 4.43Å; V378-F382 PolarHBondContact O-N 2.92Å; F382-G384 PolarHBondContact O-N 2.75Å; F382-L406 HydrophobicContact CB-CD2 3.89Å; F382-P707 WeakPolarHBondContact O-CB 3.49Å; F382-V709 HydrophobicContact CD1-CB 3.86Å; F382-V709 HydrophobicContact CD1-CG1 3.76Å; F382-V709 HydrophobicContact CE1-CB 3.96Å; F382-V709 HydrophobicContact CE1-CG1 3.51Å
383	G	94.9	Very high	90.7	Very high	4 Å²	4	25 Å²	25	4%	0.041	13%	0.131	C	C	.	.			trans	-75.2	110.4	-172.8	0	0	0	0	0	113.4	D379 F405	D379-G383 WeakPolarHBondContact O-CA 3.4Å; D379-G383 PolarHBondContact O-N 3.45Å; G383-F405 WeakPolarHBondContact CA-O 3.42Å
384	G	94.4	Very high	91.5	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	158.8	168.6	0	0	0	0	0	112.2	F382 M404 F405 S705	F382-G384 PolarHBondContact O-N 2.75Å; G384-M404 CarbonylContact O-C 3.59Å; G384-M404 WeakPolarHBondContact O-CA 3.33Å; G384-M404 WeakPolarHBondContact O-CE 3.41Å; G384-F405 VanDerWaalsContact C-CD1 3.5Å; G384-F405 VanDerWaalsContact C-CE1 3.43Å; G384-F405 PolarHBondContact N-O 3.16Å; G384-F405 WeakPolarHBondContact O-CD1 3.2Å; G384-F405 PolarHBondContact O-N 3.46Å; G384-S705 CarbonylContact C-O 3.48Å; G384-S705 WeakPolarHBondContact CA-O 3.35Å
385	E	94.8	Very high	92.1	Very high	20 Å²	20	26.8 Å²	26.8	9%	0.093	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	130.6	171.9	-65.1	167	-139.3	0	0	109.5	K375 M404 S704 S705 K748	K375-E385 IonicContact NZ-OE1 2.66Å; K375-E385 PolarHBondContact NZ-OE1 2.99Å; E385-M404 HydrophobicContact CG-SD 3.48Å; E385-M404 WeakPolarHBondContact CG-SD 3.42Å; E385-S704 PolarHBondContact O-N 2.76Å; E385-S704 PolarHBondContact O-OG 3.32Å; E385-S705 PolarHBondContact N-O 2.77Å; E385-S705 PolarHBondContact O-N 2.74Å; E385-K748 IonicContact OE1-NZ 2.68Å; E385-K748 WeakPolarHBondContact OE2-CE 3.29Å; E385-K748 IonicContact OE2-NZ 3.16Å; E385-K748 PolarHBondContact OE2-NZ 3.31Å
386	M	94	Very high	92.5	Very high	9 Å²	9	27.6 Å²	27.6	4%	0.044	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	138.6	174.5	-171	67	59.5	0	0	109.1	T402 E403 F405 L408 F659 M701 I703	M386-T402 CarbonylContact O-C 3.33Å; M386-T402 WeakPolarHBondContact O-CA 3.48Å; M386-E403 PolarHBondContact N-O 3.22Å; M386-E403 PolarHBondContact O-N 3.19Å; M386-F405 HydrophobicContact CB-CD1 3.97Å; M386-F405 HydrophobicContact CB-CE1 4.22Å; M386-F405 HydrophobicContact CE-CD1 4.21Å; M386-F405 HydrophobicContact CE-CE1 3.88Å; M386-F405 HydrophobicContact CE-CZ 4.45Å; M386-L408 HydrophobicContact CE-CD1 4.21Å; M386-L408 HydrophobicContact CE-CD2 3.5Å; M386-L408 VanDerWaalsContact CE-CD2 3.5Å; M386-F659 HydrophobicContact CE-CE1 3.82Å; M386-F659 HydrophobicContact SD-CE1 4.45Å; M386-M701 HydrophobicContact CG-CB 4.21Å; M386-M701 HydrophobicContact CG-CE 3.74Å; M386-M701 HydrophobicContact SD-CB 3.95Å; M386-I703 HydrophobicContact CE-CD1 4.48Å; M386-I703 HydrophobicContact CE-CG1 3.55Å; M386-I703 HydrophobicContact SD-CG1 4.08Å
387	T	93.9	Very high	92.6	Very high	15 Å²	15	28 Å²	28	9%	0.092	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	119.9	178.7	-72.2	0	0	0	0	110.3	V400 M701 L702 S704	T387-V400 HydrophobicContact CG2-CG1 3.5Å; T387-M701 WeakPolarHBondContact O-CA 3.25Å; T387-L702 PolarHBondContact N-O 2.91Å; T387-L702 PolarHBondContact O-N 2.93Å; T387-S704 WeakPolarHBondContact OG1-CB 3.3Å; T387-S704 PolarHBondContact OG1-OG 3.18Å
388	S	93.5	Very high	92.6	Very high	11 Å²	11	27.9 Å²	27.9	8%	0.077	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	102.4	169.8	-173.3	0	0	0	0	108.6	V400 V401	S388-V400 WeakPolarHBondContact O-CA 3.4Å; S388-V401 PolarHBondContact N-O 3.06Å; S388-V401 PolarHBondContact O-N 3.26Å; S388-V401 VanDerWaalsContact O-N 3.08Å
389	T	92.8	Very high	92.4	Very high	13 Å²	13	29 Å²	29	8%	0.08	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	126	172.4	-60.3	0	0	0	0	109.3	V398 V400 A635 F636 K699 Q700	T389-V398 HydrophobicContact CG2-CG1 3.7Å; T389-V400 HydrophobicContact CG2-CG2 4.27Å; T389-A635 HydrophobicContact CG2-CB 4.21Å; T389-A635 WeakPolarHBondContact CG2-O 3.37Å; T389-F636 HydrophobicContact CG2-CD1 4.37Å; T389-F636 HydrophobicContact CG2-CE1 3.89Å; T389-F636 HydrophobicContact CG2-CZ 4.28Å; T389-K699 CarbonylContact O-C 3.53Å; T389-K699 VanDerWaalsContact O-CA 3.31Å; T389-K699 WeakPolarHBondContact O-CA 3.48Å; T389-Q700 PolarHBondContact N-O 2.95Å; T389-Q700 PolarHBondContact O-N 3.26Å
390	I	92.8	Very high	92.3	Very high	31 Å²	31	28.5 Å²	28.5	16%	0.159	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	131.3	174.3	-57.4	177.8	0	0	0	109.6	V398 S399 L665 L671 A697 L698 K699	I390-V398 CarbonylContact O-C 3.55Å; I390-V398 WeakPolarHBondContact O-CA 3.31Å; I390-S399 PolarHBondContact N-O 3.17Å; I390-S399 PolarHBondContact O-N 3.3Å; I390-S399 PolarHBondContact O-OG 2.94Å; I390-L665 HydrophobicContact CG2-CD1 4.44Å; I390-L671 HydrophobicContact CG2-CD1 4.17Å; I390-L671 HydrophobicContact CG2-CD2 3.76Å; I390-L671 HydrophobicContact CG2-CG 4.49Å; I390-A697 HydrophobicContact CG2-CB 4.12Å; I390-L698 CarbonylContact C-O 3.54Å; I390-L698 WeakPolarHBondContact CA-O 3.29Å; I390-K699 HydrophobicContact CD1-CD 4.26Å; I390-K699 HydrophobicContact CG1-CB 4.15Å; I390-K699 HydrophobicContact CG1-CD 4.25Å; I390-K699 HydrophobicContact CG1-CG 3.97Å
391	M	92.5	Very high	92.3	Very high	14 Å²	14	26.5 Å²	26.5	7%	0.069	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	122.1	175.1	-178.1	-173.3	66.2	0	0	111.1	Q393 K396 V398 P632 F636 A697 L698	M391-Q393 PolarHBondContact O-N 3.29Å; M391-K396 HydrophobicContact SD-CD 4.25Å; M391-V398 HydrophobicContact CB-CG2 4.25Å; M391-V398 HydrophobicContact CG-CG2 4.05Å; M391-P632 HydrophobicContact SD-CB 3.83Å; M391-F636 HydrophobicContact CB-CE2 3.92Å; M391-F636 HydrophobicContact CB-CZ 3.74Å; M391-F636 HydrophobicContact CE-CE2 3.93Å; M391-F636 HydrophobicContact SD-CE2 4.23Å; M391-A697 CarbonylContact O-C 3.4Å; M391-A697 VanDerWaalsContact O-CA 3.22Å; M391-A697 WeakPolarHBondContact O-CA 3.47Å; M391-A697 WeakPolarHBondContact O-CB 3.32Å; M391-L698 HydrophobicContact CE-CD1 3.9Å; M391-L698 HydrophobicContact CE-CG 4.37Å; M391-L698 PolarHBondContact N-O 3.32Å; M391-L698 PolarHBondContact O-N 2.84Å
392	C	92	Very high	92.2	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.007	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	123.3	171.1	171.7	0	0	0	0	110.9	Q394 C395 K396 T397 L671 C673 T695	C392-Q394 VanDerWaalsContact C-N 3.29Å; C392-Q394 PolarHBondContact O-N 2.91Å; C392-C395 PolarHBondContact SG-N 3.21Å; C392-C395 PolarHBondContact SG-SG 3.07Å; C392-K396 VanDerWaalsContact O-CA 3.27Å; C392-K396 WeakPolarHBondContact O-CA 3.35Å; C392-K396 PolarHBondContact O-N 3.43Å; C392-T397 PolarHBondContact N-O 3.07Å; C392-T397 VanDerWaalsContact N-O 3.07Å; C392-L671 HydrophobicContact CB-CD2 4.07Å; C392-C673 HydrophobicContact CB-CB 4.44Å; C392-C673 VanDerWaalsContact SG-SG 3.64Å; C392-T695 PolarHBondContact SG-OG1 2.97Å
393	Q	91.2	Very high	92	Very high	70 Å²	70	35.9 Å²	35.9	33%	0.327	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-28.7	-177.7	-68.2	-171.7	2.8	0	0	113.1	M391 K396 D696 L698	M391-Q393 PolarHBondContact O-N 3.29Å; Q393-K396 WeakPolarHBondContact O-CE 3.45Å; Q393-K396 PolarHBondContact O-NZ 2.82Å; Q393-D696 VanDerWaalsContact CB-O 3.32Å; Q393-D696 WeakPolarHBondContact CB-O 3.42Å; Q393-D696 PolarHBondContact N-O 2.88Å; Q393-L698 HydrophobicContact CG-CG 4.38Å
394	Q	89.9	Confident	91.9	Very high	125 Å²	125	39.9 Å²	39.9	58%	0.584	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-49.5	-178.8	-64.4	-178.4	4.4	0	0	113.1	C392 T695	C392-Q394 VanDerWaalsContact C-N 3.29Å; C392-Q394 PolarHBondContact O-N 2.91Å; Q394-T695 VanDerWaalsContact CD-CG2 3.45Å; Q394-T695 HydrophobicContact CG-CG2 4.21Å; Q394-T695 VanDerWaalsContact OE1-CG2 3.24Å
395	C	89.4	Confident	91.9	Very high	15 Å²	15	40.9 Å²	40.9	10%	0.101	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-4.2	-172	74.7	0	0	0	0	114.9	C392 T397 C673	C392-C395 PolarHBondContact SG-N 3.21Å; C392-C395 PolarHBondContact SG-SG 3.07Å; C395-T397 PolarHBondContact O-N 3.47Å; C395-T397 VanDerWaalsContact O-N 3.1Å; C395-T397 VanDerWaalsContact SG-CB 3.57Å; C395-T397 PolarHBondContact SG-OG1 3.19Å; C395-C673 PolarHBondContact SG-SG 3.46Å
396	K	90.6	Very high	92	Very high	108 Å²	108	40.4 Å²	40.4	47%	0.47	21%	0.209	S	C	.	.			trans	55.3	16.9	-176.1	-51.2	-53.6	-170.8	-164.3	0	115.3	M391 C392 Q393 V398 P632	M391-K396 HydrophobicContact SD-CD 4.25Å; C392-K396 VanDerWaalsContact O-CA 3.27Å; C392-K396 WeakPolarHBondContact O-CA 3.35Å; C392-K396 PolarHBondContact O-N 3.43Å; Q393-K396 WeakPolarHBondContact O-CE 3.45Å; Q393-K396 PolarHBondContact O-NZ 2.82Å; K396-V398 PolarHBondContact O-N 2.97Å; K396-P632 HydrophobicContact CB-CB 4.38Å; K396-P632 HydrophobicContact CB-CG 3.85Å
397	T	89.6	Confident	92.1	Very high	33 Å²	33	40.4 Å²	40.4	20%	0.202	21%	0.209	C	C	.	.			trans	-68.9	127	170.4	-59.4	0	0	0	0	109.1	C392 C395 I627 A675	C392-T397 PolarHBondContact N-O 3.07Å; C392-T397 VanDerWaalsContact N-O 3.07Å; C395-T397 PolarHBondContact O-N 3.47Å; C395-T397 VanDerWaalsContact O-N 3.1Å; C395-T397 VanDerWaalsContact SG-CB 3.57Å; C395-T397 PolarHBondContact SG-OG1 3.19Å; T397-I627 HydrophobicContact CG2-CG2 3.75Å; T397-A675 HydrophobicContact CG2-CB 4.18Å; T397-A675 WeakPolarHBondContact OG1-CB 3.31Å
398	V	89.8	Confident	92.3	Very high	4 Å²	4	40 Å²	40	2%	0.024	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	136.4	173.6	-174.5	0	0	0	0	108.7	T389 I390 M391 K396 V400 I628 A635	T389-V398 HydrophobicContact CG2-CG1 3.7Å; I390-V398 CarbonylContact O-C 3.55Å; I390-V398 WeakPolarHBondContact O-CA 3.31Å; M391-V398 HydrophobicContact CB-CG2 4.25Å; M391-V398 HydrophobicContact CG-CG2 4.05Å; K396-V398 PolarHBondContact O-N 2.97Å; V398-V400 HydrophobicContact CG1-CG2 4.16Å; V398-I628 PolarHBondContact O-N 3.42Å; V398-A635 HydrophobicContact CG1-CB 4.12Å; V398-A635 HydrophobicContact CG2-CB 3.97Å
399	S	89.6	Confident	92.4	Very high	24 Å²	24	40.2 Å²	40.2	17%	0.168	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	136.6	174	52	0	0	0	0	109.1	I390 T626	I390-S399 PolarHBondContact N-O 3.17Å; I390-S399 PolarHBondContact O-N 3.3Å; I390-S399 PolarHBondContact O-OG 2.94Å; S399-T626 WeakPolarHBondContact CA-O 3.2Å
400	V	90.2	Very high	92.5	Very high	16 Å²	16	39.6 Å²	39.6	10%	0.097	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	134.4	-173.6	178.5	0	0	0	0	111.1	T387 S388 T389 V398 T626 I628	T387-V400 HydrophobicContact CG2-CG1 3.5Å; S388-V400 WeakPolarHBondContact O-CA 3.4Å; T389-V400 HydrophobicContact CG2-CG2 4.27Å; V398-V400 HydrophobicContact CG1-CG2 4.16Å; V400-T626 PolarHBondContact N-O 2.83Å; V400-T626 PolarHBondContact O-N 3.04Å; V400-T626 VanDerWaalsContact O-N 3.15Å; V400-T626 PolarHBondContact O-OG1 3.15Å; V400-I628 HydrophobicContact CB-CD1 3.78Å; V400-I628 HydrophobicContact CB-CG1 4.2Å; V400-I628 HydrophobicContact CG1-CD1 4.32Å; V400-I628 HydrophobicContact CG2-CD1 3.66Å; V400-I628 HydrophobicContact CG2-CG1 4.08Å
401	V	92.1	Very high	92.4	Very high	44 Å²	44	40 Å²	40	27%	0.267	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	144.4	174.2	-179.9	0	0	0	0	108.8	S388	S388-V401 PolarHBondContact N-O 3.06Å; S388-V401 PolarHBondContact O-N 3.26Å; S388-V401 VanDerWaalsContact O-N 3.08Å
402	T	91.5	Very high	92.2	Very high	90 Å²	90	39.5 Å²	39.5	55%	0.552	21%	0.207	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-122.4	130.8	-179.4	49.9	0	0	0	0	111.5	M386	M386-T402 CarbonylContact O-C 3.33Å; M386-T402 WeakPolarHBondContact O-CA 3.48Å
403	E	92.9	Very high	91.2	Very high	106 Å²	106	41.1 Å²	41.1	50%	0.495	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	140.3	-175.2	-67.9	166.1	-157.2	0	0	110.4	M386	M386-E403 PolarHBondContact N-O 3.22Å; M386-E403 PolarHBondContact O-N 3.19Å
404	M	93.1	Very high	90	Very high	88 Å²	88	39.9 Å²	39.9	43%	0.433	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	143.7	174	-78	-64.2	-52.3	0	0	111.5	D379 G384 E385	D379-M404 HydrophobicContact CB-CE 4.46Å; G384-M404 CarbonylContact O-C 3.59Å; G384-M404 WeakPolarHBondContact O-CA 3.33Å; G384-M404 WeakPolarHBondContact O-CE 3.41Å; E385-M404 HydrophobicContact CG-SD 3.48Å; E385-M404 WeakPolarHBondContact CG-SD 3.42Å
405	F	95.1	Very high	88.4	Confident	21 Å²	21	35.7 Å²	35.7	9%	0.092	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	154	171.5	69.5	-93.1	0	0	0	112.6	G383 G384 M386 L408 I703 P707 L710	G383-F405 WeakPolarHBondContact CA-O 3.42Å; G384-F405 VanDerWaalsContact C-CD1 3.5Å; G384-F405 VanDerWaalsContact C-CE1 3.43Å; G384-F405 PolarHBondContact N-O 3.16Å; G384-F405 WeakPolarHBondContact O-CD1 3.2Å; G384-F405 PolarHBondContact O-N 3.46Å; M386-F405 HydrophobicContact CB-CD1 3.97Å; M386-F405 HydrophobicContact CB-CE1 4.22Å; M386-F405 HydrophobicContact CE-CD1 4.21Å; M386-F405 HydrophobicContact CE-CE1 3.88Å; M386-F405 HydrophobicContact CE-CZ 4.45Å; F405-L408 HydrophobicContact CB-CD2 4.38Å; F405-L408 HydrophobicContact CD1-CD2 4.01Å; F405-L408 HydrophobicContact CD2-CD2 3.52Å; F405-L408 HydrophobicContact CD2-CG 3.85Å; F405-L408 HydrophobicContact CE1-CD2 4.09Å; F405-L408 HydrophobicContact CE2-CD1 4.07Å; F405-L408 HydrophobicContact CE2-CD2 3.62Å; F405-L408 HydrophobicContact CE2-CG 3.61Å; F405-L408 HydrophobicContact CG-CD2 3.72Å; F405-L408 HydrophobicContact CZ-CD1 4.14Å; F405-L408 HydrophobicContact CZ-CD2 3.9Å; F405-L408 HydrophobicContact CZ-CG 4.1Å; F405-I703 HydrophobicContact CE1-CG2 4.5Å; F405-I703 HydrophobicContact CZ-CG1 4.45Å; F405-I703 HydrophobicContact CZ-CG2 4.37Å; F405-P707 HydrophobicContact CE2-CG 4.19Å; F405-L710 HydrophobicContact CE2-CD1 4.31Å
406	L	95.8	Very high	86.5	Confident	10 Å²	10	38.2 Å²	38.2	5%	0.052	22%	0.216	C	C	.	.	S	Bend	trans	-110.2	-23.5	170.2	-64.5	176.9	0	0	0	112.6	L330 V378 F382	L330-L406 HydrophobicContact CB-CD1 3.86Å; L330-L406 HydrophobicContact CD1-CB 4.38Å; L330-L406 HydrophobicContact CD1-CD1 4.22Å; V378-L406 HydrophobicContact CG1-CD1 4.23Å; V378-L406 HydrophobicContact CG1-CD2 3.88Å; F382-L406 HydrophobicContact CB-CD2 3.89Å
407	D	96.6	Very high	84.5	Confident	9 Å²	9	38 Å²	38	5%	0.048	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	148.9	174.8	74.4	-72.7	0	0	0	110.7	Q323 R327 S409 T711	Q323-D407 PolarHBondContact NE2-OD2 3.28Å; R327-D407 IonicContact CZ-OD1 3.36Å; R327-D407 IonicContact NE-OD1 3.69Å; R327-D407 PolarHBondContact NE-OD1 3.04Å; R327-D407 IonicContact NH2-OD1 3.37Å; R327-D407 PolarHBondContact NH2-OD1 3.31Å; R327-D407 IonicContact NH2-OD2 2.68Å; D407-S409 PolarHBondContact OD2-OG 3Å; D407-T711 VanDerWaalsContact CA-O 3.32Å; D407-T711 WeakPolarHBondContact CA-O 3.44Å; D407-T711 HydrophobicContact CB-CG2 3.9Å
408	L	96.8	Very high	82.4	Confident	6 Å²	6	44.2 Å²	44.2	3%	0.031	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	109.7	170	-60.1	-179.7	0	0	0	109.9	M386 F405 L410 L656 F659 I703 L710 T711 L712 H713	M386-L408 HydrophobicContact CE-CD1 4.21Å; M386-L408 HydrophobicContact CE-CD2 3.5Å; M386-L408 VanDerWaalsContact CE-CD2 3.5Å; F405-L408 HydrophobicContact CB-CD2 4.38Å; F405-L408 HydrophobicContact CD1-CD2 4.01Å; F405-L408 HydrophobicContact CD2-CD2 3.52Å; F405-L408 HydrophobicContact CD2-CG 3.85Å; F405-L408 HydrophobicContact CE1-CD2 4.09Å; F405-L408 HydrophobicContact CE2-CD1 4.07Å; F405-L408 HydrophobicContact CE2-CD2 3.62Å; F405-L408 HydrophobicContact CE2-CG 3.61Å; F405-L408 HydrophobicContact CG-CD2 3.72Å; F405-L408 HydrophobicContact CZ-CD1 4.14Å; F405-L408 HydrophobicContact CZ-CD2 3.9Å; F405-L408 HydrophobicContact CZ-CG 4.1Å; L408-L410 HydrophobicContact CB-CD2 3.92Å; L408-L410 PolarHBondContact O-N 3.21Å; L408-L656 HydrophobicContact CD1-CD2 4.46Å; L408-F659 HydrophobicContact CD2-CE1 4.3Å; L408-F659 HydrophobicContact CD2-CZ 4.45Å; L408-I703 HydrophobicContact CD1-CD1 3.8Å; L408-I703 HydrophobicContact CD1-CG1 4.42Å; L408-L710 HydrophobicContact CD1-CD1 4.17Å; L408-T711 PolarHBondContact N-O 2.99Å; L408-L712 HydrophobicContact CB-CD2 3.82Å; L408-L712 HydrophobicContact CD1-CD2 4.22Å; L408-L712 HydrophobicContact CG-CD2 4.4Å; L408-H713 PolarHBondContact O-N 3.38Å
409	S	96.4	Very high	80.3	Confident	17 Å²	17	50.2 Å²	50.2	12%	0.119	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	88.6	179.9	-68.3	0	0	0	0	111.5	Q323 D407 H713 K715	Q323-S409 PolarHBondContact NE2-OG 3.28Å; D407-S409 PolarHBondContact OD2-OG 3Å; S409-H713 CarbonylContact C-O 3.54Å; S409-H713 WeakPolarHBondContact CA-O 3.39Å; S409-H713 WeakPolarHBondContact CB-ND1 3.5Å; S409-H713 PolarHBondContact OG-ND1 2.85Å; S409-K715 WeakPolarHBondContact O-CD 3.49Å; S409-K715 WeakPolarHBondContact O-CE 3.5Å; S409-K715 PolarHBondContact O-NZ 2.92Å
410	L	94.9	Very high	78.1	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	141	-170.6	-50.4	-173.1	0	0	0	113.5	L408 C655 L656 F659 L712 H713 M714 K715	L408-L410 HydrophobicContact CB-CD2 3.92Å; L408-L410 PolarHBondContact O-N 3.21Å; L410-C655 HydrophobicContact CB-CB 4.06Å; L410-C655 HydrophobicContact CD1-CB 3.94Å; L410-L656 HydrophobicContact CD1-CD2 3.71Å; L410-L656 HydrophobicContact CD1-CG 3.72Å; L410-L656 HydrophobicContact CD2-CD2 3.89Å; L410-L656 HydrophobicContact CG-CD2 4.46Å; L410-F659 HydrophobicContact CD2-CB 3.99Å; L410-F659 HydrophobicContact CD2-CD1 4.19Å; L410-F659 HydrophobicContact CD2-CD2 4.09Å; L410-F659 HydrophobicContact CD2-CG 3.82Å; L410-L712 HydrophobicContact CD1-CD2 4.49Å; L410-H713 PolarHBondContact N-O 3.45Å; L410-M714 HydrophobicContact CB-CE 4.44Å; L410-M714 HydrophobicContact CD1-CE 4.04Å; L410-M714 HydrophobicContact CG-CE 4.33Å; L410-K715 VanDerWaalsContact O-CB 3.25Å; L410-K715 WeakPolarHBondContact O-CB 3.49Å; L410-K715 PolarHBondContact O-N 2.85Å
411	P	90.8	Very high	75.6	Confident	40 Å²	40	63.2 Å²	63.2	26%	0.26	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	129.7	177.2	30.8	-33.9	0	0	0	112.4
412	V	87.3	Confident	73	Confident	2 Å²	2	66.6 Å²	66.6	1%	0.012	33%	0.331	C	S	.	.			trans	-94.4	114	174.8	-174.6	0	0	0	0	110.4	D414 M714 R716 Q718 V727 V731	V412-D414 PolarHBondContact O-N 2.88Å; V412-M714 HydrophobicContact CG2-CB 3.92Å; V412-R716 HydrophobicContact CG2-CG 4.32Å; V412-Q718 PolarHBondContact O-NE2 2.86Å; V412-V727 HydrophobicContact CB-CG1 4.41Å; V412-V727 HydrophobicContact CG1-CG1 3.78Å; V412-V731 HydrophobicContact CG1-CG2 3.68Å; V412-V731 HydrophobicContact CG2-CG2 4.25Å
413	S	73	Confident	70.6	Confident	35 Å²	35	70.7 Å²	70.7	25%	0.245	34%	0.344	C	S	.	.			trans	-80.2	113.1	-174.9	-86.5	0	0	0	0	114.1	Q658 R729	S413-Q658 PolarHBondContact OG-OE1 3.45Å; S413-R729 PolarHBondContact O-NH1 2.9Å
414	D	65.2	Low	68	Low	44 Å²	44	74.5 Å²	74.5	24%	0.235	36%	0.359	C	S	.	.			trans	-93.5	101	170.3	-175.9	11.2	0	0	0	112.7	V412 A416 Y417 R418 V727	V412-D414 PolarHBondContact O-N 2.88Å; D414-A416 VanDerWaalsContact C-N 3.33Å; D414-A416 WeakPolarHBondContact OD1-CA 3.39Å; D414-A416 VanDerWaalsContact OD1-CB 3.23Å; D414-A416 WeakPolarHBondContact OD1-CB 3.29Å; D414-A416 PolarHBondContact OD1-N 3.31Å; D414-Y417 PolarHBondContact O-N 3.32Å; D414-R418 PolarHBondContact O-N 2.88Å; D414-V727 HydrophobicContact CB-CG1 4.42Å
415	E	55.8	Low	65.3	Low	38 Å²	38	76 Å²	76	18%	0.178	37%	0.373	C	S	.	.	H	α-helix	trans	-70	-25.1	174.3	-71	172.5	75	0	0	114.1	Y417 R418 K419 R729	E415-Y417 PolarHBondContact O-N 2.9Å; E415-R418 PolarHBondContact O-N 2.86Å; E415-R418 VanDerWaalsContact O-N 3.17Å; E415-K419 PolarHBondContact O-N 2.88Å; E415-R729 IonicContact OE2-CZ 2.61Å; E415-R729 VanDerWaalsContact OE2-CZ 3.29Å; E415-R729 IonicContact OE2-NH1 2.75Å; E415-R729 PolarHBondContact OE2-NH1 2.79Å; E415-R729 IonicContact OE2-NH2 3.93Å; E415-R729 PolarHBondContact OE2-NH2 2.91Å
416	A	50.1	Low	62	Low	67 Å²	67	82.9 Å²	82.9	55%	0.554	41%	0.41	S	S	*	.	H	α-helix	trans	-65.7	-26.6	178.5	0	0	0	0	0	111	D414	D414-A416 VanDerWaalsContact C-N 3.33Å; D414-A416 WeakPolarHBondContact OD1-CA 3.39Å; D414-A416 VanDerWaalsContact OD1-CB 3.23Å; D414-A416 WeakPolarHBondContact OD1-CB 3.29Å; D414-A416 PolarHBondContact OD1-N 3.31Å
417	Y	47.8	Very low	59.2	Low	104 Å²	104	87.7 Å²	87.7	41%	0.408	44%	0.442	S	S	.	.	H	α-helix	trans	-80.7	-42.3	167.7	-110.6	-97.3	0	0	0	113.5	D414 E415 K419 K420 N720	D414-Y417 PolarHBondContact O-N 3.32Å; E415-Y417 PolarHBondContact O-N 2.9Å; Y417-K419 VanDerWaalsContact C-N 3.28Å; Y417-K419 PolarHBondContact O-N 2.83Å; Y417-K420 PolarHBondContact O-N 2.91Å; Y417-K420 VanDerWaalsContact O-N 3.08Å; Y417-N720 HydrophobicContact CE1-CB 4.32Å
418	R	46.6	Very low	56	Low	164 Å²	164	99.3 Å²	99.3	62%	0.619	49%	0.485	S	S	*	.	H	α-helix	trans	-54.8	-42	177.8	-75.5	-168.3	176.6	-169.5	1.4	112.4	D414 E415 K420 K421 T422	D414-R418 PolarHBondContact O-N 2.88Å; E415-R418 PolarHBondContact O-N 2.86Å; E415-R418 VanDerWaalsContact O-N 3.17Å; R418-K420 PolarHBondContact O-N 2.83Å; R418-K420 VanDerWaalsContact O-N 3.15Å; R418-K421 PolarHBondContact O-N 3.14Å; R418-T422 PolarHBondContact O-N 2.91Å; R418-T422 PolarHBondContact O-OG1 3.46Å
419	K	45.8	Very low	52.7	Low	129 Å²	129	105.7 Å²	105.7	56%	0.561	53%	0.525	S	S	*	.	H	α-helix	trans	-61	-22.1	179.9	-71.1	174.4	-176.7	171.4	0	114.3	E415 Y417	E415-K419 PolarHBondContact O-N 2.88Å; Y417-K419 VanDerWaalsContact C-N 3.28Å; Y417-K419 PolarHBondContact O-N 2.83Å
420	K	43.4	Very low	49.5	Very low	134 Å²	134	110.3 Å²	110.3	58%	0.583	56%	0.557	S	S	*	*	H	α-helix	trans	-79.4	-21.8	172.6	-68.7	175.6	-177.1	164.5	0	113.6	Y417 R418	Y417-K420 PolarHBondContact O-N 2.91Å; Y417-K420 VanDerWaalsContact O-N 3.08Å; R418-K420 PolarHBondContact O-N 2.83Å; R418-K420 VanDerWaalsContact O-N 3.15Å
421	K	36.7	Very low	46.2	Very low	179 Å²	179	120.1 Å²	120.1	78%	0.778	60%	0.603	S	S	*	*	H	α-helix	trans	-83.3	-39.9	-176.8	-142.5	174.3	-174.5	-179.9	0	111.3	R418 K424	R418-K421 PolarHBondContact O-N 3.14Å; K421-K424 PolarHBondContact O-N 2.91Å
422	T	38.5	Very low	43.2	Very low	115 Å²	115	123.4 Å²	123.4	71%	0.706	63%	0.627	S	S	*	*	H	α-helix	trans	-70.6	-25.9	177.9	29.1	0	0	0	0	114.6	R418 K424	R418-T422 PolarHBondContact O-N 2.91Å; R418-T422 PolarHBondContact O-OG1 3.46Å; T422-K424 PolarHBondContact O-N 2.82Å
423	Q	40.9	Very low	40.3	Very low	176 Å²	176	129.1 Å²	129.1	82%	0.822	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	3.9	176.4	-76.9	-167.5	-24.1	0	0	115
424	K	38	Very low	38.2	Very low	187 Å²	187	135.8 Å²	135.8	81%	0.813	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.2	1.7	-175	-92.6	-168.7	165.5	-170.2	0	116.5	K421 T422	K421-K424 PolarHBondContact O-N 2.91Å; T422-K424 PolarHBondContact O-N 2.82Å
425	V	35.5	Very low	36.3	Very low	118 Å²	118	140.2 Å²	140.2	72%	0.715	72%	0.718	S	S	*	*			trans	-129.2	91.9	-179.7	-173.1	0	0	0	0	110.7
426	L	27.2	Very low	35.1	Very low	166 Å²	166	144.2 Å²	144.2	87%	0.869	74%	0.736	S	S	*	*			trans	-156.6	95.3	163.4	-109.1	171.5	0	0	0	108.7
427	P	35.8	Very low	34	Very low	111 Å²	111	150 Å²	150	72%	0.721	74%	0.744	S	S	*	*			trans	-65.6	136.1	167.8	-15.9	30.8	0	0	0	109.6
428	R	29.5	Very low	33.1	Very low	253 Å²	253	152.7 Å²	152.7	96%	0.955	77%	0.765	S	S	*	*			trans	-84.3	116.9	167.7	-76.6	-177.7	171.2	-175.5	-4.1	109.3
429	T	27.5	Very low	32.2	Very low	141 Å²	141	148.6 Å²	148.6	87%	0.865	77%	0.774	S	S	*	*			trans	-113.7	136.9	153.8	42.9	0	0	0	0	108.4
430	S	29.5	Very low	31.4	Very low	114 Å²	114	148 Å²	148	80%	0.797	79%	0.786	S	S	*	*			trans	-106.7	129.2	-176.2	52.1	0	0	0	0	110.3
431	E	26.1	Very low	30.6	Very low	205 Å²	205	147.5 Å²	147.5	96%	0.958	79%	0.79	S	S	*	*			trans	-150.1	159.3	158	-126.5	161.8	-141.2	0	0	110
432	S	26.4	Very low	30.3	Very low	110 Å²	110	146.5 Å²	146.5	77%	0.769	79%	0.792	S	S	*	*			trans	-127.3	138.7	-158.9	57.3	0	0	0	0	113.6
433	S	27.6	Very low	29.9	Very low	122 Å²	122	147 Å²	147	85%	0.853	79%	0.789	S	S	*	*			trans	-152	158.4	157.2	-48	0	0	0	0	109.5
434	Q	28.2	Very low	29.2	Very low	175 Å²	175	148.2 Å²	148.2	82%	0.818	79%	0.786	S	S	*	*			trans	-92.9	156.8	179.5	-57.2	148.8	-88.8	0	0	108.5
435	D	26.2	Very low	28.6	Very low	137 Å²	137	145.9 Å²	145.9	73%	0.733	78%	0.778	S	S	*	*				-174.9	153.8	69.9	-103.4	-35.1	0	0	0	115.1
436	E	29.9	Very low	28.3	Very low	121 Å²	121	147.7 Å²	147.7	57%	0.565	78%	0.784	S	S	*	*			trans	61.1	100	137.3	-57.1	-105.3	95.1	0	0	124.2
437	R	28	Very low	28.4	Very low	188 Å²	188	147.5 Å²	147.5	71%	0.709	78%	0.784	S	S	*	*				86.6	135.2	122.4	-65.4	-174.6	-161.3	169.4	18.7	123.8
438	N	28.3	Very low	28.2	Very low	162 Å²	162	147.5 Å²	147.5	87%	0.866	78%	0.778	S	S	*	*			trans	65.1	137.7	155.6	-54.6	-10	0	0	0	117.2
439	G	26.5	Very low	28.2	Very low	77 Å²	77	141.2 Å²	141.2	79%	0.794	77%	0.772	S	S	*	*			cis	163	159	-0.7	0	0	0	0	0	107.7
440	S	29.1	Very low	28.4	Very low	116 Å²	116	140.2 Å²	140.2	81%	0.811	77%	0.766	S	S	*	*			cis	-159.6	176.7	4	54.5	0	0	0	0	110.9
441	D	27.1	Very low	28.6	Very low	124 Å²	124	141.4 Å²	141.4	66%	0.663	77%	0.769	S	S	*	*			trans	-34.4	163.7	176.4	-47.7	-74.1	0	0	0	118.4	I443	D441-I443 HydrophobicContact CB-CD1 4.39Å
442	L	31.6	Very low	28.9	Very low	158 Å²	158	135.4 Å²	135.4	83%	0.827	76%	0.762	S	S	*	*			cis	-147.4	140.2	46.5	-63.4	155.7	0	0	0	110.4
443	I	30.2	Very low	29.3	Very low	127 Å²	127	134 Å²	134	65%	0.651	77%	0.765	S	S	*	*				70.7	108.5	57.1	-59.5	177.9	0	0	0	114.9	D441	D441-I443 HydrophobicContact CB-CD1 4.39Å
444	R	25.5	Very low	30	Very low	201 Å²	201	131.1 Å²	131.1	76%	0.758	75%	0.745	S	S	*	*				-165.1	134.8	115.5	-100.9	-174.2	85.1	168.1	5	112.8
445	E	25.4	Very low	31.5	Very low	138 Å²	138	126.2 Å²	126.2	65%	0.645	73%	0.73	S	S	*	*			trans	31.9	113.3	147.7	-66.7	142.6	-151.8	0	0	119
446	N	29.8	Very low	33	Very low	155 Å²	155	128.3 Å²	128.3	83%	0.829	73%	0.733	S	S	*	*			cis	72.9	111.4	31.5	-161.6	75.8	0	0	0	115.8
447	D	28	Very low	34.3	Very low	162 Å²	162	130.7 Å²	130.7	87%	0.866	74%	0.738	S	S	*	*			trans	-146.5	149.3	154.1	-160.1	0.9	0	0	0	108.4
448	D	32.9	Very low	35.8	Very low	112 Å²	112	127.4 Å²	127.4	60%	0.599	73%	0.73	S	S	*	*			trans	-122.9	146.8	-161.8	-176.1	24	0	0	0	113.5
449	S	28.6	Very low	37.4	Very low	120 Å²	120	124.9 Å²	124.9	84%	0.839	71%	0.713	S	S	*	*			trans	-166.7	96.5	164.9	-86.4	0	0	0	0	111.7
450	T	31.9	Very low	39.6	Very low	120 Å²	120	128.8 Å²	128.8	74%	0.736	71%	0.708	S	S	*	*			trans	-69.5	126.5	178.7	58.4	0	0	0	0	113.4
451	T	32.8	Very low	41.6	Very low	140 Å²	140	128.8 Å²	128.8	86%	0.859	69%	0.694	S	S	*	*			trans	-151.7	131.9	150.6	-39.6	0	0	0	0	111.4	G453	T451-G453 PolarHBondContact O-N 2.75Å
452	G	34	Very low	43.5	Very low	79 Å²	79	125.5 Å²	125.5	81%	0.814	68%	0.684	S	S	*	*			trans	-72.3	105.5	-176.4	0	0	0	0	0	114.1	S454	G452-S454 PolarHBondContact O-N 3.21Å
453	G	33.1	Very low	45.5	Very low	80 Å²	80	126.2 Å²	126.2	83%	0.825	68%	0.68	S	S	*	*			trans	-70.2	114.2	176.7	0	0	0	0	0	113.4	T451	T451-G453 PolarHBondContact O-N 2.75Å
454	S	43	Very low	47.5	Very low	62 Å²	62	128 Å²	128	43%	0.434	68%	0.683	S	S	.	*			trans	-65.7	147.4	176.8	55.4	0	0	0	0	113.1	G452 Q459	G452-S454 PolarHBondContact O-N 3.21Å; S454-Q459 PolarHBondContact O-NE2 2.85Å; S454-Q459 PolarHBondContact OG-NE2 3.46Å
455	S	59.6	Low	49.6	Very low	72 Å²	72	124 Å²	124	50%	0.503	67%	0.673	S	S	.	*			trans	-61	139.4	-176.1	173.5	0	0	0	0	112.2	Y457 Q458 Q459	S455-Y457 PolarHBondContact O-N 2.72Å; S455-Y457 PolarHBondContact OG-N 2.96Å; S455-Q458 WeakPolarHBondContact O-CB 3.49Å; S455-Q458 PolarHBondContact O-N 2.75Å; S455-Q459 PolarHBondContact O-N 3.31Å
456	K	57.8	Low	51.7	Low	181 Å²	181	120.3 Å²	120.3	79%	0.787	67%	0.666	S	S	*	*	H	α-helix	trans	-51	-27.3	177.1	-67.1	-178.9	178.6	177.3	0	113.1	K460	K456-K460 WeakPolarHBondContact O-CB 3.25Å; K456-K460 PolarHBondContact O-N 3.22Å; K456-K460 VanDerWaalsContact O-N 3.16Å
457	Y	57.6	Low	53.7	Low	171 Å²	171	120.6 Å²	120.6	67%	0.671	66%	0.66	S	S	*	*	H	α-helix	trans	-65.6	-44.4	173.9	-177	-94.3	0	0	0	113.1	S455 K460 K461	S455-Y457 PolarHBondContact O-N 2.72Å; S455-Y457 PolarHBondContact OG-N 2.96Å; Y457-K460 PolarHBondContact O-N 3.32Å; Y457-K461 HydrophobicContact CE1-CD 4.38Å; Y457-K461 WeakPolarHBondContact O-CB 3.27Å; Y457-K461 PolarHBondContact O-N 3.02Å
458	Q	58.8	Low	55.7	Low	118 Å²	118	121.3 Å²	121.3	55%	0.551	66%	0.655	S	S	*	*	H	α-helix	trans	-65.1	-42.6	-179.8	-68.8	169.7	-31.5	0	0	111	S455 K460 K461 A462	S455-Q458 WeakPolarHBondContact O-CB 3.49Å; S455-Q458 PolarHBondContact O-N 2.75Å; Q458-K460 PolarHBondContact O-N 2.73Å; Q458-K461 PolarHBondContact O-N 3.24Å; Q458-A462 PolarHBondContact O-N 3.29Å
459	Q	62.9	Low	57.2	Low	109 Å²	109	122.6 Å²	122.6	51%	0.509	66%	0.658	S	S	.	*	H	α-helix	trans	-62.1	-41	175.6	-60.5	179.9	3.7	0	0	112	S454 S455 A462 K463	S454-Q459 PolarHBondContact O-NE2 2.85Å; S454-Q459 PolarHBondContact OG-NE2 3.46Å; S455-Q459 PolarHBondContact O-N 3.31Å; Q459-A462 PolarHBondContact O-N 3.26Å; Q459-K463 WeakPolarHBondContact O-CB 3.48Å; Q459-K463 PolarHBondContact O-N 2.68Å
460	K	71.9	Confident	59.1	Low	160 Å²	160	119.4 Å²	119.4	70%	0.696	64%	0.639	S	S	*	*	H	α-helix	trans	-67.6	-34.9	175.7	-160.1	171.5	-175.3	178.6	0	112.2	K456 Y457 Q458 K464	K456-K460 WeakPolarHBondContact O-CB 3.25Å; K456-K460 PolarHBondContact O-N 3.22Å; K456-K460 VanDerWaalsContact O-N 3.16Å; Y457-K460 PolarHBondContact O-N 3.32Å; Q458-K460 PolarHBondContact O-N 2.73Å; K460-K464 PolarHBondContact O-N 3.47Å; K460-K464 VanDerWaalsContact O-N 3.16Å
461	K	71.1	Confident	60.7	Low	115 Å²	115	121.2 Å²	121.2	50%	0.5	64%	0.636	S	S	.	*	H	α-helix	trans	-66.1	-47.9	174.1	-169.3	171.4	-178.7	175.3	0	111.6	Y457 Q458 K463 K464 Q465	Y457-K461 HydrophobicContact CE1-CD 4.38Å; Y457-K461 WeakPolarHBondContact O-CB 3.27Å; Y457-K461 PolarHBondContact O-N 3.02Å; Q458-K461 PolarHBondContact O-N 3.24Å; K461-K463 PolarHBondContact O-N 3.36Å; K461-K464 PolarHBondContact O-N 2.89Å; K461-Q465 PolarHBondContact O-N 3.42Å
462	A	67.3	Low	61.8	Low	55 Å²	55	122.8 Å²	122.8	46%	0.455	63%	0.631	S	S	.	*	H	α-helix	trans	-58.8	-45.6	175.4	0	0	0	0	0	112.2	Q458 Q459 K464 Q465 A466	Q458-A462 PolarHBondContact O-N 3.29Å; Q459-A462 PolarHBondContact O-N 3.26Å; A462-K464 VanDerWaalsContact C-N 3.34Å; A462-K464 PolarHBondContact O-N 3.33Å; A462-Q465 PolarHBondContact O-N 3.4Å; A462-Q465 VanDerWaalsContact O-N 3.12Å; A462-A466 PolarHBondContact O-N 2.78Å
463	K	73.8	Confident	62.6	Low	173 Å²	173	128.8 Å²	128.8	75%	0.752	63%	0.629	S	S	*	*	H	α-helix	trans	-65	-32.8	179.2	-158.1	166.6	-173.5	172.1	0	113	Q459 K461 K467	Q459-K463 WeakPolarHBondContact O-CB 3.48Å; Q459-K463 PolarHBondContact O-N 2.68Å; K461-K463 PolarHBondContact O-N 3.36Å; K463-K467 PolarHBondContact O-N 3.43Å
464	K	72.4	Confident	63.6	Low	166 Å²	166	131.1 Å²	131.1	72%	0.722	62%	0.619	S	S	*	*	H	α-helix	trans	-69.2	-40.4	169.5	-91.8	-165.6	173.1	-172	0	112.4	K460 K461 A462 K467 K468	K460-K464 PolarHBondContact O-N 3.47Å; K460-K464 VanDerWaalsContact O-N 3.16Å; K461-K464 PolarHBondContact O-N 2.89Å; A462-K464 VanDerWaalsContact C-N 3.34Å; A462-K464 PolarHBondContact O-N 3.33Å; K464-K467 PolarHBondContact O-N 3.08Å; K464-K468 PolarHBondContact O-N 3.36Å; K464-K468 VanDerWaalsContact O-N 3.14Å
465	Q	68.6	Low	64	Low	117 Å²	117	134.8 Å²	134.8	55%	0.547	63%	0.628	S	S	.	*	H	α-helix	trans	-65.6	-45.4	178.8	-75.8	176.4	-41.5	0	0	112.3	K461 A462 K467 K468 Q469	K461-Q465 PolarHBondContact O-N 3.42Å; A462-Q465 PolarHBondContact O-N 3.4Å; A462-Q465 VanDerWaalsContact O-N 3.12Å; Q465-K467 VanDerWaalsContact C-N 3.33Å; Q465-K467 PolarHBondContact O-N 3.07Å; Q465-K468 PolarHBondContact O-N 3.01Å; Q465-Q469 PolarHBondContact O-N 3.03Å
466	A	69.4	Low	63.2	Low	59 Å²	59	139.3 Å²	139.3	49%	0.488	64%	0.639	S	S	.	*	H	α-helix	trans	-57.3	-43.5	174.9	0	0	0	0	0	112.2	A462 K468 Q469 A470	A462-A466 PolarHBondContact O-N 2.78Å; A466-K468 PolarHBondContact O-N 2.9Å; A466-Q469 PolarHBondContact O-N 3.47Å; A466-A470 PolarHBondContact O-N 3.02Å
467	K	71.4	Confident	62.5	Low	162 Å²	162	137.2 Å²	137.2	70%	0.704	64%	0.636	S	S	*	*	H	α-helix	trans	-68.5	-30.1	179.2	-153.4	172.2	-173.6	-179.2	0	113.1	K463 K464 Q465 K471	K463-K467 PolarHBondContact O-N 3.43Å; K464-K467 PolarHBondContact O-N 3.08Å; Q465-K467 VanDerWaalsContact C-N 3.33Å; Q465-K467 PolarHBondContact O-N 3.07Å; K467-K471 PolarHBondContact O-N 3.49Å
468	K	70.4	Confident	61.7	Low	176 Å²	176	135.9 Å²	135.9	77%	0.765	64%	0.636	S	S	*	*	H	α-helix	trans	-70.3	-39.8	168.8	-86.6	-162.3	172.6	-170.9	0	112.3	K464 Q465 A466 K472	K464-K468 PolarHBondContact O-N 3.36Å; K464-K468 VanDerWaalsContact O-N 3.14Å; Q465-K468 PolarHBondContact O-N 3.01Å; A466-K468 PolarHBondContact O-N 2.9Å; K468-K472 PolarHBondContact O-N 3.3Å; K468-K472 VanDerWaalsContact O-N 3.14Å
469	Q	65.8	Low	60.8	Low	140 Å²	140	135.3 Å²	135.3	65%	0.654	64%	0.641	S	S	*	*	H	α-helix	trans	-66.3	-36.5	177.3	-73.1	-175.9	-6.2	0	0	112.9	Q465 A466 K472 R473	Q465-Q469 PolarHBondContact O-N 3.03Å; A466-Q469 PolarHBondContact O-N 3.47Å; Q469-K472 PolarHBondContact O-N 3.37Å; Q469-R473 PolarHBondContact O-N 2.9Å
470	A	68	Low	59.8	Low	53 Å²	53	140.8 Å²	140.8	44%	0.438	66%	0.656	S	S	.	*	H	α-helix	trans	-60.8	-52.4	174.8	0	0	0	0	0	112.3	A466 K472 R473 Q474	A466-A470 PolarHBondContact O-N 3.02Å; A470-K472 VanDerWaalsContact C-N 3.27Å; A470-K472 PolarHBondContact O-N 2.91Å; A470-R473 PolarHBondContact O-N 3.25Å; A470-Q474 PolarHBondContact O-N 3.48Å
471	K	66.3	Low	58.2	Low	157 Å²	157	140.2 Å²	140.2	68%	0.683	66%	0.66	S	S	*	*	H	α-helix	trans	-58.5	-37.6	176.1	-79.2	-159.3	168	-160	0	112.6	K467 R473 Q474 H475	K467-K471 PolarHBondContact O-N 3.49Å; K471-R473 PolarHBondContact O-N 2.98Å; K471-Q474 PolarHBondContact O-N 3.47Å; K471-H475 PolarHBondContact O-N 3.14Å
472	K	54.8	Low	56.2	Low	174 Å²	174	141.3 Å²	141.3	76%	0.757	68%	0.676	S	S	*	*	H	α-helix	trans	-74.2	-2.3	177.6	-145.4	175.5	-172.8	179.8	0	114.2	K468 Q469 A470	K468-K472 PolarHBondContact O-N 3.3Å; K468-K472 VanDerWaalsContact O-N 3.14Å; Q469-K472 PolarHBondContact O-N 3.37Å; A470-K472 VanDerWaalsContact C-N 3.27Å; A470-K472 PolarHBondContact O-N 2.91Å
473	R	51.7	Low	54.3	Low	204 Å²	204	147.1 Å²	147.1	77%	0.77	70%	0.699	S	S	*	*	H	α-helix	trans	-95.2	-41	167.8	-75.8	-176.7	172.7	-174	-2.4	112.6	Q469 A470 K471 K476 L477	Q469-R473 PolarHBondContact O-N 2.9Å; A470-R473 PolarHBondContact O-N 3.25Å; K471-R473 PolarHBondContact O-N 2.98Å; R473-K476 PolarHBondContact O-N 2.81Å; R473-L477 PolarHBondContact O-N 3.44Å
474	Q	53.4	Low	52.1	Low	130 Å²	130	142.4 Å²	142.4	61%	0.607	70%	0.699	S	S	*	*	H	α-helix	trans	-61.3	-52.1	174.9	-70.3	178.5	-79.1	0	0	111.1	A470 K471 K476 L477 E478	A470-Q474 PolarHBondContact O-N 3.48Å; K471-Q474 PolarHBondContact O-N 3.47Å; Q474-K476 PolarHBondContact O-N 3.27Å; Q474-L477 PolarHBondContact O-N 2.97Å; Q474-E478 PolarHBondContact O-N 3.14Å
475	H	51.6	Low	50	Low	138 Å²	138	141 Å²	141	64%	0.639	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	13.8	177.7	-152	-48.8	0	0	0	114.2	K471 T479	K471-H475 PolarHBondContact O-N 3.14Å; H475-T479 PolarHBondContact O-OG1 2.71Å
476	K	42.8	Very low	48.1	Very low	168 Å²	168	143.2 Å²	143.2	73%	0.73	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121	-0.5	169	-154.7	-179.3	178.7	-178.3	0	112.6	R473 Q474	R473-K476 PolarHBondContact O-N 2.81Å; Q474-K476 PolarHBondContact O-N 3.27Å
477	L	42.6	Very low	46.1	Very low	137 Å²	137	147.4 Å²	147.4	72%	0.717	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	-44.9	171.2	-163.3	68.8	0	0	0	110.3	R473 Q474 T479 R480	R473-L477 PolarHBondContact O-N 3.44Å; Q474-L477 PolarHBondContact O-N 2.97Å; L477-T479 PolarHBondContact O-N 3.34Å; L477-R480 PolarHBondContact O-N 3.06Å
478	E	41.9	Very low	44.1	Very low	142 Å²	142	145 Å²	145	66%	0.664	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-65.4	-36.1	179.1	-68.1	157.6	148.7	0	0	112.1	Q474 R480	Q474-E478 PolarHBondContact O-N 3.14Å; E478-R480 PolarHBondContact O-N 3.42Å; E478-R480 VanDerWaalsContact O-N 3.11Å
479	T	38.8	Very low	42.4	Very low	107 Å²	107	142.1 Å²	142.1	66%	0.656	74%	0.737	S	S	*	*	G	3₁₀ helix	trans	-84.2	30	179.5	-29.5	0	0	0	0	113.8	H475 L477	H475-T479 PolarHBondContact O-OG1 2.71Å; L477-T479 PolarHBondContact O-N 3.34Å
480	R	43.1	Very low	40.5	Very low	223 Å²	223	139.8 Å²	139.8	84%	0.842	74%	0.736	S	S	*	*	G	3₁₀ helix	trans	-128.4	7.1	176	-148.5	-175.7	171.2	164	-0.1	115.3	L477 E478	L477-R480 PolarHBondContact O-N 3.06Å; E478-R480 PolarHBondContact O-N 3.42Å; E478-R480 VanDerWaalsContact O-N 3.11Å
481	I	36.5	Very low	38.5	Very low	149 Å²	149	144.5 Å²	144.5	76%	0.764	75%	0.754	S	S	*	*	S	Bend	trans	-132.7	58.2	175.4	-43.2	-177.7	0	0	0	111.2
482	T	30.2	Very low	36.6	Very low	138 Å²	138	140.8 Å²	140.8	85%	0.847	75%	0.752	S	S	*	*			trans	-171.9	97.2	155.4	7.2	0	0	0	0	112.4
483	L	27.4	Very low	35.2	Very low	177 Å²	177	140.3 Å²	140.3	93%	0.927	76%	0.758	S	S	*	*			trans	-168.8	125	136.9	-154.8	67.6	0	0	0	108.5
484	G	26.8	Very low	34	Very low	74 Å²	74	133.9 Å²	133.9	76%	0.763	76%	0.755	S	S	*	*			trans	175.7	41	-169.4	0	0	0	0	0	117
485	N	28.8	Very low	32.7	Very low	137 Å²	137	134.4 Å²	134.4	73%	0.733	76%	0.762	S	S	*	*			trans	30.7	111.8	160.4	-61.8	5	0	0	0	121.4
486	L	29.5	Very low	31.6	Very low	162 Å²	162	135 Å²	135	85%	0.848	77%	0.765	S	S	*	*				38.2	105	119.8	-62.6	171.2	0	0	0	119.9
487	T	26.2	Very low	31	Very low	148 Å²	148	132.9 Å²	132.9	91%	0.908	76%	0.76	S	S	*	*				-166.6	147.4	123.4	19.7	0	0	0	0	111.9
488	S	28.7	Very low	30.3	Very low	112 Å²	112	133.2 Å²	133.2	78%	0.783	76%	0.763	S	S	*	*			trans	-93.5	156.3	159.4	-42.3	0	0	0	0	108.5
489	P	36.3	Very low	29.8	Very low	114 Å²	114	131.3 Å²	131.3	74%	0.74	76%	0.761	S	S	*	*				-153.7	166.1	77.2	42.2	-23.4	0	0	0	117.8
490	S	25.5	Very low	29.5	Very low	91 Å²	91	131.1 Å²	131.1	64%	0.636	76%	0.76	S	S	*	*			trans	54.3	128.3	137.4	68.2	0	0	0	0	123.8
491	N	25.8	Very low	29	Very low	153 Å²	153	128.5 Å²	128.5	82%	0.818	76%	0.757	S	S	*	*			trans	85.8	131.5	130.4	-66.9	7.3	0	0	0	122.9
492	A	26.8	Very low	28.7	Very low	78 Å²	78	128.1 Å²	128.1	65%	0.645	76%	0.756	S	S	*	*			trans	79.6	124.4	131.2	0	0	0	0	0	121.7
493	D	25.4	Very low	28.9	Very low	165 Å²	165	125 Å²	125	88%	0.882	75%	0.745	S	S	*	*				56.8	149.5	128.7	-49.8	-21.4	0	0	0	122.5
494	G	25.7	Very low	29.1	Very low	69 Å²	69	124.8 Å²	124.8	71%	0.711	74%	0.737	S	S	*	*			trans	110.5	81.9	162.7	0	0	0	0	0	113.9
495	D	26.2	Very low	29.3	Very low	140 Å²	140	127.3 Å²	127.3	75%	0.749	73%	0.733	S	S	*	*				55	112.3	84.4	-93.9	-22.6	0	0	0	114.5
496	Q	28.9	Very low	29.3	Very low	150 Å²	150	126.8 Å²	126.8	70%	0.701	73%	0.734	S	S	*	*				93.8	152.4	92.1	-130.8	-176.9	102.3	0	0	109.8
497	I	29.9	Very low	29.6	Very low	124 Å²	124	126.5 Å²	126.5	64%	0.636	73%	0.729	S	S	*	*			cis	-148.5	160.8	15.2	-29.9	171.5	0	0	0	109.4
498	D	28.3	Very low	29.6	Very low	145 Å²	145	125.9 Å²	125.9	78%	0.775	72%	0.72	S	S	*	*			trans	74.2	151.2	138.2	-98.9	4.5	0	0	0	122.3
499	V	30.8	Very low	29.9	Very low	101 Å²	101	124 Å²	124	61%	0.612	71%	0.711	S	S	*	*			cis	-153.5	143.4	2.5	74.6	0	0	0	0	112.1
500	T	32.1	Very low	29.4	Very low	103 Å²	103	124.9 Å²	124.9	63%	0.632	71%	0.71	S	S	*	*			trans	44.8	159.5	153.2	58.5	0	0	0	0	121.8
501	E	34.2	Very low	29.6	Very low	168 Å²	168	128.3 Å²	128.3	79%	0.785	72%	0.716	S	S	*	*			cis	-162.9	170.6	-11.1	-108.2	156.6	179.8	0	0	105.6
502	D	29.4	Very low	29.9	Very low	141 Å²	141	128.3 Å²	128.3	75%	0.754	71%	0.713	S	S	*	*			cis	-158.3	166.5	19.8	-157.6	-7.4	0	0	0	111.2
503	A	35.3	Very low	31.1	Very low	73 Å²	73	128.8 Å²	128.8	60%	0.603	71%	0.709	S	S	*	*			trans	31.3	145.9	149.1	0	0	0	0	0	124.3
504	K	30.6	Very low	31.4	Very low	173 Å²	173	128.4 Å²	128.4	75%	0.752	70%	0.702	S	S	*	*			cis	-171.7	153.5	-3.5	-110.6	176.7	177.2	176.4	0	112.4
505	D	30.5	Very low	31.3	Very low	127 Å²	127	133 Å²	133	68%	0.679	71%	0.705	S	S	*	*			trans	45.3	149.9	142	-41.9	-23.4	0	0	0	121.2
506	T	29.4	Very low	31.4	Very low	126 Å²	126	134.8 Å²	134.8	77%	0.773	71%	0.708	S	S	*	*			cis	-147.9	159.4	25.9	-38	0	0	0	0	114.5
507	E	34.8	Very low	31.2	Very low	155 Å²	155	133.6 Å²	133.6	72%	0.724	71%	0.711	S	S	*	*			trans	-76.1	178.2	-174.8	-53.7	134.6	135.6	0	0	114.7
508	N	27.8	Very low	31	Very low	136 Å²	136	132.5 Å²	132.5	73%	0.727	71%	0.714	S	S	*	*			cis	-152.1	156.1	42	-76	-98.6	0	0	0	110.4
509	A	33.5	Very low	31.1	Very low	73 Å²	73	132.3 Å²	132.3	60%	0.603	71%	0.713	S	S	*	*			cis	74.2	137.2	43.3	0	0	0	0	0	113.3
510	D	26.1	Very low	30.9	Very low	131 Å²	131	133.8 Å²	133.8	70%	0.701	72%	0.717	S	S	*	*			cis	-138.3	162.8	6.8	-86.6	-47.3	0	0	0	111
511	Q	30.9	Very low	30.7	Very low	164 Å²	164	135.6 Å²	135.6	77%	0.766	72%	0.719	S	S	*	*			cis	80.1	144.4	33.1	-54.8	-172.9	116.1	0	0	115.3
512	M	31.1	Very low	30.2	Very low	153 Å²	153	135.8 Å²	135.8	75%	0.754	72%	0.719	S	S	*	*			cis	-133.1	-104.1	-13.6	-138.1	-72.2	85.9	0	0	110.1
513	P	51.8	Low	30	Very low	88 Å²	88	136.3 Å²	136.3	57%	0.571	72%	0.722	S	S	*	*			cis	-136.1	176.6	-35.9	46.1	-30.8	0	0	0	116.3
514	H	31.2	Very low	30.1	Very low	157 Å²	157	137.4 Å²	137.4	73%	0.727	72%	0.723	S	S	*	*			trans	63.9	139.6	157	-59.7	-59.3	0	0	0	121
515	E	25.1	Very low	29.9	Very low	166 Å²	166	138.4 Å²	138.4	78%	0.776	73%	0.728	S	S	*	*			cis	-154.2	-174.9	-0.6	-136.1	153.1	-136.1	0	0	114.7
516	E	27.8	Very low	29.9	Very low	176 Å²	176	138.5 Å²	138.5	82%	0.822	74%	0.735	S	S	*	*			trans	-89	-175.9	-165	-55.5	-176.9	145.5	0	0	114.3
517	V	24.5	Very low	29.6	Very low	126 Å²	126	139 Å²	139	76%	0.764	74%	0.738	S	S	*	*			cis	-158.4	151.4	35.1	177.1	0	0	0	0	113.4
518	S	25.4	Very low	28.9	Very low	100 Å²	100	137.4 Å²	137.4	70%	0.699	74%	0.742	S	S	*	*			trans	-20	163.7	154.8	-64.2	0	0	0	0	121.7
519	L	30.1	Very low	28.8	Very low	141 Å²	141	139.5 Å²	139.5	74%	0.738	75%	0.747	S	S	*	*			cis	-168.4	150.7	-0.8	-112	165.8	0	0	0	112.2
520	N	27.6	Very low	28.4	Very low	132 Å²	132	144 Å²	144	71%	0.706	75%	0.754	S	S	*	*			trans	58.7	157.3	152.3	-79.3	13.1	0	0	0	121.5
521	E	27.2	Very low	28.2	Very low	142 Å²	142	147.3 Å²	147.3	66%	0.664	77%	0.765	S	S	*	*			cis	-154.7	163	5.8	-135.2	-176.5	128.1	0	0	114.6
522	Q	25	Very low	28	Very low	171 Å²	171	146.9 Å²	146.9	80%	0.799	76%	0.763	S	S	*	*			trans	75.1	152.4	154.5	-70.4	177.5	32	0	0	123.5
523	D	23.8	Very low	27.6	Very low	152 Å²	152	147.2 Å²	147.2	81%	0.813	77%	0.768	S	S	*	*			trans	-90.6	-178.4	-172.7	-113.1	-50.6	0	0	0	112.9
524	P	37.4	Very low	26.5	Very low	97 Å²	97	149.9 Å²	149.9	63%	0.63	77%	0.773	S	S	*	*			cis	-138.7	179	-13.1	39	-21	0	0	0	116.1
525	K	26.7	Very low	26.2	Very low	194 Å²	194	149.8 Å²	149.8	84%	0.843	78%	0.778	S	S	*	*			trans	68.2	148.1	163.2	-65.2	-178.8	179.8	178.1	0	118.6
526	P	30.8	Very low	26.4	Very low	129 Å²	129	147.6 Å²	147.6	84%	0.838	78%	0.775	S	S	*	*			trans	-132.9	153.6	130.8	37.8	-29.1	0	0	0	114.3
527	V	22.9	Very low	26.3	Very low	137 Å²	137	147.5 Å²	147.5	83%	0.83	78%	0.775	S	S	*	*			trans	-126.4	138.2	151.5	169.5	0	0	0	0	105.2
528	C	21.3	Very low	26.3	Very low	120 Å²	120	148.4 Å²	148.4	81%	0.811	77%	0.771	S	S	*	*			trans	-172.5	128.6	149.6	-103.3	0	0	0	0	110.4
529	E	25.4	Very low	26.4	Very low	180 Å²	180	150.3 Å²	150.3	84%	0.841	77%	0.769	S	S	*	*			trans	-84.2	150.4	138	-61.7	178.3	135.9	0	0	107.2
530	F	25.2	Very low	26	Very low	169 Å²	169	150.8 Å²	150.8	74%	0.741	77%	0.772	S	S	*	*			trans	177.1	134.8	140.7	-107.8	-68.6	0	0	0	109.6	Q532	F530-Q532 HydrophobicContact CD1-CB 4.03Å; F530-Q532 HydrophobicContact CE1-CB 4.11Å
531	E	21.9	Very low	25.9	Very low	200 Å²	200	148.1 Å²	148.1	94%	0.935	78%	0.775	S	S	*	*				-135.9	138.9	127.9	-76.6	-160.8	148.4	0	0	107.9
532	Q	25.5	Very low	25.8	Very low	154 Å²	154	150 Å²	150	72%	0.72	78%	0.784	S	S	*	*			trans	-153.8	135.1	176.8	-179.7	-178.1	62.5	0	0	105.7	F530	F530-Q532 HydrophobicContact CD1-CB 4.03Å; F530-Q532 HydrophobicContact CE1-CB 4.11Å
533	D	22.4	Very low	25.9	Very low	160 Å²	160	147.7 Å²	147.7	86%	0.856	78%	0.777	S	S	*	*			trans	-122.1	152.8	-178.6	-144.1	-17.9	0	0	0	111.4
534	Q	29.8	Very low	26.1	Very low	145 Å²	145	147.3 Å²	147.3	68%	0.678	77%	0.768	S	S	*	*			trans	-114.8	157.8	-156.7	-57.1	178.7	-1.3	0	0	113.1
535	N	24.8	Very low	25.4	Very low	155 Å²	155	149 Å²	149	83%	0.829	77%	0.772	S	S	*	*				-170.5	177.1	108.9	-102.5	-71.7	0	0	0	113.2
536	V	28.9	Very low	25.5	Very low	119 Å²	119	145 Å²	145	72%	0.721	77%	0.769	S	S	*	*			trans	-128.9	157.3	-153.3	176.4	0	0	0	0	112.1
537	E	25.8	Very low	25.6	Very low	175 Å²	175	145.1 Å²	145.1	82%	0.818	77%	0.77	S	S	*	*			trans	142.5	146.7	151.4	-82	174	-167.8	0	0	111.3
538	Q	25.2	Very low	25.8	Very low	145 Å²	145	143.1 Å²	143.1	68%	0.678	76%	0.761	S	S	*	*			cis	-163.6	158.7	-27.8	-155.2	-175.2	-53.8	0	0	109.2
539	E	26	Very low	25.9	Very low	140 Å²	140	144.5 Å²	144.5	65%	0.654	76%	0.761	S	S	*	*			trans	76.4	133.6	157.7	-56.3	-147.9	164.8	0	0	124.2
540	N	23.4	Very low	25.7	Very low	150 Å²	150	142.7 Å²	142.7	80%	0.802	76%	0.757	S	S	*	*			trans	57.6	136.3	140.8	-57.4	-27	0	0	0	123.5
541	G	24.2	Very low	25.6	Very low	76 Å²	76	139.8 Å²	139.8	78%	0.784	75%	0.753	S	S	*	*			trans	146.8	77.4	151.1	0	0	0	0	0	119.6
542	E	26.4	Very low	25.6	Very low	183 Å²	183	134.8 Å²	134.8	86%	0.855	74%	0.74	S	S	*	*			trans	9	149.6	150.6	-57.5	177.5	146.7	0	0	123.9
543	D	25.9	Very low	25.6	Very low	121 Å²	121	135.4 Å²	135.4	65%	0.647	75%	0.747	S	S	*	*			trans	69.7	147.6	147.5	-76.3	-5.2	0	0	0	120.6
544	K	28	Very low	25.5	Very low	144 Å²	144	132.3 Å²	132.3	63%	0.626	74%	0.744	S	S	*	*			cis	-159.4	158.8	-5.3	-124.2	174.6	178.8	67.9	0	114.5
545	D	23.8	Very low	25.1	Very low	133 Å²	133	132.5 Å²	132.5	71%	0.711	75%	0.75	S	S	*	*			trans	47.9	115.9	144	-60.6	-18.5	0	0	0	122.6
546	S	28.4	Very low	25	Very low	111 Å²	111	129.8 Å²	129.8	78%	0.776	74%	0.742	S	S	*	*			trans	-62.9	177.6	144.2	-48.1	0	0	0	0	111.4
547	P	31.8	Very low	24.7	Very low	131 Å²	131	129.2 Å²	129.2	85%	0.851	74%	0.744	S	S	*	*				-136.2	153.1	103.5	37.6	-29.4	0	0	0	114.5
548	S	27.7	Very low	24.5	Very low	94 Å²	94	127 Å²	127	66%	0.657	74%	0.742	S	S	*	*			trans	-86.9	-176.4	162.3	51	0	0	0	0	111.2
549	D	23	Very low	24.3	Very low	149 Å²	149	125 Å²	125	80%	0.797	74%	0.744	S	S	*	*			trans	128.2	141.5	145.1	-64.5	1	0	0	0	112.6
550	D	20.9	Very low	24.2	Very low	142 Å²	142	125.1 Å²	125.1	76%	0.759	75%	0.749	S	S	*	*			cis	-166.6	-158.4	-22.5	-175.6	21	0	0	0	106.9
551	V	23.9	Very low	24.2	Very low	109 Å²	109	129.5 Å²	129.5	66%	0.661	75%	0.754	S	S	*	*			trans	76.9	74.3	155	-60.3	0	0	0	0	120.2
552	S	22.8	Very low	24	Very low	94 Å²	94	134.1 Å²	134.1	66%	0.657	75%	0.753	S	S	*	*				68.2	130.7	110.7	73.1	0	0	0	0	123.4
553	L	23.6	Very low	23.9	Very low	168 Å²	168	129.5 Å²	129.5	88%	0.88	74%	0.738	S	S	*	*			trans	54.3	120.4	133.4	-61.7	168.8	0	0	0	120.7
554	A	22.1	Very low	23.8	Very low	94 Å²	94	130.4 Å²	130.4	78%	0.777	75%	0.747	S	S	*	*				173.4	120.1	100.1	0	0	0	0	0	115.5
555	D	21.2	Very low	23.5	Very low	150 Å²	150	130.3 Å²	130.3	80%	0.802	75%	0.753	S	S	*	*				52.3	138.3	127.4	-154	16.7	0	0	0	124.5
556	S	22.1	Very low	23.6	Very low	97 Å²	97	127.9 Å²	127.9	68%	0.678	75%	0.746	S	S	*	*			trans	68.3	160.7	154.9	86.2	0	0	0	0	118.8
557	S	22.3	Very low	23.5	Very low	107 Å²	107	130.8 Å²	130.8	75%	0.748	75%	0.748	S	S	*	*			cis	-159.8	154.5	-25.8	45	0	0	0	0	113.4
558	V	22	Very low	23.2	Very low	130 Å²	130	132.2 Å²	132.2	79%	0.788	74%	0.743	S	S	*	*			trans	-16.6	135	160.2	-152.4	0	0	0	0	118.3
559	S	21.4	Very low	23	Very low	101 Å²	101	134.1 Å²	134.1	71%	0.706	74%	0.742	S	S	*	*				152.3	108.8	107.3	-162.5	0	0	0	0	118.3
560	N	23.9	Very low	23.1	Very low	144 Å²	144	134.4 Å²	134.4	77%	0.77	74%	0.738	S	S	*	*			trans	23.1	127.8	133.8	-56.2	-13.7	0	0	0	122.5
561	R	23.5	Very low	23.3	Very low	241 Å²	241	132.8 Å²	132.8	91%	0.909	74%	0.737	S	S	*	*			trans	-167.2	147.3	146.7	-104.6	163	-171.9	-180	3.5	108.6
562	F	20.1	Very low	23.4	Very low	173 Å²	173	135.6 Å²	135.6	76%	0.759	74%	0.743	S	S	*	*			cis	-152.9	118.3	-0.6	-169.4	-123	0	0	0	112
563	T	24.4	Very low	23.4	Very low	86 Å²	86	138.4 Å²	138.4	53%	0.528	75%	0.751	S	S	.	*			trans	36.2	133.6	149.2	61.8	0	0	0	0	123.4
564	V	22.7	Very low	23.3	Very low	140 Å²	140	134.9 Å²	134.9	85%	0.848	74%	0.74	S	S	*	*			trans	-97.2	150.4	140.6	173.5	0	0	0	0	108.8
565	L	22.5	Very low	23.5	Very low	142 Å²	142	137.4 Å²	137.4	74%	0.743	75%	0.746	S	S	*	*			trans	-116.7	147.4	170.1	-60	173.4	0	0	0	107.8
566	S	25.9	Very low	23.6	Very low	82 Å²	82	135 Å²	135	57%	0.573	74%	0.741	S	S	*	*			cis	-146.8	154.1	21.6	-100.9	0	0	0	0	112.4
567	E	25.4	Very low	23.6	Very low	173 Å²	173	135.5 Å²	135.5	81%	0.808	74%	0.743	S	S	*	*			trans	39.8	133.6	132.4	-60.7	146.5	157	0	0	119.5
568	E	25.4	Very low	23.7	Very low	160 Å²	160	137.3 Å²	137.3	75%	0.748	74%	0.744	S	S	*	*			cis	-165.6	174.3	17.3	-129.8	-162.1	163	0	0	109.3
569	Q	24.9	Very low	23.9	Very low	135 Å²	135	138.6 Å²	138.6	63%	0.631	74%	0.742	S	S	*	*			cis	-150.6	-95.5	4.8	-166.8	-172.9	76.8	0	0	113.9
570	H	23.9	Very low	24	Very low	155 Å²	155	139.8 Å²	139.8	72%	0.718	75%	0.745	S	S	*	*			trans	-121.4	167	-168.9	-69.6	-49.5	0	0	0	112
571	S	25.7	Very low	24.1	Very low	107 Å²	107	138.5 Å²	138.5	75%	0.748	75%	0.747	S	S	*	*			cis	-146.8	162.8	17.5	62.7	0	0	0	0	115.3
572	H	25.4	Very low	24.2	Very low	169 Å²	169	134.2 Å²	134.2	78%	0.782	74%	0.743	S	S	*	*			trans	-41.2	146.7	164.7	-67.8	-102.5	0	0	0	115.5
573	D	22.7	Very low	24.6	Very low	153 Å²	153	132.3 Å²	132.3	82%	0.818	75%	0.745	S	S	*	*				-161	169.4	83.8	-155.4	3.4	0	0	0	112.8
574	S	22.8	Very low	24.7	Very low	94 Å²	94	135.7 Å²	135.7	66%	0.657	76%	0.76	S	S	*	*			trans	-139.4	134.6	-169.1	57.5	0	0	0	0	113.6
575	T	25	Very low	25.1	Very low	147 Å²	147	135.1 Å²	135.1	90%	0.902	75%	0.752	S	S	*	*			trans	-156.4	162.8	162.2	-71.7	0	0	0	0	109.7
576	S	24.1	Very low	25.6	Very low	100 Å²	100	138.5 Å²	138.5	70%	0.699	76%	0.764	S	S	*	*			trans	-92.9	-178.6	-158.8	59.2	0	0	0	0	117.5
577	C	21.1	Very low	26.1	Very low	106 Å²	106	137 Å²	137	72%	0.716	76%	0.761	S	S	*	*			trans	-27.5	162.9	166.2	62.3	0	0	0	0	118.5
578	N	25.1	Very low	26.4	Very low	145 Å²	145	133.9 Å²	133.9	78%	0.775	75%	0.746	S	S	*	*			cis	-155.9	-173.8	37.2	-140.1	6.7	0	0	0	115.4
579	E	25.6	Very low	27	Very low	158 Å²	158	132.2 Å²	132.2	74%	0.738	74%	0.742	S	S	*	*			trans	-63.4	151.4	-167.4	-51.3	175	132.2	0	0	118.6
580	T	24.6	Very low	27.6	Very low	125 Å²	125	130.7 Å²	130.7	77%	0.767	74%	0.738	S	S	*	*				164.7	149.1	103.8	39.3	0	0	0	0	116
581	S	25.3	Very low	28.4	Very low	118 Å²	118	126.8 Å²	126.8	83%	0.825	73%	0.725	S	S	*	*			trans	80.4	150	156.5	78.3	0	0	0	0	120.7
582	N	26.7	Very low	29.1	Very low	151 Å²	151	127.7 Å²	127.7	81%	0.807	72%	0.717	S	S	*	*			trans	-100.3	146.7	-164.2	-58.7	-55.1	0	0	0	114.4
583	T	26.9	Very low	29.9	Very low	133 Å²	133	122.7 Å²	122.7	82%	0.816	70%	0.696	S	S	*	*				174.1	169.7	117.4	28.7	0	0	0	0	112.4
584	D	27.3	Very low	30.9	Very low	157 Å²	157	115.6 Å²	115.6	84%	0.84	66%	0.659	S	S	*	*			trans	69.5	72.5	172.6	-65.6	1.6	0	0	0	118.8
585	L	30.3	Very low	31.6	Very low	128 Å²	128	116.7 Å²	116.7	67%	0.67	66%	0.658	S	S	*	*			trans	-121.8	67.9	168.5	-69.6	175.8	0	0	0	113.5	G587	L585-G587 PolarHBondContact O-N 3.39Å
586	E	34.5	Very low	32.2	Very low	213 Å²	213	116.2 Å²	116.2	100%	0.995	65%	0.645	S	S	*	*			trans	-88	34.4	168.7	-66	-167.2	139.1	0	0	112.7
587	G	34.9	Very low	33	Very low	50 Å²	50	115.8 Å²	115.8	52%	0.515	64%	0.635	S	S	.	*	S	Bend	trans	-128.8	-22.3	-170.1	0	0	0	0	0	117.6	L585	L585-G587 PolarHBondContact O-N 3.39Å
588	E	32.3	Very low	33.6	Very low	107 Å²	107	118.2 Å²	118.2	50%	0.5	64%	0.635	S	S	.	*	S	Bend	trans	-101.7	-10.9	-162.9	-60.4	-177.8	152.6	0	0	114.2	D590 T591	E588-D590 VanDerWaalsContact C-N 3.3Å; E588-D590 PolarHBondContact O-N 2.93Å; E588-T591 PolarHBondContact O-OG1 2.9Å; E588-T591 VanDerWaalsContact O-OG1 3.06Å
589	L	37.9	Very low	34.2	Very low	126 Å²	126	119.7 Å²	119.7	66%	0.66	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-5.5	177.2	-71.6	171.2	0	0	0	114.4	R772	L589-R772 PolarHBondContact O-NH2 2.99Å
590	D	37.5	Very low	34.4	Very low	103 Å²	103	116.8 Å²	116.8	55%	0.551	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	-24	172.5	-81.8	-20.4	0	0	0	112.4	E588 R772	E588-D590 VanDerWaalsContact C-N 3.3Å; E588-D590 PolarHBondContact O-N 2.93Å; D590-R772 IonicContact OD1-CZ 3.68Å; D590-R772 IonicContact OD1-NE 3.88Å; D590-R772 IonicContact OD1-NH2 2.68Å; D590-R772 PolarHBondContact OD1-NH2 3.43Å
591	T	41.6	Very low	34.7	Very low	72 Å²	72	117.1 Å²	117.1	44%	0.442	63%	0.632	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81	-48.1	178.4	44.3	0	0	0	0	112.4	E588 L593 A594 D595	E588-T591 PolarHBondContact O-OG1 2.9Å; E588-T591 VanDerWaalsContact O-OG1 3.06Å; T591-L593 PolarHBondContact O-N 3.16Å; T591-L593 VanDerWaalsContact O-N 3.14Å; T591-A594 WeakPolarHBondContact O-CB 3.41Å; T591-A594 PolarHBondContact O-N 2.91Å; T591-D595 PolarHBondContact O-N 2.87Å
592	Q	38.8	Very low	35.2	Very low	126 Å²	126	117.8 Å²	117.8	59%	0.589	63%	0.626	S	S	*	*	H	α-helix	trans	-60.2	-27.6	-180	-68.1	-177.9	-11	0	0	113.3	Q596	Q592-Q596 WeakPolarHBondContact O-CG 3.42Å
593	L	43.3	Very low	35.6	Very low	64 Å²	64	117.9 Å²	117.9	34%	0.335	63%	0.627	S	S	.	*	H	α-helix	trans	-81.1	-16.2	175.1	-94.5	162.9	0	0	0	114.2	T591	T591-L593 PolarHBondContact O-N 3.16Å; T591-L593 VanDerWaalsContact O-N 3.14Å
594	A	42.5	Very low	36	Very low	5 Å²	5	118.9 Å²	118.9	4%	0.041	63%	0.627	C	S	.	*	H	α-helix	trans	-80.5	-41.2	176.6	0	0	0	0	0	111.5	T591 L597 Q719	T591-A594 WeakPolarHBondContact O-CB 3.41Å; T591-A594 PolarHBondContact O-N 2.91Å; A594-L597 PolarHBondContact O-N 2.6Å; A594-Q719 PolarHBondContact O-NE2 3.06Å
595	D	37.8	Very low	36.2	Very low	117 Å²	117	115.1 Å²	115.1	63%	0.626	62%	0.617	S	S	*	*	H	α-helix	trans	-71.9	-38	-178.8	-63.3	-29.3	0	0	0	111.7	T591 L597 Q598	T591-D595 PolarHBondContact O-N 2.87Å; D595-L597 PolarHBondContact O-N 3.17Å; D595-Q598 PolarHBondContact O-N 3.01Å; D595-Q598 VanDerWaalsContact O-N 3.09Å
596	Q	38.5	Very low	36.5	Very low	137 Å²	137	116.1 Å²	116.1	64%	0.64	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-21.8	175.3	-74.7	-177.7	-0.5	0	0	113.9	Q592 V600	Q592-Q596 WeakPolarHBondContact O-CG 3.42Å; Q596-V600 WeakPolarHBondContact O-CG2 3.41Å
597	L	41	Very low	36.5	Very low	91 Å²	91	113.3 Å²	113.3	48%	0.476	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.8	-8	177	-81.9	168.7	0	0	0	114.1	A594 D595 I724	A594-L597 PolarHBondContact O-N 2.6Å; D595-L597 PolarHBondContact O-N 3.17Å; L597-I724 HydrophobicContact CD1-CD1 3.47Å; L597-I724 VanDerWaalsContact CD1-CD1 3.47Å; L597-I724 HydrophobicContact CD1-CG1 4.24Å
598	Q	33.3	Very low	36.2	Very low	157 Å²	157	119.6 Å²	119.6	73%	0.734	62%	0.623	S	S	*	*	S	Bend	trans	-105.1	1.7	-175.8	-159.6	163.3	-13.1	0	0	114.2	D595	D595-Q598 PolarHBondContact O-N 3.01Å; D595-Q598 VanDerWaalsContact O-N 3.09Å
599	Q	37.2	Very low	36.1	Very low	175 Å²	175	121.8 Å²	121.8	82%	0.818	64%	0.638	S	S	*	*	S	Bend	trans	-118.4	12	174.6	-71.7	-168.3	-23.3	0	0	114.7	T601	Q599-T601 PolarHBondContact O-N 2.89Å; Q599-T601 VanDerWaalsContact O-N 3.1Å
600	V	30.6	Very low	35.6	Very low	97 Å²	97	124.5 Å²	124.5	59%	0.588	65%	0.652	S	S	*	*			trans	-88.9	70	179.8	-174.5	0	0	0	0	111.3	Q596 L602	Q596-V600 WeakPolarHBondContact O-CG2 3.41Å; V600-L602 HydrophobicContact CG1-CD1 4.41Å; V600-L602 HydrophobicContact CG1-CD2 3.92Å; V600-L602 HydrophobicContact CG1-CG 3.78Å
601	T	29.6	Very low	35.2	Very low	132 Å²	132	126.9 Å²	126.9	81%	0.81	67%	0.665	S	S	*	*			trans	-84.5	97.7	157.7	44.1	0	0	0	0	108.6	Q599 N603	Q599-T601 PolarHBondContact O-N 2.89Å; Q599-T601 VanDerWaalsContact O-N 3.1Å; T601-N603 PolarHBondContact O-N 2.85Å
602	L	35.7	Very low	34.7	Very low	132 Å²	132	128.3 Å²	128.3	69%	0.691	68%	0.678	S	S	*	*			trans	-73.2	87.2	179.2	-69.7	174.8	0	0	0	111.2	V600	V600-L602 HydrophobicContact CG1-CD1 4.41Å; V600-L602 HydrophobicContact CG1-CD2 3.92Å; V600-L602 HydrophobicContact CG1-CG 3.78Å
603	N	36	Very low	34.1	Very low	154 Å²	154	131.4 Å²	131.4	82%	0.824	70%	0.695	S	S	*	*			trans	-149.9	50.1	164.6	-108.7	14.6	0	0	0	109.6	T601	T601-N603 PolarHBondContact O-N 2.85Å
604	D	35	Very low	33.3	Very low	153 Å²	153	135.9 Å²	135.9	82%	0.818	72%	0.719	S	S	*	*			trans	-168.1	93.6	162.2	-102.8	-29.6	0	0	0	109.8
605	A	32.2	Very low	32.7	Very low	78 Å²	78	141.6 Å²	141.6	65%	0.645	76%	0.756	S	S	*	*			trans	-156.9	18.1	179.6	0	0	0	0	0	114.2
606	F	35.9	Very low	32.1	Very low	150 Å²	150	140.2 Å²	140.2	66%	0.658	76%	0.761	S	S	*	*	S	Bend	trans	-146.5	40.5	-179.2	-84.8	-59.4	0	0	0	114.2
607	I	34.2	Very low	31.8	Very low	154 Å²	154	143.5 Å²	143.5	79%	0.79	78%	0.776	S	S	*	*			trans	-129.9	109.4	159.5	-54.4	-179.7	0	0	0	108.4
608	E	30.2	Very low	31.1	Very low	182 Å²	182	148.3 Å²	148.3	85%	0.85	80%	0.796	S	S	*	*			trans	-132.1	122.6	156.6	-79.9	-175.5	158.3	0	0	107
609	D	28.5	Very low	30.8	Very low	152 Å²	152	146 Å²	146	81%	0.813	80%	0.797	S	S	*	*			trans	51.4	91.9	155.3	-53	-9.9	0	0	0	119.8
610	L	28.5	Very low	30.4	Very low	183 Å²	183	146.6 Å²	146.6	96%	0.958	80%	0.8	S	S	*	*			trans	-134.6	111.1	146.7	-106.4	166	0	0	0	108.2
611	D	29.5	Very low	30.4	Very low	153 Å²	153	149.6 Å²	149.6	82%	0.818	81%	0.813	S	S	*	*			trans	-84.9	151.8	-156.2	-129.3	-29.9	0	0	0	115.5
612	S	30.6	Very low	30.6	Very low	102 Å²	102	151.6 Å²	151.6	71%	0.713	81%	0.813	S	S	*	*			trans	60.1	105.1	161.1	65.5	0	0	0	0	120.8
613	M	26.8	Very low	30.9	Very low	191 Å²	191	150.5 Å²	150.5	94%	0.941	81%	0.812	S	S	*	*				-166.7	155.4	125.8	-105.8	170.2	65.6	0	0	111
614	D	26	Very low	31.2	Very low	158 Å²	158	150.8 Å²	150.8	85%	0.845	81%	0.808	S	S	*	*			trans	-68.5	153.6	-171.7	-92.3	-55.9	0	0	0	114.6
615	P	29.4	Very low	32.1	Very low	126 Å²	126	147.8 Å²	147.8	82%	0.818	79%	0.786	S	S	*	*			trans	-78.3	134.4	-169.5	30.9	-35.6	0	0	0	114.1
616	A	25.9	Very low	33.8	Very low	88 Å²	88	147.1 Å²	147.1	73%	0.727	77%	0.774	S	S	*	*			trans	-119.3	145	158.5	0	0	0	0	0	108.6	E618	A616-E618 PolarHBondContact O-N 3.45Å
617	E	31.8	Very low	35.2	Very low	205 Å²	205	143.9 Å²	143.9	96%	0.958	76%	0.763	S	S	*	*			trans	-49.9	100.6	-166.1	-60	177.4	160.7	0	0	114.5
618	E	26.2	Very low	36.7	Very low	193 Å²	193	139.2 Å²	139.2	90%	0.902	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-78.7	128.5	166	-69.6	-165.7	135.7	0	0	110.1	A616	A616-E618 PolarHBondContact O-N 3.45Å
619	S	27.6	Very low	38.1	Very low	108 Å²	108	138.3 Å²	138.3	76%	0.755	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-78.5	136.9	177.2	54.5	0	0	0	0	111.5	D621	S619-D621 PolarHBondContact O-N 3.15Å
620	E	29	Very low	39.6	Very low	187 Å²	187	134 Å²	134	87%	0.874	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-49.1	126.5	171.1	-60	176.7	164.9	0	0	111.5	E622	E620-E622 PolarHBondContact O-N 3.25Å
621	D	29	Very low	41.4	Very low	160 Å²	160	129.3 Å²	129.3	86%	0.856	69%	0.691	S	S	*	*			trans	-64.1	97.2	175.2	-85.2	-51.5	0	0	0	110.7	S619 V623	S619-D621 PolarHBondContact O-N 3.15Å; D621-V623 PolarHBondContact O-N 2.68Å
622	E	35.3	Very low	43.2	Very low	174 Å²	174	124.4 Å²	124.4	81%	0.813	67%	0.667	S	S	*	*			trans	-62.2	104.7	169.5	-83	-155.6	132.6	0	0	109.6	E620 E624	E620-E622 PolarHBondContact O-N 3.25Å; E622-E624 PolarHBondContact O-N 3.45Å
623	V	41.2	Very low	45	Very low	110 Å²	110	127.3 Å²	127.3	67%	0.667	67%	0.669	S	S	*	*			trans	-55.2	109.3	172.9	178.8	0	0	0	0	109.5	D621 Y625	D621-V623 PolarHBondContact O-N 2.68Å; V623-Y625 WeakPolarHBondContact O-CD1 3.34Å; V623-Y625 PolarHBondContact O-N 3.23Å
624	E	42.4	Very low	47.4	Very low	160 Å²	160	122.9 Å²	122.9	75%	0.748	65%	0.649	S	S	*	*			trans	-70.4	82.9	-166.9	-167.2	178.5	-179.2	0	0	112.7	E622 T626	E622-E624 PolarHBondContact O-N 3.45Å; E624-T626 PolarHBondContact O-N 3.08Å
625	Y	54.4	Low	49.8	Very low	89 Å²	89	115.7 Å²	115.7	35%	0.349	61%	0.612	S	S	.	*			trans	-74.8	108.5	175.7	60.6	-84.3	0	0	0	110.8	V623 I627 V674	V623-Y625 WeakPolarHBondContact O-CD1 3.34Å; V623-Y625 PolarHBondContact O-N 3.23Å; Y625-I627 HydrophobicContact CD2-CG1 4.06Å; Y625-I627 HydrophobicContact CE2-CD1 4.1Å; Y625-I627 HydrophobicContact CE2-CG1 4.03Å; Y625-I627 PolarHBondContact O-N 3.47Å; Y625-V674 HydrophobicContact CE2-CG2 4.42Å
626	T	67.1	Low	52.5	Low	65 Å²	65	111.4 Å²	111.4	40%	0.399	58%	0.58	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-70.3	115.9	177.8	60.1	0	0	0	0	110.4	S399 V400 E624 I628	S399-T626 WeakPolarHBondContact CA-O 3.2Å; V400-T626 PolarHBondContact N-O 2.83Å; V400-T626 PolarHBondContact O-N 3.04Å; V400-T626 VanDerWaalsContact O-N 3.15Å; V400-T626 PolarHBondContact O-OG1 3.15Å; E624-T626 PolarHBondContact O-N 3.08Å; T626-I628 PolarHBondContact O-N 3.37Å; T626-I628 VanDerWaalsContact O-N 3.17Å
627	I	66	Low	55.3	Low	82 Å²	82	110.8 Å²	110.8	42%	0.421	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.9	94.9	170.4	-57.3	179	0	0	0	107.7	T397 Y625	T397-I627 HydrophobicContact CG2-CG2 3.75Å; Y625-I627 HydrophobicContact CD2-CG1 4.06Å; Y625-I627 HydrophobicContact CE2-CD1 4.1Å; Y625-I627 HydrophobicContact CE2-CG1 4.03Å; Y625-I627 PolarHBondContact O-N 3.47Å
628	I	66.3	Low	58.1	Low	55 Å²	55	102.3 Å²	102.3	28%	0.282	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	121.6	179.1	-46.1	-169.7	0	0	0	109	V398 V400 T626 Q630	V398-I628 PolarHBondContact O-N 3.42Å; V400-I628 HydrophobicContact CB-CD1 3.78Å; V400-I628 HydrophobicContact CB-CG1 4.2Å; V400-I628 HydrophobicContact CG1-CD1 4.32Å; V400-I628 HydrophobicContact CG2-CD1 3.66Å; V400-I628 HydrophobicContact CG2-CG1 4.08Å; T626-I628 PolarHBondContact O-N 3.37Å; T626-I628 VanDerWaalsContact O-N 3.17Å; I628-Q630 HydrophobicContact CG2-CB 3.9Å; I628-Q630 HydrophobicContact CG2-CG 3.61Å; I628-Q630 PolarHBondContact O-N 3.45Å
629	N	58.1	Low	61	Low	164 Å²	164	94.7 Å²	94.7	88%	0.877	49%	0.492	S	S	*	.			trans	-74.2	51.1	166.8	-66.3	-46.3	0	0	0	110.9
630	Q	59.7	Low	63.8	Low	61 Å²	61	91 Å²	91	29%	0.285	47%	0.467	S	S	.	.			trans	-82.5	155.8	169.4	-96.8	177.7	37.4	0	0	110	I628 P632	I628-Q630 HydrophobicContact CG2-CB 3.9Å; I628-Q630 HydrophobicContact CG2-CG 3.61Å; I628-Q630 PolarHBondContact O-N 3.45Å; Q630-P632 WeakPolarHBondContact O-CD 3.1Å
631	D	67	Low	66.5	Low	85 Å²	85	88 Å²	88	46%	0.455	46%	0.461	S	S	.	.			trans	-60.8	126.5	171.3	-165.5	-43.9	0	0	0	109.8	E633 L634 A635	D631-E633 PolarHBondContact O-N 2.69Å; D631-E633 VanDerWaalsContact O-N 3.12Å; D631-E633 WeakPolarHBondContact OD1-CB 3.36Å; D631-E633 PolarHBondContact OD1-N 2.85Å; D631-L634 HydrophobicContact CB-CB 4.26Å; D631-L634 HydrophobicContact CB-CD1 3.95Å; D631-L634 HydrophobicContact CB-CG 3.91Å; D631-L634 PolarHBondContact O-N 3.17Å; D631-A635 PolarHBondContact O-N 2.93Å
632	P	67.6	Low	69.2	Low	49 Å²	49	83.2 Å²	83.2	32%	0.318	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-27.8	174.5	-29.7	37.8	0	0	0	114.7	M391 K396 Q630	M391-P632 HydrophobicContact SD-CB 3.83Å; K396-P632 HydrophobicContact CB-CB 4.38Å; K396-P632 HydrophobicContact CB-CG 3.85Å; Q630-P632 WeakPolarHBondContact O-CD 3.1Å
633	E	68.6	Low	71.4	Confident	164 Å²	164	80.7 Å²	80.7	77%	0.766	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-23.8	177.7	-60.5	-169.3	176.8	0	0	112.8	D631	D631-E633 PolarHBondContact O-N 2.69Å; D631-E633 VanDerWaalsContact O-N 3.12Å; D631-E633 WeakPolarHBondContact OD1-CB 3.36Å; D631-E633 PolarHBondContact OD1-N 2.85Å
634	L	76.6	Confident	73.3	Confident	97 Å²	97	79.8 Å²	79.8	51%	0.508	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-14.7	179.5	-59.2	179.6	0	0	0	113.5	D631 F636 N637	D631-L634 HydrophobicContact CB-CB 4.26Å; D631-L634 HydrophobicContact CB-CD1 3.95Å; D631-L634 HydrophobicContact CB-CG 3.91Å; D631-L634 PolarHBondContact O-N 3.17Å; L634-F636 PolarHBondContact O-N 2.76Å; L634-F636 VanDerWaalsContact O-N 3.11Å; L634-N637 VanDerWaalsContact CD2-ND2 3.33Å; L634-N637 WeakPolarHBondContact CD2-ND2 3.44Å; L634-N637 PolarHBondContact O-N 3.36Å
635	A	76.4	Confident	75.1	Confident	8 Å²	8	73.8 Å²	73.8	7%	0.066	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-23.9	-170.5	0	0	0	0	0	115.1	T389 V398 D631	T389-A635 HydrophobicContact CG2-CB 4.21Å; T389-A635 WeakPolarHBondContact CG2-O 3.37Å; V398-A635 HydrophobicContact CG1-CB 4.12Å; V398-A635 HydrophobicContact CG2-CB 3.97Å; D631-A635 PolarHBondContact O-N 2.93Å
636	F	85.7	Confident	76.3	Confident	36 Å²	36	77.1 Å²	77.1	16%	0.158	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	14.3	-176.3	-58.9	-70.5	0	0	0	113.2	T389 M391 L634 V662 L698 Q700	T389-F636 HydrophobicContact CG2-CD1 4.37Å; T389-F636 HydrophobicContact CG2-CE1 3.89Å; T389-F636 HydrophobicContact CG2-CZ 4.28Å; M391-F636 HydrophobicContact CB-CE2 3.92Å; M391-F636 HydrophobicContact CB-CZ 3.74Å; M391-F636 HydrophobicContact CE-CE2 3.93Å; M391-F636 HydrophobicContact SD-CE2 4.23Å; L634-F636 PolarHBondContact O-N 2.76Å; L634-F636 VanDerWaalsContact O-N 3.11Å; F636-V662 HydrophobicContact CD1-CG2 4.49Å; F636-L698 HydrophobicContact CE1-CB 4.42Å; F636-L698 HydrophobicContact CE2-CB 4.17Å; F636-L698 HydrophobicContact CE2-CD1 4.33Å; F636-L698 HydrophobicContact CZ-CB 3.72Å; F636-Q700 HydrophobicContact CD1-CB 3.7Å; F636-Q700 HydrophobicContact CE1-CB 3.98Å; F636-Q700 PolarHBondContact O-OE1 3.46Å
637	N	86.1	Confident	76.5	Confident	75 Å²	75	83.8 Å²	83.8	40%	0.401	44%	0.443	S	S	.	.			trans	-75.2	136.4	-179.5	-77.9	-9	0	0	0	112.5	L634 A745	L634-N637 VanDerWaalsContact CD2-ND2 3.33Å; L634-N637 WeakPolarHBondContact CD2-ND2 3.44Å; L634-N637 PolarHBondContact O-N 3.36Å; N637-A745 HydrophobicContact CB-CB 3.94Å; N637-A745 WeakPolarHBondContact O-CB 3.4Å; N637-A745 PolarHBondContact O-N 2.62Å
638	T	89.3	Confident	76.8	Confident	26 Å²	26	86.7 Å²	86.7	16%	0.16	46%	0.455	C	S	.	.	B	Isolated β-bridge	trans	-98.7	161.7	173.9	47.2	0	0	0	0	112.3	S640 R642 L702 C743	T638-S640 VanDerWaalsContact C-N 3.27Å; T638-S640 PolarHBondContact O-N 2.78Å; T638-S640 PolarHBondContact OG1-O 2.9Å; T638-R642 HydrophobicContact CG2-CG 4.09Å; T638-R642 WeakPolarHBondContact OG1-CG 3.37Å; T638-L702 HydrophobicContact CG2-CD1 3.84Å; T638-L702 HydrophobicContact CG2-CD2 3.52Å; T638-L702 HydrophobicContact CG2-CG 4.36Å; T638-C743 CarbonylContact C-O 3.58Å; T638-C743 WeakPolarHBondContact CA-O 3.48Å; T638-C743 VanDerWaalsContact CB-O 3.29Å; T638-C743 WeakPolarHBondContact CB-O 3.48Å; T638-C743 WeakPolarHBondContact CG2-O 3.31Å
639	L	86.7	Confident	77.5	Confident	33 Å²	33	87.8 Å²	87.8	17%	0.173	46%	0.459	C	S	.	.	S	Bend	trans	-64.7	-31.1	178.9	-172.6	69.6	0	0	0	112.7	A740 C743 I750 D754 I757	L639-A740 HydrophobicContact CB-CB 4.47Å; L639-A740 HydrophobicContact CD2-CB 4.11Å; L639-A740 HydrophobicContact CG-CB 4.48Å; L639-C743 HydrophobicContact CB-CB 4.19Å; L639-C743 PolarHBondContact N-O 3.04Å; L639-I750 HydrophobicContact CD2-CD1 3.76Å; L639-I750 HydrophobicContact CD2-CG2 4.19Å; L639-D754 WeakPolarHBondContact CD1-O 3.45Å; L639-I757 HydrophobicContact CD2-CD1 3.76Å; L639-I757 HydrophobicContact CD2-CG1 3.96Å
640	S	87.8	Confident	79	Confident	32 Å²	32	80.9 Å²	80.9	22%	0.224	42%	0.423	C	S	.	.	S	Bend	trans	-133.6	165.8	176.1	-163.9	0	0	0	0	112.1	T638 R642 A740 T755	T638-S640 VanDerWaalsContact C-N 3.27Å; T638-S640 PolarHBondContact O-N 2.78Å; T638-S640 PolarHBondContact OG1-O 2.9Å; S640-R642 PolarHBondContact O-N 2.82Å; S640-A740 PolarHBondContact N-O 3.4Å; S640-T755 VanDerWaalsContact CB-O 3.29Å; S640-T755 WeakPolarHBondContact CB-O 3.29Å; S640-T755 PolarHBondContact OG-O 3.11Å
641	T	85.2	Confident	80.6	Confident	122 Å²	122	78.1 Å²	78.1	75%	0.748	41%	0.41	S	S	*	.			trans	-71.7	127	-174.1	-61.6	0	0	0	0	111.2	T643	T641-T643 PolarHBondContact O-N 2.91Å
642	R	85.8	Confident	81.9	Confident	60 Å²	60	74 Å²	74	23%	0.226	39%	0.389	C	S	.	.			trans	-84.5	103.9	-176.4	-45.7	-173.9	75.8	-153.3	-6.5	111	T638 S640 F657 T660 Q700 P741	T638-R642 HydrophobicContact CG2-CG 4.09Å; T638-R642 WeakPolarHBondContact OG1-CG 3.37Å; S640-R642 PolarHBondContact O-N 2.82Å; R642-F657 HydrophobicContact CB-CE2 4.19Å; R642-F657 PolarHBondContact NH2-O 2.83Å; R642-T660 VanDerWaalsContact CZ-O 3.29Å; R642-T660 PolarHBondContact NH1-O 2.93Å; R642-T660 PolarHBondContact NH2-O 3.29Å; R642-T660 PolarHBondContact NH2-OG1 2.72Å; R642-Q700 VanDerWaalsContact NH1-NE2 3.15Å; R642-P741 PolarHBondContact NE-O 3.09Å; R642-P741 VanDerWaalsContact NE-O 3.14Å
643	T	82	Confident	83.2	Confident	121 Å²	121	74.8 Å²	74.8	74%	0.742	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-73.3	129.2	167.4	-55.8	0	0	0	0	109.7	T641 F657	T641-T643 PolarHBondContact O-N 2.91Å; T643-F657 WeakPolarHBondContact O-CD2 3.39Å; T643-F657 WeakPolarHBondContact O-CE2 2.91Å
644	S	79.9	Confident	84.3	Confident	91 Å²	91	67.7 Å²	67.7	64%	0.636	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-74.7	125	175.3	-166.5	0	0	0	0	109.8
645	P	80.8	Confident	85.2	Confident	34 Å²	34	63.2 Å²	63.2	22%	0.221	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-69	159.3	-177.6	29.5	-36.6	0	0	0	112	E649 F657	P645-E649 WeakPolarHBondContact CB-OE2 3.42Å; P645-F657 HydrophobicContact CG-CB 4.17Å; P645-F657 HydrophobicContact CG-CD1 4.03Å; P645-F657 HydrophobicContact CG-CG 4.03Å
646	E	80.5	Confident	86	Confident	160 Å²	160	62.9 Å²	62.9	75%	0.748	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-67.7	143.3	177	-69.6	-166.2	179.7	0	0	111.3	Q648 E649	E646-Q648 PolarHBondContact O-N 2.76Å; E646-E649 HydrophobicContact CB-CB 4.19Å; E646-E649 PolarHBondContact N-OE2 2.86Å; E646-E649 WeakPolarHBondContact O-CB 3.41Å; E646-E649 PolarHBondContact O-N 3.3Å
647	K	69.8	Low	86.4	Confident	204 Å²	204	62.4 Å²	62.4	89%	0.887	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-12.5	-172.5	-67.7	-179.2	179.5	174.8	0	115.5
648	Q	72.6	Confident	86.7	Confident	143 Å²	143	62.3 Å²	62.3	67%	0.668	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.6	1.2	176.6	-60.1	-176.1	44.8	0	0	112.6	E646 R729	E646-Q648 PolarHBondContact O-N 2.76Å; Q648-R729 PolarHBondContact O-NH2 3.48Å
649	E	82.4	Confident	86.9	Confident	79 Å²	79	64 Å²	64	37%	0.369	33%	0.33	S	S	.	.			trans	-64.7	149.1	177.6	-156	-174.7	150.1	0	0	110.4	P645 E646 S651	P645-E649 WeakPolarHBondContact CB-OE2 3.42Å; E646-E649 HydrophobicContact CB-CB 4.19Å; E646-E649 PolarHBondContact N-OE2 2.86Å; E646-E649 WeakPolarHBondContact O-CB 3.41Å; E646-E649 PolarHBondContact O-N 3.3Å; E649-S651 WeakPolarHBondContact OE1-CB 3.45Å; E649-S651 PolarHBondContact OE1-OG 2.8Å
650	C	88.4	Confident	87.2	Confident	18 Å²	18	62.4 Å²	62.4	12%	0.122	32%	0.322	C	S	.	.			trans	-141.3	75.8	172.7	-165.8	0	0	0	0	107.9	R729 H730 V731 Q732	C650-R729 VanDerWaalsContact SG-CD 3.57Å; C650-H730 PolarHBondContact SG-O 3.28Å; C650-V731 CarbonylContact O-C 3.56Å; C650-V731 WeakPolarHBondContact O-CA 3.33Å; C650-Q732 PolarHBondContact O-N 2.91Å
651	S	93.7	Very high	87.5	Confident	3 Å²	3	65.7 Å²	65.7	2%	0.021	33%	0.334	C	S	.	.	B	Isolated β-bridge	trans	-121	160.8	-179.5	66.6	0	0	0	0	111.5	E649 Q653 S654 C655 Q732	E649-S651 WeakPolarHBondContact OE1-CB 3.45Å; E649-S651 PolarHBondContact OE1-OG 2.8Å; S651-Q653 PolarHBondContact O-N 3.03Å; S651-S654 PolarHBondContact N-OG 3.12Å; S651-S654 PolarHBondContact O-N 3.39Å; S651-S654 VanDerWaalsContact O-N 3.11Å; S651-S654 PolarHBondContact O-OG 3.19Å; S651-S654 WeakPolarHBondContact OG-CB 3.35Å; S651-S654 PolarHBondContact OG-N 2.88Å; S651-S654 PolarHBondContact OG-OG 2.81Å; S651-C655 PolarHBondContact O-N 2.99Å; S651-C655 PolarHBondContact O-SG 2.83Å; S651-Q732 CarbonylContact C-O 3.57Å; S651-Q732 WeakPolarHBondContact CA-O 3.3Å
652	V	94.9	Very high	87.8	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-55.7	-39.2	170.5	168.6	0	0	0	0	110.9	C655 L656 L712 M714 V731 Q732 F733 L737 L829	V652-C655 PolarHBondContact O-N 3.33Å; V652-L656 HydrophobicContact CG1-CD1 3.83Å; V652-L656 HydrophobicContact CG1-CG 4.29Å; V652-L656 WeakPolarHBondContact O-CB 3.45Å; V652-L656 WeakPolarHBondContact O-CG 3.4Å; V652-L656 PolarHBondContact O-N 2.73Å; V652-L712 HydrophobicContact CG1-CD1 3.54Å; V652-M714 HydrophobicContact CG2-CE 4.44Å; V652-M714 HydrophobicContact CG2-SD 4.45Å; V652-V731 HydrophobicContact CG2-CG1 4.28Å; V652-Q732 PolarHBondContact N-O 3.32Å; V652-F733 HydrophobicContact CG2-CB 3.67Å; V652-L737 HydrophobicContact CG1-CD1 4.43Å; V652-L737 HydrophobicContact CG1-CD2 4.26Å; V652-L829 HydrophobicContact CG2-CD1 3.55Å
653	Q	93.9	Very high	88.1	Confident	64 Å²	64	64.8 Å²	64.8	30%	0.299	33%	0.327	S	S	.	.	H	α-helix	trans	-61	-43.4	175.3	-64.1	93.2	-46.6	0	0	112.2	S651 L656 F657 L737 Y742	S651-Q653 PolarHBondContact O-N 3.03Å; Q653-L656 PolarHBondContact O-N 3.17Å; Q653-F657 WeakPolarHBondContact O-CB 3.21Å; Q653-F657 PolarHBondContact O-N 2.81Å; Q653-L737 HydrophobicContact CG-CD1 4.19Å; Q653-Y742 VanDerWaalsContact CA-OH 3.29Å; Q653-Y742 WeakPolarHBondContact CA-OH 3.44Å; Q653-Y742 WeakPolarHBondContact CB-OH 3.45Å; Q653-Y742 PolarHBondContact O-OH 3.02Å; Q653-Y742 VanDerWaalsContact O-OH 3.09Å
654	S	92.9	Very high	88.7	Confident	15 Å²	15	62.9 Å²	62.9	11%	0.105	32%	0.316	C	S	.	.	H	α-helix	trans	-66.2	-37.9	175.6	72.6	0	0	0	0	112.4	S651 F657 Q658	S651-S654 PolarHBondContact N-OG 3.12Å; S651-S654 PolarHBondContact O-N 3.39Å; S651-S654 VanDerWaalsContact O-N 3.11Å; S651-S654 PolarHBondContact O-OG 3.19Å; S651-S654 WeakPolarHBondContact OG-CB 3.35Å; S651-S654 PolarHBondContact OG-N 2.88Å; S651-S654 PolarHBondContact OG-OG 2.81Å; S654-F657 PolarHBondContact O-N 2.98Å; S654-Q658 WeakPolarHBondContact O-CB 3.39Å; S654-Q658 PolarHBondContact O-N 3.43Å
655	C	94.1	Very high	89.3	Confident	3 Å²	3	60 Å²	60	2%	0.02	29%	0.293	C	S	.	.	H	α-helix	trans	-69.8	-39.3	176.8	-65.3	0	0	0	0	112.1	L410 S651 V652 F659	L410-C655 HydrophobicContact CB-CB 4.06Å; L410-C655 HydrophobicContact CD1-CB 3.94Å; S651-C655 PolarHBondContact O-N 2.99Å; S651-C655 PolarHBondContact O-SG 2.83Å; V652-C655 PolarHBondContact O-N 3.33Å; C655-F659 VanDerWaalsContact O-CB 3.25Å; C655-F659 WeakPolarHBondContact O-CB 3.38Å; C655-F659 PolarHBondContact O-N 2.96Å
656	L	94.6	Very high	89.7	Confident	1 Å²	1	61 Å²	61	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-66.7	-40.9	173.1	-75.9	169.3	0	0	0	111.4	L408 L410 V652 Q653 F659 T660 L712 L737 L739 Y742	L408-L656 HydrophobicContact CD1-CD2 4.46Å; L410-L656 HydrophobicContact CD1-CD2 3.71Å; L410-L656 HydrophobicContact CD1-CG 3.72Å; L410-L656 HydrophobicContact CD2-CD2 3.89Å; L410-L656 HydrophobicContact CG-CD2 4.46Å; V652-L656 HydrophobicContact CG1-CD1 3.83Å; V652-L656 HydrophobicContact CG1-CG 4.29Å; V652-L656 WeakPolarHBondContact O-CB 3.45Å; V652-L656 WeakPolarHBondContact O-CG 3.4Å; V652-L656 PolarHBondContact O-N 2.73Å; Q653-L656 PolarHBondContact O-N 3.17Å; L656-F659 PolarHBondContact O-N 2.99Å; L656-T660 PolarHBondContact O-N 3.38Å; L656-T660 PolarHBondContact O-OG1 2.84Å; L656-L712 HydrophobicContact CD2-CD2 4.45Å; L656-L737 HydrophobicContact CD1-CD1 4.21Å; L656-L737 HydrophobicContact CD1-CD2 4.12Å; L656-L739 HydrophobicContact CD1-CD1 4.35Å; L656-Y742 HydrophobicContact CB-CD1 3.73Å; L656-Y742 HydrophobicContact CB-CD2 4.08Å; L656-Y742 HydrophobicContact CB-CE1 3.62Å; L656-Y742 HydrophobicContact CB-CE2 3.98Å; L656-Y742 HydrophobicContact CB-CG 3.96Å; L656-Y742 HydrophobicContact CD1-CD2 3.97Å; L656-Y742 HydrophobicContact CD1-CE2 3.84Å
657	F	93.1	Very high	90	Very high	27 Å²	27	60.9 Å²	60.9	12%	0.118	30%	0.298	C	S	.	.	H	α-helix	trans	-58.8	-50.6	174.6	-175.4	-80.6	0	0	0	110.8	R642 T643 P645 Q653 S654 F659 T660 E661 Y742	R642-F657 HydrophobicContact CB-CE2 4.19Å; R642-F657 PolarHBondContact NH2-O 2.83Å; T643-F657 WeakPolarHBondContact O-CD2 3.39Å; T643-F657 WeakPolarHBondContact O-CE2 2.91Å; P645-F657 HydrophobicContact CG-CB 4.17Å; P645-F657 HydrophobicContact CG-CD1 4.03Å; P645-F657 HydrophobicContact CG-CG 4.03Å; Q653-F657 WeakPolarHBondContact O-CB 3.21Å; Q653-F657 PolarHBondContact O-N 2.81Å; S654-F657 PolarHBondContact O-N 2.98Å; F657-F659 PolarHBondContact O-N 3.11Å; F657-T660 CarbonylContact O-C 3.59Å; F657-T660 PolarHBondContact O-N 3.35Å; F657-T660 PolarHBondContact O-OG1 3.11Å; F657-E661 PolarHBondContact O-N 3.24Å; F657-Y742 HydrophobicContact CB-CE1 4.1Å
658	Q	91.9	Very high	90.6	Very high	72 Å²	72	59 Å²	59	34%	0.336	30%	0.298	S	S	.	.	H	α-helix	trans	-63.3	-38.4	178.1	-168.2	-171.5	-29.4	0	0	112.1	S413 S654 T660 E661	S413-Q658 PolarHBondContact OG-OE1 3.45Å; S654-Q658 WeakPolarHBondContact O-CB 3.39Å; S654-Q658 PolarHBondContact O-N 3.43Å; Q658-T660 VanDerWaalsContact C-N 3.27Å; Q658-T660 PolarHBondContact O-N 3.21Å; Q658-E661 WeakPolarHBondContact O-CB 3.42Å; Q658-E661 PolarHBondContact O-N 3.09Å
659	F	93.5	Very high	91.4	Very high	61 Å²	61	58 Å²	58	27%	0.268	30%	0.297	S	S	.	.	H	α-helix	trans	-68.1	-25.2	177.2	-177.8	-93.3	0	0	0	113.3	M386 L408 L410 C655 L656 F657	M386-F659 HydrophobicContact CE-CE1 3.82Å; M386-F659 HydrophobicContact SD-CE1 4.45Å; L408-F659 HydrophobicContact CD2-CE1 4.3Å; L408-F659 HydrophobicContact CD2-CZ 4.45Å; L410-F659 HydrophobicContact CD2-CB 3.99Å; L410-F659 HydrophobicContact CD2-CD1 4.19Å; L410-F659 HydrophobicContact CD2-CD2 4.09Å; L410-F659 HydrophobicContact CD2-CG 3.82Å; C655-F659 VanDerWaalsContact O-CB 3.25Å; C655-F659 WeakPolarHBondContact O-CB 3.38Å; C655-F659 PolarHBondContact O-N 2.96Å; L656-F659 PolarHBondContact O-N 2.99Å; F657-F659 PolarHBondContact O-N 3.11Å
660	T	94.3	Very high	91.6	Very high	1 Å²	1	55.6 Å²	55.6	1%	0.006	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	21.8	179	56.8	0	0	0	0	112.3	R642 L656 F657 Q658 Q700 M701 L702	R642-T660 VanDerWaalsContact CZ-O 3.29Å; R642-T660 PolarHBondContact NH1-O 2.93Å; R642-T660 PolarHBondContact NH2-O 3.29Å; R642-T660 PolarHBondContact NH2-OG1 2.72Å; L656-T660 PolarHBondContact O-N 3.38Å; L656-T660 PolarHBondContact O-OG1 2.84Å; F657-T660 CarbonylContact O-C 3.59Å; F657-T660 PolarHBondContact O-N 3.35Å; F657-T660 PolarHBondContact O-OG1 3.11Å; Q658-T660 VanDerWaalsContact C-N 3.27Å; Q658-T660 PolarHBondContact O-N 3.21Å; T660-Q700 WeakPolarHBondContact O-CG 3.31Å; T660-Q700 PolarHBondContact O-NE2 3.48Å; T660-M701 WeakPolarHBondContact CA-O 3.29Å; T660-M701 VanDerWaalsContact CB-O 3.29Å; T660-M701 WeakPolarHBondContact CB-O 3.05Å; T660-M701 VanDerWaalsContact CG2-O 3.29Å; T660-M701 WeakPolarHBondContact CG2-O 3.29Å; T660-L702 HydrophobicContact CG2-CD2 4.41Å
661	E	92.4	Very high	91.7	Very high	100 Å²	100	56.5 Å²	56.5	47%	0.467	29%	0.293	S	S	.	.	S	Bend	trans	-72.5	156.1	176.6	-167.1	162.3	-151.3	0	0	110.6	F657 Q658 E663	F657-E661 PolarHBondContact O-N 3.24Å; Q658-E661 WeakPolarHBondContact O-CB 3.42Å; Q658-E661 PolarHBondContact O-N 3.09Å; E661-E663 PolarHBondContact O-N 2.79Å
662	V	92.7	Very high	91.5	Very high	55 Å²	55	59.5 Å²	59.5	33%	0.333	31%	0.308	S	S	.	.			trans	-84.1	107.4	177.1	-177.8	0	0	0	0	109	F636 L698 K699 Q700	F636-V662 HydrophobicContact CD1-CG2 4.49Å; V662-L698 HydrophobicContact CG1-CB 4.02Å; V662-L698 HydrophobicContact CG1-CD1 4.3Å; V662-L698 HydrophobicContact CG1-CD2 4.2Å; V662-L698 HydrophobicContact CG1-CG 4.4Å; V662-K699 CarbonylContact C-O 3.5Å; V662-K699 WeakPolarHBondContact CA-O 3.46Å; V662-Q700 HydrophobicContact CG2-CB 4.24Å; V662-Q700 HydrophobicContact CG2-CG 4Å
663	E	92.5	Very high	91.2	Very high	108 Å²	108	59.8 Å²	59.8	51%	0.505	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	142.1	177.3	-58.8	-178	130.8	0	0	110.6	E661 L698 K699	E661-E663 PolarHBondContact O-N 2.79Å; E663-L698 WeakPolarHBondContact O-CA 3.37Å; E663-K699 PolarHBondContact N-O 2.97Å; E663-K699 PolarHBondContact O-N 3.34Å; E663-K699 IonicContact OE2-NZ 3.65Å; E663-K699 PolarHBondContact OE2-NZ 3.11Å; E663-K699 VanDerWaalsContact OE2-NZ 3.15Å
664	T	93.3	Very high	90.9	Very high	81 Å²	81	58.9 Å²	58.9	50%	0.497	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	110.5	171.4	-50.3	0	0	0	0	110.1	T666 A697 L698	T664-T666 HydrophobicContact CG2-CG2 3.63Å; T664-T666 PolarHBondContact O-N 2.83Å; T664-A697 CarbonylContact C-O 3.46Å; T664-L698 HydrophobicContact CG2-CD2 4.07Å
665	L	92.1	Very high	90.6	Very high	31 Å²	31	59.1 Å²	59.1	16%	0.162	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	114	175.4	-65.2	-177.3	0	0	0	109.3	I390 N669 D696 A697 K699	I390-L665 HydrophobicContact CG2-CD1 4.44Å; L665-N669 WeakPolarHBondContact CB-O 3.5Å; L665-D696 VanDerWaalsContact O-CA 3.26Å; L665-D696 WeakPolarHBondContact O-CA 3.29Å; L665-A697 HydrophobicContact CB-CB 4.15Å; L665-A697 HydrophobicContact CD1-CB 4.32Å; L665-A697 PolarHBondContact N-O 2.76Å; L665-A697 PolarHBondContact O-N 2.89Å; L665-K699 HydrophobicContact CD1-CB 3.9Å; L665-K699 HydrophobicContact CD1-CD 4.21Å; L665-K699 HydrophobicContact CG-CB 4.03Å
666	T	90.7	Very high	90.3	Very high	56 Å²	56	59.6 Å²	59.6	34%	0.344	32%	0.315	S	S	.	.			trans	-140.7	165	-177.3	65.6	0	0	0	0	112.5	T664 N668 N669 S670 D696	T664-T666 HydrophobicContact CG2-CG2 3.63Å; T664-T666 PolarHBondContact O-N 2.83Å; T666-N668 PolarHBondContact O-N 2.83Å; T666-N669 WeakPolarHBondContact O-CA 3.27Å; T666-N669 PolarHBondContact O-N 2.7Å; T666-S670 PolarHBondContact O-N 2.71Å; T666-D696 VanDerWaalsContact CA-OD1 3.24Å; T666-D696 WeakPolarHBondContact CA-OD1 3.47Å; T666-D696 WeakPolarHBondContact CB-OD1 3.49Å; T666-D696 HydrophobicContact CG2-CB 4.28Å
667	Q	85.3	Confident	90	Very high	157 Å²	157	60 Å²	60	73%	0.734	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	52.9	-121.2	173.3	-55.4	-178.7	5.9	0	0	112	N669 S670	Q667-N669 PolarHBondContact O-N 3.17Å; Q667-S670 VanDerWaalsContact O-CB 3.25Å; Q667-S670 WeakPolarHBondContact O-CB 3.43Å; Q667-S670 PolarHBondContact O-N 3.06Å; Q667-S670 PolarHBondContact O-OG 3.26Å
668	N	83.8	Confident	89.6	Confident	165 Å²	165	64.7 Å²	64.7	88%	0.882	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-63	-20.3	179.7	-63.5	7.9	0	0	0	113.4	T666	T666-N668 PolarHBondContact O-N 2.83Å
669	N	88.2	Confident	89.2	Confident	121 Å²	121	68.4 Å²	68.4	65%	0.647	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-102.2	13.2	177.5	-64.4	9.7	0	0	0	112.2	L665 T666 Q667	L665-N669 WeakPolarHBondContact CB-O 3.5Å; T666-N669 WeakPolarHBondContact O-CA 3.27Å; T666-N669 PolarHBondContact O-N 2.7Å; Q667-N669 PolarHBondContact O-N 3.17Å
670	S	87.2	Confident	88.6	Confident	28 Å²	28	69.1 Å²	69.1	20%	0.196	35%	0.353	C	S	.	.			trans	-67.9	146.1	-177.8	56	0	0	0	0	112.8	T666 Q667	T666-S670 PolarHBondContact O-N 2.71Å; Q667-S670 VanDerWaalsContact O-CB 3.25Å; Q667-S670 WeakPolarHBondContact O-CB 3.43Å; Q667-S670 PolarHBondContact O-N 3.06Å; Q667-S670 PolarHBondContact O-OG 3.26Å
671	L	90.4	Very high	87.9	Confident	38 Å²	38	73.7 Å²	73.7	20%	0.199	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	127.2	-173.8	174	67.8	0	0	0	111.6	I390 C392 C673 Y694 T695 A697	I390-L671 HydrophobicContact CG2-CD1 4.17Å; I390-L671 HydrophobicContact CG2-CD2 3.76Å; I390-L671 HydrophobicContact CG2-CG 4.49Å; C392-L671 HydrophobicContact CB-CD2 4.07Å; L671-C673 PolarHBondContact O-N 3Å; L671-Y694 CarbonylContact O-C 3.58Å; L671-Y694 VanDerWaalsContact O-CA 3.29Å; L671-Y694 WeakPolarHBondContact O-CA 3.45Å; L671-T695 PolarHBondContact N-O 3.38Å; L671-T695 PolarHBondContact O-N 3.4Å; L671-T695 PolarHBondContact O-OG1 2.82Å; L671-A697 HydrophobicContact CB-CB 3.67Å; L671-A697 HydrophobicContact CD2-CB 3.8Å; L671-A697 HydrophobicContact CG-CB 4.38Å
672	L	89.9	Confident	86.7	Confident	66 Å²	66	77.5 Å²	77.5	35%	0.346	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	92.8	163.8	176.4	47.9	0	0	0	109.9	V674 N692 Y694	L672-V674 PolarHBondContact O-N 3.44Å; L672-V674 VanDerWaalsContact O-N 3.15Å; L672-N692 HydrophobicContact CD1-CB 3.68Å; L672-Y694 HydrophobicContact CB-CD1 4Å; L672-Y694 HydrophobicContact CB-CE1 3.72Å; L672-Y694 HydrophobicContact CD1-CE1 4.41Å; L672-Y694 HydrophobicContact CG-CE1 4.42Å
673	C	88.5	Confident	85.3	Confident	6 Å²	6	77.7 Å²	77.7	4%	0.041	40%	0.401	C	S	.	.			trans	-80.5	104.9	-175	-174.3	0	0	0	0	111.1	C392 C395 L671 A675 C676 T677 I693 T695	C392-C673 HydrophobicContact CB-CB 4.44Å; C392-C673 VanDerWaalsContact SG-SG 3.64Å; C395-C673 PolarHBondContact SG-SG 3.46Å; L671-C673 PolarHBondContact O-N 3Å; C673-A675 PolarHBondContact O-N 2.92Å; C673-C676 HydrophobicContact CB-CB 3.96Å; C673-C676 PolarHBondContact O-N 3.21Å; C673-C676 PolarHBondContact SG-N 3.43Å; C673-C676 VanDerWaalsContact SG-N 3.4Å; C673-T677 VanDerWaalsContact O-CB 3.29Å; C673-T677 WeakPolarHBondContact O-CB 3.32Å; C673-T677 PolarHBondContact O-N 3.45Å; C673-T677 PolarHBondContact O-OG1 2.84Å; C673-I693 PolarHBondContact N-O 3.45Å; C673-T695 HydrophobicContact CB-CG2 3.76Å; C673-T695 WeakPolarHBondContact CB-OG1 3.43Å
674	V	87.6	Confident	83.8	Confident	45 Å²	45	76.6 Å²	76.6	27%	0.273	40%	0.396	S	S	.	.	H	α-helix	trans	-56.9	-37.8	175.1	178.4	0	0	0	0	111.5	Y625 L672 K678	Y625-V674 HydrophobicContact CE2-CG2 4.42Å; L672-V674 PolarHBondContact O-N 3.44Å; L672-V674 VanDerWaalsContact O-N 3.15Å; V674-K678 HydrophobicContact CG1-CD 3.82Å; V674-K678 VanDerWaalsContact CG1-CE 3.46Å; V674-K678 HydrophobicContact CG1-CG 4.36Å; V674-K678 VanDerWaalsContact O-CB 3.3Å; V674-K678 WeakPolarHBondContact O-CB 3.49Å; V674-K678 VanDerWaalsContact O-CG 3.27Å; V674-K678 WeakPolarHBondContact O-CG 3.43Å; V674-K678 PolarHBondContact O-N 3.12Å
675	A	87.3	Confident	82	Confident	20 Å²	20	82 Å²	82	17%	0.165	41%	0.412	C	S	.	.	H	α-helix	trans	-67.5	-48.2	177.9	0	0	0	0	0	112.8	T397 C673 K678 R679	T397-A675 HydrophobicContact CG2-CB 4.18Å; T397-A675 WeakPolarHBondContact OG1-CB 3.31Å; C673-A675 PolarHBondContact O-N 2.92Å; A675-K678 PolarHBondContact O-N 3.2Å; A675-R679 WeakPolarHBondContact O-CG 3.39Å; A675-R679 PolarHBondContact O-N 3.46Å
676	C	87.3	Confident	80.2	Confident	13 Å²	13	86.4 Å²	86.4	9%	0.088	44%	0.44	C	S	.	.	H	α-helix	trans	-60.9	-45.2	173.8	-70	0	0	0	0	111.4	C673 K678 R679 H680 I693 T695	C673-C676 HydrophobicContact CB-CB 3.96Å; C673-C676 PolarHBondContact O-N 3.21Å; C673-C676 PolarHBondContact SG-N 3.43Å; C673-C676 VanDerWaalsContact SG-N 3.4Å; C676-K678 VanDerWaalsContact C-N 3.35Å; C676-K678 PolarHBondContact O-N 2.91Å; C676-R679 WeakPolarHBondContact O-CB 3.25Å; C676-R679 PolarHBondContact O-N 3.34Å; C676-H680 PolarHBondContact O-N 2.98Å; C676-I693 HydrophobicContact CB-CB 4.2Å; C676-I693 HydrophobicContact CB-CG2 3.91Å; C676-T695 HydrophobicContact CB-CG2 4.3Å
677	T	87.4	Confident	78.5	Confident	8 Å²	8	88.1 Å²	88.1	5%	0.049	47%	0.47	C	S	.	.	H	α-helix	trans	-60.2	-41.9	178.6	-58.9	0	0	0	0	111.7	C673 K681 I693	C673-T677 VanDerWaalsContact O-CB 3.29Å; C673-T677 WeakPolarHBondContact O-CB 3.32Å; C673-T677 PolarHBondContact O-N 3.45Å; C673-T677 PolarHBondContact O-OG1 2.84Å; T677-K681 HydrophobicContact CG2-CD 3.98Å; T677-K681 VanDerWaalsContact CG2-CE 3.49Å; T677-K681 VanDerWaalsContact CG2-NZ 3.28Å; T677-K681 WeakPolarHBondContact O-CB 3.23Å; T677-K681 VanDerWaalsContact O-CG 3.28Å; T677-K681 WeakPolarHBondContact O-CG 3.48Å; T677-K681 PolarHBondContact O-N 3.07Å; T677-K681 VanDerWaalsContact O-N 3.16Å; T677-I693 PolarHBondContact OG1-N 3.28Å
678	K	85.5	Confident	77.1	Confident	126 Å²	126	82.6 Å²	82.6	55%	0.548	46%	0.455	S	S	.	.	H	α-helix	trans	-68.4	-30.4	173.8	-75.2	173.8	-179.5	170.7	0	112.8	V674 A675 C676 K682	V674-K678 HydrophobicContact CG1-CD 3.82Å; V674-K678 VanDerWaalsContact CG1-CE 3.46Å; V674-K678 HydrophobicContact CG1-CG 4.36Å; V674-K678 VanDerWaalsContact O-CB 3.3Å; V674-K678 WeakPolarHBondContact O-CB 3.49Å; V674-K678 VanDerWaalsContact O-CG 3.27Å; V674-K678 WeakPolarHBondContact O-CG 3.43Å; V674-K678 PolarHBondContact O-N 3.12Å; A675-K678 PolarHBondContact O-N 3.2Å; C676-K678 VanDerWaalsContact C-N 3.35Å; C676-K678 PolarHBondContact O-N 2.91Å; K678-K682 WeakPolarHBondContact O-CG 3.45Å
679	R	83.8	Confident	75.8	Confident	150 Å²	150	79.4 Å²	79.4	57%	0.566	45%	0.445	S	S	*	.	H	α-helix	trans	-69.9	-46.6	174	-70.7	173.6	-165.3	-172	6.9	111.7	A675 C676 K682 G683	A675-R679 WeakPolarHBondContact O-CG 3.39Å; A675-R679 PolarHBondContact O-N 3.46Å; C676-R679 WeakPolarHBondContact O-CB 3.25Å; C676-R679 PolarHBondContact O-N 3.34Å; R679-K682 PolarHBondContact O-N 2.99Å; R679-K682 VanDerWaalsContact O-N 3.14Å; R679-G683 PolarHBondContact O-N 3.42Å
680	H	81.6	Confident	74.7	Confident	77 Å²	77	82.6 Å²	82.6	36%	0.356	45%	0.454	S	S	.	.	H	α-helix	trans	-63.6	-45.2	179.7	-158.3	-82.9	0	0	0	112.1	C676 K682 G683 E684 I693	C676-H680 PolarHBondContact O-N 2.98Å; H680-K682 PolarHBondContact O-N 2.84Å; H680-G683 PolarHBondContact O-N 2.7Å; H680-E684 IonicContact CE1-OE1 3.68Å; H680-E684 PolarHBondContact CE1-OE1 3.23Å; H680-E684 IonicContact CE1-OE2 3.17Å; H680-E684 PolarHBondContact CE1-OE2 2.98Å; H680-E684 IonicContact CG-OE2 3.88Å; H680-E684 VanDerWaalsContact ND1-CD 3.26Å; H680-E684 IonicContact ND1-OE1 3.93Å; H680-E684 IonicContact ND1-OE2 3.19Å; H680-E684 PolarHBondContact ND1-OE2 3.2Å; H680-E684 PolarHBondContact O-N 2.85Å; H680-I693 HydrophobicContact CB-CD1 3.44Å; H680-I693 VanDerWaalsContact CB-CD1 3.44Å
681	K	78.4	Confident	74.3	Confident	97 Å²	97	88.2 Å²	88.2	42%	0.422	47%	0.474	S	S	.	.	H	α-helix	trans	-61	-13.2	174.9	-70.6	171.9	-177.9	171.7	0	114	T677 N692	T677-K681 HydrophobicContact CG2-CD 3.98Å; T677-K681 VanDerWaalsContact CG2-CE 3.49Å; T677-K681 VanDerWaalsContact CG2-NZ 3.28Å; T677-K681 WeakPolarHBondContact O-CB 3.23Å; T677-K681 VanDerWaalsContact O-CG 3.28Å; T677-K681 WeakPolarHBondContact O-CG 3.48Å; T677-K681 PolarHBondContact O-N 3.07Å; T677-K681 VanDerWaalsContact O-N 3.16Å; K681-N692 PolarHBondContact NZ-OD1 2.74Å
682	K	68.2	Low	74.1	Confident	179 Å²	179	89.9 Å²	89.9	78%	0.778	48%	0.483	S	S	*	.	H	α-helix	trans	-95.2	-15.8	171	-74.2	-176.2	176.7	-172.9	0	114	K678 R679 H680	K678-K682 WeakPolarHBondContact O-CG 3.45Å; R679-K682 PolarHBondContact O-N 2.99Å; R679-K682 VanDerWaalsContact O-N 3.14Å; H680-K682 PolarHBondContact O-N 2.84Å
683	G	63.2	Low	73.9	Confident	60 Å²	60	88.3 Å²	88.3	62%	0.619	48%	0.475	S	S	*	.	H	α-helix	trans	-87.4	-40.2	177.2	0	0	0	0	0	113.4	R679 H680 K685	R679-G683 PolarHBondContact O-N 3.42Å; H680-G683 PolarHBondContact O-N 2.7Å; G683-K685 PolarHBondContact O-N 3.22Å; G683-K685 VanDerWaalsContact O-N 3.07Å
684	E	61	Low	74	Confident	85 Å²	85	94.2 Å²	94.2	40%	0.397	50%	0.497	S	S	.	.			trans	-78.5	90	-177.5	-68.4	175.9	120.2	0	0	112.4	H680 T686	H680-E684 IonicContact CE1-OE1 3.68Å; H680-E684 PolarHBondContact CE1-OE1 3.23Å; H680-E684 IonicContact CE1-OE2 3.17Å; H680-E684 PolarHBondContact CE1-OE2 2.98Å; H680-E684 IonicContact CG-OE2 3.88Å; H680-E684 VanDerWaalsContact ND1-CD 3.26Å; H680-E684 IonicContact ND1-OE1 3.93Å; H680-E684 IonicContact ND1-OE2 3.19Å; H680-E684 PolarHBondContact ND1-OE2 3.2Å; H680-E684 PolarHBondContact O-N 2.85Å; E684-T686 VanDerWaalsContact C-N 3.28Å; E684-T686 PolarHBondContact O-N 2.69Å
685	K	55.5	Low	74.2	Confident	194 Å²	194	92.2 Å²	92.2	84%	0.843	49%	0.485	S	S	*	.			trans	-80.8	2	176.3	-71.7	-170.2	175.4	-177.2	0	115.1	G683	G683-K685 PolarHBondContact O-N 3.22Å; G683-K685 VanDerWaalsContact O-N 3.07Å
686	T	53.3	Low	74.5	Confident	123 Å²	123	94.4 Å²	94.4	76%	0.755	49%	0.494	S	S	*	.	S	Bend	trans	-143.3	103	-172.4	50.4	0	0	0	0	112.7	E684 G688	E684-T686 VanDerWaalsContact C-N 3.28Å; E684-T686 PolarHBondContact O-N 2.69Å; T686-G688 PolarHBondContact O-N 2.67Å
687	G	55.6	Low	74.8	Confident	93 Å²	93	93.8 Å²	93.8	96%	0.959	49%	0.49	S	S	*	.	S	Bend	trans	65.2	-6.5	156.2	0	0	0	0	0	119.5
688	G	55.1	Low	75.1	Confident	41 Å²	41	95.2 Å²	95.2	42%	0.423	50%	0.497	S	S	.	.			trans	-60.9	141.8	-178.3	0	0	0	0	0	113.3	T686	T686-G688 PolarHBondContact O-N 2.67Å
689	S	57.3	Low	75.5	Confident	98 Å²	98	91.2 Å²	91.2	69%	0.685	48%	0.48	S	S	*	.			trans	-65.5	147.6	173.1	55.9	0	0	0	0	110.5	K691	S689-K691 PolarHBondContact O-N 3.32Å
690	K	64.3	Low	76	Confident	188 Å²	188	84.1 Å²	84.1	82%	0.817	45%	0.453	S	S	*	.			trans	-68.6	65.4	-176.1	-66	178.2	-179.3	174.1	0	112.4	N692	K690-N692 PolarHBondContact O-N 3.19Å
691	K	79.6	Confident	76.6	Confident	145 Å²	145	81.8 Å²	81.8	63%	0.63	44%	0.443	S	S	*	.			trans	-67.7	125.3	-174.7	-163.2	170.4	-176	178	0	111.1	S689	S689-K691 PolarHBondContact O-N 3.32Å
692	N	85.4	Confident	77.4	Confident	73 Å²	73	77.4 Å²	77.4	39%	0.39	42%	0.424	S	S	.	.			trans	-80	136.5	170.5	-81.3	-3.7	0	0	0	109.2	L672 K681 K690 Y694	L672-N692 HydrophobicContact CD1-CB 3.68Å; K681-N692 PolarHBondContact NZ-OD1 2.74Å; K690-N692 PolarHBondContact O-N 3.19Å; N692-Y694 HydrophobicContact CB-CE2 4.24Å
693	I	87.1	Confident	78.7	Confident	33 Å²	33	68.9 Å²	68.9	17%	0.169	39%	0.387	C	S	.	.			trans	-106	111.5	-174	-59.2	-172.9	0	0	0	110.4	C673 C676 T677 H680 T695	C673-I693 PolarHBondContact N-O 3.45Å; C676-I693 HydrophobicContact CB-CB 4.2Å; C676-I693 HydrophobicContact CB-CG2 3.91Å; T677-I693 PolarHBondContact OG1-N 3.28Å; H680-I693 HydrophobicContact CB-CD1 3.44Å; H680-I693 VanDerWaalsContact CB-CD1 3.44Å; I693-T695 HydrophobicContact CG2-CG2 3.81Å
694	Y	90.2	Very high	80.1	Confident	131 Å²	131	66.4 Å²	66.4	51%	0.514	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	139.8	170	-61.8	-90.3	0	0	0	110	L671 L672 N692	L671-Y694 CarbonylContact O-C 3.58Å; L671-Y694 VanDerWaalsContact O-CA 3.29Å; L671-Y694 WeakPolarHBondContact O-CA 3.45Å; L672-Y694 HydrophobicContact CB-CD1 4Å; L672-Y694 HydrophobicContact CB-CE1 3.72Å; L672-Y694 HydrophobicContact CD1-CE1 4.41Å; L672-Y694 HydrophobicContact CG-CE1 4.42Å; N692-Y694 HydrophobicContact CB-CE2 4.24Å
695	T	90.3	Very high	81.7	Confident	3 Å²	3	62.5 Å²	62.5	2%	0.018	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	144.2	-171.6	63.8	0	0	0	0	110.5	C392 Q394 L671 C673 C676 I693	C392-T695 PolarHBondContact SG-OG1 2.97Å; Q394-T695 VanDerWaalsContact CD-CG2 3.45Å; Q394-T695 HydrophobicContact CG-CG2 4.21Å; Q394-T695 VanDerWaalsContact OE1-CG2 3.24Å; L671-T695 PolarHBondContact N-O 3.38Å; L671-T695 PolarHBondContact O-N 3.4Å; L671-T695 PolarHBondContact O-OG1 2.82Å; C673-T695 HydrophobicContact CB-CG2 3.76Å; C673-T695 WeakPolarHBondContact CB-OG1 3.43Å; C676-T695 HydrophobicContact CB-CG2 4.3Å; I693-T695 HydrophobicContact CG2-CG2 3.81Å
696	D	94	Very high	83.5	Confident	66 Å²	66	53.6 Å²	53.6	35%	0.353	30%	0.304	S	S	.	.			trans	-61.6	143.2	169	-55.2	-49.3	0	0	0	110.7	Q393 L665 T666	Q393-D696 VanDerWaalsContact CB-O 3.32Å; Q393-D696 WeakPolarHBondContact CB-O 3.42Å; Q393-D696 PolarHBondContact N-O 2.88Å; L665-D696 VanDerWaalsContact O-CA 3.26Å; L665-D696 WeakPolarHBondContact O-CA 3.29Å; T666-D696 VanDerWaalsContact CA-OD1 3.24Å; T666-D696 WeakPolarHBondContact CA-OD1 3.47Å; T666-D696 WeakPolarHBondContact CB-OD1 3.49Å; T666-D696 HydrophobicContact CG2-CB 4.28Å
697	A	93.6	Very high	85.5	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	157.7	-175.1	0	0	0	0	0	111.6	I390 M391 T664 L665 L671	I390-A697 HydrophobicContact CG2-CB 4.12Å; M391-A697 CarbonylContact O-C 3.4Å; M391-A697 VanDerWaalsContact O-CA 3.22Å; M391-A697 WeakPolarHBondContact O-CA 3.47Å; M391-A697 WeakPolarHBondContact O-CB 3.32Å; T664-A697 CarbonylContact C-O 3.46Å; L665-A697 HydrophobicContact CB-CB 4.15Å; L665-A697 HydrophobicContact CD1-CB 4.32Å; L665-A697 PolarHBondContact N-O 2.76Å; L665-A697 PolarHBondContact O-N 2.89Å; L671-A697 HydrophobicContact CB-CB 3.67Å; L671-A697 HydrophobicContact CD2-CB 3.8Å; L671-A697 HydrophobicContact CG-CB 4.38Å
698	L	94	Very high	87.4	Confident	38 Å²	38	45.7 Å²	45.7	20%	0.199	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	139.9	164.2	-62.7	-176.8	0	0	0	108.9	I390 M391 Q393 F636 V662 E663 T664	I390-L698 CarbonylContact C-O 3.54Å; I390-L698 WeakPolarHBondContact CA-O 3.29Å; M391-L698 HydrophobicContact CE-CD1 3.9Å; M391-L698 HydrophobicContact CE-CG 4.37Å; M391-L698 PolarHBondContact N-O 3.32Å; M391-L698 PolarHBondContact O-N 2.84Å; Q393-L698 HydrophobicContact CG-CG 4.38Å; F636-L698 HydrophobicContact CE1-CB 4.42Å; F636-L698 HydrophobicContact CE2-CB 4.17Å; F636-L698 HydrophobicContact CE2-CD1 4.33Å; F636-L698 HydrophobicContact CZ-CB 3.72Å; V662-L698 HydrophobicContact CG1-CB 4.02Å; V662-L698 HydrophobicContact CG1-CD1 4.3Å; V662-L698 HydrophobicContact CG1-CD2 4.2Å; V662-L698 HydrophobicContact CG1-CG 4.4Å; E663-L698 WeakPolarHBondContact O-CA 3.37Å; T664-L698 HydrophobicContact CG2-CD2 4.07Å
699	K	93.4	Very high	89.4	Confident	41 Å²	41	43.8 Å²	43.8	18%	0.178	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	141	175.3	173.2	174.8	168.4	-66.5	0	109.7	T389 I390 V662 E663 L665 M701	T389-K699 CarbonylContact O-C 3.53Å; T389-K699 VanDerWaalsContact O-CA 3.31Å; T389-K699 WeakPolarHBondContact O-CA 3.48Å; I390-K699 HydrophobicContact CD1-CD 4.26Å; I390-K699 HydrophobicContact CG1-CB 4.15Å; I390-K699 HydrophobicContact CG1-CD 4.25Å; I390-K699 HydrophobicContact CG1-CG 3.97Å; V662-K699 CarbonylContact C-O 3.5Å; V662-K699 WeakPolarHBondContact CA-O 3.46Å; E663-K699 PolarHBondContact N-O 2.97Å; E663-K699 PolarHBondContact O-N 3.34Å; E663-K699 IonicContact OE2-NZ 3.65Å; E663-K699 PolarHBondContact OE2-NZ 3.11Å; E663-K699 VanDerWaalsContact OE2-NZ 3.15Å; L665-K699 HydrophobicContact CD1-CB 3.9Å; L665-K699 HydrophobicContact CD1-CD 4.21Å; L665-K699 HydrophobicContact CG-CB 4.03Å; K699-M701 PolarHBondContact NZ-SD 2.9Å; K699-M701 VanDerWaalsContact NZ-SD 3.36Å
700	Q	94.5	Very high	91.3	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.009	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	145.5	171.3	-162.7	-175.2	5.9	0	0	110.2	T389 F636 R642 T660 V662 L702	T389-Q700 PolarHBondContact N-O 2.95Å; T389-Q700 PolarHBondContact O-N 3.26Å; F636-Q700 HydrophobicContact CD1-CB 3.7Å; F636-Q700 HydrophobicContact CE1-CB 3.98Å; F636-Q700 PolarHBondContact O-OE1 3.46Å; R642-Q700 VanDerWaalsContact NH1-NE2 3.15Å; T660-Q700 WeakPolarHBondContact O-CG 3.31Å; T660-Q700 PolarHBondContact O-NE2 3.48Å; V662-Q700 HydrophobicContact CG2-CB 4.24Å; V662-Q700 HydrophobicContact CG2-CG 4Å; Q700-L702 HydrophobicContact CG-CG 4.14Å
701	M	94.9	Very high	92.9	Very high	28 Å²	28	30.2 Å²	30.2	14%	0.138	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	130.7	166	-49.5	-57.4	-65.1	0	0	108.7	M386 T387 T660 K699	M386-M701 HydrophobicContact CG-CB 4.21Å; M386-M701 HydrophobicContact CG-CE 3.74Å; M386-M701 HydrophobicContact SD-CB 3.95Å; T387-M701 WeakPolarHBondContact O-CA 3.25Å; T660-M701 WeakPolarHBondContact CA-O 3.29Å; T660-M701 VanDerWaalsContact CB-O 3.29Å; T660-M701 WeakPolarHBondContact CB-O 3.05Å; T660-M701 VanDerWaalsContact CG2-O 3.29Å; T660-M701 WeakPolarHBondContact CG2-O 3.29Å; K699-M701 PolarHBondContact NZ-SD 2.9Å; K699-M701 VanDerWaalsContact NZ-SD 3.36Å
702	L	95.3	Very high	93.8	Very high	4 Å²	4	23.3 Å²	23.3	2%	0.021	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	143.8	176.1	-74.9	177	0	0	0	111.4	T387 T638 T660 Q700 S704 Y742 A744	T387-L702 PolarHBondContact N-O 2.91Å; T387-L702 PolarHBondContact O-N 2.93Å; T638-L702 HydrophobicContact CG2-CD1 3.84Å; T638-L702 HydrophobicContact CG2-CD2 3.52Å; T638-L702 HydrophobicContact CG2-CG 4.36Å; T660-L702 HydrophobicContact CG2-CD2 4.41Å; Q700-L702 HydrophobicContact CG-CG 4.14Å; L702-S704 PolarHBondContact O-N 3.15Å; L702-Y742 WeakPolarHBondContact CD2-O 3.36Å; L702-A744 HydrophobicContact CB-CB 3.96Å; L702-A744 HydrophobicContact CD1-CB 4.35Å
703	I	95.3	Very high	94.4	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	121.2	-178.6	-60.3	167.9	0	0	0	109.5	M386 F405 L408 P706 L739 Y742 C743 A744	M386-I703 HydrophobicContact CE-CD1 4.48Å; M386-I703 HydrophobicContact CE-CG1 3.55Å; M386-I703 HydrophobicContact SD-CG1 4.08Å; F405-I703 HydrophobicContact CE1-CG2 4.5Å; F405-I703 HydrophobicContact CZ-CG1 4.45Å; F405-I703 HydrophobicContact CZ-CG2 4.37Å; L408-I703 HydrophobicContact CD1-CD1 3.8Å; L408-I703 HydrophobicContact CD1-CG1 4.42Å; I703-P706 HydrophobicContact CG2-CB 4.05Å; I703-L739 HydrophobicContact CD1-CD1 3.88Å; I703-L739 HydrophobicContact CD1-CD2 3.92Å; I703-L739 HydrophobicContact CD1-CG 3.96Å; I703-Y742 PolarHBondContact N-O 3.18Å; I703-C743 CarbonylContact O-C 3.59Å; I703-C743 WeakPolarHBondContact O-CA 3.25Å; I703-C743 WeakPolarHBondContact O-CB 3.3Å; I703-A744 PolarHBondContact O-N 2.8Å
704	S	93.3	Very high	94.8	Very high	8 Å²	8	19 Å²	19	6%	0.056	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	-16.9	-178.3	51.4	0	0	0	0	114.2	E385 T387 L702 K748	E385-S704 PolarHBondContact O-N 2.76Å; E385-S704 PolarHBondContact O-OG 3.32Å; T387-S704 WeakPolarHBondContact OG1-CB 3.3Å; T387-S704 PolarHBondContact OG1-OG 3.18Å; L702-S704 PolarHBondContact O-N 3.15Å; S704-K748 WeakPolarHBondContact O-CB 3.32Å; S704-K748 PolarHBondContact O-N 3.42Å
705	S	93.8	Very high	94.9	Very high	4 Å²	4	17.4 Å²	17.4	3%	0.028	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	114.6	158.7	-175	0	0	0	0	108.4	G384 E385 N749	G384-S705 CarbonylContact C-O 3.48Å; G384-S705 WeakPolarHBondContact CA-O 3.35Å; E385-S705 PolarHBondContact N-O 2.77Å; E385-S705 PolarHBondContact O-N 2.74Å; S705-N749 PolarHBondContact OG-ND2 3.09Å
706	P	94.5	Very high	94.8	Very high	6 Å²	6	17.4 Å²	17.4	4%	0.039	9%	0.09	C	C	.	.			trans	-80.4	138.9	179.4	35.7	-36.3	0	0	0	110	I703 L739 I750 I757 Y759	I703-P706 HydrophobicContact CG2-CB 4.05Å; P706-L739 HydrophobicContact CB-CD2 3.79Å; P706-I750 HydrophobicContact CG-CD1 4.24Å; P706-I757 HydrophobicContact CG-CD1 4.42Å; P706-I757 HydrophobicContact CG-CG2 4.45Å; P706-Y759 WeakPolarHBondContact CB-OH 3.47Å
707	P	95.3	Very high	94.4	Very high	3 Å²	3	16.8 Å²	16.8	2%	0.019	8%	0.084	C	C	.	.			trans	-74.4	155	-176.1	31.1	-36.4	0	0	0	112	F382 F405 V709 L710 Y759	F382-P707 WeakPolarHBondContact O-CB 3.49Å; F405-P707 HydrophobicContact CE2-CG 4.19Å; P707-V709 PolarHBondContact O-N 3.33Å; P707-L710 HydrophobicContact CG-CB 4.07Å; P707-L710 HydrophobicContact CG-CD1 3.92Å; P707-Y759 WeakPolarHBondContact O-CE1 3.29Å; P707-Y759 PolarHBondContact O-OH 3.44Å
708	S	94.8	Very high	93.6	Very high	48 Å²	48	19.3 Å²	19.3	34%	0.336	10%	0.096	S	C	.	.	S	Bend	trans	-58.9	-36.7	173.4	-49.8	0	0	0	0	111.8	L241 Q380 V381 R833	L241-S708 VanDerWaalsContact CD2-CB 3.46Å; Q380-S708 WeakPolarHBondContact O-CB 3.48Å; Q380-S708 PolarHBondContact O-OG 2.89Å; V381-S708 WeakPolarHBondContact O-CB 3.34Å; V381-S708 PolarHBondContact O-N 3.1Å; S708-R833 PolarHBondContact O-N 3.43Å
709	V	96.4	Very high	92.8	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	111.6	176	-178.4	0	0	0	0	108.8	T239 V381 F382 P707 Y762 Y831 E832	T239-V709 HydrophobicContact CG2-CG1 4.3Å; T239-V709 HydrophobicContact CG2-CG2 3.77Å; V381-V709 HydrophobicContact CG1-CB 4Å; V381-V709 HydrophobicContact CG1-CG2 3.63Å; V381-V709 WeakPolarHBondContact O-CB 3.46Å; V381-V709 PolarHBondContact O-N 2.76Å; F382-V709 HydrophobicContact CD1-CB 3.86Å; F382-V709 HydrophobicContact CD1-CG1 3.76Å; F382-V709 HydrophobicContact CE1-CB 3.96Å; F382-V709 HydrophobicContact CE1-CG1 3.51Å; P707-V709 PolarHBondContact O-N 3.33Å; V709-Y762 HydrophobicContact CG1-CE1 4.11Å; V709-Y762 VanDerWaalsContact CG1-OH 3.28Å; V709-Y762 WeakPolarHBondContact CG1-OH 3.28Å; V709-Y831 CarbonylContact C-O 3.54Å; V709-Y831 WeakPolarHBondContact CA-O 3.47Å; V709-E832 HydrophobicContact CG2-CG 4.33Å
710	L	97.4	Very high	91.6	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	113.4	-179.8	177.5	67.6	0	0	0	110.4	F405 L408 P707 L712 L737 L739 Y759 Y831	F405-L710 HydrophobicContact CE2-CD1 4.31Å; L408-L710 HydrophobicContact CD1-CD1 4.17Å; P707-L710 HydrophobicContact CG-CB 4.07Å; P707-L710 HydrophobicContact CG-CD1 3.92Å; L710-L712 HydrophobicContact CD1-CD2 3.85Å; L710-L712 HydrophobicContact CD2-CD1 4.41Å; L710-L712 HydrophobicContact CD2-CD2 4Å; L710-L712 HydrophobicContact CD2-CG 4.26Å; L710-L712 HydrophobicContact CG-CD2 3.8Å; L710-L712 HydrophobicContact CG-CG 4.09Å; L710-L737 HydrophobicContact CD2-CD2 4.18Å; L710-L739 HydrophobicContact CD2-CD1 3.81Å; L710-L739 HydrophobicContact CD2-CD2 4.13Å; L710-Y759 HydrophobicContact CB-CD1 3.97Å; L710-Y759 HydrophobicContact CB-CE1 3.71Å; L710-Y831 PolarHBondContact N-O 3.29Å; L710-Y831 PolarHBondContact O-N 3.25Å
711	T	98.1	Very high	90.7	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.006	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	124.2	169.9	-51	0	0	0	0	109.9	L326 D407 L408 F830	L326-T711 HydrophobicContact CD2-CG2 3.83Å; D407-T711 VanDerWaalsContact CA-O 3.32Å; D407-T711 WeakPolarHBondContact CA-O 3.44Å; D407-T711 HydrophobicContact CB-CG2 3.9Å; L408-T711 PolarHBondContact N-O 2.99Å; T711-F830 HydrophobicContact CG2-CD1 4.28Å; T711-F830 HydrophobicContact CG2-CE1 3.93Å; T711-F830 HydrophobicContact CG2-CZ 4.35Å
712	L	98.1	Very high	89.8	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	122.6	173.1	-55.1	-179.5	0	0	0	110.4	L408 L410 V652 L656 L710 M714 L737 L828 L829 Y831	L408-L712 HydrophobicContact CB-CD2 3.82Å; L408-L712 HydrophobicContact CD1-CD2 4.22Å; L408-L712 HydrophobicContact CG-CD2 4.4Å; L410-L712 HydrophobicContact CD1-CD2 4.49Å; V652-L712 HydrophobicContact CG1-CD1 3.54Å; L656-L712 HydrophobicContact CD2-CD2 4.45Å; L710-L712 HydrophobicContact CD1-CD2 3.85Å; L710-L712 HydrophobicContact CD2-CD1 4.41Å; L710-L712 HydrophobicContact CD2-CD2 4Å; L710-L712 HydrophobicContact CD2-CG 4.26Å; L710-L712 HydrophobicContact CG-CD2 3.8Å; L710-L712 HydrophobicContact CG-CG 4.09Å; L712-M714 HydrophobicContact CB-CE 3.69Å; L712-L737 HydrophobicContact CD1-CD2 4.07Å; L712-L828 CarbonylContact O-C 3.54Å; L712-L828 WeakPolarHBondContact O-CA 3.35Å; L712-L829 HydrophobicContact CB-CB 4.33Å; L712-L829 PolarHBondContact N-O 2.89Å; L712-L829 PolarHBondContact O-N 3.43Å; L712-Y831 HydrophobicContact CD1-CD2 4.16Å; L712-Y831 HydrophobicContact CD1-CE2 3.91Å; L712-Y831 HydrophobicContact CG-CD2 4.45Å
713	H	97.5	Very high	88.6	Confident	17 Å²	17	35.6 Å²	35.6	8%	0.079	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	127.5	173	159.7	-143.9	0	0	0	110.1	Q323 L408 S409 L410 Y827 L828	Q323-H713 HydrophobicContact CG-CB 3.88Å; L408-H713 PolarHBondContact O-N 3.38Å; S409-H713 CarbonylContact C-O 3.54Å; S409-H713 WeakPolarHBondContact CA-O 3.39Å; S409-H713 WeakPolarHBondContact CB-ND1 3.5Å; S409-H713 PolarHBondContact OG-ND1 2.85Å; L410-H713 PolarHBondContact N-O 3.45Å; H713-Y827 AromaticContact CD2-CE2 3.47Å; H713-Y827 VanDerWaalsContact CD2-CE2 3.47Å; H713-Y827 WeakPolarHBondContact CD2-CE2 3.47Å; H713-Y827 AromaticContact CD2-CZ 3.58Å; H713-Y827 PolarHBondContact CD2-OH 3.29Å; H713-Y827 AromaticContact NE2-CE2 3.32Å; H713-Y827 VanDerWaalsContact NE2-CE2 3.32Å; H713-Y827 WeakPolarHBondContact NE2-CE2 3.47Å; H713-Y827 AromaticContact NE2-CZ 3.45Å; H713-Y827 PolarHBondContact NE2-OH 3.25Å; H713-L828 HydrophobicContact CB-CD2 3.66Å
714	M	95.6	Very high	87.6	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	107.4	174.4	-59.5	-56	108.3	0	0	109.2	L410 V412 V652 L712 R716 V731 A826 Y827 L829	L410-M714 HydrophobicContact CB-CE 4.44Å; L410-M714 HydrophobicContact CD1-CE 4.04Å; L410-M714 HydrophobicContact CG-CE 4.33Å; V412-M714 HydrophobicContact CG2-CB 3.92Å; V652-M714 HydrophobicContact CG2-CE 4.44Å; V652-M714 HydrophobicContact CG2-SD 4.45Å; L712-M714 HydrophobicContact CB-CE 3.69Å; M714-R716 HydrophobicContact CB-CG 4.18Å; M714-R716 PolarHBondContact O-N 3.41Å; M714-V731 HydrophobicContact SD-CG1 4.19Å; M714-A826 WeakPolarHBondContact CG-O 3.26Å; M714-Y827 PolarHBondContact N-O 3.27Å; M714-L829 HydrophobicContact CE-CD1 4.17Å
715	K	92.5	Very high	87	Confident	97 Å²	97	39.8 Å²	39.8	42%	0.422	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	77.5	176.5	-70.2	178.9	168.1	167.1	0	111.3	S409 L410 Q718	S409-K715 WeakPolarHBondContact O-CD 3.49Å; S409-K715 WeakPolarHBondContact O-CE 3.5Å; S409-K715 PolarHBondContact O-NZ 2.92Å; L410-K715 VanDerWaalsContact O-CB 3.25Å; L410-K715 WeakPolarHBondContact O-CB 3.49Å; L410-K715 PolarHBondContact O-N 2.85Å; K715-Q718 PolarHBondContact O-NE2 3.04Å
716	R	89.2	Confident	86.7	Confident	2 Å²	2	40.9 Å²	40.9	1%	0.008	22%	0.216	C	C	.	.			trans	-81.1	-13.4	179.7	-70.5	-176.5	-180	-75.2	-2.6	113.2	V412 M714 K726 V727 R729 A826	V412-R716 HydrophobicContact CG2-CG 4.32Å; M714-R716 HydrophobicContact CB-CG 4.18Å; M714-R716 PolarHBondContact O-N 3.41Å; R716-K726 CarbonylContact O-C 3.58Å; R716-K726 WeakPolarHBondContact O-CA 3.15Å; R716-V727 PolarHBondContact NH1-O 2.89Å; R716-V727 PolarHBondContact O-N 3.33Å; R716-R729 PolarHBondContact NH1-O 3.36Å; R716-A826 VanDerWaalsContact CZ-O 3.25Å; R716-A826 PolarHBondContact NE-O 3.19Å; R716-A826 PolarHBondContact NH2-O 3.25Å
717	F	84.3	Confident	86.3	Confident	54 Å²	54	41 Å²	41	24%	0.237	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	123.8	-179	-56.7	-52.9	0	0	0	110	D321 K726 H767 M771 Y827	D321-F717 WeakPolarHBondContact OD2-CE2 3.29Å; F717-K726 HydrophobicContact CD1-CB 4.12Å; F717-K726 HydrophobicContact CD1-CG 4.04Å; F717-K726 HydrophobicContact CE1-CB 4.15Å; F717-K726 HydrophobicContact CE1-CD 3.96Å; F717-K726 HydrophobicContact CE1-CG 3.78Å; F717-H767 AromaticContact CZ-CE1 3.78Å; F717-H767 AromaticContact CZ-ND1 3.55Å; F717-M771 HydrophobicContact CB-CE 3.81Å; F717-M771 HydrophobicContact CB-SD 3.91Å; F717-M771 HydrophobicContact CD1-CE 3.44Å; F717-M771 VanDerWaalsContact CD1-CE 3.44Å; F717-M771 HydrophobicContact CD1-SD 3.32Å; F717-M771 WeakPolarHBondContact CD1-SD 3.37Å; F717-M771 HydrophobicContact CD2-SD 4.46Å; F717-M771 HydrophobicContact CE1-CE 4.3Å; F717-M771 HydrophobicContact CE1-SD 3.81Å; F717-M771 HydrophobicContact CG-CE 3.96Å; F717-M771 HydrophobicContact CG-SD 3.66Å; F717-Y827 HydrophobicContact CD2-CE2 4.39Å; F717-Y827 AromaticContact CE2-CE2 3.96Å; F717-Y827 HydrophobicContact CE2-CE2 3.96Å
718	Q	78.1	Confident	85.9	Confident	52 Å²	52	44.9 Å²	44.9	24%	0.243	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	129.5	-172.4	-63.8	-177.8	7.9	0	0	111.2	V412 K715 C725 V727	V412-Q718 PolarHBondContact O-NE2 2.86Å; K715-Q718 PolarHBondContact O-NE2 3.04Å; Q718-C725 PolarHBondContact N-O 3.33Å; Q718-C725 PolarHBondContact O-N 3.25Å; Q718-C725 PolarHBondContact O-SG 2.96Å; Q718-C725 VanDerWaalsContact O-SG 3.4Å; Q718-V727 HydrophobicContact CG-CG2 4.19Å
719	Q	76.9	Confident	85.6	Confident	80 Å²	80	45.9 Å²	45.9	37%	0.374	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	108.8	176.5	-175.1	175.2	6.2	0	0	110.1	A594 G721 I724	A594-Q719 PolarHBondContact O-NE2 3.06Å; Q719-G721 VanDerWaalsContact CG-O 3.28Å; Q719-G721 WeakPolarHBondContact CG-O 3.3Å; Q719-I724 HydrophobicContact CB-CG2 4.48Å
720	N	67.6	Low	85.4	Confident	54 Å²	54	49 Å²	49	29%	0.289	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	83.3	178.3	-80.6	-35	0	0	0	109	Y417 S723 C725	Y417-N720 HydrophobicContact CE1-CB 4.32Å; N720-S723 CarbonylContact C-O 3.52Å; N720-S723 WeakPolarHBondContact CA-O 3.47Å; N720-S723 PolarHBondContact N-O 3.28Å; N720-S723 PolarHBondContact O-N 2.9Å; N720-S723 PolarHBondContact O-OG 3.21Å; N720-C725 PolarHBondContact ND2-SG 3.03Å
721	G	76.9	Confident	85.2	Confident	56 Å²	56	49.1 Å²	49.1	58%	0.577	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.9	-136.4	-169.4	0	0	0	0	0	110.7	Q719 S723	Q719-G721 VanDerWaalsContact CG-O 3.28Å; Q719-G721 WeakPolarHBondContact CG-O 3.3Å; G721-S723 PolarHBondContact O-N 3.35Å
722	Y	74.9	Confident	85.1	Confident	202 Å²	202	53.3 Å²	53.3	79%	0.792	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	6.6	176.7	-52.4	-71.8	0	0	0	115
723	S	69.5	Low	85	Confident	63 Å²	63	53.3 Å²	53.3	44%	0.441	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	119.5	-177.3	61.4	0	0	0	0	111.7	N720 G721	N720-S723 CarbonylContact C-O 3.52Å; N720-S723 WeakPolarHBondContact CA-O 3.47Å; N720-S723 PolarHBondContact N-O 3.28Å; N720-S723 PolarHBondContact O-N 2.9Å; N720-S723 PolarHBondContact O-OG 3.21Å; G721-S723 PolarHBondContact O-N 3.35Å
724	I	75.5	Confident	84.9	Confident	57 Å²	57	53.7 Å²	53.7	29%	0.292	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	128.6	175.9	-29	164.9	0	0	0	108.6	L597 Q719 M771	L597-I724 HydrophobicContact CD1-CD1 3.47Å; L597-I724 VanDerWaalsContact CD1-CD1 3.47Å; L597-I724 HydrophobicContact CD1-CG1 4.24Å; Q719-I724 HydrophobicContact CB-CG2 4.48Å; I724-M771 HydrophobicContact CB-CE 3.96Å; I724-M771 HydrophobicContact CG2-CE 3.41Å; I724-M771 VanDerWaalsContact CG2-CE 3.41Å; I724-M771 HydrophobicContact CG2-SD 4.25Å
725	C	80.2	Confident	84.9	Confident	39 Å²	39	55.3 Å²	55.3	26%	0.264	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	154.1	-176	63.9	0	0	0	0	113	Q718 N720 M771	Q718-C725 PolarHBondContact N-O 3.33Å; Q718-C725 PolarHBondContact O-N 3.25Å; Q718-C725 PolarHBondContact O-SG 2.96Å; Q718-C725 VanDerWaalsContact O-SG 3.4Å; N720-C725 PolarHBondContact ND2-SG 3.03Å; C725-M771 WeakPolarHBondContact O-CE 3.37Å
726	K	87.8	Confident	85	Confident	27 Å²	27	54.4 Å²	54.4	12%	0.117	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	124	174.4	-174.6	-176.6	173.2	174.5	0	110.6	R716 F717 N728 H767 G769	R716-K726 CarbonylContact O-C 3.58Å; R716-K726 WeakPolarHBondContact O-CA 3.15Å; F717-K726 HydrophobicContact CD1-CB 4.12Å; F717-K726 HydrophobicContact CD1-CG 4.04Å; F717-K726 HydrophobicContact CE1-CB 4.15Å; F717-K726 HydrophobicContact CE1-CD 3.96Å; F717-K726 HydrophobicContact CE1-CG 3.78Å; K726-N728 VanDerWaalsContact CD-OD1 3.31Å; K726-N728 WeakPolarHBondContact CD-OD1 3.35Å; K726-N728 WeakPolarHBondContact CE-OD1 3.37Å; K726-N728 WeakPolarHBondContact CG-OD1 3.31Å; K726-N728 PolarHBondContact O-N 2.94Å; K726-H767 PolarHBondContact NZ-ND1 2.92Å; K726-H767 PolarHBondContact NZ-O 3.07Å; K726-G769 VanDerWaalsContact CD-O 3.3Å; K726-G769 WeakPolarHBondContact CD-O 3.33Å; K726-G769 PolarHBondContact NZ-O 3.44Å
727	V	86.1	Confident	85.3	Confident	8 Å²	8	54.4 Å²	54.4	5%	0.048	28%	0.28	C	S	.	.			trans	-80.6	94.3	176.8	-177.9	0	0	0	0	109.3	V412 D414 R716 Q718 R729	V412-V727 HydrophobicContact CB-CG1 4.41Å; V412-V727 HydrophobicContact CG1-CG1 3.78Å; D414-V727 HydrophobicContact CB-CG1 4.42Å; R716-V727 PolarHBondContact NH1-O 2.89Å; R716-V727 PolarHBondContact O-N 3.33Å; Q718-V727 HydrophobicContact CG-CG2 4.19Å; V727-R729 HydrophobicContact CG1-CB 3.89Å; V727-R729 PolarHBondContact O-N 3.05Å
728	N	86.3	Confident	85.9	Confident	86 Å²	86	53.8 Å²	53.8	46%	0.46	28%	0.279	S	S	.	.			trans	-84.7	17.6	176.1	-59.2	-33.8	0	0	0	112.9	K726 Q825	K726-N728 VanDerWaalsContact CD-OD1 3.31Å; K726-N728 WeakPolarHBondContact CD-OD1 3.35Å; K726-N728 WeakPolarHBondContact CE-OD1 3.37Å; K726-N728 WeakPolarHBondContact CG-OD1 3.31Å; K726-N728 PolarHBondContact O-N 2.94Å; N728-Q825 PolarHBondContact O-NE2 3.14Å
729	R	88.1	Confident	86.6	Confident	69 Å²	69	51.3 Å²	51.3	26%	0.26	27%	0.267	S	S	.	.			trans	-66	133.7	171.2	-171.5	178.9	-178.6	165.9	7.7	108.3	S413 E415 Q648 C650 R716 V727	S413-R729 PolarHBondContact O-NH1 2.9Å; E415-R729 IonicContact OE2-CZ 2.61Å; E415-R729 VanDerWaalsContact OE2-CZ 3.29Å; E415-R729 IonicContact OE2-NH1 2.75Å; E415-R729 PolarHBondContact OE2-NH1 2.79Å; E415-R729 IonicContact OE2-NH2 3.93Å; E415-R729 PolarHBondContact OE2-NH2 2.91Å; Q648-R729 PolarHBondContact O-NH2 3.48Å; C650-R729 VanDerWaalsContact SG-CD 3.57Å; R716-R729 PolarHBondContact NH1-O 3.36Å; V727-R729 HydrophobicContact CG1-CB 3.89Å; V727-R729 PolarHBondContact O-N 3.05Å
730	H	92.3	Very high	87.4	Confident	66 Å²	66	47.5 Å²	47.5	31%	0.306	25%	0.25	S	C	.	.			trans	-62.2	140.9	171.2	-171.6	44.2	0	0	0	109.9	C650 Q732 Q822 C824	C650-H730 PolarHBondContact SG-O 3.28Å; H730-Q732 PolarHBondContact NE2-OE1 3.2Å; H730-Q822 PolarHBondContact CE1-O 3.1Å; H730-Q822 PolarHBondContact NE2-O 3.2Å; H730-Q822 VanDerWaalsContact NE2-O 3.07Å; H730-C824 PolarHBondContact CE1-O 2.88Å; H730-C824 VanDerWaalsContact CE1-O 3.29Å; H730-C824 PolarHBondContact ND1-O 3.23Å
731	V	94.1	Very high	88.6	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.006	24%	0.242	C	C	.	.			trans	-118.6	116.3	173.7	-179.3	0	0	0	0	106	V412 C650 V652 M714 F733	V412-V731 HydrophobicContact CG1-CG2 3.68Å; V412-V731 HydrophobicContact CG2-CG2 4.25Å; C650-V731 CarbonylContact O-C 3.56Å; C650-V731 WeakPolarHBondContact O-CA 3.33Å; V652-V731 HydrophobicContact CG2-CG1 4.28Å; M714-V731 HydrophobicContact SD-CG1 4.19Å; V731-F733 VanDerWaalsContact O-CD1 3.27Å; V731-F733 WeakPolarHBondContact O-CD1 3.39Å
732	Q	95.3	Very high	89.4	Confident	89 Å²	89	44.1 Å²	44.1	42%	0.416	22%	0.218	S	C	.	.	B	Isolated β-bridge	trans	-72.1	129.4	179.9	-171.4	63.2	12.2	0	0	110	C650 S651 V652 H730	C650-Q732 PolarHBondContact O-N 2.91Å; S651-Q732 CarbonylContact C-O 3.57Å; S651-Q732 WeakPolarHBondContact CA-O 3.3Å; V652-Q732 PolarHBondContact N-O 3.32Å; H730-Q732 PolarHBondContact NE2-OE1 3.2Å
733	F	96.6	Very high	90.3	Very high	1 Å²	1	34.5 Å²	34.5	0%	0.004	18%	0.18	C	C	.	.			trans	-125.3	137	174.6	49.1	-91.4	0	0	0	110	V652 V731 L761 V764 V821 A826 L829	V652-F733 HydrophobicContact CG2-CB 3.67Å; V731-F733 VanDerWaalsContact O-CD1 3.27Å; V731-F733 WeakPolarHBondContact O-CD1 3.39Å; F733-L761 HydrophobicContact CD2-CD2 3.69Å; F733-L761 HydrophobicContact CE2-CD2 3.76Å; F733-V764 HydrophobicContact CE2-CG2 4.26Å; F733-V764 HydrophobicContact CZ-CG2 4.48Å; F733-V821 HydrophobicContact CE2-CG1 4.37Å; F733-V821 VanDerWaalsContact CZ-O 3.29Å; F733-V821 WeakPolarHBondContact CZ-O 3.5Å; F733-A826 HydrophobicContact CD1-CB 3.88Å; F733-A826 HydrophobicContact CE1-CB 3.45Å; F733-A826 VanDerWaalsContact CE1-CB 3.45Å; F733-A826 HydrophobicContact CZ-CB 4.1Å; F733-L829 HydrophobicContact CB-CD1 3.82Å; F733-L829 HydrophobicContact CB-CD2 4.33Å; F733-L829 HydrophobicContact CD1-CD1 4.34Å; F733-L829 HydrophobicContact CD1-CD2 4.02Å; F733-L829 HydrophobicContact CD2-CD2 3.89Å; F733-L829 HydrophobicContact CE1-CD2 4.28Å; F733-L829 HydrophobicContact CE2-CD2 4.11Å; F733-L829 HydrophobicContact CG-CD1 4.13Å; F733-L829 HydrophobicContact CG-CD2 3.82Å; F733-L829 HydrophobicContact CZ-CD2 4.29Å
734	P	95.4	Very high	91.3	Very high	24 Å²	24	32.2 Å²	32.2	16%	0.156	17%	0.165	C	C	.	.			trans	-77.1	164.8	177	36.2	-38.5	0	0	0	110.8	I736 L737 Y831	P734-I736 VanDerWaalsContact CB-O 3.24Å; P734-I736 WeakPolarHBondContact CB-O 3.5Å; P734-I736 WeakPolarHBondContact CG-O 3.28Å; P734-L737 HydrophobicContact CG-CB 4.04Å; P734-L737 HydrophobicContact CG-CD1 4.18Å; P734-Y831 PolarHBondContact O-OH 2.91Å
735	L	94.7	Very high	91.7	Very high	34 Å²	34	31.9 Å²	31.9	18%	0.178	17%	0.171	C	C	.	.	S	Bend	trans	-80.2	-28.1	167.7	-63.1	176	0	0	0	111.7	L761 W805 E818 Q822	L735-L761 HydrophobicContact CD2-CD2 4.19Å; L735-L761 PolarHBondContact O-N 3.36Å; L735-W805 HydrophobicContact CD2-CZ2 4.08Å; L735-E818 HydrophobicContact CD1-CB 4.15Å; L735-Q822 HydrophobicContact CD2-CG 4.18Å; L735-Q822 HydrophobicContact CG-CG 4.47Å
736	I	96	Very high	91.7	Very high	79 Å²	79	37.6 Å²	37.6	41%	0.405	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	119.9	172.8	-49.9	-64.4	0	0	0	108.2	P734 L758 Y759 I834	P734-I736 VanDerWaalsContact CB-O 3.24Å; P734-I736 WeakPolarHBondContact CB-O 3.5Å; P734-I736 WeakPolarHBondContact CG-O 3.28Å; I736-L758 HydrophobicContact CG2-CB 4.28Å; I736-L758 HydrophobicContact CG2-CD2 4.43Å; I736-Y759 CarbonylContact C-O 3.6Å; I736-Y759 VanDerWaalsContact CA-O 3.28Å; I736-Y759 WeakPolarHBondContact CA-O 3.26Å; I736-I834 HydrophobicContact CD1-CD1 3.97Å; I736-I834 HydrophobicContact CG2-CD1 4.32Å
737	L	95.9	Very high	91.4	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	126	177.9	175.7	64.9	0	0	0	109.4	V652 Q653 L656 L710 L712 P734 L758 Y759 Y831	V652-L737 HydrophobicContact CG1-CD1 4.43Å; V652-L737 HydrophobicContact CG1-CD2 4.26Å; Q653-L737 HydrophobicContact CG-CD1 4.19Å; L656-L737 HydrophobicContact CD1-CD1 4.21Å; L656-L737 HydrophobicContact CD1-CD2 4.12Å; L710-L737 HydrophobicContact CD2-CD2 4.18Å; L712-L737 HydrophobicContact CD1-CD2 4.07Å; P734-L737 HydrophobicContact CG-CB 4.04Å; P734-L737 HydrophobicContact CG-CD1 4.18Å; L737-L758 CarbonylContact O-C 3.55Å; L737-L758 WeakPolarHBondContact O-CA 3.3Å; L737-Y759 PolarHBondContact N-O 3.04Å; L737-Y759 PolarHBondContact O-N 2.85Å; L737-Y831 HydrophobicContact CB-CD1 4Å; L737-Y831 HydrophobicContact CB-CE1 3.55Å; L737-Y831 HydrophobicContact CD2-CD1 4.45Å; L737-Y831 HydrophobicContact CD2-CD2 4.45Å; L737-Y831 HydrophobicContact CD2-CE1 4.2Å; L737-Y831 HydrophobicContact CD2-CE2 4.19Å
738	D	95	Very high	91.2	Very high	42 Å²	42	41.9 Å²	41.9	23%	0.225	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	126.1	164	-178.8	18.7	0	0	0	109.5	A740 I757 L758	D738-A740 WeakPolarHBondContact OD1-CB 3.27Å; D738-A740 PolarHBondContact OD1-N 2.81Å; D738-I757 WeakPolarHBondContact CA-O 3.32Å; D738-I757 PolarHBondContact OD1-N 2.88Å; D738-L758 HydrophobicContact CB-CD2 3.89Å
739	L	94.9	Very high	90.4	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.218	C	C	.	.			trans	-95.4	-14.3	179.5	-160.1	67.4	0	0	0	112.9	L656 I703 P706 L710 P741 Y742 C743 I757 Y759	L656-L739 HydrophobicContact CD1-CD1 4.35Å; I703-L739 HydrophobicContact CD1-CD1 3.88Å; I703-L739 HydrophobicContact CD1-CD2 3.92Å; I703-L739 HydrophobicContact CD1-CG 3.96Å; P706-L739 HydrophobicContact CB-CD2 3.79Å; L710-L739 HydrophobicContact CD2-CD1 3.81Å; L710-L739 HydrophobicContact CD2-CD2 4.13Å; L739-P741 VanDerWaalsContact C-CD 3.45Å; L739-Y742 HydrophobicContact CD1-CD2 4.24Å; L739-Y742 PolarHBondContact O-N 3.47Å; L739-C743 PolarHBondContact O-N 3.43Å; L739-I757 HydrophobicContact CB-CB 4.13Å; L739-I757 HydrophobicContact CB-CD1 4.48Å; L739-I757 HydrophobicContact CB-CG2 4.46Å; L739-I757 PolarHBondContact N-O 3.21Å; L739-Y759 HydrophobicContact CB-CD2 4.08Å; L739-Y759 HydrophobicContact CB-CE2 3.89Å; L739-Y759 HydrophobicContact CD2-CD2 4.43Å; L739-Y759 HydrophobicContact CD2-CE2 3.63Å; L739-Y759 HydrophobicContact CG-CE2 4.39Å
740	A	92.6	Very high	89.9	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-56.4	-35.9	-173.1	0	0	0	0	0	115.6	L639 S640 D738 Y742 C743 T755 I757	L639-A740 HydrophobicContact CB-CB 4.47Å; L639-A740 HydrophobicContact CD2-CB 4.11Å; L639-A740 HydrophobicContact CG-CB 4.48Å; S640-A740 PolarHBondContact N-O 3.4Å; D738-A740 WeakPolarHBondContact OD1-CB 3.27Å; D738-A740 PolarHBondContact OD1-N 2.81Å; A740-Y742 PolarHBondContact O-N 2.95Å; A740-Y742 VanDerWaalsContact O-N 3.09Å; A740-C743 PolarHBondContact O-N 3.3Å; A740-T755 WeakPolarHBondContact CB-O 3.32Å; A740-I757 HydrophobicContact CB-CD1 4.23Å; A740-I757 HydrophobicContact CB-CG1 4.04Å
741	P	93.3	Very high	88.9	Confident	20 Å²	20	41.9 Å²	41.9	13%	0.13	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-67.4	-4	175.3	-22	35.1	0	0	0	115.4	R642 L739	R642-P741 PolarHBondContact NE-O 3.09Å; R642-P741 VanDerWaalsContact NE-O 3.14Å; L739-P741 VanDerWaalsContact C-CD 3.45Å
742	Y	93.8	Very high	87.5	Confident	18 Å²	18	52 Å²	52	7%	0.071	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-120.1	-1.7	-179.2	-42.6	-69.3	0	0	0	112.5	Q653 L656 F657 L702 I703 L739 A740	Q653-Y742 VanDerWaalsContact CA-OH 3.29Å; Q653-Y742 WeakPolarHBondContact CA-OH 3.44Å; Q653-Y742 WeakPolarHBondContact CB-OH 3.45Å; Q653-Y742 PolarHBondContact O-OH 3.02Å; Q653-Y742 VanDerWaalsContact O-OH 3.09Å; L656-Y742 HydrophobicContact CB-CD1 3.73Å; L656-Y742 HydrophobicContact CB-CD2 4.08Å; L656-Y742 HydrophobicContact CB-CE1 3.62Å; L656-Y742 HydrophobicContact CB-CE2 3.98Å; L656-Y742 HydrophobicContact CB-CG 3.96Å; L656-Y742 HydrophobicContact CD1-CD2 3.97Å; L656-Y742 HydrophobicContact CD1-CE2 3.84Å; F657-Y742 HydrophobicContact CB-CE1 4.1Å; L702-Y742 WeakPolarHBondContact CD2-O 3.36Å; I703-Y742 PolarHBondContact N-O 3.18Å; L739-Y742 HydrophobicContact CD1-CD2 4.24Å; L739-Y742 PolarHBondContact O-N 3.47Å; A740-Y742 PolarHBondContact O-N 2.95Å; A740-Y742 VanDerWaalsContact O-N 3.09Å
743	C	92.8	Very high	86.1	Confident	0 Å²	0	51 Å²	51	0%	0	29%	0.285	C	S	.	.	B	Isolated β-bridge	trans	-94.6	145.9	175.9	-72.5	0	0	0	0	111.7	T638 L639 I703 L739 A740 I757	T638-C743 CarbonylContact C-O 3.58Å; T638-C743 WeakPolarHBondContact CA-O 3.48Å; T638-C743 VanDerWaalsContact CB-O 3.29Å; T638-C743 WeakPolarHBondContact CB-O 3.48Å; T638-C743 WeakPolarHBondContact CG2-O 3.31Å; L639-C743 HydrophobicContact CB-CB 4.19Å; L639-C743 PolarHBondContact N-O 3.04Å; I703-C743 CarbonylContact O-C 3.59Å; I703-C743 WeakPolarHBondContact O-CA 3.25Å; I703-C743 WeakPolarHBondContact O-CB 3.3Å; L739-C743 PolarHBondContact O-N 3.43Å; A740-C743 PolarHBondContact O-N 3.3Å; C743-I757 HydrophobicContact CB-CD1 3.94Å; C743-I757 WeakPolarHBondContact SG-CD1 3.34Å
744	A	89.9	Confident	85.1	Confident	16 Å²	16	54.2 Å²	54.2	13%	0.132	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-66.3	147.2	173.5	0	0	0	0	0	111.1	L702 I703 K746 C747	L702-A744 HydrophobicContact CB-CB 3.96Å; L702-A744 HydrophobicContact CD1-CB 4.35Å; I703-A744 PolarHBondContact O-N 2.8Å; A744-K746 PolarHBondContact O-N 2.78Å; A744-K746 VanDerWaalsContact O-N 3.08Å; A744-C747 WeakPolarHBondContact O-CB 3.46Å; A744-C747 PolarHBondContact O-N 2.9Å
745	A	84.3	Confident	84.4	Confident	50 Å²	50	57 Å²	57	41%	0.413	32%	0.319	S	S	.	.	S	Bend	trans	-59.9	-21.9	-178.5	0	0	0	0	0	114.6	N637	N637-A745 HydrophobicContact CB-CB 3.94Å; N637-A745 WeakPolarHBondContact O-CB 3.4Å; N637-A745 PolarHBondContact O-N 2.62Å
746	K	81.1	Confident	84.1	Confident	159 Å²	159	61.5 Å²	61.5	69%	0.691	34%	0.339	S	S	*	.	S	Bend	trans	-105.8	67.6	170.9	-68.4	-178.3	179.6	175.4	0	110.1	A744	A744-K746 PolarHBondContact O-N 2.78Å; A744-K746 VanDerWaalsContact O-N 3.08Å
747	C	82.1	Confident	84	Confident	19 Å²	19	58 Å²	58	13%	0.128	32%	0.321	C	S	.	.			trans	-84.6	135.9	-178.7	-147.5	0	0	0	0	111	A744 I750	A744-C747 WeakPolarHBondContact O-CB 3.46Å; A744-C747 PolarHBondContact O-N 2.9Å; C747-I750 HydrophobicContact CB-CD1 3.9Å
748	K	79.9	Confident	83.9	Confident	106 Å²	106	60.9 Å²	60.9	46%	0.461	34%	0.336	S	S	.	.	S	Bend	trans	-75.3	152.7	174.6	-61.6	178.3	179.3	176.4	0	110.3	E385 S704 I750	E385-K748 IonicContact OE1-NZ 2.68Å; E385-K748 WeakPolarHBondContact OE2-CE 3.29Å; E385-K748 IonicContact OE2-NZ 3.16Å; E385-K748 PolarHBondContact OE2-NZ 3.31Å; S704-K748 WeakPolarHBondContact O-CB 3.32Å; S704-K748 PolarHBondContact O-N 3.42Å; K748-I750 PolarHBondContact O-N 2.73Å
749	N	71	Confident	84	Confident	110 Å²	110	58.9 Å²	58.9	59%	0.588	33%	0.325	S	S	*	.	S	Bend	trans	62.9	37.7	173.2	-47	-55.4	0	0	0	114.2	S705 R833	S705-N749 PolarHBondContact OG-ND2 3.09Å; N749-R833 PolarHBondContact O-NH1 3.43Å; N749-R833 PolarHBondContact O-NH2 3.46Å
750	I	76.4	Confident	84	Confident	34 Å²	34	60 Å²	60	17%	0.174	33%	0.334	C	S	.	.	S	Bend	trans	-145.2	145.9	-179.7	-65.4	-173.9	0	0	0	107.3	L639 P706 C747 K748 D754 I757	L639-I750 HydrophobicContact CD2-CD1 3.76Å; L639-I750 HydrophobicContact CD2-CG2 4.19Å; P706-I750 HydrophobicContact CG-CD1 4.24Å; C747-I750 HydrophobicContact CB-CD1 3.9Å; K748-I750 PolarHBondContact O-N 2.73Å; I750-D754 HydrophobicContact CG2-CB 3.57Å; I750-I757 HydrophobicContact CD1-CD1 3.32Å; I750-I757 HydrophobicContact CD1-CG1 3.54Å
751	S	72.1	Confident	84.2	Confident	77 Å²	77	60 Å²	60	54%	0.538	33%	0.334	S	S	.	.			trans	-83.3	151.4	-179.1	-33.3	0	0	0	0	111.6	G753 D754	S751-G753 PolarHBondContact O-N 3.28Å; S751-D754 WeakPolarHBondContact CA-OD2 3.32Å; S751-D754 WeakPolarHBondContact CB-OD2 3.42Å; S751-D754 PolarHBondContact N-OD2 3.29Å; S751-D754 PolarHBondContact O-N 2.82Å; S751-D754 VanDerWaalsContact O-N 3.12Å; S751-D754 PolarHBondContact OG-OD2 3.47Å
752	E	64.3	Low	84.3	Confident	214 Å²	214	59.5 Å²	59.5	100%	1	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	100.4	175.4	-66	-168.2	150	0	0	110.9
753	G	65	Low	84.5	Confident	66 Å²	66	58.7 Å²	58.7	68%	0.68	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	129.2	-16.8	-178.1	0	0	0	0	0	114.4	S751 T755	S751-G753 PolarHBondContact O-N 3.28Å; G753-T755 PolarHBondContact O-N 3.35Å
754	D	76.4	Confident	84.7	Confident	69 Å²	69	58.7 Å²	58.7	37%	0.369	33%	0.326	S	S	.	.			trans	-69.9	116.9	177.9	-65.6	-24.9	0	0	0	110.5	L639 I750 S751	L639-D754 WeakPolarHBondContact CD1-O 3.45Å; I750-D754 HydrophobicContact CG2-CB 3.57Å; S751-D754 WeakPolarHBondContact CA-OD2 3.32Å; S751-D754 WeakPolarHBondContact CB-OD2 3.42Å; S751-D754 PolarHBondContact N-OD2 3.29Å; S751-D754 PolarHBondContact O-N 2.82Å; S751-D754 VanDerWaalsContact O-N 3.12Å; S751-D754 PolarHBondContact OG-OD2 3.47Å
755	T	81.7	Confident	85.1	Confident	84 Å²	84	57.9 Å²	57.9	52%	0.515	32%	0.32	S	S	.	.			trans	-108.6	10	-176.7	49.3	0	0	0	0	114	S640 A740 G753	S640-T755 VanDerWaalsContact CB-O 3.29Å; S640-T755 WeakPolarHBondContact CB-O 3.29Å; S640-T755 PolarHBondContact OG-O 3.11Å; A740-T755 WeakPolarHBondContact CB-O 3.32Å; G753-T755 PolarHBondContact O-N 3.35Å
756	Q	88.4	Confident	85.7	Confident	128 Å²	128	57 Å²	57	60%	0.598	31%	0.307	S	S	*	.			trans	-138.6	144.1	-179.8	-67.3	-176	-24.1	0	0	110.2	L758	Q756-L758 HydrophobicContact CB-CD2 4.34Å; Q756-L758 HydrophobicContact CB-CG 4.48Å
757	I	92.4	Very high	86.4	Confident	5 Å²	5	49.9 Å²	49.9	3%	0.026	28%	0.276	C	S	.	.			trans	-134.9	89	173.3	-47.2	162.6	0	0	0	107.3	L639 P706 D738 L739 A740 C743 I750 Y759	L639-I757 HydrophobicContact CD2-CD1 3.76Å; L639-I757 HydrophobicContact CD2-CG1 3.96Å; P706-I757 HydrophobicContact CG-CD1 4.42Å; P706-I757 HydrophobicContact CG-CG2 4.45Å; D738-I757 WeakPolarHBondContact CA-O 3.32Å; D738-I757 PolarHBondContact OD1-N 2.88Å; L739-I757 HydrophobicContact CB-CB 4.13Å; L739-I757 HydrophobicContact CB-CD1 4.48Å; L739-I757 HydrophobicContact CB-CG2 4.46Å; L739-I757 PolarHBondContact N-O 3.21Å; A740-I757 HydrophobicContact CB-CD1 4.23Å; A740-I757 HydrophobicContact CB-CG1 4.04Å; C743-I757 HydrophobicContact CB-CD1 3.94Å; C743-I757 WeakPolarHBondContact SG-CD1 3.34Å; I750-I757 HydrophobicContact CD1-CD1 3.32Å; I750-I757 HydrophobicContact CD1-CG1 3.54Å; I757-Y759 HydrophobicContact CG2-CD2 4.32Å; I757-Y759 HydrophobicContact CG2-CE2 3.61Å; I757-Y759 WeakPolarHBondContact O-CD2 3.34Å
758	L	94.7	Very high	86.8	Confident	61 Å²	61	51.7 Å²	51.7	32%	0.319	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	138.4	-172.4	-54.8	-177.1	0	0	0	111.7	I736 L737 D738 Q756 I834	I736-L758 HydrophobicContact CG2-CB 4.28Å; I736-L758 HydrophobicContact CG2-CD2 4.43Å; L737-L758 CarbonylContact O-C 3.55Å; L737-L758 WeakPolarHBondContact O-CA 3.3Å; D738-L758 HydrophobicContact CB-CD2 3.89Å; Q756-L758 HydrophobicContact CB-CD2 4.34Å; Q756-L758 HydrophobicContact CB-CG 4.48Å; L758-I834 HydrophobicContact CB-CB 4.26Å; L758-I834 HydrophobicContact CB-CD1 4.1Å; L758-I834 HydrophobicContact CB-CG1 4.46Å; L758-I834 PolarHBondContact O-N 2.89Å
759	Y	96.3	Very high	87.3	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	131.2	176.7	-79.7	-96.2	0	0	0	110.8	P706 P707 L710 I736 L737 L739 I757 E832 R833	P706-Y759 WeakPolarHBondContact CB-OH 3.47Å; P707-Y759 WeakPolarHBondContact O-CE1 3.29Å; P707-Y759 PolarHBondContact O-OH 3.44Å; L710-Y759 HydrophobicContact CB-CD1 3.97Å; L710-Y759 HydrophobicContact CB-CE1 3.71Å; I736-Y759 CarbonylContact C-O 3.6Å; I736-Y759 VanDerWaalsContact CA-O 3.28Å; I736-Y759 WeakPolarHBondContact CA-O 3.26Å; L737-Y759 PolarHBondContact N-O 3.04Å; L737-Y759 PolarHBondContact O-N 2.85Å; L739-Y759 HydrophobicContact CB-CD2 4.08Å; L739-Y759 HydrophobicContact CB-CE2 3.89Å; L739-Y759 HydrophobicContact CD2-CD2 4.43Å; L739-Y759 HydrophobicContact CD2-CE2 3.63Å; L739-Y759 HydrophobicContact CG-CE2 4.39Å; I757-Y759 HydrophobicContact CG2-CD2 4.32Å; I757-Y759 HydrophobicContact CG2-CE2 3.61Å; I757-Y759 WeakPolarHBondContact O-CD2 3.34Å; Y759-E832 CarbonylContact C-O 3.55Å; Y759-E832 WeakPolarHBondContact CA-O 3.42Å; Y759-E832 VanDerWaalsContact CD1-C 3.45Å; Y759-R833 HydrophobicContact CD1-CB 4.1Å; Y759-R833 VanDerWaalsContact CD1-N 3.33Å; Y759-R833 HydrophobicContact CE1-CB 3.64Å; Y759-R833 HydrophobicContact CE1-CG 4.45Å
760	S	95.5	Very high	88	Confident	25 Å²	25	47.2 Å²	47.2	18%	0.175	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	127.9	169.8	-177.3	0	0	0	0	110.4	Y762 Y831 E832	S760-Y762 PolarHBondContact O-N 3.02Å; S760-Y831 CarbonylContact O-C 3.51Å; S760-Y831 WeakPolarHBondContact O-CA 3.21Å; S760-E832 PolarHBondContact N-O 3.18Å; S760-E832 PolarHBondContact O-N 2.96Å
761	L	96.8	Very high	88.2	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	130.3	163.9	-170.7	78.4	0	0	0	108.9	F733 L735 V764 W805 L829 Y831	F733-L761 HydrophobicContact CD2-CD2 3.69Å; F733-L761 HydrophobicContact CE2-CD2 3.76Å; L735-L761 HydrophobicContact CD2-CD2 4.19Å; L735-L761 PolarHBondContact O-N 3.36Å; L761-V764 HydrophobicContact CD1-CG2 4.47Å; L761-V764 HydrophobicContact CD2-CG2 4.02Å; L761-V764 HydrophobicContact CG-CG2 4.5Å; L761-W805 HydrophobicContact CD2-CH2 3.79Å; L761-W805 HydrophobicContact CD2-CZ2 4.16Å; L761-W805 HydrophobicContact CG-CH2 3.95Å; L761-W805 HydrophobicContact CG-CZ2 4.48Å; L761-L829 HydrophobicContact CD1-CB 4.1Å; L761-L829 HydrophobicContact CD1-CD2 3.8Å; L761-Y831 HydrophobicContact CB-CD1 3.99Å; L761-Y831 HydrophobicContact CB-CE1 3.7Å; L761-Y831 HydrophobicContact CD1-CD1 4.15Å; L761-Y831 HydrophobicContact CD1-CD2 3.94Å; L761-Y831 HydrophobicContact CD1-CE1 3.83Å; L761-Y831 HydrophobicContact CD1-CE2 3.61Å; L761-Y831 HydrophobicContact CD1-CG 4.21Å; L761-Y831 HydrophobicContact CG-CE1 4.37Å
762	Y	96	Very high	88.5	Confident	9 Å²	9	52.2 Å²	52.2	4%	0.035	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	-12.1	173.6	74.9	-82.9	0	0	0	113.2	Q238 T239 V709 S760 V780 K781 F830 E832	Q238-Y762 HydrophobicContact CB-CD2 4.25Å; Q238-Y762 HydrophobicContact CB-CE2 4.41Å; T239-Y762 PolarHBondContact OG1-OH 2.86Å; V709-Y762 HydrophobicContact CG1-CE1 4.11Å; V709-Y762 VanDerWaalsContact CG1-OH 3.28Å; V709-Y762 WeakPolarHBondContact CG1-OH 3.28Å; S760-Y762 PolarHBondContact O-N 3.02Å; Y762-V780 CarbonylContact O-C 3.56Å; Y762-V780 WeakPolarHBondContact O-CA 3.41Å; Y762-K781 PolarHBondContact O-N 3.15Å; Y762-F830 HydrophobicContact CD1-CB 4.36Å; Y762-F830 VanDerWaalsContact CD1-O 3.3Å; Y762-F830 WeakPolarHBondContact CD1-O 3.38Å; Y762-F830 HydrophobicContact CE1-CB 3.73Å; Y762-F830 HydrophobicContact CE2-CB 4.29Å; Y762-F830 PolarHBondContact N-O 2.85Å; Y762-E832 HydrophobicContact CD1-CB 3.82Å; Y762-E832 HydrophobicContact CE1-CB 3.91Å
763	G	97	Very high	89.5	Confident	0 Å²	0	45 Å²	45	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	145.6	-176.9	0	0	0	0	0	113.9	N235 Y779 F830	N235-G763 WeakPolarHBondContact OD1-CA 3.21Å; G763-Y779 CarbonylContact C-O 3.53Å; G763-Y779 WeakPolarHBondContact CA-O 3.36Å; G763-F830 PolarHBondContact N-O 3.48Å; G763-F830 PolarHBondContact O-N 3.15Å
764	V	98.3	Very high	90.8	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	144	174.4	-168.3	0	0	0	0	109.3	N235 F733 L761 A778 Y779 W805 V821 A826 L828 L829	N235-V764 PolarHBondContact ND2-O 3.46Å; N235-V764 VanDerWaalsContact ND2-O 3.17Å; N235-V764 PolarHBondContact OD1-N 3.31Å; N235-V764 PolarHBondContact OD1-O 2.98Å; F733-V764 HydrophobicContact CE2-CG2 4.26Å; F733-V764 HydrophobicContact CZ-CG2 4.48Å; L761-V764 HydrophobicContact CD1-CG2 4.47Å; L761-V764 HydrophobicContact CD2-CG2 4.02Å; L761-V764 HydrophobicContact CG-CG2 4.5Å; V764-A778 CarbonylContact O-C 3.52Å; V764-A778 VanDerWaalsContact O-CA 3.3Å; V764-A778 WeakPolarHBondContact O-CA 3.2Å; V764-Y779 HydrophobicContact CB-CD2 4.28Å; V764-Y779 PolarHBondContact N-O 3.47Å; V764-Y779 PolarHBondContact O-N 3.42Å; V764-W805 HydrophobicContact CG2-CZ3 4.48Å; V764-V821 HydrophobicContact CG2-CG1 3.91Å; V764-A826 HydrophobicContact CG1-CB 3.59Å; V764-L828 WeakPolarHBondContact CA-O 3.23Å; V764-L829 HydrophobicContact CB-CD2 4.38Å; V764-L829 HydrophobicContact CG1-CD2 3.88Å; V764-L829 HydrophobicContact CG2-CD2 3.91Å
765	V	98.2	Very high	91.7	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	126.5	160.8	175	0	0	0	0	108.2	A231 N235 Y776 T777 Y827 L828 F830	A231-V765 HydrophobicContact CB-CG1 4Å; A231-V765 HydrophobicContact CB-CG2 4.2Å; N235-V765 VanDerWaalsContact ND2-CG2 3.32Å; N235-V765 WeakPolarHBondContact ND2-CG2 3.34Å; V765-Y776 HydrophobicContact CG1-CD1 3.7Å; V765-Y776 HydrophobicContact CG1-CE1 4.43Å; V765-T777 CarbonylContact C-O 3.57Å; V765-T777 WeakPolarHBondContact CA-O 3.31Å; V765-Y827 WeakPolarHBondContact O-CB 3.48Å; V765-Y827 PolarHBondContact O-N 3.37Å; V765-L828 HydrophobicContact CB-CB 3.97Å; V765-L828 HydrophobicContact CB-CD1 4.49Å; V765-L828 HydrophobicContact CB-CG 4.35Å; V765-L828 HydrophobicContact CG2-CB 4.2Å; V765-L828 HydrophobicContact CG2-CD1 4.24Å; V765-L828 PolarHBondContact N-O 3.39Å; V765-L828 PolarHBondContact O-N 3.19Å; V765-F830 HydrophobicContact CG2-CE2 4.19Å
766	E	96.6	Very high	92.4	Very high	31 Å²	31	38.8 Å²	38.8	15%	0.145	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	130.5	172.4	173	169.4	-131.2	0	0	109.8	Y776 T777 Y779 C824 Q825	E766-Y776 WeakPolarHBondContact O-CA 3.39Å; E766-T777 PolarHBondContact N-O 2.81Å; E766-T777 PolarHBondContact O-N 2.71Å; E766-Y779 HydrophobicContact CB-CD2 4.44Å; E766-Y779 HydrophobicContact CB-CE2 3.79Å; E766-Y779 VanDerWaalsContact OE2-CE2 3.26Å; E766-Y779 WeakPolarHBondContact OE2-CE2 3.28Å; E766-Y779 PolarHBondContact OE2-OH 2.68Å; E766-C824 WeakPolarHBondContact OE1-CA 3.31Å; E766-C824 WeakPolarHBondContact OE1-CB 3.39Å; E766-Q825 HydrophobicContact CG-CB 4.42Å; E766-Q825 PolarHBondContact OE1-N 3.44Å
767	H	94.9	Very high	92.9	Very high	9 Å²	9	33.2 Å²	33.2	4%	0.042	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	108.1	173.8	178.6	-157.5	0	0	0	110.5	F717 K726 T770 Y776 Y827	F717-H767 AromaticContact CZ-CE1 3.78Å; F717-H767 AromaticContact CZ-ND1 3.55Å; K726-H767 PolarHBondContact NZ-ND1 2.92Å; K726-H767 PolarHBondContact NZ-O 3.07Å; H767-T770 PolarHBondContact CE1-O 2.92Å; H767-Y776 HydrophobicContact CB-CD1 3.8Å; H767-Y776 HydrophobicContact CB-CE1 3.57Å; H767-Y776 AromaticContact CG-CE1 3.68Å; H767-Y776 AromaticContact CG-CZ 3.89Å; H767-Y827 HydrophobicContact CB-CG 4.34Å
768	S	92.1	Very high	93.1	Very high	57 Å²	57	33 Å²	33	40%	0.399	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	147.1	171	68.5	0	0	0	0	111.3	G774 H775	S768-G774 CarbonylContact O-C 3.53Å; S768-G774 WeakPolarHBondContact O-CA 3.3Å; S768-H775 PolarHBondContact N-O 3.3Å; S768-H775 PolarHBondContact O-N 3.05Å; S768-H775 PolarHBondContact OG-O 3.02Å
769	G	89.4	Confident	93.3	Very high	42 Å²	42	30.2 Å²	30.2	43%	0.433	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	99.7	-152.8	179.6	0	0	0	0	0	114.9	K726	K726-G769 VanDerWaalsContact CD-O 3.3Å; K726-G769 WeakPolarHBondContact CD-O 3.33Å; K726-G769 PolarHBondContact NZ-O 3.44Å
770	T	86.2	Confident	93.3	Very high	80 Å²	80	30.2 Å²	30.2	49%	0.491	17%	0.173	S	C	.	.			trans	-109.1	-163.4	-165.5	72.4	0	0	0	0	112.9	H767 R772 S773	H767-T770 PolarHBondContact CE1-O 2.92Å; T770-R772 PolarHBondContact OG1-N 3.18Å; T770-S773 WeakPolarHBondContact CA-O 3.42Å; T770-S773 PolarHBondContact N-O 3.36Å; T770-S773 PolarHBondContact OG1-N 3.44Å; T770-S773 VanDerWaalsContact OG1-N 3.15Å; T770-S773 PolarHBondContact OG1-O 3.35Å
771	M	79.3	Confident	93.2	Very high	68 Å²	68	30.7 Å²	30.7	34%	0.335	17%	0.172	S	C	.	.	S	Bend	trans	-76.5	-46.1	168.8	-168.8	79.3	62.2	0	0	112	F717 I724 C725	F717-M771 HydrophobicContact CB-CE 3.81Å; F717-M771 HydrophobicContact CB-SD 3.91Å; F717-M771 HydrophobicContact CD1-CE 3.44Å; F717-M771 VanDerWaalsContact CD1-CE 3.44Å; F717-M771 HydrophobicContact CD1-SD 3.32Å; F717-M771 WeakPolarHBondContact CD1-SD 3.37Å; F717-M771 HydrophobicContact CD2-SD 4.46Å; F717-M771 HydrophobicContact CE1-CE 4.3Å; F717-M771 HydrophobicContact CE1-SD 3.81Å; F717-M771 HydrophobicContact CG-CE 3.96Å; F717-M771 HydrophobicContact CG-SD 3.66Å; I724-M771 HydrophobicContact CB-CE 3.96Å; I724-M771 HydrophobicContact CG2-CE 3.41Å; I724-M771 VanDerWaalsContact CG2-CE 3.41Å; I724-M771 HydrophobicContact CG2-SD 4.25Å; C725-M771 WeakPolarHBondContact O-CE 3.37Å
772	R	79.6	Confident	92.8	Very high	148 Å²	148	31.9 Å²	31.9	56%	0.558	18%	0.179	S	C	*	.	S	Bend	trans	-85.6	-18.2	-171.5	-67.6	-176.9	175.4	-83.8	8	113.4	L589 D590 T770	L589-R772 PolarHBondContact O-NH2 2.99Å; D590-R772 IonicContact OD1-CZ 3.68Å; D590-R772 IonicContact OD1-NE 3.88Å; D590-R772 IonicContact OD1-NH2 2.68Å; D590-R772 PolarHBondContact OD1-NH2 3.43Å; T770-R772 PolarHBondContact OG1-N 3.18Å
773	S	85.9	Confident	91.9	Very high	63 Å²	63	36.4 Å²	36.4	44%	0.441	20%	0.196	S	C	.	.	S	Bend	trans	-162.5	145.3	171	-172.2	0	0	0	0	111.7	Q319 T770	Q319-S773 VanDerWaalsContact OE1-CB 3.32Å; Q319-S773 PolarHBondContact OE1-OG 3.08Å; T770-S773 WeakPolarHBondContact CA-O 3.42Å; T770-S773 PolarHBondContact N-O 3.36Å; T770-S773 PolarHBondContact OG1-N 3.44Å; T770-S773 VanDerWaalsContact OG1-N 3.15Å; T770-S773 PolarHBondContact OG1-O 3.35Å
774	G	91.2	Very high	90.2	Very high	18 Å²	18	39 Å²	39	19%	0.186	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.7	-171.2	179.4	0	0	0	0	0	112.4	S768	S768-G774 CarbonylContact O-C 3.53Å; S768-G774 WeakPolarHBondContact O-CA 3.3Å
775	H	95.4	Very high	87.9	Confident	55 Å²	55	43 Å²	43	26%	0.255	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	133.5	178	-178.7	59.6	0	0	0	111	C227 S768 S809 D810	C227-H775 VanDerWaalsContact CB-CE1 3.41Å; C227-H775 WeakPolarHBondContact CB-CE1 3.02Å; C227-H775 WeakPolarHBondContact CB-ND1 3.39Å; C227-H775 PolarHBondContact SG-ND1 3.16Å; S768-H775 PolarHBondContact N-O 3.3Å; S768-H775 PolarHBondContact O-N 3.05Å; S768-H775 PolarHBondContact OG-O 3.02Å; H775-S809 PolarHBondContact NE2-OG 2.86Å; H775-D810 IonicContact CE1-OD2 3.5Å
776	Y	97.1	Very high	85.1	Confident	16 Å²	16	47.4 Å²	47.4	6%	0.063	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	137	180	-71.8	-84.7	0	0	0	111	F228 D321 S322 V765 E766 H767 Y827	F228-Y776 HydrophobicContact CB-CD2 3.52Å; F228-Y776 HydrophobicContact CB-CE2 3.7Å; F228-Y776 HydrophobicContact CB-CG 4.24Å; D321-Y776 PolarHBondContact OD2-OH 3.13Å; S322-Y776 VanDerWaalsContact OG-CE1 3.25Å; S322-Y776 WeakPolarHBondContact OG-CE1 3.47Å; V765-Y776 HydrophobicContact CG1-CD1 3.7Å; V765-Y776 HydrophobicContact CG1-CE1 4.43Å; E766-Y776 WeakPolarHBondContact O-CA 3.39Å; H767-Y776 HydrophobicContact CB-CD1 3.8Å; H767-Y776 HydrophobicContact CB-CE1 3.57Å; H767-Y776 AromaticContact CG-CE1 3.68Å; H767-Y776 AromaticContact CG-CZ 3.89Å; Y776-Y827 AromaticContact CE1-CD1 3.78Å; Y776-Y827 HydrophobicContact CE1-CD1 3.78Å; Y776-Y827 HydrophobicContact CE1-CE1 4.13Å
777	T	97.6	Very high	82.3	Confident	11 Å²	11	53.5 Å²	53.5	7%	0.067	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	157	173	65	0	0	0	0	110.3	V765 E766 H807 I808	V765-T777 CarbonylContact C-O 3.57Å; V765-T777 WeakPolarHBondContact CA-O 3.31Å; E766-T777 PolarHBondContact N-O 2.81Å; E766-T777 PolarHBondContact O-N 2.71Å; T777-H807 VanDerWaalsContact CB-NE2 3.27Å; T777-H807 WeakPolarHBondContact CB-NE2 3.41Å; T777-H807 PolarHBondContact OG1-NE2 3.33Å; T777-I808 WeakPolarHBondContact CA-O 3.43Å; T777-I808 WeakPolarHBondContact CB-O 3.44Å
778	A	98.1	Very high	79.3	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	150.6	178.3	0	0	0	0	0	111.6	A231 Q234 V764 V780 H807 I808	A231-A778 HydrophobicContact CB-CB 4.39Å; Q234-A778 HydrophobicContact CB-CB 3.67Å; Q234-A778 HydrophobicContact CG-CB 4.19Å; V764-A778 CarbonylContact O-C 3.52Å; V764-A778 VanDerWaalsContact O-CA 3.3Å; V764-A778 WeakPolarHBondContact O-CA 3.2Å; A778-V780 HydrophobicContact CB-CG1 4.48Å; A778-H807 CarbonylContact O-C 3.57Å; A778-H807 WeakPolarHBondContact O-CA 3.45Å; A778-H807 PolarHBondContact O-CD2 2.7Å; A778-H807 VanDerWaalsContact O-CD2 3.26Å; A778-I808 PolarHBondContact N-O 3.4Å; A778-I808 PolarHBondContact O-N 3.33Å
779	Y	97.9	Very high	76.6	Confident	3 Å²	3	65 Å²	65	1%	0.012	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	128.1	160.8	-57.8	-99.3	0	0	0	107.8	G763 V764 E766 F806 H807 V816 V821 C824	G763-Y779 CarbonylContact C-O 3.53Å; G763-Y779 WeakPolarHBondContact CA-O 3.36Å; V764-Y779 HydrophobicContact CB-CD2 4.28Å; V764-Y779 PolarHBondContact N-O 3.47Å; V764-Y779 PolarHBondContact O-N 3.42Å; E766-Y779 HydrophobicContact CB-CD2 4.44Å; E766-Y779 HydrophobicContact CB-CE2 3.79Å; E766-Y779 VanDerWaalsContact OE2-CE2 3.26Å; E766-Y779 WeakPolarHBondContact OE2-CE2 3.28Å; E766-Y779 PolarHBondContact OE2-OH 2.68Å; Y779-F806 CarbonylContact C-O 3.58Å; Y779-F806 VanDerWaalsContact CA-O 3.25Å; Y779-F806 WeakPolarHBondContact CA-O 3.47Å; Y779-H807 HydrophobicContact CD1-CB 3.86Å; Y779-H807 AromaticContact CD1-CD2 3.63Å; Y779-H807 HydrophobicContact CE1-CB 3.86Å; Y779-H807 AromaticContact CE1-CD2 3.29Å; Y779-H807 WeakPolarHBondContact CE1-CD2 3.3Å; Y779-H807 AromaticContact CE1-CG 3.73Å; Y779-H807 AromaticContact CE2-CD2 3.72Å; Y779-H807 AromaticContact CZ-CD2 3.35Å; Y779-H807 AromaticContact CZ-NE2 3.76Å; Y779-V816 HydrophobicContact CD1-CG2 4.16Å; Y779-V821 HydrophobicContact CD1-CG2 3.9Å; Y779-V821 HydrophobicContact CG-CG1 4.4Å; Y779-V821 HydrophobicContact CG-CG2 4.36Å; Y779-C824 HydrophobicContact CD2-CB 4.35Å; Y779-C824 HydrophobicContact CE2-CB 3.57Å; Y779-C824 VanDerWaalsContact CE2-SG 3.6Å
780	V	96.1	Very high	73.8	Confident	0 Å²	0	68 Å²	68	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	147.4	-179.4	-51.1	0	0	0	0	111.8	V217 Q234 Q238 Y762 A778 W805 F806 I808	V217-V780 HydrophobicContact CG1-CG2 4.33Å; V217-V780 HydrophobicContact CG2-CG2 3.81Å; Q234-V780 HydrophobicContact CB-CG1 4.22Å; Q238-V780 HydrophobicContact CG-CB 4.03Å; Q238-V780 HydrophobicContact CG-CG1 4.46Å; Q238-V780 HydrophobicContact CG-CG2 4.01Å; Y762-V780 CarbonylContact O-C 3.56Å; Y762-V780 WeakPolarHBondContact O-CA 3.41Å; A778-V780 HydrophobicContact CB-CG1 4.48Å; V780-W805 CarbonylContact O-C 3.58Å; V780-W805 WeakPolarHBondContact O-CA 3.37Å; V780-F806 HydrophobicContact CG2-CB 4.48Å; V780-F806 PolarHBondContact N-O 2.8Å; V780-F806 PolarHBondContact O-N 3Å; V780-I808 HydrophobicContact CB-CD1 4.5Å; V780-I808 HydrophobicContact CG1-CD1 4.23Å; V780-I808 HydrophobicContact CG2-CD1 3.71Å
781	K	93.6	Very high	71.4	Confident	35 Å²	35	68.9 Å²	68.9	15%	0.152	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	112.1	178.7	-165.6	173.9	-173.4	154.8	0	110.2	Y762 G803 S804 W805 E818	Y762-K781 PolarHBondContact O-N 3.15Å; K781-G803 WeakPolarHBondContact CE-O 3.41Å; K781-S804 CarbonylContact C-O 3.49Å; K781-S804 WeakPolarHBondContact CA-O 3.38Å; K781-W805 HydrophobicContact CB-CD2 3.78Å; K781-W805 HydrophobicContact CB-CE3 3.91Å; K781-W805 HydrophobicContact CB-CG 4.42Å; K781-W805 HydrophobicContact CB-CH2 3.95Å; K781-W805 HydrophobicContact CB-CZ2 3.85Å; K781-W805 HydrophobicContact CB-CZ3 3.98Å; K781-W805 HydrophobicContact CD-CD2 4.45Å; K781-W805 HydrophobicContact CD-CZ2 3.75Å; K781-W805 HydrophobicContact CG-CD2 4.12Å; K781-W805 HydrophobicContact CG-CG 4.37Å; K781-W805 HydrophobicContact CG-CZ2 4.19Å; K781-E818 IonicContact NZ-OE1 3.16Å; K781-E818 PolarHBondContact NZ-OE1 3.22Å
782	T	87.9	Confident	69	Low	25 Å²	25	73.5 Å²	73.5	15%	0.153	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-74.9	129.4	170.6	54.5	0	0	0	0	109.8	V217 G803 S804 F806	V217-T782 HydrophobicContact CG2-CG2 3.43Å; V217-T782 VanDerWaalsContact CG2-CG2 3.43Å; T782-G803 CarbonylContact O-C 3.59Å; T782-G803 WeakPolarHBondContact O-CA 3.48Å; T782-S804 PolarHBondContact N-O 3.25Å; T782-S804 PolarHBondContact O-N 3.18Å; T782-S804 PolarHBondContact OG1-O 2.79Å; T782-F806 HydrophobicContact CG2-CD2 3.9Å; T782-F806 HydrophobicContact CG2-CE2 3.67Å
783	R	77.6	Confident	66.9	Low	103 Å²	103	70 Å²	70	39%	0.389	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-70.2	139.8	169.1	-72.1	177.1	169.1	171.7	-1	110.3	Q240 E832	Q240-R783 VanDerWaalsContact OE1-CD 3.27Å; R783-E832 IonicContact CZ-OE1 3.62Å; R783-E832 IonicContact CZ-OE2 3.42Å; R783-E832 IonicContact NH1-OE1 4Å; R783-E832 PolarHBondContact NH1-OE1 3.33Å; R783-E832 IonicContact NH1-OE2 2.72Å; R783-E832 IonicContact NH2-OE1 3.84Å; R783-E832 PolarHBondContact NH2-OE1 2.84Å; R783-E832 IonicContact NH2-OE2 2.72Å; R783-E832 PolarHBondContact NH2-OE2 2.92Å
784	P	62.3	Low	64.2	Low	55 Å²	55	74.8 Å²	74.8	36%	0.357	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-63.7	142	172.1	-21.4	35.3	0	0	0	111	S786 P801	P784-S786 PolarHBondContact O-N 3.11Å; P784-P801 HydrophobicContact CG-CB 4.21Å; P784-P801 WeakPolarHBondContact CG-O 3.12Å
785	D	48.6	Very low	61.8	Low	85 Å²	85	83.4 Å²	83.4	46%	0.455	46%	0.463	S	S	.	.			trans	-73.1	109	178.2	-144.4	0.8	0	0	0	109.3	C213 S214	C213-D785 PolarHBondContact N-OD1 3.14Å; C213-D785 VanDerWaalsContact N-OD1 3.14Å; S214-D785 PolarHBondContact N-OD1 2.69Å; S214-D785 PolarHBondContact OG-OD2 3.02Å
786	S	39.3	Very low	58.6	Low	91 Å²	91	83.9 Å²	83.9	64%	0.636	48%	0.483	S	S	*	.			trans	-122.4	55.9	-159.8	59	0	0	0	0	115	P784	P784-S786 PolarHBondContact O-N 3.11Å
787	L	37.2	Very low	55.9	Low	160 Å²	160	92.6 Å²	92.6	84%	0.838	52%	0.524	S	S	*	.			trans	-90.8	129.1	139.3	-87.7	73.4	0	0	0	107.3
788	K	32.3	Very low	52.8	Low	191 Å²	191	97.6 Å²	97.6	83%	0.83	56%	0.555	S	S	*	*			cis	-137.8	124.1	31.6	-57.8	165.7	-173	176.7	0	111.7
789	S	35.2	Very low	49.9	Very low	117 Å²	117	103.7 Å²	103.7	82%	0.818	59%	0.587	S	S	*	*			trans	-90.1	126.9	156.3	-72.9	0	0	0	0	109.5
790	S	32.2	Very low	47.1	Very low	104 Å²	104	108.9 Å²	108.9	73%	0.727	62%	0.615	S	S	*	*			trans	-146.7	77.4	167.9	-66.5	0	0	0	0	109.4
791	S	34.7	Very low	44.7	Very low	99 Å²	99	113.3 Å²	113.3	69%	0.692	64%	0.643	S	S	*	*			trans	33.1	101.5	134.7	59.9	0	0	0	0	116.9
792	N	28.3	Very low	43.2	Very low	164 Å²	164	119.4 Å²	119.4	88%	0.877	67%	0.665	S	S	*	*				-155.4	150.5	84.7	-82.5	-27.6	0	0	0	109.9
793	G	36.3	Very low	42.5	Very low	74 Å²	74	118.5 Å²	118.5	76%	0.763	66%	0.662	S	S	*	*			trans	-100.2	153.6	-159.4	0	0	0	0	0	115.9
794	K	29.9	Very low	43.1	Very low	164 Å²	164	117 Å²	117	71%	0.713	67%	0.666	S	S	*	*			trans	-132	151.9	131.2	-86.1	-170	167.8	-168.1	0	107.6	E69	E69-K794 WeakPolarHBondContact OE1-CD 3.48Å; E69-K794 WeakPolarHBondContact OE1-CE 3.43Å; E69-K794 IonicContact OE1-NZ 2.63Å; E69-K794 PolarHBondContact OE1-NZ 3.04Å
795	Q	40.3	Very low	44.7	Very low	200 Å²	200	114.6 Å²	114.6	94%	0.935	65%	0.65	S	S	*	*			trans	-90.9	111.6	175.4	-74.9	175.2	-74.5	0	0	109.7
796	G	28.4	Very low	46.9	Very low	64 Å²	64	112.9 Å²	112.9	66%	0.66	64%	0.639	S	S	*	*			trans	-138.1	138.6	165.5	0	0	0	0	0	107.7	T798	G796-T798 PolarHBondContact O-N 2.95Å
797	E	39	Very low	49.7	Very low	200 Å²	200	110.7 Å²	110.7	94%	0.935	62%	0.618	S	S	*	*			trans	-21.5	106.2	-162	-63.6	-172.2	116.6	0	0	117.1	D799	E797-D799 PolarHBondContact O-N 2.97Å
798	T	33.3	Very low	52.6	Low	116 Å²	116	103.2 Å²	103.2	71%	0.712	58%	0.579	S	S	*	*			trans	-75.1	84.2	-173.1	-43.1	0	0	0	0	113	G796 L800	G796-T798 PolarHBondContact O-N 2.95Å; T798-L800 PolarHBondContact O-N 3.22Å
799	D	37.2	Very low	55.6	Low	127 Å²	127	95.8 Å²	95.8	68%	0.679	55%	0.552	S	S	*	*			trans	-70.3	99.4	172.1	-153.3	10.4	0	0	0	110	E797 R802	E797-D799 PolarHBondContact O-N 2.97Å; D799-R802 IonicContact OD1-NH2 3.37Å
800	L	39.4	Very low	58.5	Low	113 Å²	113	91.2 Å²	91.2	59%	0.592	52%	0.518	S	S	*	.			trans	-56.7	135.7	-176.8	-80.3	157.9	0	0	0	111.2	T798 R802	T798-L800 PolarHBondContact O-N 3.22Å; L800-R802 PolarHBondContact O-N 2.92Å
801	P	46.5	Very low	61.5	Low	92 Å²	92	90 Å²	90	60%	0.597	51%	0.506	S	S	*	.			trans	-63	111.2	-173.9	26.7	-35.2	0	0	0	110.5	P784 G803	P784-P801 HydrophobicContact CG-CB 4.21Å; P784-P801 WeakPolarHBondContact CG-O 3.12Å; P801-G803 PolarHBondContact O-N 2.93Å
802	R	61.2	Low	64.4	Low	163 Å²	163	87.8 Å²	87.8	62%	0.615	49%	0.491	S	S	*	.			trans	-68.1	105.7	-168.1	-64.4	-172.4	-174	-125.4	0.8	111.9	D799 L800 E818	D799-R802 IonicContact OD1-NH2 3.37Å; L800-R802 PolarHBondContact O-N 2.92Å; R802-E818 IonicContact NH1-OE2 3.16Å; R802-E818 PolarHBondContact NH1-OE2 3.15Å
803	G	74.3	Confident	67.6	Low	7 Å²	7	81.8 Å²	81.8	7%	0.072	46%	0.46	C	S	.	.	P	Polyproline II helix	trans	-60.9	134.4	170.2	0	0	0	0	0	112.9	K781 T782 P801	K781-G803 WeakPolarHBondContact CE-O 3.41Å; T782-G803 CarbonylContact O-C 3.59Å; T782-G803 WeakPolarHBondContact O-CA 3.48Å; P801-G803 PolarHBondContact O-N 2.93Å
804	S	89.4	Confident	70.4	Confident	70 Å²	70	83.3 Å²	83.3	49%	0.49	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-68.5	140.8	178.9	-59.2	0	0	0	0	112	K781 T782	K781-S804 CarbonylContact C-O 3.49Å; K781-S804 WeakPolarHBondContact CA-O 3.38Å; T782-S804 PolarHBondContact N-O 3.25Å; T782-S804 PolarHBondContact O-N 3.18Å; T782-S804 PolarHBondContact OG1-O 2.79Å
805	W	95.1	Very high	73.5	Confident	5 Å²	5	80 Å²	80	2%	0.019	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	142.4	173.6	-74.7	89.8	0	0	0	112.1	L735 L761 V764 V780 K781 P815 V816 E818 V821	L735-W805 HydrophobicContact CD2-CZ2 4.08Å; L761-W805 HydrophobicContact CD2-CH2 3.79Å; L761-W805 HydrophobicContact CD2-CZ2 4.16Å; L761-W805 HydrophobicContact CG-CH2 3.95Å; L761-W805 HydrophobicContact CG-CZ2 4.48Å; V764-W805 HydrophobicContact CG2-CZ3 4.48Å; V780-W805 CarbonylContact O-C 3.58Å; V780-W805 WeakPolarHBondContact O-CA 3.37Å; K781-W805 HydrophobicContact CB-CD2 3.78Å; K781-W805 HydrophobicContact CB-CE3 3.91Å; K781-W805 HydrophobicContact CB-CG 4.42Å; K781-W805 HydrophobicContact CB-CH2 3.95Å; K781-W805 HydrophobicContact CB-CZ2 3.85Å; K781-W805 HydrophobicContact CB-CZ3 3.98Å; K781-W805 HydrophobicContact CD-CD2 4.45Å; K781-W805 HydrophobicContact CD-CZ2 3.75Å; K781-W805 HydrophobicContact CG-CD2 4.12Å; K781-W805 HydrophobicContact CG-CG 4.37Å; K781-W805 HydrophobicContact CG-CZ2 4.19Å; W805-P815 WeakPolarHBondContact O-CA 3.38Å; W805-V816 HydrophobicContact CB-CG2 3.9Å; W805-V816 PolarHBondContact O-N 3.49Å; W805-E818 PolarHBondContact NE1-OE1 3.46Å; W805-E818 VanDerWaalsContact NE1-OE1 3.13Å; W805-V821 HydrophobicContact CB-CG2 3.97Å; W805-V821 HydrophobicContact CD2-CB 4.45Å; W805-V821 HydrophobicContact CD2-CG1 4.34Å; W805-V821 HydrophobicContact CD2-CG2 3.75Å; W805-V821 HydrophobicContact CE3-CB 4.47Å; W805-V821 HydrophobicContact CE3-CG1 3.99Å; W805-V821 HydrophobicContact CE3-CG2 3.78Å; W805-V821 HydrophobicContact CG-CG2 3.88Å; W805-V821 HydrophobicContact CH2-CG1 4.1Å; W805-V821 HydrophobicContact CZ2-CG1 4.41Å; W805-V821 HydrophobicContact CZ3-CG1 3.88Å
806	F	96.1	Very high	76.2	Confident	49 Å²	49	72.4 Å²	72.4	22%	0.215	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	136.2	175.1	-63.8	-92.2	0	0	0	110.3	V217 Y779 V780 T782 I808 V813 Q814 P815	V217-F806 HydrophobicContact CB-CG 4.43Å; V217-F806 HydrophobicContact CG1-CB 4.24Å; V217-F806 HydrophobicContact CG2-CB 4.43Å; V217-F806 HydrophobicContact CG2-CD2 3.86Å; V217-F806 HydrophobicContact CG2-CE2 4.39Å; V217-F806 HydrophobicContact CG2-CG 4.19Å; Y779-F806 CarbonylContact C-O 3.58Å; Y779-F806 VanDerWaalsContact CA-O 3.25Å; Y779-F806 WeakPolarHBondContact CA-O 3.47Å; V780-F806 HydrophobicContact CG2-CB 4.48Å; V780-F806 PolarHBondContact N-O 2.8Å; V780-F806 PolarHBondContact O-N 3Å; T782-F806 HydrophobicContact CG2-CD2 3.9Å; T782-F806 HydrophobicContact CG2-CE2 3.67Å; F806-I808 HydrophobicContact CB-CD1 4.13Å; F806-I808 WeakPolarHBondContact O-CD1 3.36Å; F806-V813 HydrophobicContact CB-CG1 4.26Å; F806-V813 HydrophobicContact CD1-CG1 3.9Å; F806-V813 HydrophobicContact CG-CG1 4.39Å; F806-Q814 CarbonylContact C-O 3.51Å; F806-Q814 VanDerWaalsContact CA-O 3.29Å; F806-Q814 WeakPolarHBondContact CA-O 3.46Å; F806-P815 HydrophobicContact CD1-CB 4.23Å; F806-P815 HydrophobicContact CE1-CB 4.09Å
807	H	97.5	Very high	79.3	Confident	45 Å²	45	72.3 Å²	72.3	21%	0.208	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	135	164.5	-178.7	-125.1	0	0	0	109.1	T777 A778 Y779 V813 Q814 V816	T777-H807 VanDerWaalsContact CB-NE2 3.27Å; T777-H807 WeakPolarHBondContact CB-NE2 3.41Å; T777-H807 PolarHBondContact OG1-NE2 3.33Å; A778-H807 CarbonylContact O-C 3.57Å; A778-H807 WeakPolarHBondContact O-CA 3.45Å; A778-H807 PolarHBondContact O-CD2 2.7Å; A778-H807 VanDerWaalsContact O-CD2 3.26Å; Y779-H807 HydrophobicContact CD1-CB 3.86Å; Y779-H807 AromaticContact CD1-CD2 3.63Å; Y779-H807 HydrophobicContact CE1-CB 3.86Å; Y779-H807 AromaticContact CE1-CD2 3.29Å; Y779-H807 WeakPolarHBondContact CE1-CD2 3.3Å; Y779-H807 AromaticContact CE1-CG 3.73Å; Y779-H807 AromaticContact CE2-CD2 3.72Å; Y779-H807 AromaticContact CZ-CD2 3.35Å; Y779-H807 AromaticContact CZ-NE2 3.76Å; H807-V813 WeakPolarHBondContact O-CA 3.43Å; H807-Q814 PolarHBondContact N-O 3.46Å; H807-Q814 PolarHBondContact O-N 3.02Å; H807-V816 HydrophobicContact CB-CG1 3.73Å; H807-V816 HydrophobicContact CB-CG2 4.33Å
808	I	97.4	Very high	81.9	Confident	3 Å²	3	64.5 Å²	64.5	2%	0.015	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	124.1	-180	-52	91.4	0	0	0	110.1	V217 Q234 T777 A778 V780 F806 D810 S812 V813	V217-I808 HydrophobicContact CG1-CD1 3.81Å; V217-I808 HydrophobicContact CG1-CG1 3.71Å; Q234-I808 HydrophobicContact CG-CB 4.12Å; Q234-I808 HydrophobicContact CG-CG1 4.43Å; Q234-I808 HydrophobicContact CG-CG2 3.95Å; T777-I808 WeakPolarHBondContact CA-O 3.43Å; T777-I808 WeakPolarHBondContact CB-O 3.44Å; A778-I808 PolarHBondContact N-O 3.4Å; A778-I808 PolarHBondContact O-N 3.33Å; V780-I808 HydrophobicContact CB-CD1 4.5Å; V780-I808 HydrophobicContact CG1-CD1 4.23Å; V780-I808 HydrophobicContact CG2-CD1 3.71Å; F806-I808 HydrophobicContact CB-CD1 4.13Å; F806-I808 WeakPolarHBondContact O-CD1 3.36Å; I808-D810 WeakPolarHBondContact CG2-O 3.17Å; I808-S812 VanDerWaalsContact CA-O 3.31Å; I808-S812 WeakPolarHBondContact CA-O 3.43Å; I808-V813 HydrophobicContact CG1-CB 4.48Å; I808-V813 HydrophobicContact CG1-CG1 4.27Å; I808-V813 HydrophobicContact CG1-CG2 3.97Å; I808-V813 HydrophobicContact CG2-CG2 4.04Å
809	S	96.7	Very high	84.8	Confident	36 Å²	36	62.8 Å²	62.8	25%	0.252	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	95.6	171.2	175.9	0	0	0	0	108.3	H775 T811 S812	H775-S809 PolarHBondContact NE2-OG 2.86Å; S809-T811 PolarHBondContact O-N 2.95Å; S809-S812 PolarHBondContact N-O 2.83Å; S809-S812 PolarHBondContact O-N 3.45Å
810	D	95.7	Very high	87.6	Confident	21 Å²	21	61.2 Å²	61.2	11%	0.112	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.3	-106.7	-171.7	-64.4	-44.2	0	0	0	112.1	G219 L220 N222 C227 N230 H775 I808	G219-D810 CarbonylContact C-O 3.48Å; G219-D810 VanDerWaalsContact CA-O 3.29Å; G219-D810 WeakPolarHBondContact CA-O 3.45Å; L220-D810 PolarHBondContact N-O 3.3Å; L220-D810 CarbonylContact O-C 3.02Å; L220-D810 WeakPolarHBondContact O-CA 3.35Å; N222-D810 HydrophobicContact CB-CB 4.07Å; N222-D810 PolarHBondContact ND2-OD2 2.94Å; C227-D810 WeakPolarHBondContact CA-OD1 3.41Å; N230-D810 WeakPolarHBondContact CB-OD1 3.35Å; N230-D810 PolarHBondContact ND2-OD1 3.16Å; H775-D810 IonicContact CE1-OD2 3.5Å; I808-D810 WeakPolarHBondContact CG2-O 3.17Å
811	T	95.8	Very high	90.3	Very high	77 Å²	77	55.9 Å²	55.9	47%	0.472	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-18.1	-177.3	56	0	0	0	0	113.9	L220 V297 S809	L220-T811 PolarHBondContact O-N 3.06Å; V297-T811 HydrophobicContact CG1-CG2 3.84Å; V297-T811 HydrophobicContact CG2-CG2 4.33Å; S809-T811 PolarHBondContact O-N 2.95Å
812	S	95.3	Very high	92.6	Very high	53 Å²	53	54 Å²	54	37%	0.371	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	125.5	-179.2	-172.2	0	0	0	0	110.9	I808 S809	I808-S812 VanDerWaalsContact CA-O 3.31Å; I808-S812 WeakPolarHBondContact CA-O 3.43Å; S809-S812 PolarHBondContact N-O 2.83Å; S809-S812 PolarHBondContact O-N 3.45Å
813	V	95.7	Very high	94.1	Very high	39 Å²	39	49.4 Å²	49.4	24%	0.236	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	127.1	174.9	178	0	0	0	0	108.1	V217 F806 H807 I808	V217-V813 HydrophobicContact CB-CG1 4.26Å; V217-V813 HydrophobicContact CG1-CG1 3.61Å; V217-V813 HydrophobicContact CG1-CG2 4.15Å; F806-V813 HydrophobicContact CB-CG1 4.26Å; F806-V813 HydrophobicContact CD1-CG1 3.9Å; F806-V813 HydrophobicContact CG-CG1 4.39Å; H807-V813 WeakPolarHBondContact O-CA 3.43Å; I808-V813 HydrophobicContact CG1-CB 4.48Å; I808-V813 HydrophobicContact CG1-CG1 4.27Å; I808-V813 HydrophobicContact CG1-CG2 3.97Å; I808-V813 HydrophobicContact CG2-CG2 4.04Å
814	Q	94.9	Very high	95.1	Very high	106 Å²	106	49 Å²	49	50%	0.495	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	135	-179.2	-60.2	-60.2	-31.4	0	0	111	F806 H807	F806-Q814 CarbonylContact C-O 3.51Å; F806-Q814 VanDerWaalsContact CA-O 3.29Å; F806-Q814 WeakPolarHBondContact CA-O 3.46Å; H807-Q814 PolarHBondContact N-O 3.46Å; H807-Q814 PolarHBondContact O-N 3.02Å
815	P	94.8	Very high	95.3	Very high	94 Å²	94	48.6 Å²	48.6	61%	0.61	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.6	142.8	172.7	30	-34.2	0	0	0	110.9	W805 F806	W805-P815 WeakPolarHBondContact O-CA 3.38Å; F806-P815 HydrophobicContact CD1-CB 4.23Å; F806-P815 HydrophobicContact CE1-CB 4.09Å
816	V	96	Very high	95.4	Very high	40 Å²	40	48.4 Å²	48.4	24%	0.242	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	159.8	-178.1	-65	0	0	0	0	112.3	Y779 W805 H807 K820 V821	Y779-V816 HydrophobicContact CD1-CG2 4.16Å; W805-V816 HydrophobicContact CB-CG2 3.9Å; W805-V816 PolarHBondContact O-N 3.49Å; H807-V816 HydrophobicContact CB-CG1 3.73Å; H807-V816 HydrophobicContact CB-CG2 4.33Å; V816-K820 HydrophobicContact CB-CB 4.43Å; V816-K820 HydrophobicContact CB-CG 4.32Å; V816-K820 HydrophobicContact CG1-CG 4.44Å; V816-V821 HydrophobicContact CG2-CG2 3.86Å
817	S	94.8	Very high	95.4	Very high	62 Å²	62	46.2 Å²	46.2	43%	0.434	27%	0.266	S	S	.	.			trans	-79.6	153.5	175.9	63.5	0	0	0	0	112.6	S819 K820 V821	S817-S819 PolarHBondContact O-N 3.01Å; S817-S819 PolarHBondContact OG-OG 3.27Å; S817-K820 WeakPolarHBondContact O-CB 3.34Å; S817-K820 PolarHBondContact O-N 3.16Å; S817-K820 WeakPolarHBondContact OG-CB 3.49Å; S817-K820 PolarHBondContact OG-N 3.36Å; S817-V821 PolarHBondContact O-N 2.93Å; S817-V821 VanDerWaalsContact O-N 3.16Å
818	E	94.1	Very high	95.4	Very high	36 Å²	36	44 Å²	44	17%	0.168	26%	0.257	C	S	.	.	H	α-helix	trans	-56.4	-37.1	174.3	-48.2	-157	97.6	0	0	111.2	L735 K781 R802 W805 K820 V821 Q822	L735-E818 HydrophobicContact CD1-CB 4.15Å; K781-E818 IonicContact NZ-OE1 3.16Å; K781-E818 PolarHBondContact NZ-OE1 3.22Å; R802-E818 IonicContact NH1-OE2 3.16Å; R802-E818 PolarHBondContact NH1-OE2 3.15Å; W805-E818 PolarHBondContact NE1-OE1 3.46Å; W805-E818 VanDerWaalsContact NE1-OE1 3.13Å; E818-K820 VanDerWaalsContact C-N 3.35Å; E818-K820 PolarHBondContact O-N 2.94Å; E818-V821 WeakPolarHBondContact O-CB 3.48Å; E818-V821 PolarHBondContact O-N 3.12Å; E818-Q822 WeakPolarHBondContact O-CG 3.41Å; E818-Q822 PolarHBondContact O-N 3.38Å
819	S	94	Very high	95.5	Very high	81 Å²	81	44 Å²	44	57%	0.566	26%	0.256	S	S	*	.	H	α-helix	trans	-63	-34.1	174.5	55.9	0	0	0	0	114	S817 S823	S817-S819 PolarHBondContact O-N 3.01Å; S817-S819 PolarHBondContact OG-OG 3.27Å; S819-S823 PolarHBondContact O-N 3.43Å
820	K	94.6	Very high	95.6	Very high	94 Å²	94	42.2 Å²	42.2	41%	0.409	24%	0.244	S	C	.	.	H	α-helix	trans	-70.8	-39.7	174.5	173.8	57.3	-165.3	154.9	0	110.6	V816 S817 E818 S823	V816-K820 HydrophobicContact CB-CB 4.43Å; V816-K820 HydrophobicContact CB-CG 4.32Å; V816-K820 HydrophobicContact CG1-CG 4.44Å; S817-K820 WeakPolarHBondContact O-CB 3.34Å; S817-K820 PolarHBondContact O-N 3.16Å; S817-K820 WeakPolarHBondContact OG-CB 3.49Å; S817-K820 PolarHBondContact OG-N 3.36Å; E818-K820 VanDerWaalsContact C-N 3.35Å; E818-K820 PolarHBondContact O-N 2.94Å; K820-S823 PolarHBondContact O-N 3.14Å; K820-S823 PolarHBondContact O-OG 3.2Å
821	V	95.8	Very high	95.6	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.4	-52.5	174.9	-177.7	0	0	0	0	110.4	F733 V764 Y779 W805 V816 S817 E818 S823 C824	F733-V821 HydrophobicContact CE2-CG1 4.37Å; F733-V821 VanDerWaalsContact CZ-O 3.29Å; F733-V821 WeakPolarHBondContact CZ-O 3.5Å; V764-V821 HydrophobicContact CG2-CG1 3.91Å; Y779-V821 HydrophobicContact CD1-CG2 3.9Å; Y779-V821 HydrophobicContact CG-CG1 4.4Å; Y779-V821 HydrophobicContact CG-CG2 4.36Å; W805-V821 HydrophobicContact CB-CG2 3.97Å; W805-V821 HydrophobicContact CD2-CB 4.45Å; W805-V821 HydrophobicContact CD2-CG1 4.34Å; W805-V821 HydrophobicContact CD2-CG2 3.75Å; W805-V821 HydrophobicContact CE3-CB 4.47Å; W805-V821 HydrophobicContact CE3-CG1 3.99Å; W805-V821 HydrophobicContact CE3-CG2 3.78Å; W805-V821 HydrophobicContact CG-CG2 3.88Å; W805-V821 HydrophobicContact CH2-CG1 4.1Å; W805-V821 HydrophobicContact CZ2-CG1 4.41Å; W805-V821 HydrophobicContact CZ3-CG1 3.88Å; V816-V821 HydrophobicContact CG2-CG2 3.86Å; S817-V821 PolarHBondContact O-N 2.93Å; S817-V821 VanDerWaalsContact O-N 3.16Å; E818-V821 WeakPolarHBondContact O-CB 3.48Å; E818-V821 PolarHBondContact O-N 3.12Å; V821-S823 PolarHBondContact O-N 2.97Å; V821-C824 WeakPolarHBondContact O-CB 3.48Å; V821-C824 PolarHBondContact O-N 3.38Å; V821-C824 PolarHBondContact O-SG 3.35Å
822	Q	95.3	Very high	95.6	Very high	54 Å²	54	38.8 Å²	38.8	25%	0.252	22%	0.222	S	C	.	.	H	α-helix	trans	-61	-17.4	179.2	-68.7	-179.1	-61.4	0	0	114.6	H730 L735 E818	H730-Q822 PolarHBondContact CE1-O 3.1Å; H730-Q822 PolarHBondContact NE2-O 3.2Å; H730-Q822 VanDerWaalsContact NE2-O 3.07Å; L735-Q822 HydrophobicContact CD2-CG 4.18Å; L735-Q822 HydrophobicContact CG-CG 4.47Å; E818-Q822 WeakPolarHBondContact O-CG 3.41Å; E818-Q822 PolarHBondContact O-N 3.38Å
823	S	94.1	Very high	95.5	Very high	65 Å²	65	39.2 Å²	39.2	46%	0.455	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-5	175.9	76.7	0	0	0	0	114.8	S819 K820 V821	S819-S823 PolarHBondContact O-N 3.43Å; K820-S823 PolarHBondContact O-N 3.14Å; K820-S823 PolarHBondContact O-OG 3.2Å; V821-S823 PolarHBondContact O-N 2.97Å
824	C	94.4	Very high	95.2	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.22	C	C	.	.	S	Bend	trans	-84.7	154	-171.9	90.4	0	0	0	0	112.9	H730 E766 Y779 V821 A826	H730-C824 PolarHBondContact CE1-O 2.88Å; H730-C824 VanDerWaalsContact CE1-O 3.29Å; H730-C824 PolarHBondContact ND1-O 3.23Å; E766-C824 WeakPolarHBondContact OE1-CA 3.31Å; E766-C824 WeakPolarHBondContact OE1-CB 3.39Å; Y779-C824 HydrophobicContact CD2-CB 4.35Å; Y779-C824 HydrophobicContact CE2-CB 3.57Å; Y779-C824 VanDerWaalsContact CE2-SG 3.6Å; V821-C824 WeakPolarHBondContact O-CB 3.48Å; V821-C824 PolarHBondContact O-N 3.38Å; V821-C824 PolarHBondContact O-SG 3.35Å; C824-A826 PolarHBondContact O-N 3.44Å
825	Q	93.8	Very high	93.7	Very high	61 Å²	61	45.7 Å²	45.7	29%	0.285	25%	0.25	S	S	.	.			trans	-80.9	66.9	179.7	-60.7	-160.3	-11.6	0	0	111.4	N728 E766 Y827	N728-Q825 PolarHBondContact O-NE2 3.14Å; E766-Q825 HydrophobicContact CG-CB 4.42Å; E766-Q825 PolarHBondContact OE1-N 3.44Å; Q825-Y827 PolarHBondContact O-N 2.99Å
826	A	95.9	Very high	93.6	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-49.6	126.5	-178.9	0	0	0	0	0	112.4	M714 R716 F733 V764 C824 L829	M714-A826 WeakPolarHBondContact CG-O 3.26Å; R716-A826 VanDerWaalsContact CZ-O 3.25Å; R716-A826 PolarHBondContact NE-O 3.19Å; R716-A826 PolarHBondContact NH2-O 3.25Å; F733-A826 HydrophobicContact CD1-CB 3.88Å; F733-A826 HydrophobicContact CE1-CB 3.45Å; F733-A826 VanDerWaalsContact CE1-CB 3.45Å; F733-A826 HydrophobicContact CZ-CB 4.1Å; V764-A826 HydrophobicContact CG1-CB 3.59Å; C824-A826 PolarHBondContact O-N 3.44Å; A826-L829 HydrophobicContact CB-CD2 3.64Å; A826-L829 HydrophobicContact CB-CG 4.03Å
827	Y	97	Very high	93.5	Very high	3 Å²	3	43.4 Å²	43.4	1%	0.012	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	-46.8	176.5	178.4	-114.5	0	0	0	110.6	D321 S322 Q323 H713 M714 F717 V765 H767 Y776 Q825	D321-Y827 PolarHBondContact OD1-OH 3.34Å; D321-Y827 PolarHBondContact OD2-OH 3Å; D321-Y827 VanDerWaalsContact OD2-OH 3.12Å; S322-Y827 WeakPolarHBondContact OG-CD1 3.03Å; S322-Y827 VanDerWaalsContact OG-CE1 3.3Å; S322-Y827 WeakPolarHBondContact OG-CE1 3.33Å; Q323-Y827 HydrophobicContact CB-CE1 4.14Å; Q323-Y827 WeakPolarHBondContact CB-OH 3.5Å; H713-Y827 AromaticContact CD2-CE2 3.47Å; H713-Y827 VanDerWaalsContact CD2-CE2 3.47Å; H713-Y827 WeakPolarHBondContact CD2-CE2 3.47Å; H713-Y827 AromaticContact CD2-CZ 3.58Å; H713-Y827 PolarHBondContact CD2-OH 3.29Å; H713-Y827 AromaticContact NE2-CE2 3.32Å; H713-Y827 VanDerWaalsContact NE2-CE2 3.32Å; H713-Y827 WeakPolarHBondContact NE2-CE2 3.47Å; H713-Y827 AromaticContact NE2-CZ 3.45Å; H713-Y827 PolarHBondContact NE2-OH 3.25Å; M714-Y827 PolarHBondContact N-O 3.27Å; F717-Y827 HydrophobicContact CD2-CE2 4.39Å; F717-Y827 AromaticContact CE2-CE2 3.96Å; F717-Y827 HydrophobicContact CE2-CE2 3.96Å; V765-Y827 WeakPolarHBondContact O-CB 3.48Å; V765-Y827 PolarHBondContact O-N 3.37Å; H767-Y827 HydrophobicContact CB-CG 4.34Å; Y776-Y827 AromaticContact CE1-CD1 3.78Å; Y776-Y827 HydrophobicContact CE1-CD1 3.78Å; Y776-Y827 HydrophobicContact CE1-CE1 4.13Å; Q825-Y827 PolarHBondContact O-N 2.99Å
828	L	98.1	Very high	93.4	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	146	162.9	-57.3	177.9	0	0	0	109.8	V232 Q323 L326 L712 H713 V764 V765 F830	V232-L828 HydrophobicContact CG2-CD1 4.35Å; Q323-L828 HydrophobicContact CB-CD2 3.91Å; Q323-L828 HydrophobicContact CG-CD2 3.94Å; L326-L828 HydrophobicContact CD2-CD1 4.24Å; L712-L828 CarbonylContact O-C 3.54Å; L712-L828 WeakPolarHBondContact O-CA 3.35Å; H713-L828 HydrophobicContact CB-CD2 3.66Å; V764-L828 WeakPolarHBondContact CA-O 3.23Å; V765-L828 HydrophobicContact CB-CB 3.97Å; V765-L828 HydrophobicContact CB-CD1 4.49Å; V765-L828 HydrophobicContact CB-CG 4.35Å; V765-L828 HydrophobicContact CG2-CB 4.2Å; V765-L828 HydrophobicContact CG2-CD1 4.24Å; V765-L828 PolarHBondContact N-O 3.39Å; V765-L828 PolarHBondContact O-N 3.19Å; L828-F830 HydrophobicContact CB-CE2 3.92Å; L828-F830 HydrophobicContact CB-CZ 4.47Å; L828-F830 HydrophobicContact CD1-CE2 4.28Å; L828-F830 HydrophobicContact CD1-CZ 4.18Å
829	L	98.4	Very high	93.4	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	135.7	169.8	-64.5	165.9	0	0	0	108.9	V652 L712 M714 F733 L761 V764 A826 Y831	V652-L829 HydrophobicContact CG2-CD1 3.55Å; L712-L829 HydrophobicContact CB-CB 4.33Å; L712-L829 PolarHBondContact N-O 2.89Å; L712-L829 PolarHBondContact O-N 3.43Å; M714-L829 HydrophobicContact CE-CD1 4.17Å; F733-L829 HydrophobicContact CB-CD1 3.82Å; F733-L829 HydrophobicContact CB-CD2 4.33Å; F733-L829 HydrophobicContact CD1-CD1 4.34Å; F733-L829 HydrophobicContact CD1-CD2 4.02Å; F733-L829 HydrophobicContact CD2-CD2 3.89Å; F733-L829 HydrophobicContact CE1-CD2 4.28Å; F733-L829 HydrophobicContact CE2-CD2 4.11Å; F733-L829 HydrophobicContact CG-CD1 4.13Å; F733-L829 HydrophobicContact CG-CD2 3.82Å; F733-L829 HydrophobicContact CZ-CD2 4.29Å; L761-L829 HydrophobicContact CD1-CB 4.1Å; L761-L829 HydrophobicContact CD1-CD2 3.8Å; V764-L829 HydrophobicContact CB-CD2 4.38Å; V764-L829 HydrophobicContact CG1-CD2 3.88Å; V764-L829 HydrophobicContact CG2-CD2 3.91Å; A826-L829 HydrophobicContact CB-CD2 3.64Å; A826-L829 HydrophobicContact CB-CG 4.03Å; L829-Y831 HydrophobicContact CB-CD2 4.1Å; L829-Y831 HydrophobicContact CB-CE2 3.72Å; L829-Y831 HydrophobicContact CD1-CE2 4.09Å; L829-Y831 HydrophobicContact CG-CE2 4.43Å
830	F	98.2	Very high	93.4	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	120.4	177.2	-63.6	-93.3	0	0	0	109.7	N235 L236 L326 T711 Y762 G763 V765 L828	N235-F830 HydrophobicContact CB-CD2 3.56Å; N235-F830 HydrophobicContact CB-CE2 3.51Å; N235-F830 HydrophobicContact CB-CG 4.12Å; N235-F830 HydrophobicContact CB-CZ 4.03Å; L236-F830 HydrophobicContact CD2-CE1 4.46Å; L326-F830 HydrophobicContact CD2-CE1 3.99Å; L326-F830 HydrophobicContact CD2-CZ 3.91Å; T711-F830 HydrophobicContact CG2-CD1 4.28Å; T711-F830 HydrophobicContact CG2-CE1 3.93Å; T711-F830 HydrophobicContact CG2-CZ 4.35Å; Y762-F830 HydrophobicContact CD1-CB 4.36Å; Y762-F830 VanDerWaalsContact CD1-O 3.3Å; Y762-F830 WeakPolarHBondContact CD1-O 3.38Å; Y762-F830 HydrophobicContact CE1-CB 3.73Å; Y762-F830 HydrophobicContact CE2-CB 4.29Å; Y762-F830 PolarHBondContact N-O 2.85Å; G763-F830 PolarHBondContact N-O 3.48Å; G763-F830 PolarHBondContact O-N 3.15Å; V765-F830 HydrophobicContact CG2-CE2 4.19Å; L828-F830 HydrophobicContact CB-CE2 3.92Å; L828-F830 HydrophobicContact CB-CZ 4.47Å; L828-F830 HydrophobicContact CD1-CE2 4.28Å; L828-F830 HydrophobicContact CD1-CZ 4.18Å
831	Y	97.3	Very high	93.3	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	135.4	-175.9	-80.3	-86.1	0	0	0	109.6	V709 L710 L712 P734 L737 S760 L761 L829	V709-Y831 CarbonylContact C-O 3.54Å; V709-Y831 WeakPolarHBondContact CA-O 3.47Å; L710-Y831 PolarHBondContact N-O 3.29Å; L710-Y831 PolarHBondContact O-N 3.25Å; L712-Y831 HydrophobicContact CD1-CD2 4.16Å; L712-Y831 HydrophobicContact CD1-CE2 3.91Å; L712-Y831 HydrophobicContact CG-CD2 4.45Å; P734-Y831 PolarHBondContact O-OH 2.91Å; L737-Y831 HydrophobicContact CB-CD1 4Å; L737-Y831 HydrophobicContact CB-CE1 3.55Å; L737-Y831 HydrophobicContact CD2-CD1 4.45Å; L737-Y831 HydrophobicContact CD2-CD2 4.45Å; L737-Y831 HydrophobicContact CD2-CE1 4.2Å; L737-Y831 HydrophobicContact CD2-CE2 4.19Å; S760-Y831 CarbonylContact O-C 3.51Å; S760-Y831 WeakPolarHBondContact O-CA 3.21Å; L761-Y831 HydrophobicContact CB-CD1 3.99Å; L761-Y831 HydrophobicContact CB-CE1 3.7Å; L761-Y831 HydrophobicContact CD1-CD1 4.15Å; L761-Y831 HydrophobicContact CD1-CD2 3.94Å; L761-Y831 HydrophobicContact CD1-CE1 3.83Å; L761-Y831 HydrophobicContact CD1-CE2 3.61Å; L761-Y831 HydrophobicContact CD1-CG 4.21Å; L761-Y831 HydrophobicContact CG-CE1 4.37Å; L829-Y831 HydrophobicContact CB-CD2 4.1Å; L829-Y831 HydrophobicContact CB-CE2 3.72Å; L829-Y831 HydrophobicContact CD1-CE2 4.09Å; L829-Y831 HydrophobicContact CG-CE2 4.43Å
832	E	95	Very high	93.1	Very high	26 Å²	26	39.4 Å²	39.4	12%	0.121	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	134.7	176.4	-164.5	-177.4	124.8	0	0	109.7	V709 Y759 S760 Y762 R783 I834	V709-E832 HydrophobicContact CG2-CG 4.33Å; Y759-E832 CarbonylContact C-O 3.55Å; Y759-E832 WeakPolarHBondContact CA-O 3.42Å; Y759-E832 VanDerWaalsContact CD1-C 3.45Å; S760-E832 PolarHBondContact N-O 3.18Å; S760-E832 PolarHBondContact O-N 2.96Å; Y762-E832 HydrophobicContact CD1-CB 3.82Å; Y762-E832 HydrophobicContact CE1-CB 3.91Å; R783-E832 IonicContact CZ-OE1 3.62Å; R783-E832 IonicContact CZ-OE2 3.42Å; R783-E832 IonicContact NH1-OE1 4Å; R783-E832 PolarHBondContact NH1-OE1 3.33Å; R783-E832 IonicContact NH1-OE2 2.72Å; R783-E832 IonicContact NH2-OE1 3.84Å; R783-E832 PolarHBondContact NH2-OE1 2.84Å; R783-E832 IonicContact NH2-OE2 2.72Å; R783-E832 PolarHBondContact NH2-OE2 2.92Å; E832-I834 PolarHBondContact O-N 3.11Å
833	R	93.5	Very high	92.9	Very high	61 Å²	61	38.3 Å²	38.3	23%	0.23	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	131.8	-178.8	-176.1	171.3	172.6	179	-3	109.9	S708 N749 Y759 L835	S708-R833 PolarHBondContact O-N 3.43Å; N749-R833 PolarHBondContact O-NH1 3.43Å; N749-R833 PolarHBondContact O-NH2 3.46Å; Y759-R833 HydrophobicContact CD1-CB 4.1Å; Y759-R833 VanDerWaalsContact CD1-N 3.33Å; Y759-R833 HydrophobicContact CE1-CB 3.64Å; Y759-R833 HydrophobicContact CE1-CG 4.45Å; R833-L835 HydrophobicContact CG-CD2 4.4Å
834	I	89.3	Confident	92.8	Very high	66 Å²	66	36.1 Å²	36.1	34%	0.338	18%	0.176	S	C	.	.			trans	-82.9	133.1	168.6	-52.9	178.8	0	0	0	106.9	I736 L758 E832	I736-I834 HydrophobicContact CD1-CD1 3.97Å; I736-I834 HydrophobicContact CG2-CD1 4.32Å; L758-I834 HydrophobicContact CB-CB 4.26Å; L758-I834 HydrophobicContact CB-CD1 4.1Å; L758-I834 HydrophobicContact CB-CG1 4.46Å; L758-I834 PolarHBondContact O-N 2.89Å; E832-I834 PolarHBondContact O-N 3.11Å
835	L	63.2	Low	92.7	Very high	215 Å²	215	39.4 Å²	39.4	100%	1.126	19%	0.193	S	C	*	.			trans	-103.7	0	177	-60	177.9	0	0	0	110	R833	R833-L835 HydrophobicContact CG-CD2 4.4Å

Retrieved 835 of 835 residues in 247.3 ms (Link to these results)

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