A0A077Z2Y7_TRITR Loading...

Sodium:calcium exchanger 3

AlphaFold DB , UniProt , Accession A0A077Z2Y7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 899 aa.

						>A0A077Z2Y7_TRITR|A0A077Z2Y7
MDALRSSMFVAAIVLAVIVPAVAANCTNILDNNCRDGLLLPLWNPKDQLCITDRILRGIAYMLALIYMFLGVSIAADRFMGAIEVITSQERTVTLRKKDGSKVKIKVRIWNETVSNLTLMALGSSAPEILLSIIEICGNGFLAGDLGPNTIVGSAAFNMFMILAICVVAIPRNEVRKQLHLTVFLVTAIWSIFAYIWLYVILALSSPGVIDVWEGLATFLMFPLTVLTAYMADRRINLKKFVPMRYRADMVGLRAFSSQLELPKVDEDGTIDQMLLQQKGRNFNIEEAEFEQQRREYLSILRQLRQEMPDAELSTLQEKATYELTKRAKKSRAFYRVQATRRLIGDGNIVEKSVKQTSSRLKKRSKDVKPKQTGTTCKVSFNPCHYTVLENVGTVRVRVQRCGGRSDLTITVDYRTEDGTATAGSDYVANRGTLTMGPNCFETFIDITIIDDDIFEEDEHFYIFLDNLRVKSREGFLVSPETVATARLAALETPSIATVMILDDDHPGVFSFENDTYEVSEVAGDVIIKVVRQTGCRGKVLVPYETADGTGKAGIDYEPMEGALLFEDEEIEKSLQIGIVNKEQYERNEYFVVNLSKPVKLNASASEEKYTVGETPTSNLMDERIEEMGKPTLGKINKCIIKIKESKEFKNAVDMLIKKTNVSLLLRTSTWREQFVDAITMNPSDNNSVEGEEPVKPTTVGYAVHILTMPWKITCAFMPPTDYWDGWASFICSIVLIGFITALIGDLANHFGCTIGLIDAVTAITFVAIGTSVPDTFASHVAAIQDKYADSSITNVTGSNAVNVFLGIGLAWTIAAVYHAYNGDEFRVHAGTLAFSVTIFCVEATVCIVILVVRRSKSIGGELGGPLRCKVATAVTFVSLWLVYILLSSLESYCIISGF
					

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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	45.5	Very low	59.7	Low	185 Å²	185	113.3 Å²	113.3	91%	0.911	61%	0.613	S	S	*	*				0	-48.3	0	-90.6	174.8	64.3	0	0	112.1	A3 L4 R5	M1-A3 PolarHBondContact O-N 2.94Å; M1-L4 WeakPolarHBondContact O-CB 3.07Å; M1-L4 PolarHBondContact O-N 2.59Å; M1-L4 VanDerWaalsContact O-N 3.07Å; M1-R5 PolarHBondContact O-N 2.66Å
2	D	59.2	Low	59.8	Low	127 Å²	127	108.7 Å²	108.7	68%	0.679	60%	0.602	S	S	*	*	H	α-helix	trans	-63.8	-36.8	-179.3	-63.3	-31.1	0	0	0	114.1	L4 R5 S6	D2-L4 PolarHBondContact O-N 2.99Å; D2-R5 PolarHBondContact O-N 2.83Å; D2-S6 PolarHBondContact O-N 3.11Å; D2-S6 PolarHBondContact O-OG 3.42Å; D2-S6 VanDerWaalsContact O-OG 3.07Å
3	A	57.7	Low	59.4	Low	79 Å²	79	107.5 Å²	107.5	65%	0.653	59%	0.592	S	S	*	*	H	α-helix	trans	-64.9	-26.3	173.3	0	0	0	0	0	113.9	M1 S6 S7	M1-A3 PolarHBondContact O-N 2.94Å; A3-S6 WeakPolarHBondContact CA-OG 3.25Å; A3-S6 PolarHBondContact O-OG 3.41Å; A3-S7 PolarHBondContact O-N 2.83Å
4	L	57.3	Low	58.8	Low	124 Å²	124	105.1 Å²	105.1	65%	0.649	58%	0.582	S	S	*	*	H	α-helix	trans	-79.7	-30.3	177.5	-131.4	105.6	0	0	0	111.3	M1 D2 S7 M8	M1-L4 WeakPolarHBondContact O-CB 3.07Å; M1-L4 PolarHBondContact O-N 2.59Å; M1-L4 VanDerWaalsContact O-N 3.07Å; D2-L4 PolarHBondContact O-N 2.99Å; L4-S7 PolarHBondContact O-OG 2.93Å; L4-M8 WeakPolarHBondContact O-CB 3.5Å; L4-M8 WeakPolarHBondContact O-CG 3.44Å; L4-M8 PolarHBondContact O-N 3.49Å; L4-M8 VanDerWaalsContact O-N 3.08Å
5	R	65.8	Low	57.9	Low	180 Å²	180	106.5 Å²	106.5	68%	0.679	59%	0.587	S	S	*	*	H	α-helix	trans	-71.3	-41	174.5	-81.1	-177.4	171.1	177.1	-3.7	111.9	M1 D2 M8 F9	M1-R5 PolarHBondContact O-N 2.66Å; D2-R5 PolarHBondContact O-N 2.83Å; R5-M8 PolarHBondContact O-N 3.31Å; R5-F9 WeakPolarHBondContact O-CB 3.42Å; R5-F9 PolarHBondContact O-N 3.45Å
6	S	64.1	Low	57.3	Low	69 Å²	69	104.4 Å²	104.4	48%	0.483	59%	0.588	S	S	.	*	H	α-helix	trans	-69	-36.6	175.9	38.2	0	0	0	0	112.4	D2 A3 F9 V10	D2-S6 PolarHBondContact O-N 3.11Å; D2-S6 PolarHBondContact O-OG 3.42Å; D2-S6 VanDerWaalsContact O-OG 3.07Å; A3-S6 WeakPolarHBondContact CA-OG 3.25Å; A3-S6 PolarHBondContact O-OG 3.41Å; S6-F9 PolarHBondContact O-N 2.92Å; S6-V10 WeakPolarHBondContact O-CG2 3.46Å; S6-V10 PolarHBondContact O-N 3.13Å; S6-V10 VanDerWaalsContact O-N 3.08Å
7	S	61.4	Low	56.5	Low	67 Å²	67	105 Å²	105	47%	0.469	59%	0.594	S	S	.	*	H	α-helix	trans	-68.7	-37.9	174.4	78.2	0	0	0	0	112.6	A3 L4 V10 A11	A3-S7 PolarHBondContact O-N 2.83Å; L4-S7 PolarHBondContact O-OG 2.93Å; S7-V10 PolarHBondContact O-N 2.94Å; S7-A11 WeakPolarHBondContact O-CB 3.42Å; S7-A11 PolarHBondContact O-N 2.93Å
8	M	61.8	Low	55.3	Low	130 Å²	130	105.9 Å²	105.9	64%	0.64	60%	0.596	S	S	*	*	H	α-helix	trans	-66.3	-35.8	174.5	-82.1	-151.7	68.6	0	0	112.8	L4 R5 A11 A12	L4-M8 WeakPolarHBondContact O-CB 3.5Å; L4-M8 WeakPolarHBondContact O-CG 3.44Å; L4-M8 PolarHBondContact O-N 3.49Å; L4-M8 VanDerWaalsContact O-N 3.08Å; R5-M8 PolarHBondContact O-N 3.31Å; M8-A11 PolarHBondContact O-N 2.8Å; M8-A12 WeakPolarHBondContact O-CB 3.36Å; M8-A12 PolarHBondContact O-N 3.35Å
9	F	63.5	Low	54.3	Low	151 Å²	151	105.9 Å²	105.9	66%	0.662	60%	0.599	S	S	*	*	H	α-helix	trans	-67.9	-43.4	176.6	-159.3	-97.5	0	0	0	111.4	R5 S6 A12 I13	R5-F9 WeakPolarHBondContact O-CB 3.42Å; R5-F9 PolarHBondContact O-N 3.45Å; S6-F9 PolarHBondContact O-N 2.92Å; F9-A12 PolarHBondContact O-N 3.32Å; F9-I13 HydrophobicContact CD1-CD1 3.87Å; F9-I13 HydrophobicContact CE1-CD1 3.85Å; F9-I13 WeakPolarHBondContact O-CG1 3.5Å; F9-I13 PolarHBondContact O-N 3.49Å; F9-I13 VanDerWaalsContact O-N 3.13Å
10	V	62.9	Low	53.3	Low	88 Å²	88	106.4 Å²	106.4	53%	0.533	61%	0.606	S	S	.	*	H	α-helix	trans	-66.1	-40.8	174.4	176.3	0	0	0	0	111	S6 S7 A12 I13 V14	S6-V10 WeakPolarHBondContact O-CG2 3.46Å; S6-V10 PolarHBondContact O-N 3.13Å; S6-V10 VanDerWaalsContact O-N 3.08Å; S7-V10 PolarHBondContact O-N 2.94Å; V10-A12 VanDerWaalsContact C-N 3.35Å; V10-A12 PolarHBondContact O-N 3.28Å; V10-I13 PolarHBondContact O-N 2.88Å; V10-V14 HydrophobicContact CG1-CG2 4.37Å; V10-V14 VanDerWaalsContact O-CG2 3.29Å; V10-V14 WeakPolarHBondContact O-CG2 3.15Å; V10-V14 PolarHBondContact O-N 2.95Å
11	A	57.8	Low	52.6	Low	46 Å²	46	104.1 Å²	104.1	38%	0.38	60%	0.6	S	S	.	*	H	α-helix	trans	-65.8	-35.2	177.2	0	0	0	0	0	112.4	S7 M8 V14 L15	S7-A11 WeakPolarHBondContact O-CB 3.42Å; S7-A11 PolarHBondContact O-N 2.93Å; M8-A11 PolarHBondContact O-N 2.8Å; A11-V14 PolarHBondContact O-N 3.03Å; A11-L15 WeakPolarHBondContact O-CB 3.47Å; A11-L15 PolarHBondContact O-N 3.14Å
12	A	60.9	Low	52	Low	58 Å²	58	102.1 Å²	102.1	48%	0.479	60%	0.598	S	S	.	*	H	α-helix	trans	-66.4	-39.7	174.1	0	0	0	0	0	111.9	M8 F9 V10 L15 A16	M8-A12 WeakPolarHBondContact O-CB 3.36Å; M8-A12 PolarHBondContact O-N 3.35Å; F9-A12 PolarHBondContact O-N 3.32Å; V10-A12 VanDerWaalsContact C-N 3.35Å; V10-A12 PolarHBondContact O-N 3.28Å; A12-L15 PolarHBondContact O-N 2.88Å; A12-A16 WeakPolarHBondContact O-CB 3.27Å; A12-A16 PolarHBondContact O-N 3.11Å
13	I	54.7	Low	51	Low	94 Å²	94	100 Å²	100	48%	0.482	60%	0.598	S	S	.	*	H	α-helix	trans	-64.1	-45	173.2	-66	167.1	0	0	0	110.1	F9 V10 A16 V17	F9-I13 HydrophobicContact CD1-CD1 3.87Å; F9-I13 HydrophobicContact CE1-CD1 3.85Å; F9-I13 WeakPolarHBondContact O-CG1 3.5Å; F9-I13 PolarHBondContact O-N 3.49Å; F9-I13 VanDerWaalsContact O-N 3.13Å; V10-I13 PolarHBondContact O-N 2.88Å; I13-A16 PolarHBondContact O-N 3.2Å; I13-V17 VanDerWaalsContact O-CG2 3.24Å; I13-V17 WeakPolarHBondContact O-CG2 3.49Å; I13-V17 PolarHBondContact O-N 2.98Å; I13-V17 VanDerWaalsContact O-N 3.12Å
14	V	51	Low	50.3	Low	73 Å²	73	99.4 Å²	99.4	44%	0.442	59%	0.594	S	S	.	*	H	α-helix	trans	-66.4	-38.4	178.4	174	0	0	0	0	111.6	V10 A11 V17 I18	V10-V14 HydrophobicContact CG1-CG2 4.37Å; V10-V14 VanDerWaalsContact O-CG2 3.29Å; V10-V14 WeakPolarHBondContact O-CG2 3.15Å; V10-V14 PolarHBondContact O-N 2.95Å; A11-V14 PolarHBondContact O-N 3.03Å; V14-V17 PolarHBondContact O-N 3.13Å; V14-I18 HydrophobicContact CG1-CD1 3.67Å; V14-I18 WeakPolarHBondContact O-CD1 3.49Å; V14-I18 VanDerWaalsContact O-CG1 3.28Å; V14-I18 WeakPolarHBondContact O-CG1 3.46Å; V14-I18 PolarHBondContact O-N 2.88Å
15	L	44.4	Very low	49.6	Very low	126 Å²	126	100.9 Å²	100.9	66%	0.66	60%	0.602	S	S	*	*	H	α-helix	trans	-68.1	-36.7	175.5	-109.9	112.1	0	0	0	112.4	A11 A12 V17 I18	A11-L15 WeakPolarHBondContact O-CB 3.47Å; A11-L15 PolarHBondContact O-N 3.14Å; A12-L15 PolarHBondContact O-N 2.88Å; L15-V17 PolarHBondContact O-N 3.05Å; L15-I18 PolarHBondContact O-N 3.07Å
16	A	48.9	Very low	49.1	Very low	74 Å²	74	94.4 Å²	94.4	61%	0.612	58%	0.584	S	S	*	*	H	α-helix	trans	-64.7	-29.1	174	0	0	0	0	0	112.1	A12 I13	A12-A16 WeakPolarHBondContact O-CB 3.27Å; A12-A16 PolarHBondContact O-N 3.11Å; I13-A16 PolarHBondContact O-N 3.2Å
17	V	43.7	Very low	48.3	Very low	114 Å²	114	96.1 Å²	96.1	69%	0.691	59%	0.591	S	S	*	*	H	α-helix	trans	-78.6	-19.9	176.5	173.2	0	0	0	0	112.9	I13 V14 L15	I13-V17 VanDerWaalsContact O-CG2 3.24Å; I13-V17 WeakPolarHBondContact O-CG2 3.49Å; I13-V17 PolarHBondContact O-N 2.98Å; I13-V17 VanDerWaalsContact O-N 3.12Å; V14-V17 PolarHBondContact O-N 3.13Å; L15-V17 PolarHBondContact O-N 3.05Å
18	I	34.4	Very low	47.7	Very low	122 Å²	122	98.5 Å²	98.5	63%	0.626	60%	0.599	S	S	*	*	H	α-helix	trans	-99.7	-7.1	-172.7	-65.6	169.3	0	0	0	113.6	V14 L15 P20	V14-I18 HydrophobicContact CG1-CD1 3.67Å; V14-I18 WeakPolarHBondContact O-CD1 3.49Å; V14-I18 VanDerWaalsContact O-CG1 3.28Å; V14-I18 WeakPolarHBondContact O-CG1 3.46Å; V14-I18 PolarHBondContact O-N 2.88Å; L15-I18 PolarHBondContact O-N 3.07Å; I18-P20 WeakPolarHBondContact O-CD 3.38Å
19	V	36.4	Very low	47.4	Very low	106 Å²	106	95.4 Å²	95.4	64%	0.642	58%	0.584	S	S	*	*	S	Bend	trans	-65.1	122.8	169.3	-178.5	0	0	0	0	108.1	A21	V19-A21 PolarHBondContact O-N 3.04Å
20	P	34.6	Very low	46.9	Very low	115 Å²	115	92 Å²	92	75%	0.747	57%	0.573	S	S	*	*			trans	-67.5	107.3	179.5	26.7	-30.2	0	0	0	108	I18 V22	I18-P20 WeakPolarHBondContact O-CD 3.38Å; P20-V22 PolarHBondContact O-N 2.79Å; P20-V22 VanDerWaalsContact O-N 3.13Å
21	A	37.5	Very low	46.4	Very low	59 Å²	59	94.3 Å²	94.3	49%	0.488	58%	0.582	S	S	.	*			trans	-56.1	117.3	171.2	0	0	0	0	0	108.1	V19 A23 I895	V19-A21 PolarHBondContact O-N 3.04Å; A21-A23 VanDerWaalsContact C-N 3.28Å; A21-A23 PolarHBondContact O-N 3.33Å; A21-I895 WeakPolarHBondContact CB-O 3.26Å
22	V	34.5	Very low	46.4	Very low	142 Å²	142	98.8 Å²	98.8	86%	0.861	60%	0.6	S	S	*	*			trans	-61.7	102.5	160.1	175.6	0	0	0	0	104.6	P20 A24	P20-V22 PolarHBondContact O-N 2.79Å; P20-V22 VanDerWaalsContact O-N 3.13Å; V22-A24 VanDerWaalsContact C-N 3.28Å; V22-A24 PolarHBondContact O-N 3.42Å
23	A	38.1	Very low	46.7	Very low	82 Å²	82	97 Å²	97	68%	0.678	58%	0.582	S	S	*	*			trans	-59.6	95.1	175.4	0	0	0	0	0	107.8	A21 N25	A21-A23 VanDerWaalsContact C-N 3.28Å; A21-A23 PolarHBondContact O-N 3.33Å; A23-N25 PolarHBondContact O-N 3.11Å
24	A	42.1	Very low	47.8	Very low	68 Å²	68	94.4 Å²	94.4	56%	0.562	57%	0.572	S	S	*	*			trans	-57.3	135.4	161.2	0	0	0	0	0	106.6	V22 C26	V22-A24 VanDerWaalsContact C-N 3.28Å; V22-A24 PolarHBondContact O-N 3.42Å; A24-C26 VanDerWaalsContact C-N 3.31Å; A24-C26 PolarHBondContact O-N 2.95Å
25	N	42.9	Very low	49.3	Very low	154 Å²	154	94.6 Å²	94.6	82%	0.824	56%	0.564	S	S	*	*			trans	-54.9	86.5	-178.2	-80.2	-22.3	0	0	0	111.7	A23 T27	A23-N25 PolarHBondContact O-N 3.11Å; N25-T27 VanDerWaalsContact C-N 3.3Å
26	C	55.6	Low	51.2	Low	44 Å²	44	93.2 Å²	93.2	30%	0.297	56%	0.558	S	S	.	*			trans	-94.1	25.2	173.3	-73.5	0	0	0	0	112.4	A24 N28 I29 C894	A24-C26 VanDerWaalsContact C-N 3.31Å; A24-C26 PolarHBondContact O-N 2.95Å; C26-N28 VanDerWaalsContact C-N 3.26Å; C26-N28 PolarHBondContact O-N 3.18Å; C26-I29 HydrophobicContact CB-CD1 3.88Å; C26-I29 HydrophobicContact CB-CG1 4.47Å; C26-C894 HydrophobicContact CB-CB 3.82Å; C26-C894 WeakPolarHBondContact CB-SG 3.49Å; C26-C894 WeakPolarHBondContact SG-CB 3.35Å; C26-C894 CovalentContact SG-SG 2.04Å; C26-C894 PolarHBondContact SG-SG 3.33Å
27	T	48.1	Very low	53	Low	105 Å²	105	90.5 Å²	90.5	64%	0.644	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-20.7	179.8	51.6	0	0	0	0	113.6	N25	N25-T27 VanDerWaalsContact C-N 3.3Å
28	N	48.1	Very low	55.1	Low	117 Å²	117	89.6 Å²	89.6	63%	0.626	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	0.5	-174.6	-70.5	-1	0	0	0	114.8	C26	C26-N28 VanDerWaalsContact C-N 3.26Å; C26-N28 PolarHBondContact O-N 3.18Å
29	I	54.8	Low	57.7	Low	66 Å²	66	87.9 Å²	87.9	34%	0.338	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-34.5	-175.7	-60.8	179.2	0	0	0	111.6	C26 N33 I758	C26-I29 HydrophobicContact CB-CD1 3.88Å; C26-I29 HydrophobicContact CB-CG1 4.47Å; I29-N33 PolarHBondContact O-ND2 3.15Å; I29-N33 PolarHBondContact O-OD1 3.49Å; I29-I758 HydrophobicContact CG2-CG2 3.85Å
30	L	53.4	Low	60.3	Low	80 Å²	80	85.4 Å²	85.4	42%	0.419	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-33.6	-178.6	-91	116.7	0	0	0	113.9	N32 N33	L30-N32 VanDerWaalsContact C-N 3.29Å; L30-N32 PolarHBondContact O-N 3.49Å; L30-N33 PolarHBondContact O-N 3.42Å
31	D	51.5	Low	63	Low	136 Å²	136	84.8 Å²	84.8	73%	0.727	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-25.3	-175.7	-81.2	-11.4	0	0	0	113
32	N	58.4	Low	65.2	Low	140 Å²	140	82.5 Å²	82.5	75%	0.749	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-10.2	-178.8	-80	-8	0	0	0	114.7	L30 C34	L30-N32 VanDerWaalsContact C-N 3.29Å; L30-N32 PolarHBondContact O-N 3.49Å; N32-C34 PolarHBondContact O-N 2.93Å
33	N	67.3	Low	67.8	Low	20 Å²	20	81.7 Å²	81.7	11%	0.107	46%	0.46	C	S	.	.	S	Bend	trans	-82.7	-14	-171.1	-65	-20.8	0	0	0	114	I29 L30 R35	I29-N33 PolarHBondContact O-ND2 3.15Å; I29-N33 PolarHBondContact O-OD1 3.49Å; L30-N33 PolarHBondContact O-N 3.42Å; N33-R35 PolarHBondContact O-N 3.41Å
34	C	78.7	Confident	69.9	Low	39 Å²	39	82.5 Å²	82.5	26%	0.264	45%	0.453	S	S	.	.			trans	-94.9	68.8	-171	-68.6	0	0	0	0	113.3	N32 K46 C753	N32-C34 PolarHBondContact O-N 2.93Å; C34-K46 PolarHBondContact O-NZ 3.23Å; C34-K46 VanDerWaalsContact O-NZ 3.12Å; C34-C753 HydrophobicContact CB-CB 4.08Å; C34-C753 WeakPolarHBondContact CB-SG 3.1Å; C34-C753 WeakPolarHBondContact SG-CB 3.3Å; C34-C753 CovalentContact SG-SG 2.03Å; C34-C753 PolarHBondContact SG-SG 3.22Å
35	R	81.6	Confident	71.8	Confident	77 Å²	77	83 Å²	83	29%	0.291	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-95.2	156.9	174.1	60.8	-178.5	169	177.5	-1.5	113.1	N33 E135 N139 D759	N33-R35 PolarHBondContact O-N 3.41Å; R35-E135 IonicContact NH2-OE1 3.8Å; R35-N139 PolarHBondContact NH1-ND2 2.87Å; R35-N139 PolarHBondContact NH1-OD1 3.43Å; R35-N139 VanDerWaalsContact NH1-OD1 3.14Å; R35-D759 IonicContact NH2-OD2 3.84Å
36	D	85.7	Confident	73	Confident	97 Å²	97	80.1 Å²	80.1	52%	0.519	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-66.1	147.4	168	-74.6	-46.9	0	0	0	110.1	L42	D36-L42 VanDerWaalsContact OD1-CB 3.24Å; D36-L42 WeakPolarHBondContact OD1-CB 3.27Å; D36-L42 PolarHBondContact OD1-N 2.74Å
37	G	85.3	Confident	73.7	Confident	18 Å²	18	84.4 Å²	84.4	19%	0.186	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-74	165.2	175.8	0	0	0	0	0	111.7	L39 L40 D746 H750	G37-L39 VanDerWaalsContact C-N 3.31Å; G37-L40 WeakPolarHBondContact CA-O 3.46Å; G37-L40 PolarHBondContact N-O 2.04Å; G37-D746 WeakPolarHBondContact CA-OD1 3.49Å; G37-H750 PolarHBondContact N-NE2 2.72Å
38	L	87.3	Confident	74.8	Confident	95 Å²	95	89 Å²	89	50%	0.497	46%	0.464	S	S	.	.	S	Bend	trans	-64.2	-37.4	174.9	-179.9	63	0	0	0	112	I134 D746	L38-I134 HydrophobicContact CD2-CG2 3.73Å; L38-D746 VanDerWaalsContact N-CG 3.27Å; L38-D746 PolarHBondContact N-OD1 2.91Å; L38-D746 PolarHBondContact N-OD2 3.2Å; L38-D746 VanDerWaalsContact N-OD2 3.16Å
39	L	90.1	Very high	76	Confident	85 Å²	85	85.9 Å²	85.9	45%	0.445	45%	0.447	S	S	.	.	S	Bend	trans	-116.6	-38.4	-178	-63.3	175.7	0	0	0	112.1	G37 F739 A742 L743 D746	G37-L39 VanDerWaalsContact C-N 3.31Å; L39-F739 HydrophobicContact CD1-CD2 4.17Å; L39-F739 HydrophobicContact CD1-CE2 3.98Å; L39-A742 HydrophobicContact CD1-CB 3.6Å; L39-A742 HydrophobicContact CG-CB 4.42Å; L39-L743 HydrophobicContact CB-CD2 3.97Å; L39-L743 HydrophobicContact CD1-CD2 3.8Å; L39-L743 HydrophobicContact CD1-CG 4.03Å; L39-D746 WeakPolarHBondContact CA-OD2 3.48Å; L39-D746 WeakPolarHBondContact CB-OD2 3.42Å; L39-D746 PolarHBondContact N-OD2 2.97Å
40	L	91.6	Very high	77.3	Confident	55 Å²	55	86 Å²	86	29%	0.288	45%	0.453	S	S	.	.	S	Bend	trans	-102.6	128.3	-176.2	-63.4	176.9	0	0	0	111.4	G37 L743 D746 L747 H750	G37-L40 WeakPolarHBondContact CA-O 3.46Å; G37-L40 PolarHBondContact N-O 2.04Å; L40-L743 HydrophobicContact CD1-CD2 3.93Å; L40-L743 HydrophobicContact CD2-CD2 4.06Å; L40-L743 HydrophobicContact CG-CD2 3.76Å; L40-D746 HydrophobicContact CB-CB 4.13Å; L40-D746 HydrophobicContact CD1-CB 4.38Å; L40-D746 HydrophobicContact CG-CB 4.48Å; L40-D746 PolarHBondContact N-OD2 3.43Å; L40-L747 HydrophobicContact CD1-CD2 3.79Å; L40-L747 HydrophobicContact CD1-CG 3.83Å; L40-H750 PolarHBondContact O-CE1 2.97Å; L40-H750 VanDerWaalsContact O-CE1 3.23Å
41	P	89.7	Confident	78.8	Confident	102 Å²	102	88.4 Å²	88.4	66%	0.662	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-71.1	148.7	171.4	30.4	-34	0	0	0	110.8	H750	P41-H750 PolarHBondContact O-CE1 3.48Å
42	L	85.4	Confident	80.4	Confident	10 Å²	10	86.6 Å²	86.6	5%	0.052	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-66.5	141.9	176.3	-169.6	76	0	0	0	111.1	D36 N44 K46 H750	D36-L42 VanDerWaalsContact OD1-CB 3.24Å; D36-L42 WeakPolarHBondContact OD1-CB 3.27Å; D36-L42 PolarHBondContact OD1-N 2.74Å; L42-N44 PolarHBondContact O-N 3.39Å; L42-N44 VanDerWaalsContact O-N 3.11Å; L42-K46 HydrophobicContact CD2-CD 3.63Å; L42-K46 VanDerWaalsContact CD2-CE 3.41Å; L42-K46 HydrophobicContact CD2-CG 3.8Å; L42-H750 HydrophobicContact CD1-CB 3.99Å; L42-H750 WeakPolarHBondContact CD1-CD2 3.39Å
43	W	87.3	Confident	81.8	Confident	126 Å²	126	83.5 Å²	83.5	48%	0.477	44%	0.443	S	S	.	.			trans	-73.6	103.8	176	-172.5	-3.7	0	0	0	111.3	R57 A60 Y61	W43-R57 HydrophobicContact CD2-CG 4.1Å; W43-R57 HydrophobicContact CE3-CB 4.31Å; W43-R57 HydrophobicContact CE3-CG 3.74Å; W43-R57 HydrophobicContact CH2-CG 3.89Å; W43-R57 HydrophobicContact CZ2-CG 4.23Å; W43-R57 HydrophobicContact CZ3-CB 4.22Å; W43-R57 HydrophobicContact CZ3-CG 3.65Å; W43-R57 PolarHBondContact O-NH1 3.25Å; W43-A60 HydrophobicContact CZ3-CB 4.27Å; W43-Y61 WeakPolarHBondContact CB-OH 3.43Å; W43-Y61 HydrophobicContact CE3-CE2 4.34Å; W43-Y61 PolarHBondContact N-OH 3.12Å
44	N	83.4	Confident	82.7	Confident	99 Å²	99	87.8 Å²	87.8	53%	0.529	46%	0.457	S	S	.	.	S	Bend	trans	-80.4	153.2	175.4	-68.2	-42.6	0	0	0	113	L42	L42-N44 PolarHBondContact O-N 3.39Å; L42-N44 VanDerWaalsContact O-N 3.11Å
45	P	80.8	Confident	83.2	Confident	79 Å²	79	90.7 Å²	90.7	51%	0.513	47%	0.469	S	S	.	.			cis	-74.4	153.6	-1	28.4	-37.9	0	0	0	114.3	R57	P45-R57 PolarHBondContact O-NH1 3.25Å
46	K	68.4	Low	83.7	Confident	93 Å²	93	92 Å²	92	40%	0.404	48%	0.482	S	S	.	.			trans	-83.8	-47	175.9	-53.2	-166.2	-168.9	-162.3	0	112.1	C34 L42 L49	C34-K46 PolarHBondContact O-NZ 3.23Å; C34-K46 VanDerWaalsContact O-NZ 3.12Å; L42-K46 HydrophobicContact CD2-CD 3.63Å; L42-K46 VanDerWaalsContact CD2-CE 3.41Å; L42-K46 HydrophobicContact CD2-CG 3.8Å; K46-L49 WeakPolarHBondContact O-CD1 3.49Å
47	D	70.8	Confident	83.9	Confident	134 Å²	134	88.5 Å²	88.5	72%	0.717	46%	0.461	S	S	*	.	S	Bend	trans	-95	152.6	-172.8	-54.8	-42.3	0	0	0	112.3	L49	D47-L49 PolarHBondContact O-N 3.13Å
48	Q	72.3	Confident	84.2	Confident	200 Å²	200	87.9 Å²	87.9	94%	0.935	45%	0.454	S	S	*	.	S	Bend	trans	63.3	35.5	175	-54.2	-179.7	-6.7	0	0	115.7
49	L	72.6	Confident	84.5	Confident	52 Å²	52	87.7 Å²	87.7	27%	0.272	45%	0.453	S	S	.	.			trans	-69.9	135.4	174.3	-69.3	159.6	0	0	0	111.7	K46 D47 D53	K46-L49 WeakPolarHBondContact O-CD1 3.49Å; D47-L49 PolarHBondContact O-N 3.13Å; L49-D53 HydrophobicContact CD2-CB 4.18Å
50	C	82.5	Confident	84.8	Confident	69 Å²	69	85.7 Å²	85.7	47%	0.466	45%	0.449	S	S	.	.			trans	-63.9	149.8	166.6	-174	0	0	0	0	109.7	T52 D53 R54	C50-T52 PolarHBondContact O-N 3.28Å; C50-D53 HydrophobicContact CB-CB 4.44Å; C50-D53 PolarHBondContact O-N 2.93Å; C50-R54 PolarHBondContact O-N 3.4Å
51	I	84.5	Confident	84.9	Confident	130 Å²	130	84 Å²	84	67%	0.667	44%	0.438	S	S	*	.	H	α-helix	trans	-54.3	-40.8	176.8	-61.5	173.3	0	0	0	110.5	D53 R54 I55	I51-D53 PolarHBondContact O-N 3.46Å; I51-R54 WeakPolarHBondContact O-CB 3.27Å; I51-R54 PolarHBondContact O-N 2.87Å; I51-I55 HydrophobicContact CG2-CD1 3.9Å; I51-I55 HydrophobicContact CG2-CG1 4.5Å; I51-I55 WeakPolarHBondContact O-CG1 3.44Å; I51-I55 PolarHBondContact O-N 3.03Å
52	T	85.4	Confident	85.2	Confident	99 Å²	99	81.3 Å²	81.3	61%	0.607	42%	0.418	S	S	*	.	H	α-helix	trans	-62.5	-42.5	177.8	-49	0	0	0	0	112.1	C50 I55 L56	C50-T52 PolarHBondContact O-N 3.28Å; T52-I55 PolarHBondContact O-N 3.34Å; T52-L56 WeakPolarHBondContact O-CB 3.17Å; T52-L56 PolarHBondContact O-N 3.46Å
53	D	87.2	Confident	85.6	Confident	75 Å²	75	86.1 Å²	86.1	40%	0.401	44%	0.443	S	S	.	.	H	α-helix	trans	-66.2	-41.1	178.2	-67	-29.8	0	0	0	110.9	L49 C50 I51 I55 L56 R57	L49-D53 HydrophobicContact CD2-CB 4.18Å; C50-D53 HydrophobicContact CB-CB 4.44Å; C50-D53 PolarHBondContact O-N 2.93Å; I51-D53 PolarHBondContact O-N 3.46Å; D53-I55 PolarHBondContact O-N 2.79Å; D53-L56 PolarHBondContact O-N 2.9Å; D53-R57 VanDerWaalsContact O-CB 3.31Å; D53-R57 WeakPolarHBondContact O-CB 3.07Å; D53-R57 WeakPolarHBondContact O-CG 3.43Å; D53-R57 PolarHBondContact O-N 3.38Å
54	R	86.1	Confident	86.1	Confident	109 Å²	109	81.6 Å²	81.6	41%	0.411	43%	0.432	S	S	.	.	H	α-helix	trans	-58.9	-46.5	175.8	-166	179.4	-173.3	158.8	9.3	111.5	C50 I51 G58 T754 I755 G756	C50-R54 PolarHBondContact O-N 3.4Å; I51-R54 WeakPolarHBondContact O-CB 3.27Å; I51-R54 PolarHBondContact O-N 2.87Å; R54-G58 PolarHBondContact O-N 3.24Å; R54-T754 WeakPolarHBondContact CD-O 3.44Å; R54-T754 HydrophobicContact CG-CG2 4.31Å; R54-T754 WeakPolarHBondContact CG-O 3.43Å; R54-T754 PolarHBondContact NE-O 3.19Å; R54-T754 PolarHBondContact NH2-O 3.47Å; R54-I755 PolarHBondContact NH2-O 3.42Å; R54-G756 VanDerWaalsContact NH2-CA 3.34Å; R54-G756 VanDerWaalsContact NH2-N 3.18Å
55	I	89.4	Confident	86.6	Confident	100 Å²	100	76.9 Å²	76.9	51%	0.513	41%	0.407	S	S	.	.	H	α-helix	trans	-64.5	-48.1	177.5	-67.8	168.8	0	0	0	110.6	I51 T52 D53 R57 G58 I59	I51-I55 HydrophobicContact CG2-CD1 3.9Å; I51-I55 HydrophobicContact CG2-CG1 4.5Å; I51-I55 WeakPolarHBondContact O-CG1 3.44Å; I51-I55 PolarHBondContact O-N 3.03Å; T52-I55 PolarHBondContact O-N 3.34Å; D53-I55 PolarHBondContact O-N 2.79Å; I55-R57 PolarHBondContact O-N 3.48Å; I55-G58 PolarHBondContact O-N 3.41Å; I55-I59 HydrophobicContact CG2-CD1 3.77Å; I55-I59 HydrophobicContact CG2-CG1 4.41Å; I55-I59 VanDerWaalsContact O-CG1 3.32Å; I55-I59 WeakPolarHBondContact O-CG1 3.48Å; I55-I59 PolarHBondContact O-N 3.33Å
56	L	91.1	Very high	87.3	Confident	106 Å²	106	77.7 Å²	77.7	56%	0.555	41%	0.406	S	S	*	.	H	α-helix	trans	-61.9	-44.4	-178.2	-177.3	64.2	0	0	0	111.7	T52 D53 I59 A60	T52-L56 WeakPolarHBondContact O-CB 3.17Å; T52-L56 PolarHBondContact O-N 3.46Å; D53-L56 PolarHBondContact O-N 2.9Å; L56-I59 PolarHBondContact O-N 2.82Å; L56-A60 WeakPolarHBondContact O-CB 3.28Å; L56-A60 PolarHBondContact O-N 3.28Å
57	R	91	Very high	88.6	Confident	23 Å²	23	76.8 Å²	76.8	9%	0.087	40%	0.401	C	S	.	.	H	α-helix	trans	-63.8	-44.5	174.8	-70.2	-176.6	-177.2	-168.6	5.7	111.7	W43 P45 D53 I55 I59 A60 Y61 T754	W43-R57 HydrophobicContact CD2-CG 4.1Å; W43-R57 HydrophobicContact CE3-CB 4.31Å; W43-R57 HydrophobicContact CE3-CG 3.74Å; W43-R57 HydrophobicContact CH2-CG 3.89Å; W43-R57 HydrophobicContact CZ2-CG 4.23Å; W43-R57 HydrophobicContact CZ3-CB 4.22Å; W43-R57 HydrophobicContact CZ3-CG 3.65Å; W43-R57 PolarHBondContact O-NH1 3.25Å; P45-R57 PolarHBondContact O-NH1 3.25Å; D53-R57 VanDerWaalsContact O-CB 3.31Å; D53-R57 WeakPolarHBondContact O-CB 3.07Å; D53-R57 WeakPolarHBondContact O-CG 3.43Å; D53-R57 PolarHBondContact O-N 3.38Å; I55-R57 PolarHBondContact O-N 3.48Å; R57-I59 VanDerWaalsContact C-N 3.32Å; R57-I59 PolarHBondContact O-N 3.08Å; R57-A60 WeakPolarHBondContact O-CB 3.34Å; R57-A60 PolarHBondContact O-N 3.2Å; R57-A60 VanDerWaalsContact O-N 3.15Å; R57-Y61 HydrophobicContact CB-CD2 4.5Å; R57-Y61 HydrophobicContact CB-CE2 4.47Å; R57-Y61 WeakPolarHBondContact O-CD2 3.19Å; R57-Y61 PolarHBondContact O-N 3.2Å; R57-T754 HydrophobicContact CB-CG2 3.66Å
58	G	91.3	Very high	89.8	Confident	4 Å²	4	71.9 Å²	71.9	4%	0.041	37%	0.374	C	S	.	.	H	α-helix	trans	-58	-43.4	176	0	0	0	0	0	112.4	R54 I55 M62	R54-G58 PolarHBondContact O-N 3.24Å; I55-G58 PolarHBondContact O-N 3.41Å; G58-M62 VanDerWaalsContact O-CB 3.3Å; G58-M62 WeakPolarHBondContact O-CB 3.41Å; G58-M62 PolarHBondContact O-N 3.07Å
59	I	93.9	Very high	90.8	Very high	91 Å²	91	63.3 Å²	63.3	47%	0.467	33%	0.334	S	S	.	.	H	α-helix	trans	-63.8	-44.5	174.5	-68.1	168.2	0	0	0	110.8	I55 L56 R57 Y61 M62 L63	I55-I59 HydrophobicContact CG2-CD1 3.77Å; I55-I59 HydrophobicContact CG2-CG1 4.41Å; I55-I59 VanDerWaalsContact O-CG1 3.32Å; I55-I59 WeakPolarHBondContact O-CG1 3.48Å; I55-I59 PolarHBondContact O-N 3.33Å; L56-I59 PolarHBondContact O-N 2.82Å; R57-I59 VanDerWaalsContact C-N 3.32Å; R57-I59 PolarHBondContact O-N 3.08Å; I59-Y61 PolarHBondContact O-N 3.08Å; I59-M62 PolarHBondContact O-N 3.18Å; I59-L63 HydrophobicContact CG2-CD1 3.95Å; I59-L63 HydrophobicContact CG2-CG 4.3Å; I59-L63 WeakPolarHBondContact O-CB 3.36Å; I59-L63 WeakPolarHBondContact O-CG 3.36Å; I59-L63 PolarHBondContact O-N 3Å
60	A	95.4	Very high	91.7	Very high	43 Å²	43	63 Å²	63	36%	0.355	33%	0.332	S	S	.	.	H	α-helix	trans	-60.4	-46.8	178.8	0	0	0	0	0	111.9	W43 L56 R57 L63 A64	W43-A60 HydrophobicContact CZ3-CB 4.27Å; L56-A60 WeakPolarHBondContact O-CB 3.28Å; L56-A60 PolarHBondContact O-N 3.28Å; R57-A60 WeakPolarHBondContact O-CB 3.34Å; R57-A60 PolarHBondContact O-N 3.2Å; R57-A60 VanDerWaalsContact O-N 3.15Å; A60-L63 PolarHBondContact O-N 2.94Å; A60-A64 WeakPolarHBondContact O-CB 3.43Å; A60-A64 PolarHBondContact O-N 3.41Å
61	Y	95	Very high	92.2	Very high	19 Å²	19	59.7 Å²	59.7	8%	0.075	31%	0.31	C	S	.	.	H	α-helix	trans	-63.8	-41.2	175.5	-76.2	-58.4	0	0	0	112.5	W43 R57 I59 A64 L65 L747 H750 T754	W43-Y61 WeakPolarHBondContact CB-OH 3.43Å; W43-Y61 HydrophobicContact CE3-CE2 4.34Å; W43-Y61 PolarHBondContact N-OH 3.12Å; R57-Y61 HydrophobicContact CB-CD2 4.5Å; R57-Y61 HydrophobicContact CB-CE2 4.47Å; R57-Y61 WeakPolarHBondContact O-CD2 3.19Å; R57-Y61 PolarHBondContact O-N 3.2Å; I59-Y61 PolarHBondContact O-N 3.08Å; Y61-A64 PolarHBondContact O-N 3.24Å; Y61-L65 WeakPolarHBondContact O-CB 3.33Å; Y61-L65 WeakPolarHBondContact O-CG 3.24Å; Y61-L65 PolarHBondContact O-N 2.83Å; Y61-L747 HydrophobicContact CD1-CD2 3.86Å; Y61-L747 HydrophobicContact CE1-CD2 4.19Å; Y61-H750 HydrophobicContact CD1-CB 4.11Å; Y61-H750 HydrophobicContact CE1-CB 3.57Å; Y61-H750 AromaticContact CE1-ND1 3.91Å; Y61-H750 HydrophobicContact CE2-CB 4.17Å; Y61-T754 VanDerWaalsContact CE2-OG1 3.31Å; Y61-T754 WeakPolarHBondContact CE2-OG1 3.41Å
62	M	94.9	Very high	92.6	Very high	47 Å²	47	53.5 Å²	53.5	23%	0.232	28%	0.278	C	S	.	.	H	α-helix	trans	-61.7	-44.9	176	-175.4	63.6	79.1	0	0	111.8	G58 I59 A64 L65 I66 F751 F766	G58-M62 VanDerWaalsContact O-CB 3.3Å; G58-M62 WeakPolarHBondContact O-CB 3.41Å; G58-M62 PolarHBondContact O-N 3.07Å; I59-M62 PolarHBondContact O-N 3.18Å; M62-A64 VanDerWaalsContact C-N 3.33Å; M62-A64 PolarHBondContact O-N 3.48Å; M62-L65 PolarHBondContact O-N 3.27Å; M62-I66 HydrophobicContact CG-CD1 4Å; M62-I66 VanDerWaalsContact O-CG1 3.29Å; M62-I66 WeakPolarHBondContact O-CG1 3.49Å; M62-I66 PolarHBondContact O-N 2.63Å; M62-I66 HydrophobicContact SD-CD1 4.42Å; M62-F751 HydrophobicContact CB-CD2 4.43Å; M62-F751 HydrophobicContact CB-CE2 4.03Å; M62-F751 HydrophobicContact CE-CD2 4.44Å; M62-F751 HydrophobicContact CE-CE1 3.92Å; M62-F751 HydrophobicContact CE-CE2 3.43Å; M62-F751 VanDerWaalsContact CE-CE2 3.43Å; M62-F751 HydrophobicContact CE-CZ 3.1Å; M62-F751 HydrophobicContact SD-CE2 4.42Å; M62-F751 HydrophobicContact SD-CZ 4.44Å; M62-F766 HydrophobicContact CE-CD1 3.56Å; M62-F766 HydrophobicContact CE-CE1 3.38Å; M62-F766 HydrophobicContact CE-CG 4.3Å; M62-F766 HydrophobicContact CE-CZ 3.99Å; M62-F766 HydrophobicContact SD-CD1 4.17Å; M62-F766 HydrophobicContact SD-CE1 4.46Å
63	L	95.6	Very high	92.8	Very high	110 Å²	110	49.5 Å²	49.5	58%	0.576	25%	0.254	S	S	*	.	H	α-helix	trans	-63.8	-40	176.5	-71.2	175	0	0	0	111.5	I59 A60 Y67	I59-L63 HydrophobicContact CG2-CD1 3.95Å; I59-L63 HydrophobicContact CG2-CG 4.3Å; I59-L63 WeakPolarHBondContact O-CB 3.36Å; I59-L63 WeakPolarHBondContact O-CG 3.36Å; I59-L63 PolarHBondContact O-N 3Å; A60-L63 PolarHBondContact O-N 2.94Å; L63-Y67 VanDerWaalsContact O-CB 3.32Å; L63-Y67 WeakPolarHBondContact O-CB 3.49Å; L63-Y67 PolarHBondContact O-N 3Å
64	A	96	Very high	92.9	Very high	31 Å²	31	46.3 Å²	46.3	26%	0.256	24%	0.237	S	C	.	.	H	α-helix	trans	-63	-44.6	174.2	0	0	0	0	0	111.6	A60 Y61 M62 Y67 M68 L747	A60-A64 WeakPolarHBondContact O-CB 3.43Å; A60-A64 PolarHBondContact O-N 3.41Å; Y61-A64 PolarHBondContact O-N 3.24Å; M62-A64 VanDerWaalsContact C-N 3.33Å; M62-A64 PolarHBondContact O-N 3.48Å; A64-Y67 WeakPolarHBondContact O-CB 3.33Å; A64-Y67 PolarHBondContact O-N 2.84Å; A64-M68 VanDerWaalsContact O-CG 3.32Å; A64-M68 WeakPolarHBondContact O-CG 3.19Å; A64-M68 PolarHBondContact O-N 3.49Å; A64-L747 HydrophobicContact CB-CD1 4.03Å; A64-L747 HydrophobicContact CB-CD2 4.07Å
65	L	95.6	Very high	93.1	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-59.6	-49.9	175.7	-80	171.2	0	0	0	111.9	Y61 M62 Y67 M68 F69 I744 L747 A748 F751	Y61-L65 WeakPolarHBondContact O-CB 3.33Å; Y61-L65 WeakPolarHBondContact O-CG 3.24Å; Y61-L65 PolarHBondContact O-N 2.83Å; M62-L65 PolarHBondContact O-N 3.27Å; L65-Y67 VanDerWaalsContact C-N 3.26Å; L65-Y67 PolarHBondContact O-N 3.31Å; L65-M68 PolarHBondContact O-N 3.2Å; L65-M68 VanDerWaalsContact O-N 3.1Å; L65-F69 HydrophobicContact CB-CE2 4.03Å; L65-F69 HydrophobicContact CD2-CE2 4.47Å; L65-F69 HydrophobicContact CD2-CZ 4.35Å; L65-F69 WeakPolarHBondContact O-CD2 3.26Å; L65-F69 WeakPolarHBondContact O-CG 3.29Å; L65-F69 PolarHBondContact O-N 3.3Å; L65-I744 HydrophobicContact CD2-CG2 4.31Å; L65-L747 HydrophobicContact CD2-CB 3.51Å; L65-L747 HydrophobicContact CD2-CD1 4.48Å; L65-L747 HydrophobicContact CG-CB 3.88Å; L65-A748 HydrophobicContact CD2-CB 4.32Å; L65-F751 HydrophobicContact CD1-CB 3.87Å; L65-F751 HydrophobicContact CD1-CD1 4.31Å; L65-F751 HydrophobicContact CD1-CG 3.98Å
66	I	94.3	Very high	93	Very high	96 Å²	96	36.5 Å²	36.5	49%	0.492	19%	0.194	S	C	.	.	H	α-helix	trans	-57.5	-42.4	176.3	-68.5	167.3	0	0	0	110.6	M62 F69 L70	M62-I66 HydrophobicContact CG-CD1 4Å; M62-I66 VanDerWaalsContact O-CG1 3.29Å; M62-I66 WeakPolarHBondContact O-CG1 3.49Å; M62-I66 PolarHBondContact O-N 2.63Å; M62-I66 HydrophobicContact SD-CD1 4.42Å; I66-F69 PolarHBondContact O-N 2.98Å; I66-L70 PolarHBondContact O-N 3.23Å
67	Y	95.4	Very high	92.5	Very high	74 Å²	74	32.1 Å²	32.1	29%	0.29	17%	0.171	S	C	.	.	H	α-helix	trans	-65.6	-37	177.4	-172.4	-107.9	0	0	0	112.9	L63 A64 L65 L70 G71 L707 P710 W711	L63-Y67 VanDerWaalsContact O-CB 3.32Å; L63-Y67 WeakPolarHBondContact O-CB 3.49Å; L63-Y67 PolarHBondContact O-N 3Å; A64-Y67 WeakPolarHBondContact O-CB 3.33Å; A64-Y67 PolarHBondContact O-N 2.84Å; L65-Y67 VanDerWaalsContact C-N 3.26Å; L65-Y67 PolarHBondContact O-N 3.31Å; Y67-L70 WeakPolarHBondContact O-CB 3.47Å; Y67-G71 PolarHBondContact O-N 3Å; Y67-G71 VanDerWaalsContact O-N 3.11Å; Y67-L707 HydrophobicContact CD2-CD1 4.04Å; Y67-L707 HydrophobicContact CE2-CD1 3.94Å; Y67-L707 HydrophobicContact CE2-CG 4.37Å; Y67-L707 WeakPolarHBondContact CE2-O 3.22Å; Y67-P710 WeakPolarHBondContact OH-CG 3.39Å; Y67-W711 HydrophobicContact CD1-CZ2 4.07Å; Y67-W711 AromaticContact CD1-NE1 3.66Å; Y67-W711 AromaticContact CE1-CE2 3.7Å; Y67-W711 AromaticContact CE1-CZ2 3.82Å; Y67-W711 HydrophobicContact CE1-CZ2 3.82Å; Y67-W711 AromaticContact CE1-NE1 3.23Å; Y67-W711 AromaticContact CE2-NE1 3.66Å; Y67-W711 AromaticContact CZ-CD1 3.76Å; Y67-W711 AromaticContact CZ-NE1 3.23Å; Y67-W711 PolarHBondContact O-NE1 2.79Å
68	M	95.6	Very high	92.2	Very high	30 Å²	30	32.9 Å²	32.9	15%	0.148	17%	0.174	C	C	.	.	H	α-helix	trans	-71.2	-39.5	174.8	-67.6	-57	-173.9	0	0	112.3	A64 L65 L70 G71 V72 W711 I740 L743 I744 L747	A64-M68 VanDerWaalsContact O-CG 3.32Å; A64-M68 WeakPolarHBondContact O-CG 3.19Å; A64-M68 PolarHBondContact O-N 3.49Å; L65-M68 PolarHBondContact O-N 3.2Å; L65-M68 VanDerWaalsContact O-N 3.1Å; M68-L70 VanDerWaalsContact C-N 3.27Å; M68-L70 PolarHBondContact O-N 2.85Å; M68-G71 CarbonylContact O-C 3.51Å; M68-G71 WeakPolarHBondContact O-CA 3.4Å; M68-G71 PolarHBondContact O-N 3.37Å; M68-V72 PolarHBondContact O-N 3.44Å; M68-W711 HydrophobicContact SD-CH2 3.72Å; M68-W711 HydrophobicContact SD-CZ2 3.58Å; M68-W711 VanDerWaalsContact SD-CZ2 3.58Å; M68-I740 HydrophobicContact CB-CG2 4.18Å; M68-I740 HydrophobicContact SD-CG2 4.12Å; M68-L743 HydrophobicContact CE-CB 4.15Å; M68-L743 HydrophobicContact CE-CD1 3.76Å; M68-L743 HydrophobicContact SD-CD1 4.34Å; M68-I744 HydrophobicContact CB-CD1 4.1Å; M68-I744 HydrophobicContact CB-CG1 3.57Å; M68-I744 HydrophobicContact CG-CG1 4.42Å; M68-L747 HydrophobicContact CE-CD1 4.2Å; M68-L747 HydrophobicContact CG-CD1 3.64Å
69	F	94.5	Very high	92.1	Very high	20 Å²	20	32.8 Å²	32.8	9%	0.088	17%	0.172	C	C	.	.	H	α-helix	trans	-62	-36.1	174.2	-67	-48.8	0	0	0	112.2	L65 I66 S73 I744 G770 T771	L65-F69 HydrophobicContact CB-CE2 4.03Å; L65-F69 HydrophobicContact CD2-CE2 4.47Å; L65-F69 HydrophobicContact CD2-CZ 4.35Å; L65-F69 WeakPolarHBondContact O-CD2 3.26Å; L65-F69 WeakPolarHBondContact O-CG 3.29Å; L65-F69 PolarHBondContact O-N 3.3Å; I66-F69 PolarHBondContact O-N 2.98Å; F69-S73 WeakPolarHBondContact O-CB 3.4Å; F69-S73 PolarHBondContact O-N 2.7Å; F69-S73 PolarHBondContact O-OG 3.35Å; F69-I744 HydrophobicContact CD1-CD1 3.75Å; F69-I744 HydrophobicContact CD1-CG1 4.43Å; F69-I744 HydrophobicContact CE1-CD1 3.88Å; F69-I744 HydrophobicContact CE1-CG1 4.27Å; F69-I744 HydrophobicContact CE1-CG2 3.6Å; F69-I744 HydrophobicContact CZ-CG2 3.97Å; F69-G770 VanDerWaalsContact CD1-CA 3.43Å; F69-T771 HydrophobicContact CE1-CG2 4.2Å
70	L	91.2	Very high	91.6	Very high	45 Å²	45	28.8 Å²	28.8	24%	0.236	15%	0.152	C	C	.	.	H	α-helix	trans	-62.2	-44	170.6	-177.5	61.5	0	0	0	111.3	I66 Y67 M68 S73 I74 L707 T708	I66-L70 PolarHBondContact O-N 3.23Å; Y67-L70 WeakPolarHBondContact O-CB 3.47Å; M68-L70 VanDerWaalsContact C-N 3.27Å; M68-L70 PolarHBondContact O-N 2.85Å; L70-S73 PolarHBondContact O-N 2.86Å; L70-I74 HydrophobicContact CD1-CD1 4.45Å; L70-I74 HydrophobicContact CG-CD1 4.28Å; L70-I74 WeakPolarHBondContact O-CD1 3.4Å; L70-I74 VanDerWaalsContact O-CG1 3.28Å; L70-I74 WeakPolarHBondContact O-CG1 3.42Å; L70-I74 PolarHBondContact O-N 3.44Å; L70-I74 VanDerWaalsContact O-N 3.12Å; L70-L707 HydrophobicContact CD2-CD2 4.02Å; L70-L707 HydrophobicContact CD2-CG 4.08Å; L70-T708 HydrophobicContact CD1-CG2 3.75Å; L70-T708 HydrophobicContact CD2-CG2 3.6Å; L70-T708 HydrophobicContact CG-CG2 3.83Å
71	G	93.3	Very high	90.9	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-59.3	-49	174.2	0	0	0	0	0	113.4	Y67 M68 S73 I74 A75 W711	Y67-G71 PolarHBondContact O-N 3Å; Y67-G71 VanDerWaalsContact O-N 3.11Å; M68-G71 CarbonylContact O-C 3.51Å; M68-G71 WeakPolarHBondContact O-CA 3.4Å; M68-G71 PolarHBondContact O-N 3.37Å; G71-S73 VanDerWaalsContact C-N 3.32Å; G71-S73 PolarHBondContact O-N 2.95Å; G71-I74 PolarHBondContact O-N 2.93Å; G71-A75 PolarHBondContact O-N 3.31Å; G71-W711 VanDerWaalsContact CA-CD2 3.41Å
72	V	92.7	Very high	90.5	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.006	14%	0.137	C	C	.	.	H	α-helix	trans	-59.6	-42.6	175.3	172	0	0	0	0	111.3	M68 I74 A75 A76 P127 I740 T741 I744	M68-V72 PolarHBondContact O-N 3.44Å; V72-I74 VanDerWaalsContact C-N 3.3Å; V72-I74 PolarHBondContact O-N 3.44Å; V72-A75 PolarHBondContact O-N 3.49Å; V72-A76 VanDerWaalsContact O-CB 3.22Å; V72-A76 WeakPolarHBondContact O-CB 3.48Å; V72-A76 PolarHBondContact O-N 3.34Å; V72-P127 HydrophobicContact CG1-CB 3.89Å; V72-P127 HydrophobicContact CG1-CG 3.38Å; V72-I740 HydrophobicContact CG2-CB 3.8Å; V72-I740 HydrophobicContact CG2-CG2 3.36Å; V72-T741 HydrophobicContact CG2-CG2 4.47Å; V72-I744 HydrophobicContact CB-CD1 4.43Å; V72-I744 HydrophobicContact CG2-CD1 3.4Å
73	S	89.4	Confident	90	Very high	14 Å²	14	24.2 Å²	24.2	10%	0.098	13%	0.126	C	C	.	.	H	α-helix	trans	-61.9	-38	179.3	-61.5	0	0	0	0	112.4	F69 L70 G71 D77 V773	F69-S73 WeakPolarHBondContact O-CB 3.4Å; F69-S73 PolarHBondContact O-N 2.7Å; F69-S73 PolarHBondContact O-OG 3.35Å; L70-S73 PolarHBondContact O-N 2.86Å; G71-S73 VanDerWaalsContact C-N 3.32Å; G71-S73 PolarHBondContact O-N 2.95Å; S73-D77 PolarHBondContact O-N 3.05Å; S73-V773 WeakPolarHBondContact OG-CG1 3.27Å
74	I	88.4	Confident	89.2	Confident	9 Å²	9	19 Å²	19	5%	0.046	10%	0.099	C	C	.	.	H	α-helix	trans	-71.4	-41.2	176.1	-62.3	163.8	0	0	0	110.9	L70 G71 V72 D77 R78 I344 T708 W711 C715	L70-I74 HydrophobicContact CD1-CD1 4.45Å; L70-I74 HydrophobicContact CG-CD1 4.28Å; L70-I74 WeakPolarHBondContact O-CD1 3.4Å; L70-I74 VanDerWaalsContact O-CG1 3.28Å; L70-I74 WeakPolarHBondContact O-CG1 3.42Å; L70-I74 PolarHBondContact O-N 3.44Å; L70-I74 VanDerWaalsContact O-N 3.12Å; G71-I74 PolarHBondContact O-N 2.93Å; V72-I74 VanDerWaalsContact C-N 3.3Å; V72-I74 PolarHBondContact O-N 3.44Å; I74-D77 VanDerWaalsContact O-CB 3.3Å; I74-D77 WeakPolarHBondContact O-CB 3.4Å; I74-D77 PolarHBondContact O-N 2.92Å; I74-R78 PolarHBondContact O-N 3.21Å; I74-I344 HydrophobicContact CG1-CD1 3.72Å; I74-I344 HydrophobicContact CG1-CG1 4.3Å; I74-T708 HydrophobicContact CD1-CG2 3.93Å; I74-W711 HydrophobicContact CD1-CB 3.55Å; I74-W711 HydrophobicContact CD1-CG 4.27Å; I74-C715 HydrophobicContact CG2-CB 4.35Å
75	A	90.7	Very high	88.4	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-66.7	-39.9	177.1	0	0	0	0	0	112	G71 V72 D77 R78 F79 L736 I737 I740	G71-A75 PolarHBondContact O-N 3.31Å; V72-A75 PolarHBondContact O-N 3.49Å; A75-D77 PolarHBondContact O-N 2.96Å; A75-R78 PolarHBondContact O-N 2.76Å; A75-F79 PolarHBondContact O-N 2.9Å; A75-L736 HydrophobicContact CB-CD2 4.03Å; A75-L736 HydrophobicContact CB-CG 4.44Å; A75-I737 HydrophobicContact CB-CG1 3.75Å; A75-I740 HydrophobicContact CB-CD1 4.37Å
76	A	87.8	Confident	87.8	Confident	2 Å²	2	18.2 Å²	18.2	2%	0.017	9%	0.091	C	C	.	.	H	α-helix	trans	-61.7	-31.6	174.6	0	0	0	0	0	112.1	V72 F79 M80 P774	V72-A76 VanDerWaalsContact O-CB 3.22Å; V72-A76 WeakPolarHBondContact O-CB 3.48Å; V72-A76 PolarHBondContact O-N 3.34Å; A76-F79 WeakPolarHBondContact O-CB 3.36Å; A76-F79 PolarHBondContact O-N 3.39Å; A76-M80 WeakPolarHBondContact O-CB 3.46Å; A76-M80 VanDerWaalsContact O-CG 3.31Å; A76-M80 WeakPolarHBondContact O-CG 3.13Å; A76-M80 PolarHBondContact O-N 3.33Å; A76-P774 HydrophobicContact CB-CB 4.16Å; A76-P774 HydrophobicContact CB-CG 3.97Å
77	D	81.1	Confident	87.1	Confident	14 Å²	14	14 Å²	14	8%	0.075	7%	0.07	C	C	.	.	H	α-helix	trans	-62.5	-45.7	173.2	-167.1	60.2	0	0	0	112.2	S73 I74 A75 F79 M80 G81 V337 T340	S73-D77 PolarHBondContact O-N 3.05Å; I74-D77 VanDerWaalsContact O-CB 3.3Å; I74-D77 WeakPolarHBondContact O-CB 3.4Å; I74-D77 PolarHBondContact O-N 2.92Å; A75-D77 PolarHBondContact O-N 2.96Å; D77-F79 VanDerWaalsContact C-N 3.34Å; D77-M80 PolarHBondContact O-N 3.5Å; D77-G81 PolarHBondContact O-N 3.02Å; D77-V337 VanDerWaalsContact OD1-CA 3.29Å; D77-V337 WeakPolarHBondContact OD1-CA 3.01Å; D77-T340 HydrophobicContact CB-CG2 3.7Å; D77-T340 WeakPolarHBondContact OD1-CB 3.46Å; D77-T340 PolarHBondContact OD1-OG1 3.4Å
78	R	84.6	Confident	86.1	Confident	40 Å²	40	11.4 Å²	11.4	15%	0.151	6%	0.063	C	C	.	.	H	α-helix	trans	-64.9	-40.5	174.9	-67.1	-60.2	-175.5	161.8	-0.4	111.8	I74 A75 G81 A82 C715 M718	I74-R78 PolarHBondContact O-N 3.21Å; A75-R78 PolarHBondContact O-N 2.76Å; R78-G81 PolarHBondContact O-N 3.3Å; R78-A82 PolarHBondContact O-N 3.03Å; R78-C715 HydrophobicContact CG-CB 3.99Å; R78-M718 HydrophobicContact CB-SD 3.64Å; R78-M718 HydrophobicContact CG-SD 3.99Å
79	F	88.4	Confident	85.1	Confident	1 Å²	1	12.5 Å²	12.5	0%	0.004	7%	0.067	C	C	.	.	H	α-helix	trans	-60.4	-46	175.4	-177.2	-133.6	0	0	0	112	A75 A76 D77 G81 A82 I83 L122 G123 A126 F730 S733 I734 I737	A75-F79 PolarHBondContact O-N 2.9Å; A76-F79 WeakPolarHBondContact O-CB 3.36Å; A76-F79 PolarHBondContact O-N 3.39Å; D77-F79 VanDerWaalsContact C-N 3.34Å; F79-G81 VanDerWaalsContact C-N 3.33Å; F79-G81 PolarHBondContact O-N 3.04Å; F79-A82 WeakPolarHBondContact O-CB 3.21Å; F79-A82 PolarHBondContact O-N 2.76Å; F79-I83 HydrophobicContact CD1-CD1 3.83Å; F79-I83 HydrophobicContact CD2-CD1 4.11Å; F79-I83 HydrophobicContact CD2-CG1 4.47Å; F79-I83 HydrophobicContact CE1-CD1 3.63Å; F79-I83 HydrophobicContact CE2-CD1 3.92Å; F79-I83 HydrophobicContact CE2-CG1 4.25Å; F79-I83 HydrophobicContact CG-CD1 4.08Å; F79-I83 HydrophobicContact CZ-CD1 3.67Å; F79-I83 HydrophobicContact CZ-CG1 4.38Å; F79-I83 WeakPolarHBondContact O-CG1 3.1Å; F79-I83 PolarHBondContact O-N 3.33Å; F79-L122 HydrophobicContact CZ-CD2 4.48Å; F79-L122 HydrophobicContact CZ-CG 4.32Å; F79-G123 WeakPolarHBondContact CD1-O 3.46Å; F79-A126 HydrophobicContact CD1-CB 4.15Å; F79-A126 HydrophobicContact CE1-CB 3.67Å; F79-F730 AromaticContact CD2-CD2 3.99Å; F79-F730 HydrophobicContact CD2-CD2 3.99Å; F79-F730 HydrophobicContact CD2-CE2 4.28Å; F79-F730 AromaticContact CE2-CD2 3.33Å; F79-F730 HydrophobicContact CE2-CD2 3.33Å; F79-F730 HydrophobicContact CE2-CE1 4.48Å; F79-F730 AromaticContact CE2-CE2 3.24Å; F79-F730 HydrophobicContact CE2-CE2 3.24Å; F79-F730 HydrophobicContact CE2-CG 4.02Å; F79-F730 AromaticContact CE2-CZ 3.87Å; F79-F730 HydrophobicContact CE2-CZ 3.87Å; F79-F730 HydrophobicContact CZ-CD2 4.21Å; F79-F730 AromaticContact CZ-CE2 3.66Å; F79-F730 HydrophobicContact CZ-CE2 3.66Å; F79-F730 HydrophobicContact CZ-CZ 4.14Å; F79-S733 WeakPolarHBondContact CA-OG 3.5Å; F79-S733 VanDerWaalsContact CD2-OG 3.27Å; F79-S733 WeakPolarHBondContact CD2-OG 3.5Å; F79-I734 HydrophobicContact CD2-CG1 3.96Å; F79-I734 HydrophobicContact CE2-CD1 3.58Å; F79-I734 HydrophobicContact CE2-CG1 3.3Å; F79-I734 HydrophobicContact CZ-CD1 3.83Å; F79-I734 HydrophobicContact CZ-CG1 3.66Å; F79-I737 HydrophobicContact CB-CD1 3.79Å; F79-I737 HydrophobicContact CD1-CD1 3.96Å; F79-I737 HydrophobicContact CG-CD1 3.97Å
80	M	83.9	Confident	84.1	Confident	8 Å²	8	14.9 Å²	14.9	4%	0.039	8%	0.079	C	C	.	.	H	α-helix	trans	-60.8	-40.6	174.4	-78.2	-70.1	-168	0	0	112.4	A76 D77 A82 I83 E84 M120 S124	A76-M80 WeakPolarHBondContact O-CB 3.46Å; A76-M80 VanDerWaalsContact O-CG 3.31Å; A76-M80 WeakPolarHBondContact O-CG 3.13Å; A76-M80 PolarHBondContact O-N 3.33Å; D77-M80 PolarHBondContact O-N 3.5Å; M80-A82 VanDerWaalsContact C-N 3.33Å; M80-A82 PolarHBondContact O-N 3Å; M80-I83 PolarHBondContact O-N 3.04Å; M80-I83 HydrophobicContact SD-CD1 4.48Å; M80-E84 PolarHBondContact O-N 3.12Å; M80-M120 WeakPolarHBondContact CE-O 3.37Å; M80-S124 VanDerWaalsContact CE-CB 3.45Å
81	G	80.7	Confident	83.3	Confident	12 Å²	12	21.1 Å²	21.1	12%	0.124	10%	0.099	C	C	.	.	H	α-helix	trans	-59.4	-42	173.9	0	0	0	0	0	112.7	D77 R78 F79 E84 V85	D77-G81 PolarHBondContact O-N 3.02Å; R78-G81 PolarHBondContact O-N 3.3Å; F79-G81 VanDerWaalsContact C-N 3.33Å; F79-G81 PolarHBondContact O-N 3.04Å; G81-E84 WeakPolarHBondContact O-CB 3.34Å; G81-E84 PolarHBondContact O-N 2.9Å; G81-V85 PolarHBondContact O-N 3.01Å
82	A	85.9	Confident	82.2	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-66.4	-45.5	176.3	0	0	0	0	0	112.5	R78 F79 M80 E84 V85 I86 T721 F730	R78-A82 PolarHBondContact O-N 3.03Å; F79-A82 WeakPolarHBondContact O-CB 3.21Å; F79-A82 PolarHBondContact O-N 2.76Å; M80-A82 VanDerWaalsContact C-N 3.33Å; M80-A82 PolarHBondContact O-N 3Å; A82-E84 PolarHBondContact O-N 2.82Å; A82-V85 PolarHBondContact O-N 3.43Å; A82-V85 VanDerWaalsContact O-N 3.07Å; A82-I86 WeakPolarHBondContact O-CG1 3.34Å; A82-I86 PolarHBondContact O-N 3.3Å; A82-I86 VanDerWaalsContact O-N 3.16Å; A82-T721 HydrophobicContact CB-CG2 4.37Å; A82-F730 HydrophobicContact CB-CB 4.01Å
83	I	84.1	Confident	81.3	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-56.9	-40.6	174.6	-74.5	159.5	0	0	0	111	F79 M80 V85 I86 T87 L119 M120 F730	F79-I83 HydrophobicContact CD1-CD1 3.83Å; F79-I83 HydrophobicContact CD2-CD1 4.11Å; F79-I83 HydrophobicContact CD2-CG1 4.47Å; F79-I83 HydrophobicContact CE1-CD1 3.63Å; F79-I83 HydrophobicContact CE2-CD1 3.92Å; F79-I83 HydrophobicContact CE2-CG1 4.25Å; F79-I83 HydrophobicContact CG-CD1 4.08Å; F79-I83 HydrophobicContact CZ-CD1 3.67Å; F79-I83 HydrophobicContact CZ-CG1 4.38Å; F79-I83 WeakPolarHBondContact O-CG1 3.1Å; F79-I83 PolarHBondContact O-N 3.33Å; M80-I83 PolarHBondContact O-N 3.04Å; M80-I83 HydrophobicContact SD-CD1 4.48Å; I83-V85 VanDerWaalsContact C-N 3.31Å; I83-V85 PolarHBondContact O-N 3.39Å; I83-I86 PolarHBondContact O-N 2.83Å; I83-T87 HydrophobicContact CG2-CG2 4.18Å; I83-T87 WeakPolarHBondContact O-CB 3.41Å; I83-T87 VanDerWaalsContact O-CG2 3.3Å; I83-T87 WeakPolarHBondContact O-CG2 3.43Å; I83-T87 PolarHBondContact O-N 3.27Å; I83-T87 PolarHBondContact O-OG1 3.45Å; I83-L119 WeakPolarHBondContact CD1-O 3.31Å; I83-L119 HydrophobicContact CG1-CB 4.35Å; I83-L119 HydrophobicContact CG2-CB 3.63Å; I83-M120 HydrophobicContact CG2-CG 3.94Å; I83-F730 HydrophobicContact CD1-CE2 4.39Å; I83-F730 HydrophobicContact CG1-CD2 3.83Å; I83-F730 HydrophobicContact CG1-CE2 3.79Å
84	E	79.4	Confident	80.3	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-59.3	-46.4	177.6	-145.9	-165.3	151.7	0	0	110.3	M80 G81 A82 I86 T87 S88 S331 A333 F334 R667	M80-E84 PolarHBondContact O-N 3.12Å; G81-E84 WeakPolarHBondContact O-CB 3.34Å; G81-E84 PolarHBondContact O-N 2.9Å; A82-E84 PolarHBondContact O-N 2.82Å; E84-I86 VanDerWaalsContact C-N 3.31Å; E84-I86 PolarHBondContact O-N 3.18Å; E84-T87 WeakPolarHBondContact CA-OG1 3.18Å; E84-T87 PolarHBondContact O-N 2.93Å; E84-T87 VanDerWaalsContact O-N 3.17Å; E84-T87 PolarHBondContact O-OG1 3.35Å; E84-T87 VanDerWaalsContact O-OG1 3.09Å; E84-S88 WeakPolarHBondContact O-CB 3.37Å; E84-S88 PolarHBondContact O-N 3.47Å; E84-S331 WeakPolarHBondContact OE1-CB 3.46Å; E84-S331 PolarHBondContact OE1-OG 3.24Å; E84-A333 HydrophobicContact CB-CB 3.77Å; E84-A333 VanDerWaalsContact CD-CB 3.5Å; E84-A333 HydrophobicContact CG-CB 3.32Å; E84-F334 PolarHBondContact OE2-N 3.49Å; E84-R667 VanDerWaalsContact CB-NH2 3.3Å; E84-R667 PolarHBondContact O-NH2 3.19Å; E84-R667 IonicContact OE1-NH2 2.84Å; E84-R667 PolarHBondContact OE1-NH2 2.77Å; E84-R667 IonicContact OE2-NE 3.25Å
85	V	79.3	Confident	79.3	Confident	14 Å²	14	35.4 Å²	35.4	9%	0.085	18%	0.183	C	C	.	.	H	α-helix	trans	-56.1	-48	178.4	-176.6	0	0	0	0	112.5	G81 A82 I83 T87 Q89 R667 D725	G81-V85 PolarHBondContact O-N 3.01Å; A82-V85 PolarHBondContact O-N 3.43Å; A82-V85 VanDerWaalsContact O-N 3.07Å; I83-V85 VanDerWaalsContact C-N 3.31Å; I83-V85 PolarHBondContact O-N 3.39Å; V85-T87 VanDerWaalsContact C-N 3.29Å; V85-T87 PolarHBondContact O-N 3.4Å; V85-Q89 WeakPolarHBondContact O-CG 3.5Å; V85-R667 VanDerWaalsContact CA-CZ 3.4Å; V85-R667 HydrophobicContact CG2-CB 3.93Å; V85-R667 HydrophobicContact CG2-CG 3.41Å; V85-R667 VanDerWaalsContact CG2-CG 3.41Å; V85-D725 VanDerWaalsContact CG1-C 3.48Å; V85-D725 WeakPolarHBondContact CG1-O 2.94Å
86	I	83.7	Confident	78.2	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-62.4	-41.5	180	-63.2	165.3	0	0	0	110.6	A82 I83 E84 Q89 W110 L119 W727 F730	A82-I86 WeakPolarHBondContact O-CG1 3.34Å; A82-I86 PolarHBondContact O-N 3.3Å; A82-I86 VanDerWaalsContact O-N 3.16Å; I83-I86 PolarHBondContact O-N 2.83Å; E84-I86 VanDerWaalsContact C-N 3.31Å; E84-I86 PolarHBondContact O-N 3.18Å; I86-Q89 WeakPolarHBondContact O-CG 3.44Å; I86-W110 HydrophobicContact CG2-CZ2 4.41Å; I86-W110 VanDerWaalsContact O-CD1 3.28Å; I86-W110 PolarHBondContact O-NE1 3.07Å; I86-W110 VanDerWaalsContact O-NE1 3.09Å; I86-L119 HydrophobicContact CB-CD1 4.48Å; I86-L119 HydrophobicContact CG2-CD1 3.78Å; I86-W727 HydrophobicContact CD1-CD2 3.78Å; I86-W727 HydrophobicContact CD1-CE3 3.88Å; I86-W727 HydrophobicContact CD1-CG 4.25Å; I86-W727 HydrophobicContact CD1-CH2 4.37Å; I86-W727 HydrophobicContact CD1-CZ2 4.27Å; I86-W727 HydrophobicContact CD1-CZ3 4.18Å; I86-W727 HydrophobicContact CG1-CD2 4.21Å; I86-W727 HydrophobicContact CG1-CG 4.41Å; I86-W727 HydrophobicContact CG1-CZ2 4.47Å; I86-W727 HydrophobicContact CG2-CH2 4.27Å; I86-W727 HydrophobicContact CG2-CZ2 3.66Å; I86-F730 HydrophobicContact CD1-CB 3.88Å; I86-F730 HydrophobicContact CD1-CD2 3.87Å; I86-F730 HydrophobicContact CD1-CG 3.97Å
87	T	78.4	Confident	76.9	Confident	8 Å²	8	48.2 Å²	48.2	5%	0.049	23%	0.233	C	C	.	.	H	α-helix	trans	-81.6	-26.3	-173.7	54.2	0	0	0	0	114.3	I83 E84 V85 Q89 L119	I83-T87 HydrophobicContact CG2-CG2 4.18Å; I83-T87 WeakPolarHBondContact O-CB 3.41Å; I83-T87 VanDerWaalsContact O-CG2 3.3Å; I83-T87 WeakPolarHBondContact O-CG2 3.43Å; I83-T87 PolarHBondContact O-N 3.27Å; I83-T87 PolarHBondContact O-OG1 3.45Å; E84-T87 WeakPolarHBondContact CA-OG1 3.18Å; E84-T87 PolarHBondContact O-N 2.93Å; E84-T87 VanDerWaalsContact O-N 3.17Å; E84-T87 PolarHBondContact O-OG1 3.35Å; E84-T87 VanDerWaalsContact O-OG1 3.09Å; V85-T87 VanDerWaalsContact C-N 3.29Å; V85-T87 PolarHBondContact O-N 3.4Å; T87-Q89 VanDerWaalsContact C-N 3.3Å; T87-Q89 PolarHBondContact O-N 2.95Å; T87-L119 HydrophobicContact CG2-CB 4.14Å; T87-L119 HydrophobicContact CG2-CD1 3.8Å
88	S	74.8	Confident	75.8	Confident	20 Å²	20	57.4 Å²	57.4	14%	0.14	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	10.4	-178.8	88.8	0	0	0	0	114.1	E84 R667	E84-S88 WeakPolarHBondContact O-CB 3.37Å; E84-S88 PolarHBondContact O-N 3.47Å; S88-R667 VanDerWaalsContact CB-NH2 3.29Å; S88-R667 VanDerWaalsContact OG-CZ 3.27Å; S88-R667 PolarHBondContact OG-NH1 2.8Å; S88-R667 PolarHBondContact OG-NH2 3.48Å
89	Q	74.7	Confident	74.6	Confident	52 Å²	52	60.7 Å²	60.7	24%	0.243	29%	0.292	C	S	.	.			trans	-62.3	137.8	178.6	-66.2	-178.1	-1.9	0	0	110.9	V85 I86 T87 R108 I109	V85-Q89 WeakPolarHBondContact O-CG 3.5Å; I86-Q89 WeakPolarHBondContact O-CG 3.44Å; T87-Q89 VanDerWaalsContact C-N 3.3Å; T87-Q89 PolarHBondContact O-N 2.95Å; Q89-R108 WeakPolarHBondContact O-CA 3.16Å; Q89-I109 HydrophobicContact CB-CD1 3.72Å; Q89-I109 HydrophobicContact CB-CG1 4.29Å; Q89-I109 PolarHBondContact O-N 3.38Å
90	E	74.4	Confident	73.2	Confident	71 Å²	71	62.3 Å²	62.3	33%	0.332	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	132.9	180	-68.3	175.8	-180	0	0	110.1	V107 R108 N661	E90-V107 CarbonylContact C-O 3.55Å; E90-V107 WeakPolarHBondContact CA-O 3.42Å; E90-R108 HydrophobicContact CG-CG 4.3Å; E90-N661 PolarHBondContact OE1-ND2 3.43Å; E90-N661 PolarHBondContact OE2-ND2 2.86Å
91	R	73.5	Confident	71.9	Confident	176 Å²	176	64.5 Å²	64.5	66%	0.664	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	131.8	172.7	-175.7	175.7	-178.6	177.8	2.1	109.5	V93 V107 I109	R91-V93 HydrophobicContact CG-CG2 4.33Å; R91-V93 PolarHBondContact O-N 3.15Å; R91-V107 PolarHBondContact N-O 3.07Å; R91-V107 PolarHBondContact O-N 3.22Å; R91-I109 HydrophobicContact CB-CD1 4.33Å; R91-I109 HydrophobicContact CB-CG1 3.87Å
92	T	70.3	Confident	71	Confident	89 Å²	89	71.8 Å²	71.8	55%	0.546	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	118.4	170.5	50.7	0	0	0	0	109.5	I105 K106	T92-I105 WeakPolarHBondContact CA-O 3.46Å; T92-K106 HydrophobicContact CG2-CG 3.76Å
93	V	72.9	Confident	70.1	Confident	55 Å²	55	73 Å²	73	33%	0.333	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	123.9	176.7	-177.4	0	0	0	0	108.7	R91 L95 I105	R91-V93 HydrophobicContact CG-CG2 4.33Å; R91-V93 PolarHBondContact O-N 3.15Å; V93-L95 HydrophobicContact CG1-CD2 4.49Å; V93-L95 HydrophobicContact CG1-CG 4.4Å; V93-L95 PolarHBondContact O-N 3.07Å; V93-I105 PolarHBondContact N-O 3.38Å; V93-I105 PolarHBondContact O-N 3.46Å
94	T	69.8	Low	68.9	Low	89 Å²	89	79.8 Å²	79.8	55%	0.546	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	103.4	174.9	52.6	0	0	0	0	109.5	V103 K104	T94-V103 CarbonylContact C-O 3.28Å; T94-V103 WeakPolarHBondContact CA-O 3.45Å; T94-K104 HydrophobicContact CG2-CD 4.42Å; T94-K104 HydrophobicContact CG2-CG 3.73Å
95	L	67.8	Low	68.1	Low	91 Å²	91	82.8 Å²	82.8	48%	0.476	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	133.8	173.4	-70	165.7	0	0	0	109.8	V93 K102 V103 I105	V93-L95 HydrophobicContact CG1-CD2 4.49Å; V93-L95 HydrophobicContact CG1-CG 4.4Å; V93-L95 PolarHBondContact O-N 3.07Å; L95-K102 WeakPolarHBondContact O-CA 3.45Å; L95-V103 PolarHBondContact N-O 3.08Å; L95-V103 PolarHBondContact O-N 3.3Å; L95-I105 HydrophobicContact CD1-CD1 3.62Å; L95-I105 HydrophobicContact CD1-CG1 4.1Å
96	R	67.4	Low	67.1	Low	196 Å²	196	88.5 Å²	88.5	74%	0.74	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	112.4	172.5	-164.1	174.8	-174.8	-178.6	-3.2	108
97	K	60	Low	66.4	Low	75 Å²	75	92 Å²	92	33%	0.326	45%	0.451	S	S	.	.			trans	-64.1	162.4	172.6	-83.8	179.1	170.8	176.7	0	109.9	D99 G100 S101 V103 N284	K97-D99 PolarHBondContact O-N 3.1Å; K97-G100 PolarHBondContact O-N 3.02Å; K97-S101 PolarHBondContact N-O 3.29Å; K97-V103 HydrophobicContact CD-CG2 3.81Å; K97-V103 HydrophobicContact CG-CG2 4.19Å; K97-N284 PolarHBondContact NZ-OD1 2.78Å
98	K	57.9	Low	66	Low	207 Å²	207	98 Å²	98	90%	0.9	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-30.9	174.4	-70.3	-173.1	176.9	-178.1	0	112.3	G100	K98-G100 PolarHBondContact O-N 3.35Å
99	D	59.4	Low	66.1	Low	109 Å²	109	101.4 Å²	101.4	58%	0.583	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	5	178.2	-51.4	-12.3	0	0	0	113.4	K97 S101 N282	K97-D99 PolarHBondContact O-N 3.1Å; D99-S101 VanDerWaalsContact C-N 3.26Å; D99-S101 PolarHBondContact O-N 3.18Å; D99-N282 PolarHBondContact OD2-ND2 3.46Å
100	G	59.6	Low	66.3	Low	35 Å²	35	102.7 Å²	102.7	36%	0.361	49%	0.491	S	S	.	.	S	Bend	trans	83	-14.2	178.5	0	0	0	0	0	115.5	K97 K98	K97-G100 PolarHBondContact O-N 3.02Å; K98-G100 PolarHBondContact O-N 3.35Å
101	S	56.1	Low	66.6	Low	54 Å²	54	101.2 Å²	101.2	38%	0.378	49%	0.485	S	S	.	.			trans	-68.1	140.9	176.1	57.7	0	0	0	0	112.4	K97 D99	K97-S101 PolarHBondContact N-O 3.29Å; D99-S101 VanDerWaalsContact C-N 3.26Å; D99-S101 PolarHBondContact O-N 3.18Å
102	K	61.9	Low	66.7	Low	165 Å²	165	97.6 Å²	97.6	72%	0.717	48%	0.476	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	118.5	178.2	-65.3	-179.8	-177.9	177.3	0	109.4	L95	L95-K102 WeakPolarHBondContact O-CA 3.45Å
103	V	66.7	Low	67	Low	24 Å²	24	94.2 Å²	94.2	15%	0.145	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	133.5	174.8	-178.3	0	0	0	0	109	T94 L95 K97 I105	T94-V103 CarbonylContact C-O 3.28Å; T94-V103 WeakPolarHBondContact CA-O 3.45Å; L95-V103 PolarHBondContact N-O 3.08Å; L95-V103 PolarHBondContact O-N 3.3Å; K97-V103 HydrophobicContact CD-CG2 3.81Å; K97-V103 HydrophobicContact CG-CG2 4.19Å; V103-I105 HydrophobicContact CG1-CG1 3.97Å
104	K	58.8	Low	67.6	Low	143 Å²	143	92.8 Å²	92.8	62%	0.622	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.8	93	179.6	-70.1	-171.7	-178.3	-179.5	0	110	T94	T94-K104 HydrophobicContact CG2-CD 4.42Å; T94-K104 HydrophobicContact CG2-CG 3.73Å
105	I	63	Low	68.1	Low	64 Å²	64	89 Å²	89	33%	0.328	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	131.3	178.2	-51.7	-168.3	0	0	0	109.8	T92 V93 L95 V103 V107 E286	T92-I105 WeakPolarHBondContact CA-O 3.46Å; V93-I105 PolarHBondContact N-O 3.38Å; V93-I105 PolarHBondContact O-N 3.46Å; L95-I105 HydrophobicContact CD1-CD1 3.62Å; L95-I105 HydrophobicContact CD1-CG1 4.1Å; V103-I105 HydrophobicContact CG1-CG1 3.97Å; I105-V107 HydrophobicContact CB-CG2 4.45Å; I105-V107 HydrophobicContact CG2-CG2 3.95Å; I105-E286 WeakPolarHBondContact CA-OE1 3.4Å
106	K	58.6	Low	68.5	Low	134 Å²	134	85.3 Å²	85.3	58%	0.583	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	117.9	167.8	-69.6	-178.1	-176.1	-179.2	0	109.2	T92	T92-K106 HydrophobicContact CG2-CG 3.76Å
107	V	67.9	Low	69.1	Low	74 Å²	74	76.2 Å²	76.2	45%	0.448	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	135.3	178.6	-175.3	0	0	0	0	108.4	E90 R91 I105 I109	E90-V107 CarbonylContact C-O 3.55Å; E90-V107 WeakPolarHBondContact CA-O 3.42Å; R91-V107 PolarHBondContact N-O 3.07Å; R91-V107 PolarHBondContact O-N 3.22Å; I105-V107 HydrophobicContact CB-CG2 4.45Å; I105-V107 HydrophobicContact CG2-CG2 3.95Å; V107-I109 PolarHBondContact O-N 3.26Å
108	R	71	Confident	70.2	Confident	136 Å²	136	73.7 Å²	73.7	51%	0.513	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	135.9	173.3	-68.2	-177.6	-178.9	172.4	-0.5	110.3	Q89 E90 W110	Q89-R108 WeakPolarHBondContact O-CA 3.16Å; E90-R108 HydrophobicContact CG-CG 4.3Å; R108-W110 VanDerWaalsContact C-N 3.33Å
109	I	76.3	Confident	71.3	Confident	91 Å²	91	64.8 Å²	64.8	47%	0.467	32%	0.323	S	S	.	.	S	Bend	trans	-67.6	-40.6	178.2	-62.9	179	0	0	0	109.9	Q89 R91 V107	Q89-I109 HydrophobicContact CB-CD1 3.72Å; Q89-I109 HydrophobicContact CB-CG1 4.29Å; Q89-I109 PolarHBondContact O-N 3.38Å; R91-I109 HydrophobicContact CB-CD1 4.33Å; R91-I109 HydrophobicContact CB-CG1 3.87Å; V107-I109 PolarHBondContact O-N 3.26Å
110	W	78	Confident	72.3	Confident	78 Å²	78	60 Å²	60	30%	0.295	30%	0.297	S	S	.	.	S	Bend	trans	-93.1	133.8	-179.4	-64.6	87.7	0	0	0	111.4	I86 R108 V114 L119	I86-W110 HydrophobicContact CG2-CZ2 4.41Å; I86-W110 VanDerWaalsContact O-CD1 3.28Å; I86-W110 PolarHBondContact O-NE1 3.07Å; I86-W110 VanDerWaalsContact O-NE1 3.09Å; R108-W110 VanDerWaalsContact C-N 3.33Å; W110-V114 HydrophobicContact CE3-CG1 4.25Å; W110-V114 HydrophobicContact CZ3-CG1 4.4Å; W110-L119 HydrophobicContact CH2-CD1 4.17Å; W110-L119 HydrophobicContact CZ2-CD1 4.19Å
111	N	81	Confident	73.4	Confident	40 Å²	40	58.3 Å²	58.3	21%	0.214	28%	0.28	C	S	.	.			trans	-69	138.5	164.9	170.6	-77	0	0	0	109.1	T113 V114 S115 Y230 D233	N111-T113 PolarHBondContact O-N 3.18Å; N111-T113 WeakPolarHBondContact OD1-CA 3.15Å; N111-T113 VanDerWaalsContact OD1-CB 3.28Å; N111-T113 WeakPolarHBondContact OD1-CB 3.37Å; N111-T113 PolarHBondContact OD1-N 3.42Å; N111-V114 HydrophobicContact CB-CB 4.12Å; N111-V114 HydrophobicContact CB-CG2 3.95Å; N111-V114 PolarHBondContact O-N 3.3Å; N111-V114 VanDerWaalsContact O-N 3.15Å; N111-V114 PolarHBondContact OD1-N 3.42Å; N111-V114 VanDerWaalsContact OD1-N 3.1Å; N111-S115 PolarHBondContact O-N 3.4Å; N111-S115 PolarHBondContact O-OG 3.32Å; N111-Y230 HydrophobicContact CB-CD2 3.98Å; N111-Y230 HydrophobicContact CB-CE2 3.87Å; N111-D233 PolarHBondContact ND2-OD2 3.11Å
112	E	75.5	Confident	74.8	Confident	101 Å²	101	57.3 Å²	57.3	47%	0.472	27%	0.271	S	S	.	.	H	α-helix	trans	-62.7	-41.8	-174.2	-174	169.2	-178.9	0	0	113	V114 S115 N116	E112-V114 VanDerWaalsContact C-N 3.34Å; E112-V114 PolarHBondContact O-N 2.82Å; E112-S115 WeakPolarHBondContact CA-OG 3.5Å; E112-S115 PolarHBondContact O-N 3.43Å; E112-S115 PolarHBondContact O-OG 3.4Å; E112-N116 WeakPolarHBondContact O-CB 3.49Å; E112-N116 PolarHBondContact O-N 3.03Å; E112-N116 PolarHBondContact O-ND2 3.1Å
113	T	77.6	Confident	75.9	Confident	18 Å²	18	49.5 Å²	49.5	11%	0.11	24%	0.236	C	C	.	.	H	α-helix	trans	-62.6	-43	174.3	-54.4	0	0	0	0	111.2	N111 N116 L117 V183 A229 D233	N111-T113 PolarHBondContact O-N 3.18Å; N111-T113 WeakPolarHBondContact OD1-CA 3.15Å; N111-T113 VanDerWaalsContact OD1-CB 3.28Å; N111-T113 WeakPolarHBondContact OD1-CB 3.37Å; N111-T113 PolarHBondContact OD1-N 3.42Å; T113-N116 PolarHBondContact O-N 3.41Å; T113-L117 HydrophobicContact CG2-CD1 4.03Å; T113-L117 PolarHBondContact O-N 3.3Å; T113-L117 VanDerWaalsContact O-N 3.08Å; T113-V183 HydrophobicContact CG2-CG1 3.62Å; T113-A229 HydrophobicContact CG2-CB 4.05Å; T113-D233 HydrophobicContact CG2-CB 4.42Å; T113-D233 WeakPolarHBondContact OG1-CB 3.18Å; T113-D233 VanDerWaalsContact OG1-CG 3.28Å
114	V	85.3	Confident	76.8	Confident	24 Å²	24	48.3 Å²	48.3	15%	0.145	23%	0.229	C	C	.	.	H	α-helix	trans	-64.7	-47.4	178.5	175.2	0	0	0	0	111.1	W110 N111 E112 N116 L117 T118 V226 Y230	W110-V114 HydrophobicContact CE3-CG1 4.25Å; W110-V114 HydrophobicContact CZ3-CG1 4.4Å; N111-V114 HydrophobicContact CB-CB 4.12Å; N111-V114 HydrophobicContact CB-CG2 3.95Å; N111-V114 PolarHBondContact O-N 3.3Å; N111-V114 VanDerWaalsContact O-N 3.15Å; N111-V114 PolarHBondContact OD1-N 3.42Å; N111-V114 VanDerWaalsContact OD1-N 3.1Å; E112-V114 VanDerWaalsContact C-N 3.34Å; E112-V114 PolarHBondContact O-N 2.82Å; V114-N116 PolarHBondContact O-N 3.2Å; V114-L117 PolarHBondContact O-N 3.46Å; V114-T118 HydrophobicContact CG1-CG2 4.12Å; V114-T118 WeakPolarHBondContact O-CB 3.37Å; V114-T118 WeakPolarHBondContact O-CG2 3.24Å; V114-T118 PolarHBondContact O-N 2.86Å; V114-T118 PolarHBondContact O-OG1 3.44Å; V114-V226 HydrophobicContact CB-CG1 4.41Å; V114-V226 HydrophobicContact CG1-CG1 3.82Å; V114-V226 HydrophobicContact CG2-CG1 4.2Å; V114-Y230 HydrophobicContact CG2-CD2 3.63Å; V114-Y230 HydrophobicContact CG2-CG 4.03Å
115	S	80.4	Confident	78.3	Confident	9 Å²	9	41.5 Å²	41.5	6%	0.063	20%	0.2	C	C	.	.	H	α-helix	trans	-60.2	-37.8	178	56	0	0	0	0	112	N111 E112 L119 M120	N111-S115 PolarHBondContact O-N 3.4Å; N111-S115 PolarHBondContact O-OG 3.32Å; E112-S115 WeakPolarHBondContact CA-OG 3.5Å; E112-S115 PolarHBondContact O-N 3.43Å; E112-S115 PolarHBondContact O-OG 3.4Å; S115-L119 PolarHBondContact O-N 3.5Å; S115-M120 WeakPolarHBondContact O-CB 3.45Å; S115-M120 WeakPolarHBondContact O-CG 3.33Å; S115-M120 PolarHBondContact O-N 3.36Å
116	N	75.5	Confident	79.7	Confident	15 Å²	15	38.6 Å²	38.6	8%	0.08	19%	0.185	C	C	.	.	I	π-helix	trans	-66.3	-44.7	179.1	-75.7	-45.2	0	0	0	112.5	E112 T113 V114 M120 A121 R332	E112-N116 WeakPolarHBondContact O-CB 3.49Å; E112-N116 PolarHBondContact O-N 3.03Å; E112-N116 PolarHBondContact O-ND2 3.1Å; T113-N116 PolarHBondContact O-N 3.41Å; V114-N116 PolarHBondContact O-N 3.2Å; N116-M120 PolarHBondContact OD1-SD 3.21Å; N116-A121 WeakPolarHBondContact O-CB 3.48Å; N116-A121 PolarHBondContact O-N 3.36Å; N116-R332 VanDerWaalsContact CG-NH1 3.31Å; N116-R332 PolarHBondContact ND2-NH1 2.88Å; N116-R332 PolarHBondContact OD1-NE 3.35Å; N116-R332 PolarHBondContact OD1-NH1 3.26Å
117	L	79.8	Confident	81.4	Confident	5 Å²	5	32.2 Å²	32.2	3%	0.026	16%	0.158	C	C	.	.	I	π-helix	trans	-82.9	-20.3	-177.3	-69	172	0	0	0	114	T113 V114 T187 A229 T794 V802	T113-L117 HydrophobicContact CG2-CD1 4.03Å; T113-L117 PolarHBondContact O-N 3.3Å; T113-L117 VanDerWaalsContact O-N 3.08Å; V114-L117 PolarHBondContact O-N 3.46Å; L117-T187 HydrophobicContact CD1-CG2 3.73Å; L117-T187 HydrophobicContact CD2-CG2 3.72Å; L117-T187 HydrophobicContact CG-CG2 4.32Å; L117-A229 HydrophobicContact CD1-CB 3.22Å; L117-T794 HydrophobicContact CD2-CG2 4.28Å; L117-V802 WeakPolarHBondContact O-CG2 3.14Å
118	T	84.6	Confident	82.6	Confident	21 Å²	21	28.7 Å²	28.7	13%	0.129	14%	0.136	C	C	.	.	I	π-helix	trans	-95	-92.3	178.8	55	0	0	0	0	110.9	V114 M120 L122 F222 V226	V114-T118 HydrophobicContact CG1-CG2 4.12Å; V114-T118 WeakPolarHBondContact O-CB 3.37Å; V114-T118 WeakPolarHBondContact O-CG2 3.24Å; V114-T118 PolarHBondContact O-N 2.86Å; V114-T118 PolarHBondContact O-OG1 3.44Å; T118-M120 PolarHBondContact O-N 3.39Å; T118-L122 WeakPolarHBondContact O-CB 3.29Å; T118-L122 PolarHBondContact O-N 3.24Å; T118-F222 HydrophobicContact CG2-CZ 4.15Å; T118-V226 HydrophobicContact CG2-CB 4.2Å; T118-V226 HydrophobicContact CG2-CG1 3.63Å; T118-V226 HydrophobicContact CG2-CG2 3.49Å; T118-V226 VanDerWaalsContact CG2-CG2 3.49Å
119	L	81.1	Confident	83.7	Confident	20 Å²	20	22.6 Å²	22.6	11%	0.105	11%	0.114	C	C	.	.	I	π-helix	trans	-70.2	-35.8	-170.5	-66.6	173.8	0	0	0	112.2	I83 I86 T87 W110 S115 L122 G123 F730	I83-L119 WeakPolarHBondContact CD1-O 3.31Å; I83-L119 HydrophobicContact CG1-CB 4.35Å; I83-L119 HydrophobicContact CG2-CB 3.63Å; I86-L119 HydrophobicContact CB-CD1 4.48Å; I86-L119 HydrophobicContact CG2-CD1 3.78Å; T87-L119 HydrophobicContact CG2-CB 4.14Å; T87-L119 HydrophobicContact CG2-CD1 3.8Å; W110-L119 HydrophobicContact CH2-CD1 4.17Å; W110-L119 HydrophobicContact CZ2-CD1 4.19Å; S115-L119 PolarHBondContact O-N 3.5Å; L119-L122 HydrophobicContact CD2-CD2 4.36Å; L119-G123 PolarHBondContact O-N 2.75Å; L119-F730 HydrophobicContact CD2-CE2 4.12Å; L119-F730 HydrophobicContact CD2-CZ 4.26Å
120	M	79.9	Confident	84.6	Confident	8 Å²	8	19.6 Å²	19.6	4%	0.039	10%	0.099	C	C	.	.	I	π-helix	trans	-76.8	-31.5	-178.5	-64.2	-170	-178.5	0	0	113.8	M80 I83 S115 N116 T118 G123 R336	M80-M120 WeakPolarHBondContact CE-O 3.37Å; I83-M120 HydrophobicContact CG2-CG 3.94Å; S115-M120 WeakPolarHBondContact O-CB 3.45Å; S115-M120 WeakPolarHBondContact O-CG 3.33Å; S115-M120 PolarHBondContact O-N 3.36Å; N116-M120 PolarHBondContact OD1-SD 3.21Å; T118-M120 PolarHBondContact O-N 3.39Å; M120-G123 PolarHBondContact O-N 3.36Å; M120-R336 PolarHBondContact O-NH1 3.42Å; M120-R336 VanDerWaalsContact O-NH1 3.13Å
121	A	82.1	Confident	85.4	Confident	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-73.2	-43.9	171.9	0	0	0	0	0	110.4	N116 G123 S124 S125 V802	N116-A121 WeakPolarHBondContact O-CB 3.48Å; N116-A121 PolarHBondContact O-N 3.36Å; A121-G123 PolarHBondContact O-N 3.37Å; A121-S124 PolarHBondContact O-N 3.06Å; A121-S124 PolarHBondContact O-OG 2.9Å; A121-S125 VanDerWaalsContact O-CB 3.31Å; A121-S125 WeakPolarHBondContact O-CB 3.17Å; A121-S125 PolarHBondContact O-N 3.26Å; A121-S125 PolarHBondContact O-OG 3.14Å; A121-V802 HydrophobicContact CB-CB 4.46Å; A121-V802 HydrophobicContact CB-CG2 3.83Å
122	L	86.7	Confident	86	Confident	34 Å²	34	14.4 Å²	14.4	18%	0.178	8%	0.077	C	C	.	.	H	α-helix	trans	-53.2	-40.2	168.5	175.9	65.9	0	0	0	111.7	F79 T118 L119 S124 S125 A126 I129 F730 L806	F79-L122 HydrophobicContact CZ-CD2 4.48Å; F79-L122 HydrophobicContact CZ-CG 4.32Å; T118-L122 WeakPolarHBondContact O-CB 3.29Å; T118-L122 PolarHBondContact O-N 3.24Å; L119-L122 HydrophobicContact CD2-CD2 4.36Å; L122-S124 VanDerWaalsContact C-N 3.3Å; L122-S124 PolarHBondContact O-N 3.39Å; L122-S125 PolarHBondContact O-N 3.24Å; L122-A126 WeakPolarHBondContact O-CA 3.46Å; L122-A126 WeakPolarHBondContact O-CB 3.25Å; L122-A126 PolarHBondContact O-N 3.41Å; L122-I129 HydrophobicContact CD1-CD1 3.7Å; L122-F730 HydrophobicContact CD2-CZ 4.32Å; L122-L806 HydrophobicContact CD1-CD2 3.7Å
123	G	85	Confident	87	Confident	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-47.3	-48.2	176.3	0	0	0	0	0	114.4	F79 L119 M120 A121	F79-G123 WeakPolarHBondContact CD1-O 3.46Å; L119-G123 PolarHBondContact O-N 2.75Å; M120-G123 PolarHBondContact O-N 3.36Å; A121-G123 PolarHBondContact O-N 3.37Å
124	S	84.4	Confident	87.8	Confident	0 Å²	0	12 Å²	12	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-92.9	-28.2	-174	50.3	0	0	0	0	112.6	M80 A121 L122 D775 S799	M80-S124 VanDerWaalsContact CE-CB 3.45Å; A121-S124 PolarHBondContact O-N 3.06Å; A121-S124 PolarHBondContact O-OG 2.9Å; L122-S124 VanDerWaalsContact C-N 3.3Å; L122-S124 PolarHBondContact O-N 3.39Å; S124-D775 WeakPolarHBondContact CB-OD1 3.03Å; S124-D775 PolarHBondContact OG-OD1 3.22Å; S124-S799 PolarHBondContact OG-OG 2.99Å
125	S	90.8	Very high	88.1	Confident	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-87.8	-0.3	177.7	-63.7	0	0	0	0	115	A121 L122 P127 E128 I129 S799 N803	A121-S125 VanDerWaalsContact O-CB 3.31Å; A121-S125 WeakPolarHBondContact O-CB 3.17Å; A121-S125 PolarHBondContact O-N 3.26Å; A121-S125 PolarHBondContact O-OG 3.14Å; L122-S125 PolarHBondContact O-N 3.24Å; S125-P127 VanDerWaalsContact C-CD 3.42Å; S125-P127 VanDerWaalsContact C-N 3.32Å; S125-E128 VanDerWaalsContact CA-OE2 3.28Å; S125-E128 WeakPolarHBondContact CA-OE2 3.3Å; S125-E128 PolarHBondContact O-N 3.38Å; S125-E128 VanDerWaalsContact O-OE2 3.12Å; S125-I129 WeakPolarHBondContact O-CD1 3.37Å; S125-I129 VanDerWaalsContact O-CG1 3.27Å; S125-I129 WeakPolarHBondContact O-CG1 3.47Å; S125-I129 PolarHBondContact O-N 2.9Å; S125-I129 VanDerWaalsContact O-N 3.12Å; S125-S799 WeakPolarHBondContact OG-CB 3.19Å; S125-N803 WeakPolarHBondContact CB-OD1 3.42Å; S125-N803 PolarHBondContact OG-OD1 2.85Å
126	A	92.9	Very high	88.7	Confident	3 Å²	3	11.3 Å²	11.3	3%	0.025	6%	0.06	C	C	.	.	H	α-helix	trans	-55.4	-41.6	-177.4	0	0	0	0	0	113.1	F79 L122 E128 I129 L130	F79-A126 HydrophobicContact CD1-CB 4.15Å; F79-A126 HydrophobicContact CE1-CB 3.67Å; L122-A126 WeakPolarHBondContact O-CA 3.46Å; L122-A126 WeakPolarHBondContact O-CB 3.25Å; L122-A126 PolarHBondContact O-N 3.41Å; A126-E128 PolarHBondContact O-N 3.42Å; A126-I129 PolarHBondContact O-N 2.87Å; A126-L130 HydrophobicContact CB-CD1 4.37Å; A126-L130 VanDerWaalsContact O-CB 3.24Å; A126-L130 WeakPolarHBondContact O-CB 3.33Å; A126-L130 WeakPolarHBondContact O-CD1 3.28Å; A126-L130 WeakPolarHBondContact O-CG 3.41Å; A126-L130 PolarHBondContact O-N 3.37Å
127	P	93.2	Very high	89.6	Confident	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-60.9	-42	-179.5	-24.5	35.9	0	0	0	113.7	V72 S125 L131 I737 T741 T771	V72-P127 HydrophobicContact CG1-CB 3.89Å; V72-P127 HydrophobicContact CG1-CG 3.38Å; S125-P127 VanDerWaalsContact C-CD 3.42Å; S125-P127 VanDerWaalsContact C-N 3.32Å; P127-L131 VanDerWaalsContact O-CB 3.27Å; P127-L131 WeakPolarHBondContact O-CB 3.26Å; P127-L131 PolarHBondContact O-N 2.84Å; P127-I737 HydrophobicContact CG-CG2 4.24Å; P127-T741 HydrophobicContact CB-CG2 3.81Å; P127-T771 HydrophobicContact CB-CG2 4.07Å
128	E	93.8	Very high	90	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-68.1	-44.5	179.4	-65.2	79.2	-177.8	0	0	112.2	S125 A126 L131 S132 T150 I151 T771 S772	S125-E128 VanDerWaalsContact CA-OE2 3.28Å; S125-E128 WeakPolarHBondContact CA-OE2 3.3Å; S125-E128 PolarHBondContact O-N 3.38Å; S125-E128 VanDerWaalsContact O-OE2 3.12Å; A126-E128 PolarHBondContact O-N 3.42Å; E128-L131 PolarHBondContact O-N 2.89Å; E128-S132 PolarHBondContact O-N 3.01Å; E128-S132 VanDerWaalsContact O-N 3.16Å; E128-S132 PolarHBondContact O-OG 3.42Å; E128-S132 VanDerWaalsContact O-OG 3.11Å; E128-T150 HydrophobicContact CG-CG2 4.43Å; E128-I151 HydrophobicContact CB-CG1 4.13Å; E128-T771 WeakPolarHBondContact CG-OG1 3.44Å; E128-T771 WeakPolarHBondContact OE1-CB 3.34Å; E128-T771 PolarHBondContact OE1-OG1 3.11Å; E128-S772 PolarHBondContact OE1-N 3.15Å
129	I	94.2	Very high	90.1	Very high	8 Å²	8	16 Å²	16	4%	0.041	10%	0.095	C	C	.	.	H	α-helix	trans	-63	-47.6	178.5	-68.2	164.7	0	0	0	109.5	L122 S125 A126 S132 I133 V802 L806	L122-I129 HydrophobicContact CD1-CD1 3.7Å; S125-I129 WeakPolarHBondContact O-CD1 3.37Å; S125-I129 VanDerWaalsContact O-CG1 3.27Å; S125-I129 WeakPolarHBondContact O-CG1 3.47Å; S125-I129 PolarHBondContact O-N 2.9Å; S125-I129 VanDerWaalsContact O-N 3.12Å; A126-I129 PolarHBondContact O-N 2.87Å; I129-S132 PolarHBondContact O-N 3.28Å; I129-I133 HydrophobicContact CG2-CD1 3.82Å; I129-I133 WeakPolarHBondContact O-CD1 3.22Å; I129-I133 VanDerWaalsContact O-CG1 3.3Å; I129-I133 WeakPolarHBondContact O-CG1 3.45Å; I129-I133 PolarHBondContact O-N 3.49Å; I129-I133 VanDerWaalsContact O-N 3.14Å; I129-V802 HydrophobicContact CD1-CG1 3.95Å; I129-L806 HydrophobicContact CD1-CD2 4.16Å; I129-L806 HydrophobicContact CD1-CG 4.4Å
130	L	95.5	Very high	90.5	Very high	28 Å²	28	17.1 Å²	17.1	15%	0.147	11%	0.112	C	C	.	.	H	α-helix	trans	-67.2	-39.5	-179.9	-71.7	166.2	0	0	0	111.6	A126 S132 I133 I134 I734 I737	A126-L130 HydrophobicContact CB-CD1 4.37Å; A126-L130 VanDerWaalsContact O-CB 3.24Å; A126-L130 WeakPolarHBondContact O-CB 3.33Å; A126-L130 WeakPolarHBondContact O-CD1 3.28Å; A126-L130 WeakPolarHBondContact O-CG 3.41Å; A126-L130 PolarHBondContact O-N 3.37Å; L130-S132 VanDerWaalsContact C-N 3.31Å; L130-S132 PolarHBondContact O-N 3.43Å; L130-I133 PolarHBondContact O-N 3.15Å; L130-I134 HydrophobicContact CB-CD1 4.25Å; L130-I134 VanDerWaalsContact O-CB 3.28Å; L130-I134 WeakPolarHBondContact O-CB 3.41Å; L130-I134 WeakPolarHBondContact O-CD1 3.35Å; L130-I134 WeakPolarHBondContact O-CG1 3.32Å; L130-I134 PolarHBondContact O-N 2.93Å; L130-I734 HydrophobicContact CD1-CG2 4.41Å; L130-I734 HydrophobicContact CD2-CG2 4.34Å; L130-I737 HydrophobicContact CD1-CB 4.02Å; L130-I737 HydrophobicContact CD1-CG2 3.59Å
131	L	95.2	Very high	91	Very high	6 Å²	6	18.9 Å²	18.9	3%	0.031	12%	0.119	C	C	.	.	H	α-helix	trans	-57.4	-45.7	176	-176.4	66.4	0	0	0	111.5	P127 E128 I134 E135 L146 T150 V767	P127-L131 VanDerWaalsContact O-CB 3.27Å; P127-L131 WeakPolarHBondContact O-CB 3.26Å; P127-L131 PolarHBondContact O-N 2.84Å; E128-L131 PolarHBondContact O-N 2.89Å; L131-I134 PolarHBondContact O-N 3.31Å; L131-E135 VanDerWaalsContact O-CB 3.3Å; L131-E135 WeakPolarHBondContact O-CB 3.45Å; L131-E135 PolarHBondContact O-N 2.89Å; L131-L146 HydrophobicContact CD1-CD2 4.25Å; L131-L146 HydrophobicContact CD2-CD2 4.39Å; L131-T150 HydrophobicContact CD2-CG2 3.86Å; L131-V767 HydrophobicContact CD2-CG1 3.84Å
132	S	93.6	Very high	91.4	Very high	3 Å²	3	24 Å²	24	2%	0.021	15%	0.146	C	C	.	.	H	α-helix	trans	-66.9	-38.5	-179.9	-58.3	0	0	0	0	112.7	E128 I129 L130 I136 G147 I151	E128-S132 PolarHBondContact O-N 3.01Å; E128-S132 VanDerWaalsContact O-N 3.16Å; E128-S132 PolarHBondContact O-OG 3.42Å; E128-S132 VanDerWaalsContact O-OG 3.11Å; I129-S132 PolarHBondContact O-N 3.28Å; L130-S132 VanDerWaalsContact C-N 3.31Å; L130-S132 PolarHBondContact O-N 3.43Å; S132-I136 WeakPolarHBondContact O-CG1 3.49Å; S132-I136 PolarHBondContact O-N 3.46Å; S132-G147 PolarHBondContact OG-O 3.24Å; S132-I151 WeakPolarHBondContact OG-CD1 3.2Å
133	I	95.1	Very high	91.3	Very high	32 Å²	32	24.1 Å²	24.1	16%	0.164	15%	0.152	C	C	.	.	H	α-helix	trans	-68.7	-45.8	176.5	-65.6	165.1	0	0	0	110.8	I129 L130 I136 C137 L810 A811	I129-I133 HydrophobicContact CG2-CD1 3.82Å; I129-I133 WeakPolarHBondContact O-CD1 3.22Å; I129-I133 VanDerWaalsContact O-CG1 3.3Å; I129-I133 WeakPolarHBondContact O-CG1 3.45Å; I129-I133 PolarHBondContact O-N 3.49Å; I129-I133 VanDerWaalsContact O-N 3.14Å; L130-I133 PolarHBondContact O-N 3.15Å; I133-I136 PolarHBondContact O-N 3.29Å; I133-C137 WeakPolarHBondContact O-CB 3.5Å; I133-C137 PolarHBondContact O-N 3.47Å; I133-C137 PolarHBondContact O-SG 3.46Å; I133-L810 HydrophobicContact CD1-CD2 3.84Å; I133-L810 HydrophobicContact CD1-CG 4.4Å; I133-A811 HydrophobicContact CG1-CB 3.95Å
134	I	94.5	Very high	91.4	Very high	36 Å²	36	24.4 Å²	24.4	19%	0.185	16%	0.155	C	C	.	.	H	α-helix	trans	-66.2	-40.3	-178	-69.3	164.2	0	0	0	110.7	L38 L130 L131 C137 G138 G738 T741 A742	L38-I134 HydrophobicContact CD2-CG2 3.73Å; L130-I134 HydrophobicContact CB-CD1 4.25Å; L130-I134 VanDerWaalsContact O-CB 3.28Å; L130-I134 WeakPolarHBondContact O-CB 3.41Å; L130-I134 WeakPolarHBondContact O-CD1 3.35Å; L130-I134 WeakPolarHBondContact O-CG1 3.32Å; L130-I134 PolarHBondContact O-N 2.93Å; L131-I134 PolarHBondContact O-N 3.31Å; I134-C137 PolarHBondContact O-N 3.02Å; I134-G138 WeakPolarHBondContact O-CA 3.48Å; I134-G138 PolarHBondContact O-N 3.45Å; I134-G738 WeakPolarHBondContact CD1-O 3.41Å; I134-T741 WeakPolarHBondContact CD1-OG1 3.43Å; I134-A742 HydrophobicContact CD1-CB 4.31Å; I134-A742 HydrophobicContact CG2-CB 3.94Å
135	E	92.7	Very high	91.6	Very high	15 Å²	15	28 Å²	28	7%	0.07	17%	0.174	C	C	.	.	H	α-helix	trans	-61	-46.8	178	-176.5	-179.5	-142.5	0	0	111.5	R35 L131 N139 G144 L146 G147	R35-E135 IonicContact NH2-OE1 3.8Å; L131-E135 VanDerWaalsContact O-CB 3.3Å; L131-E135 WeakPolarHBondContact O-CB 3.45Å; L131-E135 PolarHBondContact O-N 2.89Å; E135-N139 VanDerWaalsContact CG-ND2 3.32Å; E135-N139 WeakPolarHBondContact CG-ND2 3.43Å; E135-N139 VanDerWaalsContact O-CB 3.25Å; E135-N139 WeakPolarHBondContact O-CB 3.47Å; E135-N139 VanDerWaalsContact O-CG 3.23Å; E135-N139 PolarHBondContact O-N 2.86Å; E135-N139 PolarHBondContact O-ND2 3.34Å; E135-N139 VanDerWaalsContact O-ND2 3.09Å; E135-G144 VanDerWaalsContact CD-CA 3.49Å; E135-G144 WeakPolarHBondContact OE1-CA 3.31Å; E135-L146 VanDerWaalsContact OE1-CB 3.23Å; E135-L146 WeakPolarHBondContact OE1-CB 3.47Å; E135-L146 PolarHBondContact OE1-N 3.02Å; E135-L146 VanDerWaalsContact OE1-N 3.07Å; E135-G147 VanDerWaalsContact OE2-CA 3.31Å; E135-G147 WeakPolarHBondContact OE2-CA 3.35Å; E135-G147 PolarHBondContact OE2-N 3.48Å
136	I	93.3	Very high	91.5	Very high	4 Å²	4	28.1 Å²	28.1	2%	0.021	18%	0.175	C	C	.	.	H	α-helix	trans	-65	-50.3	178.8	-71.3	-172	0	0	0	110.7	S132 I133 G138 N139 F141 A811 W812 A815 F826	S132-I136 WeakPolarHBondContact O-CG1 3.49Å; S132-I136 PolarHBondContact O-N 3.46Å; I133-I136 PolarHBondContact O-N 3.29Å; I136-G138 VanDerWaalsContact C-N 3.31Å; I136-G138 PolarHBondContact O-N 2.97Å; I136-N139 PolarHBondContact O-N 2.87Å; I136-F141 HydrophobicContact CG2-CD1 4.23Å; I136-F141 WeakPolarHBondContact O-CA 3.35Å; I136-F141 PolarHBondContact O-N 2.68Å; I136-A811 HydrophobicContact CD1-CB 3.71Å; I136-W812 VanDerWaalsContact CD1-CD1 3.48Å; I136-A815 HydrophobicContact CD1-CB 4.5Å; I136-A815 HydrophobicContact CG2-CB 3.7Å; I136-F826 HydrophobicContact CD1-CZ 4.26Å
137	C	92.6	Very high	91.5	Very high	59 Å²	59	28 Å²	28	40%	0.399	17%	0.173	S	C	.	.	H	α-helix	trans	-64.7	-35.9	-179.5	-69.3	0	0	0	0	112.3	I133 I134	I133-C137 WeakPolarHBondContact O-CB 3.5Å; I133-C137 PolarHBondContact O-N 3.47Å; I133-C137 PolarHBondContact O-SG 3.46Å; I134-C137 PolarHBondContact O-N 3.02Å
138	G	88.3	Confident	91.5	Very high	30 Å²	30	28.4 Å²	28.4	31%	0.309	18%	0.176	S	C	.	.	H	α-helix	trans	-74.3	-31.9	-179.6	0	0	0	0	0	113.5	I134 I136 G140	I134-G138 WeakPolarHBondContact O-CA 3.48Å; I134-G138 PolarHBondContact O-N 3.45Å; I136-G138 VanDerWaalsContact C-N 3.31Å; I136-G138 PolarHBondContact O-N 2.97Å; G138-G140 VanDerWaalsContact C-N 3.3Å; G138-G140 PolarHBondContact O-N 3.49Å
139	N	87.6	Confident	91.5	Very high	49 Å²	49	28.6 Å²	28.6	26%	0.262	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	26.5	179.8	-65.1	-32.9	0	0	0	113.4	R35 E135 I136 F141 L142	R35-N139 PolarHBondContact NH1-ND2 2.87Å; R35-N139 PolarHBondContact NH1-OD1 3.43Å; R35-N139 VanDerWaalsContact NH1-OD1 3.14Å; E135-N139 VanDerWaalsContact CG-ND2 3.32Å; E135-N139 WeakPolarHBondContact CG-ND2 3.43Å; E135-N139 VanDerWaalsContact O-CB 3.25Å; E135-N139 WeakPolarHBondContact O-CB 3.47Å; E135-N139 VanDerWaalsContact O-CG 3.23Å; E135-N139 PolarHBondContact O-N 2.86Å; E135-N139 PolarHBondContact O-ND2 3.34Å; E135-N139 VanDerWaalsContact O-ND2 3.09Å; I136-N139 PolarHBondContact O-N 2.87Å; N139-F141 VanDerWaalsContact C-N 3.34Å; N139-F141 PolarHBondContact O-N 3.32Å; N139-L142 WeakPolarHBondContact O-CB 3.32Å; N139-L142 PolarHBondContact O-N 2.89Å
140	G	88.4	Confident	91.5	Very high	44 Å²	44	28.2 Å²	28.2	45%	0.454	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.9	35.7	178.8	0	0	0	0	0	113.8	G138 L142	G138-G140 VanDerWaalsContact C-N 3.3Å; G138-G140 PolarHBondContact O-N 3.49Å; G140-L142 PolarHBondContact O-N 3Å
141	F	91.7	Very high	91.5	Very high	46 Å²	46	26.9 Å²	26.9	20%	0.202	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.3	18.1	-177.9	-52.6	-86.2	0	0	0	114.8	I136 N139 I814 Y818 H819	I136-F141 HydrophobicContact CG2-CD1 4.23Å; I136-F141 WeakPolarHBondContact O-CA 3.35Å; I136-F141 PolarHBondContact O-N 2.68Å; N139-F141 VanDerWaalsContact C-N 3.34Å; N139-F141 PolarHBondContact O-N 3.32Å; F141-I814 HydrophobicContact CD1-CG2 4.13Å; F141-I814 HydrophobicContact CE1-CG2 3.72Å; F141-Y818 HydrophobicContact CB-CD1 3.5Å; F141-Y818 HydrophobicContact CB-CE1 3.96Å; F141-Y818 HydrophobicContact CB-CG 4.08Å; F141-Y818 HydrophobicContact CD1-CD1 4.41Å; F141-Y818 HydrophobicContact CD1-CG 4.14Å; F141-Y818 AromaticContact CD2-CD1 3.46Å; F141-Y818 HydrophobicContact CD2-CD1 3.46Å; F141-Y818 VanDerWaalsContact CD2-CD1 3.46Å; F141-Y818 AromaticContact CD2-CD2 3.71Å; F141-Y818 HydrophobicContact CD2-CD2 3.71Å; F141-Y818 AromaticContact CD2-CE1 3.46Å; F141-Y818 HydrophobicContact CD2-CE1 3.46Å; F141-Y818 VanDerWaalsContact CD2-CE1 3.46Å; F141-Y818 AromaticContact CD2-CE2 3.71Å; F141-Y818 HydrophobicContact CD2-CE2 3.71Å; F141-Y818 AromaticContact CD2-CG 3.57Å; F141-Y818 HydrophobicContact CD2-CG 3.57Å; F141-Y818 AromaticContact CD2-CZ 3.57Å; F141-Y818 HydrophobicContact CE2-CD1 4.29Å; F141-Y818 AromaticContact CE2-CD2 3.67Å; F141-Y818 HydrophobicContact CE2-CD2 3.67Å; F141-Y818 HydrophobicContact CE2-CE1 4.27Å; F141-Y818 AromaticContact CE2-CE2 3.65Å; F141-Y818 HydrophobicContact CE2-CE2 3.65Å; F141-Y818 AromaticContact CE2-CG 3.99Å; F141-Y818 HydrophobicContact CE2-CG 3.99Å; F141-Y818 AromaticContact CE2-CZ 3.95Å; F141-Y818 AromaticContact CG-CD1 3.54Å; F141-Y818 HydrophobicContact CG-CD1 3.54Å; F141-Y818 HydrophobicContact CG-CD2 4.22Å; F141-Y818 AromaticContact CG-CE1 3.97Å; F141-Y818 HydrophobicContact CG-CE1 3.97Å; F141-Y818 AromaticContact CG-CG 3.66Å; F141-Y818 HydrophobicContact CG-CG 3.66Å; F141-Y818 HydrophobicContact CZ-CD2 4.15Å; F141-Y818 HydrophobicContact CZ-CG 4.44Å; F141-H819 PolarHBondContact O-CD2 2.9Å; F141-H819 PolarHBondContact O-NE2 2.79Å
142	L	89.7	Confident	91.5	Very high	108 Å²	108	26.6 Å²	26.6	57%	0.565	17%	0.167	S	C	*	.	P	Polyproline II helix	trans	-82.8	146.3	168.5	-62	174.1	0	0	0	110.4	N139 G140 G144	N139-L142 WeakPolarHBondContact O-CB 3.32Å; N139-L142 PolarHBondContact O-N 2.89Å; G140-L142 PolarHBondContact O-N 3Å; L142-G144 PolarHBondContact O-N 3.38Å
143	A	86.1	Confident	91.6	Very high	35 Å²	35	26.4 Å²	26.4	29%	0.289	17%	0.166	S	C	.	.	P	Polyproline II helix	trans	-68.5	126.6	175.2	0	0	0	0	0	109.7	F826 V828	A143-F826 HydrophobicContact CB-CE2 3.83Å; A143-F826 HydrophobicContact CB-CZ 3.87Å; A143-V828 HydrophobicContact CB-CB 4.37Å; A143-V828 HydrophobicContact CB-CG1 4.31Å; A143-V828 HydrophobicContact CB-CG2 3.81Å
144	G	86.4	Confident	91.5	Very high	6 Å²	6	24.9 Å²	24.9	6%	0.062	16%	0.158	C	C	.	.	P	Polyproline II helix	trans	-101.6	160.3	168.9	0	0	0	0	0	111.1	E135 L142 P148	E135-G144 VanDerWaalsContact CD-CA 3.49Å; E135-G144 WeakPolarHBondContact OE1-CA 3.31Å; L142-G144 PolarHBondContact O-N 3.38Å; G144-P148 WeakPolarHBondContact O-CD 3.23Å; G144-P148 WeakPolarHBondContact O-CG 3.08Å
145	D	87.7	Confident	91.5	Very high	76 Å²	76	23.2 Å²	23.2	41%	0.406	15%	0.149	S	C	.	.	S	Bend	trans	-86.7	-21.6	179.8	-71.2	-36.5	0	0	0	112.4	N149 D759	D145-N149 WeakPolarHBondContact O-CB 3.27Å; D145-N149 PolarHBondContact O-N 3.49Å; D145-N149 PolarHBondContact O-ND2 3.06Å; D145-D759 HydrophobicContact CB-CB 4.3Å
146	L	89.6	Confident	91.7	Very high	3 Å²	3	22.5 Å²	22.5	2%	0.016	15%	0.146	C	C	.	.	H	α-helix	trans	-70.3	-49.9	-171.8	-167.6	80.2	0	0	0	111.4	L131 E135 T150 A748 A763 V767	L131-L146 HydrophobicContact CD1-CD2 4.25Å; L131-L146 HydrophobicContact CD2-CD2 4.39Å; E135-L146 VanDerWaalsContact OE1-CB 3.23Å; E135-L146 WeakPolarHBondContact OE1-CB 3.47Å; E135-L146 PolarHBondContact OE1-N 3.02Å; E135-L146 VanDerWaalsContact OE1-N 3.07Å; L146-T150 VanDerWaalsContact O-CB 3.23Å; L146-T150 WeakPolarHBondContact O-CB 3.38Å; L146-T150 PolarHBondContact O-N 2.96Å; L146-T150 PolarHBondContact O-OG1 3.25Å; L146-A748 HydrophobicContact CD1-CB 4.24Å; L146-A748 HydrophobicContact CD2-CB 4.26Å; L146-A763 HydrophobicContact CD1-CB 3.94Å; L146-A763 HydrophobicContact CG-CB 4.46Å; L146-A763 WeakPolarHBondContact O-CB 3.01Å; L146-V767 HydrophobicContact CD1-CG2 4.33Å
147	G	91.8	Very high	91.9	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.6	-58	-175.5	0	0	0	0	0	113.4	S132 E135 N149 T150 I151	S132-G147 PolarHBondContact OG-O 3.24Å; E135-G147 VanDerWaalsContact OE2-CA 3.31Å; E135-G147 WeakPolarHBondContact OE2-CA 3.35Å; E135-G147 PolarHBondContact OE2-N 3.48Å; G147-N149 PolarHBondContact O-N 3.25Å; G147-T150 WeakPolarHBondContact O-CB 3.33Å; G147-T150 PolarHBondContact O-N 3.45Å; G147-T150 VanDerWaalsContact O-N 3.14Å; G147-I151 PolarHBondContact O-N 2.7Å
148	P	93.3	Very high	91.9	Very high	8 Å²	8	20.3 Å²	20.3	5%	0.052	13%	0.129	C	C	.	.	H	α-helix	trans	-58.3	-44.5	178.2	-25.3	35.1	0	0	0	113.1	G144 T150 I151 V152 W812 L833	G144-P148 WeakPolarHBondContact O-CD 3.23Å; G144-P148 WeakPolarHBondContact O-CG 3.08Å; P148-T150 VanDerWaalsContact C-N 3.35Å; P148-T150 PolarHBondContact O-N 3.37Å; P148-I151 PolarHBondContact O-N 3.5Å; P148-V152 WeakPolarHBondContact O-CG2 3.39Å; P148-V152 PolarHBondContact O-N 2.83Å; P148-V152 VanDerWaalsContact O-N 3.15Å; P148-W812 HydrophobicContact CG-CZ2 4.39Å; P148-L833 HydrophobicContact CB-CD1 4.02Å; P148-L833 HydrophobicContact CB-CD2 3.74Å
149	N	94.1	Very high	92.2	Very high	4 Å²	4	18.9 Å²	18.9	2%	0.021	12%	0.115	C	C	.	.	H	α-helix	trans	-67.7	-33.7	176.5	-73.3	-70.8	0	0	0	112.2	D145 G147 I151 V152 G153 A760 A763 I764	D145-N149 WeakPolarHBondContact O-CB 3.27Å; D145-N149 PolarHBondContact O-N 3.49Å; D145-N149 PolarHBondContact O-ND2 3.06Å; G147-N149 PolarHBondContact O-N 3.25Å; N149-I151 VanDerWaalsContact C-N 3.34Å; N149-V152 PolarHBondContact O-N 3.5Å; N149-G153 PolarHBondContact O-N 3.02Å; N149-A760 HydrophobicContact CB-CB 4.48Å; N149-A763 HydrophobicContact CB-CB 3.74Å; N149-I764 HydrophobicContact CB-CG2 4.1Å; N149-I764 WeakPolarHBondContact O-CG2 3.45Å
150	T	95.1	Very high	92.6	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-62.6	-42.9	172.5	-62.6	0	0	0	0	110.4	E128 L131 L146 G147 P148 V152 G153 S154 A763 V767 T771	E128-T150 HydrophobicContact CG-CG2 4.43Å; L131-T150 HydrophobicContact CD2-CG2 3.86Å; L146-T150 VanDerWaalsContact O-CB 3.23Å; L146-T150 WeakPolarHBondContact O-CB 3.38Å; L146-T150 PolarHBondContact O-N 2.96Å; L146-T150 PolarHBondContact O-OG1 3.25Å; G147-T150 WeakPolarHBondContact O-CB 3.33Å; G147-T150 PolarHBondContact O-N 3.45Å; G147-T150 VanDerWaalsContact O-N 3.14Å; P148-T150 VanDerWaalsContact C-N 3.35Å; P148-T150 PolarHBondContact O-N 3.37Å; T150-V152 PolarHBondContact O-N 3.33Å; T150-G153 PolarHBondContact O-N 2.89Å; T150-S154 VanDerWaalsContact O-CB 3.27Å; T150-S154 WeakPolarHBondContact O-CB 3.17Å; T150-S154 PolarHBondContact O-N 3.42Å; T150-S154 PolarHBondContact O-OG 3.07Å; T150-A763 WeakPolarHBondContact OG1-CB 3.35Å; T150-V767 HydrophobicContact CG2-CB 4.34Å; T150-V767 HydrophobicContact CG2-CG1 3.78Å; T150-T771 HydrophobicContact CG2-CG2 4.45Å
151	I	94.8	Very high	93	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-59	-47	177.6	-80.3	174.9	0	0	0	111.8	E128 S132 G147 P148 N149 A155 N803 V804 I808	E128-I151 HydrophobicContact CB-CG1 4.13Å; S132-I151 WeakPolarHBondContact OG-CD1 3.2Å; G147-I151 PolarHBondContact O-N 2.7Å; P148-I151 PolarHBondContact O-N 3.5Å; N149-I151 VanDerWaalsContact C-N 3.34Å; I151-A155 WeakPolarHBondContact O-CB 3.36Å; I151-A155 PolarHBondContact O-N 2.94Å; I151-N803 HydrophobicContact CG1-CB 4.49Å; I151-N803 HydrophobicContact CG2-CB 3.84Å; I151-V804 HydrophobicContact CG2-CG2 4.23Å; I151-I808 HydrophobicContact CB-CD1 4.37Å; I151-I808 HydrophobicContact CB-CG1 4.47Å; I151-I808 HydrophobicContact CD1-CD1 4.35Å; I151-I808 HydrophobicContact CD1-CG1 3.54Å; I151-I808 HydrophobicContact CG2-CD1 3.8Å; I151-I808 HydrophobicContact CG2-CG1 4.1Å
152	V	94.8	Very high	93.2	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-70.2	-41.9	179.9	-176	0	0	0	0	111.2	P148 N149 T150 A155 A156 Y195 L198 L833 V837 F840	P148-V152 WeakPolarHBondContact O-CG2 3.39Å; P148-V152 PolarHBondContact O-N 2.83Å; P148-V152 VanDerWaalsContact O-N 3.15Å; N149-V152 PolarHBondContact O-N 3.5Å; T150-V152 PolarHBondContact O-N 3.33Å; V152-A155 WeakPolarHBondContact O-CB 3.49Å; V152-A155 PolarHBondContact O-N 3.23Å; V152-A156 PolarHBondContact O-N 3.38Å; V152-Y195 HydrophobicContact CG2-CD1 4.39Å; V152-Y195 HydrophobicContact CG2-CE1 4.23Å; V152-L198 HydrophobicContact CG2-CD2 4.23Å; V152-L833 HydrophobicContact CG2-CD1 3.75Å; V152-V837 HydrophobicContact CG1-CG2 4.05Å; V152-V837 HydrophobicContact CG2-CG2 3.68Å; V152-F840 HydrophobicContact CG1-CB 4.4Å
153	G	95.2	Very high	93.4	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-60.3	-45.5	175	0	0	0	0	0	113.2	N149 T150 A155 A156 F157 A768 Y884	N149-G153 PolarHBondContact O-N 3.02Å; T150-G153 PolarHBondContact O-N 2.89Å; G153-A155 VanDerWaalsContact C-N 3.31Å; G153-A155 PolarHBondContact O-N 3.1Å; G153-A156 PolarHBondContact O-N 3.39Å; G153-F157 PolarHBondContact O-N 2.77Å; G153-A768 VanDerWaalsContact C-CB 3.47Å; G153-Y884 WeakPolarHBondContact CA-OH 3.26Å; G153-Y884 PolarHBondContact N-OH 2.84Å
154	S	94.5	Very high	93.9	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-64.1	-37.8	175.5	-67.2	0	0	0	0	110.9	T150 A156 F157 N158 A768 T771 S772	T150-S154 VanDerWaalsContact O-CB 3.27Å; T150-S154 WeakPolarHBondContact O-CB 3.17Å; T150-S154 PolarHBondContact O-N 3.42Å; T150-S154 PolarHBondContact O-OG 3.07Å; S154-A156 PolarHBondContact O-N 2.79Å; S154-F157 PolarHBondContact O-N 2.99Å; S154-N158 WeakPolarHBondContact O-CB 3.19Å; S154-N158 PolarHBondContact O-N 2.85Å; S154-N158 PolarHBondContact O-OD1 2.88Å; S154-A768 VanDerWaalsContact OG-CA 3.32Å; S154-A768 WeakPolarHBondContact OG-CA 3.14Å; S154-A768 PolarHBondContact OG-O 2.88Å; S154-T771 PolarHBondContact OG-OG1 3.47Å; S154-S772 VanDerWaalsContact CB-OG 3.28Å; S154-S772 WeakPolarHBondContact CB-OG 3.37Å; S154-S772 PolarHBondContact OG-OG 3.4Å
155	A	94.7	Very high	94.3	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-62.6	-42.6	175.4	0	0	0	0	0	112.8	I151 V152 G153 M159 Y195 N800 F840	I151-A155 WeakPolarHBondContact O-CB 3.36Å; I151-A155 PolarHBondContact O-N 2.94Å; V152-A155 WeakPolarHBondContact O-CB 3.49Å; V152-A155 PolarHBondContact O-N 3.23Å; G153-A155 VanDerWaalsContact C-N 3.31Å; G153-A155 PolarHBondContact O-N 3.1Å; A155-M159 VanDerWaalsContact O-CB 3.23Å; A155-M159 WeakPolarHBondContact O-CB 3.26Å; A155-M159 PolarHBondContact O-N 2.94Å; A155-Y195 HydrophobicContact CB-CE1 3.7Å; A155-Y195 HydrophobicContact CB-CE2 4.29Å; A155-Y195 WeakPolarHBondContact CB-OH 3.04Å; A155-N800 WeakPolarHBondContact CA-OD1 3.15Å; A155-N800 PolarHBondContact O-ND2 2.83Å; A155-F840 HydrophobicContact CB-CE1 4.44Å; A155-F840 HydrophobicContact CB-CE2 4.03Å; A155-F840 HydrophobicContact CB-CZ 3.91Å; A155-F840 WeakPolarHBondContact O-CE2 3.4Å
156	A	96.1	Very high	94.7	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	3%	0.033	C	C	.	.	H	α-helix	trans	-63.3	-46.8	174.2	0	0	0	0	0	111.2	V152 G153 S154 N158 M159 F160 F840 Y884	V152-A156 PolarHBondContact O-N 3.38Å; G153-A156 PolarHBondContact O-N 3.39Å; S154-A156 PolarHBondContact O-N 2.79Å; A156-N158 PolarHBondContact O-N 3.23Å; A156-M159 PolarHBondContact O-N 2.79Å; A156-F160 HydrophobicContact CB-CD2 4.07Å; A156-F160 HydrophobicContact CB-CE2 3.86Å; A156-F160 VanDerWaalsContact O-CB 3.3Å; A156-F160 WeakPolarHBondContact O-CB 3.4Å; A156-F160 WeakPolarHBondContact O-CD2 3.48Å; A156-F160 VanDerWaalsContact O-CG 3.23Å; A156-F160 WeakPolarHBondContact O-CG 3.26Å; A156-F160 PolarHBondContact O-N 3.46Å; A156-F840 HydrophobicContact CB-CD2 3.86Å; A156-F840 HydrophobicContact CB-CE2 4.39Å; A156-Y884 HydrophobicContact CB-CD1 3.62Å; A156-Y884 HydrophobicContact CB-CD2 4.26Å; A156-Y884 HydrophobicContact CB-CE1 3.44Å; A156-Y884 VanDerWaalsContact CB-CE1 3.44Å; A156-Y884 HydrophobicContact CB-CE2 4.09Å; A156-Y884 HydrophobicContact CB-CG 4.04Å
157	F	96.6	Very high	94.9	Very high	17 Å²	17	6.3 Å²	6.3	8%	0.075	3%	0.032	C	C	.	.	H	α-helix	trans	-61.8	-44.6	177	-174.9	-98.2	0	0	0	112	G153 S154 M159 F160 M161 I162 I769 S772 T776 W881	G153-F157 PolarHBondContact O-N 2.77Å; S154-F157 PolarHBondContact O-N 2.99Å; F157-M159 PolarHBondContact O-N 3.45Å; F157-F160 PolarHBondContact O-N 3.48Å; F157-M161 HydrophobicContact CD2-CB 3.59Å; F157-M161 HydrophobicContact CD2-CG 3.54Å; F157-M161 HydrophobicContact CE2-CB 3.52Å; F157-M161 HydrophobicContact CE2-CG 3.64Å; F157-M161 HydrophobicContact CG-CB 4.12Å; F157-M161 HydrophobicContact CG-CG 4.41Å; F157-M161 HydrophobicContact CZ-CB 4.02Å; F157-M161 WeakPolarHBondContact O-CA 3.06Å; F157-M161 WeakPolarHBondContact O-CB 3.41Å; F157-M161 PolarHBondContact O-N 3.4Å; F157-I162 HydrophobicContact CD1-CD1 4.38Å; F157-I162 HydrophobicContact CD1-CG1 4.16Å; F157-I162 HydrophobicContact CE1-CD1 4.49Å; F157-I162 HydrophobicContact CE1-CG1 4.12Å; F157-I162 PolarHBondContact O-N 2.81Å; F157-I162 VanDerWaalsContact O-N 3.11Å; F157-I769 HydrophobicContact CD2-CG1 3.9Å; F157-I769 HydrophobicContact CE2-CG1 3.85Å; F157-I769 HydrophobicContact CE2-CG2 4.39Å; F157-I769 HydrophobicContact CZ-CG1 4.47Å; F157-I769 HydrophobicContact CZ-CG2 4.28Å; F157-S772 VanDerWaalsContact CD1-CB 3.42Å; F157-T776 HydrophobicContact CD1-CG2 4.41Å; F157-T776 HydrophobicContact CE1-CG2 3.41Å; F157-T776 VanDerWaalsContact CE1-CG2 3.41Å; F157-T776 HydrophobicContact CZ-CG2 4.06Å; F157-W881 AromaticContact CD2-CE2 3.75Å; F157-W881 AromaticContact CD2-CZ2 3.82Å; F157-W881 HydrophobicContact CD2-CZ2 3.82Å; F157-W881 AromaticContact CD2-NE1 3.67Å; F157-W881 HydrophobicContact CE2-CZ2 4.27Å
158	N	93.7	Very high	95	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	5%	0.054	C	C	.	.	I	π-helix	trans	-58.7	-47.4	174.7	-77.1	-3.2	0	0	0	111.5	S154 A156 I162 D775 V796 N800	S154-N158 WeakPolarHBondContact O-CB 3.19Å; S154-N158 PolarHBondContact O-N 2.85Å; S154-N158 PolarHBondContact O-OD1 2.88Å; A156-N158 PolarHBondContact O-N 3.23Å; N158-I162 HydrophobicContact CB-CD1 4.18Å; N158-I162 WeakPolarHBondContact O-CB 3.22Å; N158-I162 WeakPolarHBondContact OD1-CD1 3.31Å; N158-D775 PolarHBondContact ND2-OD2 2.79Å; N158-V796 HydrophobicContact CB-CG1 4.2Å; N158-V796 WeakPolarHBondContact O-CG1 3.3Å; N158-N800 WeakPolarHBondContact CB-OD1 3.38Å
159	M	94	Very high	94.9	Very high	1 Å²	1	10.7 Å²	10.7	1%	0.005	6%	0.062	C	C	.	.	I	π-helix	trans	-72.2	-32.6	-176.4	-162.3	62.3	-177.9	0	0	113.1	A155 A156 F157 L163 V796 F840 A844 C847 I848	A155-M159 VanDerWaalsContact O-CB 3.23Å; A155-M159 WeakPolarHBondContact O-CB 3.26Å; A155-M159 PolarHBondContact O-N 2.94Å; A156-M159 PolarHBondContact O-N 2.79Å; F157-M159 PolarHBondContact O-N 3.45Å; M159-L163 HydrophobicContact CE-CD1 4.37Å; M159-L163 VanDerWaalsContact O-CD1 3.24Å; M159-L163 WeakPolarHBondContact O-CD1 3.27Å; M159-L163 WeakPolarHBondContact O-CG 3.3Å; M159-L163 HydrophobicContact SD-CD1 4.12Å; M159-V796 HydrophobicContact SD-CG1 4.13Å; M159-F840 HydrophobicContact CB-CE2 3.99Å; M159-F840 HydrophobicContact CG-CE2 4.49Å; M159-A844 HydrophobicContact CG-CB 4.2Å; M159-C847 HydrophobicContact CE-CB 4.27Å; M159-C847 HydrophobicContact CG-CB 4.45Å; M159-C847 PolarHBondContact O-SG 2.95Å; M159-I848 HydrophobicContact CE-CD1 3.65Å; M159-I848 HydrophobicContact CE-CG1 3.24Å
160	F	96.8	Very high	94.7	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	6%	0.061	C	C	.	.	I	π-helix	trans	-105	-60.7	-171.7	-54.4	-36.1	0	0	0	111.6	A156 F157 A164 F840 E843 C847 F877 L880 W881	A156-F160 HydrophobicContact CB-CD2 4.07Å; A156-F160 HydrophobicContact CB-CE2 3.86Å; A156-F160 VanDerWaalsContact O-CB 3.3Å; A156-F160 WeakPolarHBondContact O-CB 3.4Å; A156-F160 WeakPolarHBondContact O-CD2 3.48Å; A156-F160 VanDerWaalsContact O-CG 3.23Å; A156-F160 WeakPolarHBondContact O-CG 3.26Å; A156-F160 PolarHBondContact O-N 3.46Å; F157-F160 PolarHBondContact O-N 3.48Å; F160-A164 VanDerWaalsContact O-CB 3.32Å; F160-A164 WeakPolarHBondContact O-CB 3.16Å; F160-A164 PolarHBondContact O-N 3.28Å; F160-F840 HydrophobicContact CE2-CD2 4.31Å; F160-F840 HydrophobicContact CZ-CD2 4.15Å; F160-F840 HydrophobicContact CZ-CE2 4.43Å; F160-E843 HydrophobicContact CE1-CB 4.04Å; F160-E843 HydrophobicContact CE2-CB 4.19Å; F160-E843 HydrophobicContact CZ-CB 3.47Å; F160-E843 VanDerWaalsContact CZ-CB 3.47Å; F160-C847 HydrophobicContact CD1-CB 4.2Å; F160-C847 HydrophobicContact CE1-CB 4.04Å; F160-F877 WeakPolarHBondContact O-CB 3.4Å; F160-L880 HydrophobicContact CD1-CB 4.44Å; F160-L880 HydrophobicContact CG-CB 4.42Å; F160-W881 HydrophobicContact CB-CB 3.77Å; F160-W881 HydrophobicContact CD2-CB 4.02Å; F160-W881 HydrophobicContact CG-CB 4.35Å
161	M	96.4	Very high	94.3	Very high	33 Å²	33	13.2 Å²	13.2	16%	0.163	8%	0.078	C	C	.	.	I	π-helix	trans	-71	-46.2	-174.1	-68.4	-59.6	-63.4	0	0	112.1	F157 L163 A164 I165 V878 W881	F157-M161 HydrophobicContact CD2-CB 3.59Å; F157-M161 HydrophobicContact CD2-CG 3.54Å; F157-M161 HydrophobicContact CE2-CB 3.52Å; F157-M161 HydrophobicContact CE2-CG 3.64Å; F157-M161 HydrophobicContact CG-CB 4.12Å; F157-M161 HydrophobicContact CG-CG 4.41Å; F157-M161 HydrophobicContact CZ-CB 4.02Å; F157-M161 WeakPolarHBondContact O-CA 3.06Å; F157-M161 WeakPolarHBondContact O-CB 3.41Å; F157-M161 PolarHBondContact O-N 3.4Å; M161-L163 PolarHBondContact O-N 3.3Å; M161-A164 WeakPolarHBondContact O-CB 3.46Å; M161-A164 PolarHBondContact O-N 2.86Å; M161-I165 VanDerWaalsContact O-CG1 3.31Å; M161-I165 WeakPolarHBondContact O-CG1 3.46Å; M161-I165 PolarHBondContact O-N 3.21Å; M161-V878 HydrophobicContact CE-CG1 4.46Å; M161-V878 HydrophobicContact CE-CG2 4.05Å; M161-V878 HydrophobicContact SD-CB 4.07Å; M161-V878 HydrophobicContact SD-CG1 4.03Å; M161-V878 HydrophobicContact SD-CG2 3.73Å; M161-W881 HydrophobicContact CG-CB 3.97Å; M161-W881 HydrophobicContact CG-CD2 3.54Å; M161-W881 HydrophobicContact CG-CE3 3.97Å; M161-W881 HydrophobicContact CG-CG 3.54Å; M161-W881 HydrophobicContact SD-CB 4.06Å; M161-W881 HydrophobicContact SD-CD2 3.91Å; M161-W881 HydrophobicContact SD-CE3 3.75Å; M161-W881 HydrophobicContact SD-CG 4.07Å; M161-W881 HydrophobicContact SD-CZ3 4.48Å
162	I	95.1	Very high	93.7	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.116	C	C	.	.	I	π-helix	trans	-65.9	-42.1	-178.9	-58.4	-174.7	0	0	0	111	F157 N158 A164 I165 C166 D775 T776 V796	F157-I162 HydrophobicContact CD1-CD1 4.38Å; F157-I162 HydrophobicContact CD1-CG1 4.16Å; F157-I162 HydrophobicContact CE1-CD1 4.49Å; F157-I162 HydrophobicContact CE1-CG1 4.12Å; F157-I162 PolarHBondContact O-N 2.81Å; F157-I162 VanDerWaalsContact O-N 3.11Å; N158-I162 HydrophobicContact CB-CD1 4.18Å; N158-I162 WeakPolarHBondContact O-CB 3.22Å; N158-I162 WeakPolarHBondContact OD1-CD1 3.31Å; I162-A164 VanDerWaalsContact C-N 3.34Å; I162-A164 PolarHBondContact O-N 3.45Å; I162-I165 PolarHBondContact O-N 2.82Å; I162-C166 WeakPolarHBondContact O-CB 3.35Å; I162-C166 PolarHBondContact O-N 3.49Å; I162-C166 PolarHBondContact O-SG 3.33Å; I162-D775 HydrophobicContact CD1-CB 3.73Å; I162-T776 HydrophobicContact CD1-CG2 3.66Å; I162-T776 HydrophobicContact CG1-CG2 3.59Å; I162-V796 HydrophobicContact CB-CG2 4.29Å; I162-V796 HydrophobicContact CG2-CG2 3.83Å
163	L	95	Very high	93	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-64.6	-38.1	175.4	-71.6	-174.1	0	0	0	112	M159 M161 I165 C166 V167 I793 V796 L851 F877	M159-L163 HydrophobicContact CE-CD1 4.37Å; M159-L163 VanDerWaalsContact O-CD1 3.24Å; M159-L163 WeakPolarHBondContact O-CD1 3.27Å; M159-L163 WeakPolarHBondContact O-CG 3.3Å; M159-L163 HydrophobicContact SD-CD1 4.12Å; M161-L163 PolarHBondContact O-N 3.3Å; L163-I165 PolarHBondContact O-N 2.97Å; L163-C166 PolarHBondContact O-N 2.95Å; L163-V167 VanDerWaalsContact O-CG2 3.29Å; L163-V167 WeakPolarHBondContact O-CG2 3.31Å; L163-V167 PolarHBondContact O-N 3.22Å; L163-I793 HydrophobicContact CD2-CG1 4.13Å; L163-V796 HydrophobicContact CD1-CG1 4.46Å; L163-V796 HydrophobicContact CD2-CB 4.38Å; L163-V796 HydrophobicContact CD2-CG1 4.44Å; L163-V796 HydrophobicContact CD2-CG2 4.13Å; L163-V796 HydrophobicContact CG-CG1 4.2Å; L163-V796 HydrophobicContact CG-CG2 4.49Å; L163-L851 HydrophobicContact CD1-CD1 3.8Å; L163-F877 HydrophobicContact CB-CD2 4.01Å; L163-F877 HydrophobicContact CB-CE2 4Å
164	A	96.6	Very high	92.7	Very high	4 Å²	4	34 Å²	34	3%	0.033	17%	0.171	C	C	.	.	H	α-helix	trans	-59.3	-47.3	173.1	0	0	0	0	0	111.3	F160 M161 I162 C166 V167 V168 A874 F877 V878	F160-A164 VanDerWaalsContact O-CB 3.32Å; F160-A164 WeakPolarHBondContact O-CB 3.16Å; F160-A164 PolarHBondContact O-N 3.28Å; M161-A164 WeakPolarHBondContact O-CB 3.46Å; M161-A164 PolarHBondContact O-N 2.86Å; I162-A164 VanDerWaalsContact C-N 3.34Å; I162-A164 PolarHBondContact O-N 3.45Å; A164-C166 PolarHBondContact O-N 3.47Å; A164-V167 PolarHBondContact O-N 3.46Å; A164-V168 WeakPolarHBondContact O-CG2 3.39Å; A164-V168 PolarHBondContact O-N 2.87Å; A164-A874 HydrophobicContact CB-CB 4.36Å; A164-F877 HydrophobicContact CB-CB 3.87Å; A164-F877 HydrophobicContact CB-CD2 4.42Å; A164-V878 HydrophobicContact CB-CG2 4.02Å
165	I	95.5	Very high	92.5	Very high	65 Å²	65	36.6 Å²	36.6	33%	0.333	19%	0.187	S	C	.	.	H	α-helix	trans	-59.2	-46.4	175.9	-69.7	166.1	0	0	0	110.4	M161 I162 L163 V167 V168 A169 H780	M161-I165 VanDerWaalsContact O-CG1 3.31Å; M161-I165 WeakPolarHBondContact O-CG1 3.46Å; M161-I165 PolarHBondContact O-N 3.21Å; I162-I165 PolarHBondContact O-N 2.82Å; L163-I165 PolarHBondContact O-N 2.97Å; I165-V167 VanDerWaalsContact C-N 3.34Å; I165-V167 PolarHBondContact O-N 2.93Å; I165-V168 CarbonylContact O-C 3.59Å; I165-V168 PolarHBondContact O-N 3.28Å; I165-V168 VanDerWaalsContact O-N 3.12Å; I165-A169 VanDerWaalsContact O-CB 3.27Å; I165-A169 WeakPolarHBondContact O-CB 3.34Å; I165-A169 PolarHBondContact O-N 3.42Å; I165-H780 HydrophobicContact CG2-CB 4.27Å
166	C	94.5	Very high	92.3	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.6	-38.5	178.8	-68.4	0	0	0	0	112.5	I162 L163 A164 V168 S779 A783 L863	I162-C166 WeakPolarHBondContact O-CB 3.35Å; I162-C166 PolarHBondContact O-N 3.49Å; I162-C166 PolarHBondContact O-SG 3.33Å; L163-C166 PolarHBondContact O-N 2.95Å; A164-C166 PolarHBondContact O-N 3.47Å; C166-V168 VanDerWaalsContact C-N 3.34Å; C166-S779 VanDerWaalsContact SG-C 3.55Å; C166-A783 HydrophobicContact CB-CB 4Å; C166-L863 HydrophobicContact CB-CD1 4.32Å; C166-L863 HydrophobicContact CB-CD2 4.08Å
167	V	94.6	Very high	91.9	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64.4	-41.3	174.4	170.3	0	0	0	0	110.4	L163 A164 I165 L863 K870 T873	L163-V167 VanDerWaalsContact O-CG2 3.29Å; L163-V167 WeakPolarHBondContact O-CG2 3.31Å; L163-V167 PolarHBondContact O-N 3.22Å; A164-V167 PolarHBondContact O-N 3.46Å; I165-V167 VanDerWaalsContact C-N 3.34Å; I165-V167 PolarHBondContact O-N 2.93Å; V167-L863 HydrophobicContact CG2-CD2 3.67Å; V167-K870 HydrophobicContact CG1-CB 4.48Å; V167-K870 HydrophobicContact CG1-CG 3.92Å; V167-K870 WeakPolarHBondContact O-CE 3.27Å; V167-T873 HydrophobicContact CG1-CG2 4.41Å; V167-T873 HydrophobicContact CG2-CG2 4.31Å
168	V	93.4	Very high	91.3	Very high	74 Å²	74	42.2 Å²	42.2	45%	0.448	21%	0.21	S	C	.	.	H	α-helix	trans	-74.9	-29.9	-178.9	178.6	0	0	0	0	113.2	A164 I165 C166 I170 K870 A874	A164-V168 WeakPolarHBondContact O-CG2 3.39Å; A164-V168 PolarHBondContact O-N 2.87Å; I165-V168 CarbonylContact O-C 3.59Å; I165-V168 PolarHBondContact O-N 3.28Å; I165-V168 VanDerWaalsContact O-N 3.12Å; C166-V168 VanDerWaalsContact C-N 3.34Å; V168-I170 VanDerWaalsContact C-N 3.31Å; V168-I170 PolarHBondContact O-N 3.27Å; V168-K870 VanDerWaalsContact C-CE 3.42Å; V168-K870 WeakPolarHBondContact O-CE 3.41Å; V168-K870 PolarHBondContact O-NZ 3Å; V168-A874 HydrophobicContact CG2-CB 3.37Å
169	A	91.1	Very high	90.6	Very high	26 Å²	26	46.7 Å²	46.7	22%	0.215	23%	0.234	C	C	.	.	H	α-helix	trans	-67.5	-27.2	-175.9	0	0	0	0	0	114	I165 H780 I784	I165-A169 VanDerWaalsContact O-CB 3.27Å; I165-A169 WeakPolarHBondContact O-CB 3.34Å; I165-A169 PolarHBondContact O-N 3.42Å; A169-H780 VanDerWaalsContact CB-CD2 3.46Å; A169-H780 WeakPolarHBondContact CB-CD2 3.35Å; A169-I784 HydrophobicContact CB-CD1 4.16Å; A169-I784 HydrophobicContact CB-CG1 3.94Å
170	I	91.1	Very high	89.9	Confident	1 Å²	1	50 Å²	50	1%	0.005	25%	0.249	C	C	.	.	S	Bend	trans	-65.9	132.5	-178.4	-55.5	-51.8	0	0	0	110.8	V168 E174 R176 A783 L863 K870	V168-I170 VanDerWaalsContact C-N 3.31Å; V168-I170 PolarHBondContact O-N 3.27Å; I170-E174 HydrophobicContact CG2-CB 3.62Å; I170-E174 WeakPolarHBondContact CG2-O 3.29Å; I170-R176 HydrophobicContact CD1-CG 3.56Å; I170-R176 HydrophobicContact CG1-CG 4.14Å; I170-A783 HydrophobicContact CD1-CB 4.05Å; I170-A783 WeakPolarHBondContact CD1-O 3.39Å; I170-L863 HydrophobicContact CD1-CB 4.46Å; I170-L863 HydrophobicContact CG1-CB 3.87Å; I170-K870 PolarHBondContact O-NZ 3.03Å
171	P	86.6	Confident	89.2	Confident	57 Å²	57	53 Å²	53	37%	0.37	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-53.5	159.9	176.8	-27.2	35.1	0	0	0	114.2	N173 E174	P171-N173 PolarHBondContact O-N 3.5Å; P171-E174 HydrophobicContact CB-CG 4.48Å; P171-E174 PolarHBondContact O-N 3.31Å
172	R	82.4	Confident	88.6	Confident	207 Å²	207	55 Å²	55	78%	0.781	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	135.6	179.6	-66.8	-177.7	179.8	173.2	0.9	109.9	E174	R172-E174 PolarHBondContact O-N 2.99Å
173	N	79.5	Confident	88.1	Confident	151 Å²	151	55.4 Å²	55.4	81%	0.807	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.2	3.5	-179.2	-55.6	-22	0	0	0	116.4	P171	P171-N173 PolarHBondContact O-N 3.5Å
174	E	88.8	Confident	87.6	Confident	78 Å²	78	56 Å²	56	36%	0.364	28%	0.284	S	S	.	.			trans	-91.7	148.7	169.6	-74.4	-175.2	-137.8	0	0	111.6	I170 P171 R172 R176 G865	I170-E174 HydrophobicContact CG2-CB 3.62Å; I170-E174 WeakPolarHBondContact CG2-O 3.29Å; P171-E174 HydrophobicContact CB-CG 4.48Å; P171-E174 PolarHBondContact O-N 3.31Å; R172-E174 PolarHBondContact O-N 2.99Å; E174-R176 IonicContact OE2-CZ 3.87Å; E174-R176 VanDerWaalsContact OE2-CZ 3.25Å; E174-R176 IonicContact OE2-NH1 3.99Å; E174-R176 PolarHBondContact OE2-NH1 2.98Å; E174-R176 VanDerWaalsContact OE2-NH1 3.16Å; E174-R176 IonicContact OE2-NH2 3.74Å; E174-R176 PolarHBondContact OE2-NH2 2.77Å; E174-G865 PolarHBondContact O-N 3.06Å
175	V	90	Very high	87.1	Confident	54 Å²	54	60.8 Å²	60.8	33%	0.327	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	138.5	172.2	-68.5	0	0	0	0	109.1	I859 L863	V175-I859 WeakPolarHBondContact CG1-O 3.19Å; V175-L863 WeakPolarHBondContact CA-O 2.85Å
176	R	90.7	Very high	86.8	Confident	37 Å²	37	59.3 Å²	59.3	14%	0.14	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	123.9	168.6	-52.3	-65.2	-170.8	-144.1	-4.5	107.7	I170 E174 I784 D786 K787 A789 E862 L863	I170-R176 HydrophobicContact CD1-CG 3.56Å; I170-R176 HydrophobicContact CG1-CG 4.14Å; E174-R176 IonicContact OE2-CZ 3.87Å; E174-R176 VanDerWaalsContact OE2-CZ 3.25Å; E174-R176 IonicContact OE2-NH1 3.99Å; E174-R176 PolarHBondContact OE2-NH1 2.98Å; E174-R176 VanDerWaalsContact OE2-NH1 3.16Å; E174-R176 IonicContact OE2-NH2 3.74Å; E174-R176 PolarHBondContact OE2-NH2 2.77Å; R176-I784 PolarHBondContact NH2-O 2.78Å; R176-D786 VanDerWaalsContact CD-O 3.23Å; R176-D786 WeakPolarHBondContact CD-O 3.5Å; R176-D786 PolarHBondContact NE-O 3.3Å; R176-K787 VanDerWaalsContact CD-O 3.25Å; R176-K787 WeakPolarHBondContact CD-O 3.44Å; R176-A789 HydrophobicContact CB-CB 4.03Å; R176-E862 PolarHBondContact O-N 3.44Å; R176-L863 HydrophobicContact CB-CB 4.15Å; R176-L863 HydrophobicContact CB-CD1 4.47Å; R176-L863 PolarHBondContact N-O 3.5Å; R176-L863 VanDerWaalsContact N-O 3.09Å; R176-L863 PolarHBondContact O-N 3.42Å
177	K	88.5	Confident	86.4	Confident	96 Å²	96	59.4 Å²	59.4	42%	0.417	30%	0.303	S	S	.	.	B	Isolated β-bridge	trans	-104.6	147.7	176.9	-55.3	-165.1	-158.9	-148.4	0	110.9	Y788 A789 G860 E862	K177-Y788 WeakPolarHBondContact O-CA 3.28Å; K177-Y788 WeakPolarHBondContact O-CB 3.49Å; K177-A789 PolarHBondContact O-N 3.49Å; K177-G860 WeakPolarHBondContact CD-O 3.31Å; K177-G860 WeakPolarHBondContact CE-O 3.36Å; K177-G860 WeakPolarHBondContact CG-O 3.26Å; K177-G860 PolarHBondContact NZ-O 3.27Å; K177-E862 WeakPolarHBondContact CA-OE2 3.42Å
178	Q	82.9	Confident	86.2	Confident	2 Å²	2	59.6 Å²	59.6	1%	0.009	31%	0.305	C	S	.	.			trans	-79.9	121.3	171.3	-156.2	149.1	-7.5	0	0	110.6	L181 F184 D790 T794 E862	Q178-L181 HydrophobicContact CB-CD2 4.48Å; Q178-F184 HydrophobicContact CG-CB 4.43Å; Q178-F184 VanDerWaalsContact NE2-CB 3.27Å; Q178-F184 VanDerWaalsContact NE2-CD2 3.3Å; Q178-D790 HydrophobicContact CG-CB 4.32Å; Q178-D790 WeakPolarHBondContact CG-OD1 3.49Å; Q178-T794 PolarHBondContact NE2-OG1 3.3Å; Q178-E862 PolarHBondContact N-OE2 3.46Å
179	L	79.3	Confident	86.1	Confident	95 Å²	95	60.7 Å²	60.7	50%	0.497	31%	0.307	S	S	.	.	S	Bend	trans	-82.2	-41.3	-177.7	-171.1	68	0	0	0	110.9	L181 Y788 D790	L179-L181 PolarHBondContact O-N 3.14Å; L179-Y788 HydrophobicContact CB-CD1 4.1Å; L179-Y788 HydrophobicContact CB-CE1 4.42Å; L179-Y788 HydrophobicContact CB-CG 4.3Å; L179-Y788 HydrophobicContact CD1-CE1 4.23Å; L179-Y788 HydrophobicContact CD2-CE1 4.42Å; L179-Y788 HydrophobicContact CD2-CE2 4.26Å; L179-D790 WeakPolarHBondContact CB-OD2 3.42Å; L179-D790 PolarHBondContact N-OD1 2.91Å; L179-D790 PolarHBondContact N-OD2 2.89Å
180	H	78.9	Confident	86.2	Confident	70 Å²	70	61.4 Å²	61.4	32%	0.324	30%	0.304	S	S	.	.			trans	-100.4	65.3	-172	-61.6	-79.4	0	0	0	112.9	T182 V183 F184 D790	H180-T182 VanDerWaalsContact C-N 3.28Å; H180-T182 PolarHBondContact O-N 3.09Å; H180-V183 HydrophobicContact CB-CB 4.36Å; H180-V183 HydrophobicContact CB-CG2 4.37Å; H180-V183 PolarHBondContact O-N 3.12Å; H180-F184 PolarHBondContact O-N 3.2Å; H180-D790 WeakPolarHBondContact CB-OD1 3.45Å; H180-D790 IonicContact CD2-OD1 3.53Å; H180-D790 IonicContact CG-OD1 3.97Å; H180-D790 PolarHBondContact N-OD1 2.98Å
181	L	82.1	Confident	86.1	Confident	63 Å²	63	61.6 Å²	61.6	33%	0.33	31%	0.306	S	S	.	.	H	α-helix	trans	-58.1	-33.2	-176.5	-57	166.1	0	0	0	115.3	Q178 L179 V183 F184 L185 R855	Q178-L181 HydrophobicContact CB-CD2 4.48Å; L179-L181 PolarHBondContact O-N 3.14Å; L181-V183 VanDerWaalsContact C-N 3.34Å; L181-F184 WeakPolarHBondContact O-CB 3.38Å; L181-F184 PolarHBondContact O-N 2.83Å; L181-L185 VanDerWaalsContact O-CB 3.3Å; L181-L185 WeakPolarHBondContact O-CB 3.4Å; L181-L185 PolarHBondContact O-N 3.44Å; L181-R855 VanDerWaalsContact CD2-CZ 3.49Å
182	T	84.1	Confident	86.4	Confident	75 Å²	75	60.2 Å²	60.2	46%	0.46	30%	0.295	S	S	.	.	H	α-helix	trans	-67.9	-41	-178.4	-50	0	0	0	0	110.4	H180 L185 V186 A232	H180-T182 VanDerWaalsContact C-N 3.28Å; H180-T182 PolarHBondContact O-N 3.09Å; T182-L185 PolarHBondContact O-N 3.45Å; T182-V186 VanDerWaalsContact O-CG2 3.31Å; T182-V186 WeakPolarHBondContact O-CG2 2.95Å; T182-V186 PolarHBondContact O-N 3.14Å; T182-V186 VanDerWaalsContact O-N 3.1Å; T182-A232 HydrophobicContact CG2-CB 4.08Å
183	V	84	Confident	87	Confident	8 Å²	8	53.8 Å²	53.8	5%	0.048	27%	0.273	C	S	.	.	H	α-helix	trans	-65.3	-46.6	174.8	179.6	0	0	0	0	109.3	T113 H180 L181 L185 V186 T187 A232 D233	T113-V183 HydrophobicContact CG2-CG1 3.62Å; H180-V183 HydrophobicContact CB-CB 4.36Å; H180-V183 HydrophobicContact CB-CG2 4.37Å; H180-V183 PolarHBondContact O-N 3.12Å; L181-V183 VanDerWaalsContact C-N 3.34Å; V183-L185 PolarHBondContact O-N 3.29Å; V183-V186 PolarHBondContact O-N 3.35Å; V183-T187 HydrophobicContact CG1-CG2 4.31Å; V183-T187 WeakPolarHBondContact O-CG2 3.3Å; V183-T187 PolarHBondContact O-N 2.91Å; V183-T187 PolarHBondContact O-OG1 2.98Å; V183-A232 HydrophobicContact CG2-CB 4.37Å; V183-D233 HydrophobicContact CG2-CB 4.09Å
184	F	85	Confident	87.7	Confident	14 Å²	14	46.6 Å²	46.6	6%	0.061	23%	0.234	C	C	.	.	H	α-helix	trans	-55.2	-47.4	175.3	176.5	-118.7	0	0	0	113.4	Q178 H180 L181 V186 T187 A188 I793 T797	Q178-F184 HydrophobicContact CG-CB 4.43Å; Q178-F184 VanDerWaalsContact NE2-CB 3.27Å; Q178-F184 VanDerWaalsContact NE2-CD2 3.3Å; H180-F184 PolarHBondContact O-N 3.2Å; L181-F184 WeakPolarHBondContact O-CB 3.38Å; L181-F184 PolarHBondContact O-N 2.83Å; F184-V186 VanDerWaalsContact C-N 3.32Å; F184-V186 PolarHBondContact O-N 2.91Å; F184-T187 WeakPolarHBondContact CA-OG1 3.32Å; F184-T187 PolarHBondContact O-N 3.07Å; F184-T187 PolarHBondContact O-OG1 3.29Å; F184-A188 HydrophobicContact CE2-CB 4.24Å; F184-A188 HydrophobicContact CZ-CB 4.34Å; F184-A188 WeakPolarHBondContact O-CB 3.3Å; F184-A188 PolarHBondContact O-N 3.11Å; F184-I793 HydrophobicContact CD2-CG2 3.85Å; F184-I793 HydrophobicContact CE2-CG2 3.31Å; F184-I793 HydrophobicContact CZ-CG2 4.14Å; F184-T797 HydrophobicContact CE2-CG2 4.3Å
185	L	87.3	Confident	88	Confident	104 Å²	104	42.9 Å²	42.9	55%	0.545	22%	0.217	S	C	.	.	H	α-helix	trans	-63.3	-42.3	-179.1	-177.1	67.2	0	0	0	110.5	L181 T182 V183 I189	L181-L185 VanDerWaalsContact O-CB 3.3Å; L181-L185 WeakPolarHBondContact O-CB 3.4Å; L181-L185 PolarHBondContact O-N 3.44Å; T182-L185 PolarHBondContact O-N 3.45Å; V183-L185 PolarHBondContact O-N 3.29Å; L185-I189 HydrophobicContact CD1-CD1 4.09Å; L185-I189 HydrophobicContact CD1-CG1 4.41Å; L185-I189 HydrophobicContact CG-CD1 3.84Å; L185-I189 WeakPolarHBondContact O-CB 3.23Å; L185-I189 WeakPolarHBondContact O-CD1 3.03Å; L185-I189 WeakPolarHBondContact O-CG1 3.08Å; L185-I189 PolarHBondContact O-N 3.39Å
186	V	88.6	Confident	88.2	Confident	33 Å²	33	44 Å²	44	20%	0.2	22%	0.221	C	C	.	.	H	α-helix	trans	-62.7	-48.1	176.1	170.6	0	0	0	0	110.7	T182 V183 F184 I189 W190 A229 A232	T182-V186 VanDerWaalsContact O-CG2 3.31Å; T182-V186 WeakPolarHBondContact O-CG2 2.95Å; T182-V186 PolarHBondContact O-N 3.14Å; T182-V186 VanDerWaalsContact O-N 3.1Å; V183-V186 PolarHBondContact O-N 3.35Å; F184-V186 VanDerWaalsContact C-N 3.32Å; F184-V186 PolarHBondContact O-N 2.91Å; V186-I189 PolarHBondContact O-N 3.39Å; V186-W190 PolarHBondContact O-N 2.73Å; V186-A229 HydrophobicContact CG1-CB 4.4Å; V186-A232 HydrophobicContact CG2-CB 4.06Å
187	T	86.7	Confident	88.4	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.012	22%	0.221	C	C	.	.	H	α-helix	trans	-67.6	-37.3	-179.5	57.8	0	0	0	0	112.1	L117 V183 F184 W190 S191 T794	L117-T187 HydrophobicContact CD1-CG2 3.73Å; L117-T187 HydrophobicContact CD2-CG2 3.72Å; L117-T187 HydrophobicContact CG-CG2 4.32Å; V183-T187 HydrophobicContact CG1-CG2 4.31Å; V183-T187 WeakPolarHBondContact O-CG2 3.3Å; V183-T187 PolarHBondContact O-N 2.91Å; V183-T187 PolarHBondContact O-OG1 2.98Å; F184-T187 WeakPolarHBondContact CA-OG1 3.32Å; F184-T187 PolarHBondContact O-N 3.07Å; F184-T187 PolarHBondContact O-OG1 3.29Å; T187-W190 PolarHBondContact O-N 2.67Å; T187-S191 VanDerWaalsContact O-CB 3.26Å; T187-S191 WeakPolarHBondContact O-CB 3.5Å; T187-S191 PolarHBondContact O-N 2.79Å; T187-S191 PolarHBondContact O-OG 2.03Å; T187-T794 HydrophobicContact CG2-CG2 4.29Å
188	A	88.6	Confident	88.7	Confident	5 Å²	5	39.7 Å²	39.7	4%	0.041	20%	0.201	C	C	.	.	H	α-helix	trans	-66.1	-43.5	176.2	0	0	0	0	0	111.7	F184 S191 I192 I848	F184-A188 HydrophobicContact CE2-CB 4.24Å; F184-A188 HydrophobicContact CZ-CB 4.34Å; F184-A188 WeakPolarHBondContact O-CB 3.3Å; F184-A188 PolarHBondContact O-N 3.11Å; A188-S191 WeakPolarHBondContact CA-OG 3.4Å; A188-S191 PolarHBondContact O-N 3.46Å; A188-S191 PolarHBondContact O-OG 2.96Å; A188-I192 PolarHBondContact O-N 2.96Å; A188-I192 VanDerWaalsContact O-N 3.07Å; A188-I848 HydrophobicContact CB-CD1 4.27Å
189	I	91.9	Very high	89.1	Confident	97 Å²	97	43.4 Å²	43.4	50%	0.497	22%	0.216	S	C	.	.	H	α-helix	trans	-60.5	-50.2	175.3	-71.6	166.1	0	0	0	110	L185 V186 S191 I192 F193	L185-I189 HydrophobicContact CD1-CD1 4.09Å; L185-I189 HydrophobicContact CD1-CG1 4.41Å; L185-I189 HydrophobicContact CG-CD1 3.84Å; L185-I189 WeakPolarHBondContact O-CB 3.23Å; L185-I189 WeakPolarHBondContact O-CD1 3.03Å; L185-I189 WeakPolarHBondContact O-CG1 3.08Å; L185-I189 PolarHBondContact O-N 3.39Å; V186-I189 PolarHBondContact O-N 3.39Å; I189-S191 VanDerWaalsContact C-N 3.28Å; I189-S191 PolarHBondContact O-N 3.4Å; I189-I192 PolarHBondContact O-N 3.16Å; I189-F193 WeakPolarHBondContact O-CB 3.05Å; I189-F193 PolarHBondContact O-N 3.47Å
190	W	93	Very high	89.7	Confident	41 Å²	41	40.9 Å²	40.9	16%	0.155	20%	0.204	C	C	.	.	H	α-helix	trans	-62.2	-36.2	176.9	-80.1	113.2	0	0	0	112.5	V186 T187 I192 F193 A194 M221 L224 T225 T228 F805	V186-W190 PolarHBondContact O-N 2.73Å; T187-W190 PolarHBondContact O-N 2.67Å; W190-I192 PolarHBondContact O-N 2.86Å; W190-F193 AromaticContact CE3-CD1 3.65Å; W190-F193 HydrophobicContact CE3-CD1 3.65Å; W190-F193 HydrophobicContact CE3-CE1 4.26Å; W190-F193 AromaticContact CZ3-CD1 3.6Å; W190-F193 HydrophobicContact CZ3-CD1 3.6Å; W190-F193 AromaticContact CZ3-CE1 3.72Å; W190-F193 HydrophobicContact CZ3-CE1 3.72Å; W190-F193 PolarHBondContact O-N 3.42Å; W190-A194 WeakPolarHBondContact O-CB 3.31Å; W190-A194 PolarHBondContact O-N 2.86Å; W190-M221 HydrophobicContact CH2-SD 3.65Å; W190-M221 HydrophobicContact CZ3-CB 4.32Å; W190-M221 HydrophobicContact CZ3-CG 4.4Å; W190-M221 HydrophobicContact CZ3-SD 3.7Å; W190-L224 HydrophobicContact CH2-CB 4.4Å; W190-T225 HydrophobicContact CB-CG2 3.73Å; W190-T225 HydrophobicContact CD2-CG2 4.26Å; W190-T225 VanDerWaalsContact CD2-OG1 3.25Å; W190-T225 VanDerWaalsContact CE3-OG1 3.29Å; W190-T225 HydrophobicContact CG-CG2 3.71Å; W190-T228 HydrophobicContact CZ2-CG2 4.42Å; W190-T228 PolarHBondContact NE1-OG1 3.19Å; W190-F805 AromaticContact CE3-CE2 3.69Å; W190-F805 HydrophobicContact CE3-CE2 3.69Å; W190-F805 AromaticContact CE3-CZ 3.63Å; W190-F805 HydrophobicContact CE3-CZ 3.63Å; W190-F805 HydrophobicContact CZ3-CE2 4.31Å; W190-F805 AromaticContact CZ3-CZ 3.99Å; W190-F805 HydrophobicContact CZ3-CZ 3.99Å
191	S	90	Very high	90.4	Very high	4 Å²	4	37.5 Å²	37.5	3%	0.028	19%	0.189	C	C	.	.	H	α-helix	trans	-66.6	-33	178.5	75.9	0	0	0	0	113.4	T187 A188 I189 Y195 T797	T187-S191 VanDerWaalsContact O-CB 3.26Å; T187-S191 WeakPolarHBondContact O-CB 3.5Å; T187-S191 PolarHBondContact O-N 2.79Å; T187-S191 PolarHBondContact O-OG 2.03Å; A188-S191 WeakPolarHBondContact CA-OG 3.4Å; A188-S191 PolarHBondContact O-N 3.46Å; A188-S191 PolarHBondContact O-OG 2.96Å; I189-S191 VanDerWaalsContact C-N 3.28Å; I189-S191 PolarHBondContact O-N 3.4Å; S191-Y195 WeakPolarHBondContact O-CD2 3.23Å; S191-Y195 WeakPolarHBondContact O-CE2 3.41Å; S191-T797 VanDerWaalsContact CB-O 3.26Å; S191-T797 WeakPolarHBondContact CB-O 3.06Å
192	I	92.2	Very high	90.8	Very high	29 Å²	29	34.6 Å²	34.6	15%	0.149	17%	0.173	C	C	.	.	H	α-helix	trans	-82.3	-44.2	173.8	-63.6	167.2	0	0	0	109.6	A188 I189 W190 A194 Y195 I196 I848	A188-I192 PolarHBondContact O-N 2.96Å; A188-I192 VanDerWaalsContact O-N 3.07Å; I189-I192 PolarHBondContact O-N 3.16Å; W190-I192 PolarHBondContact O-N 2.86Å; I192-A194 PolarHBondContact O-N 2.96Å; I192-Y195 PolarHBondContact O-N 3.03Å; I192-I196 HydrophobicContact CG2-CD1 3.67Å; I192-I196 HydrophobicContact CG2-CG1 4.08Å; I192-I196 PolarHBondContact O-N 3.44Å; I192-I848 HydrophobicContact CD1-CD1 3.36Å; I192-I848 HydrophobicContact CG1-CD1 3.86Å
193	F	95.1	Very high	90.9	Very high	71 Å²	71	32.9 Å²	32.9	31%	0.311	17%	0.167	S	C	.	.	H	α-helix	trans	-56.7	-35.9	-179.3	176.2	-102.2	0	0	0	112	I189 W190 Y195 I196 W197 F805	I189-F193 WeakPolarHBondContact O-CB 3.05Å; I189-F193 PolarHBondContact O-N 3.47Å; W190-F193 AromaticContact CE3-CD1 3.65Å; W190-F193 HydrophobicContact CE3-CD1 3.65Å; W190-F193 HydrophobicContact CE3-CE1 4.26Å; W190-F193 AromaticContact CZ3-CD1 3.6Å; W190-F193 HydrophobicContact CZ3-CD1 3.6Å; W190-F193 AromaticContact CZ3-CE1 3.72Å; W190-F193 HydrophobicContact CZ3-CE1 3.72Å; W190-F193 PolarHBondContact O-N 3.42Å; F193-Y195 VanDerWaalsContact C-N 3.29Å; F193-Y195 PolarHBondContact O-N 2.79Å; F193-I196 PolarHBondContact O-N 3.29Å; F193-W197 HydrophobicContact CE1-CB 4.27Å; F193-W197 HydrophobicContact CZ-CB 4.28Å; F193-W197 HydrophobicContact CZ-CE3 4.32Å; F193-W197 WeakPolarHBondContact O-CB 3.41Å; F193-W197 PolarHBondContact O-N 3.14Å; F193-F805 HydrophobicContact CD1-CZ 4.12Å
194	A	94.7	Very high	91.2	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-56.5	-42.6	176.6	0	0	0	0	0	112.6	W190 I192 L198 V804 F805	W190-A194 WeakPolarHBondContact O-CB 3.31Å; W190-A194 PolarHBondContact O-N 2.86Å; I192-A194 PolarHBondContact O-N 2.96Å; A194-L198 WeakPolarHBondContact O-CB 3.49Å; A194-L198 PolarHBondContact O-N 2.86Å; A194-V804 HydrophobicContact CB-CB 3.86Å; A194-V804 HydrophobicContact CB-CG1 4.07Å; A194-V804 HydrophobicContact CB-CG2 4.26Å; A194-V804 WeakPolarHBondContact O-CG1 3.5Å; A194-F805 HydrophobicContact CB-CD1 4.27Å; A194-F805 HydrophobicContact CB-CD2 4.35Å; A194-F805 HydrophobicContact CB-CE1 3.67Å; A194-F805 HydrophobicContact CB-CE2 3.76Å; A194-F805 HydrophobicContact CB-CZ 3.37Å
195	Y	94.6	Very high	91.4	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-80	-33.9	-180	-66	-95.2	0	0	0	111.9	V152 A155 S191 I192 F193 W197 L198 Y199 N800 V804 V837 F840 C841	V152-Y195 HydrophobicContact CG2-CD1 4.39Å; V152-Y195 HydrophobicContact CG2-CE1 4.23Å; A155-Y195 HydrophobicContact CB-CE1 3.7Å; A155-Y195 HydrophobicContact CB-CE2 4.29Å; A155-Y195 WeakPolarHBondContact CB-OH 3.04Å; S191-Y195 WeakPolarHBondContact O-CD2 3.23Å; S191-Y195 WeakPolarHBondContact O-CE2 3.41Å; I192-Y195 PolarHBondContact O-N 3.03Å; F193-Y195 VanDerWaalsContact C-N 3.29Å; F193-Y195 PolarHBondContact O-N 2.79Å; Y195-W197 VanDerWaalsContact C-N 3.31Å; Y195-L198 WeakPolarHBondContact O-CB 3.2Å; Y195-L198 PolarHBondContact O-N 3.21Å; Y195-Y199 PolarHBondContact O-N 3.46Å; Y195-N800 HydrophobicContact CE2-CB 4.18Å; Y195-N800 WeakPolarHBondContact CE2-O 3.23Å; Y195-N800 PolarHBondContact OH-O 3.39Å; Y195-V804 HydrophobicContact CD1-CG2 3.95Å; Y195-V804 HydrophobicContact CD2-CG2 4.11Å; Y195-V804 HydrophobicContact CE1-CG2 3.52Å; Y195-V804 HydrophobicContact CE2-CG2 3.7Å; Y195-V804 HydrophobicContact CG-CG2 4.21Å; Y195-V837 WeakPolarHBondContact O-CG1 3.43Å; Y195-F840 AromaticContact CD1-CD1 3.72Å; Y195-F840 HydrophobicContact CD1-CD1 3.72Å; Y195-F840 AromaticContact CD1-CE1 3.76Å; Y195-F840 HydrophobicContact CD1-CE1 3.76Å; Y195-F840 HydrophobicContact CD2-CD1 4.17Å; Y195-F840 AromaticContact CD2-CE1 3.46Å; Y195-F840 HydrophobicContact CD2-CE1 3.46Å; Y195-F840 VanDerWaalsContact CD2-CE1 3.46Å; Y195-F840 HydrophobicContact CD2-CZ 4.36Å; Y195-F840 HydrophobicContact CE1-CD1 4.24Å; Y195-F840 HydrophobicContact CE1-CE1 4.02Å; Y195-F840 AromaticContact CE2-CE1 3.76Å; Y195-F840 HydrophobicContact CE2-CE1 3.76Å; Y195-F840 HydrophobicContact CE2-CZ 4.27Å; Y195-F840 AromaticContact CG-CD1 3.7Å; Y195-F840 HydrophobicContact CG-CD1 3.7Å; Y195-F840 AromaticContact CG-CE1 3.48Å; Y195-F840 HydrophobicContact CG-CE1 3.48Å; Y195-F840 VanDerWaalsContact CG-CE1 3.48Å; Y195-C841 VanDerWaalsContact CB-SG 3.52Å
196	I	94.2	Very high	91.5	Very high	79 Å²	79	35.6 Å²	35.6	41%	0.405	19%	0.188	S	C	.	.	H	α-helix	trans	-61.5	-44.1	169.5	-65	176.1	0	0	0	110.2	I192 F193 L198 Y199 V200	I192-I196 HydrophobicContact CG2-CD1 3.67Å; I192-I196 HydrophobicContact CG2-CG1 4.08Å; I192-I196 PolarHBondContact O-N 3.44Å; F193-I196 PolarHBondContact O-N 3.29Å; I196-L198 VanDerWaalsContact C-N 3.33Å; I196-L198 PolarHBondContact O-N 3.41Å; I196-Y199 WeakPolarHBondContact O-CB 3.35Å; I196-Y199 PolarHBondContact O-N 2.82Å; I196-V200 HydrophobicContact CG2-CG2 4.49Å; I196-V200 WeakPolarHBondContact O-CG2 3.39Å; I196-V200 PolarHBondContact O-N 3.32Å
197	W	95.4	Very high	91.5	Very high	41 Å²	41	38.7 Å²	38.7	16%	0.155	21%	0.208	C	C	.	.	H	α-helix	trans	-61.7	-42.1	176.2	176.6	-103.9	0	0	0	111.4	F193 Y195 Y199 V200 I201 W213 A217 T218	F193-W197 HydrophobicContact CE1-CB 4.27Å; F193-W197 HydrophobicContact CZ-CB 4.28Å; F193-W197 HydrophobicContact CZ-CE3 4.32Å; F193-W197 WeakPolarHBondContact O-CB 3.41Å; F193-W197 PolarHBondContact O-N 3.14Å; Y195-W197 VanDerWaalsContact C-N 3.31Å; W197-Y199 VanDerWaalsContact C-N 3.32Å; W197-Y199 PolarHBondContact O-N 2.83Å; W197-V200 HydrophobicContact CE3-CG1 4.42Å; W197-V200 HydrophobicContact CZ3-CG1 4.34Å; W197-V200 WeakPolarHBondContact O-CB 3.27Å; W197-V200 PolarHBondContact O-N 3.43Å; W197-V200 VanDerWaalsContact O-N 3.11Å; W197-I201 HydrophobicContact CD2-CG2 4.19Å; W197-I201 HydrophobicContact CH2-CG2 4.17Å; W197-I201 HydrophobicContact CZ2-CG2 3.59Å; W197-I201 WeakPolarHBondContact O-CG1 3.47Å; W197-I201 PolarHBondContact O-N 3.04Å; W197-W213 HydrophobicContact CH2-CZ3 4.28Å; W197-A217 HydrophobicContact CZ2-CB 4.31Å; W197-T218 PolarHBondContact NE1-OG1 2.9Å
198	L	93.3	Very high	91.5	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-57.4	-43.4	173.1	-176.2	60.9	0	0	0	112.2	V152 A194 Y195 I196 I201 L202 V804 I808 W812 V837	V152-L198 HydrophobicContact CG2-CD2 4.23Å; A194-L198 WeakPolarHBondContact O-CB 3.49Å; A194-L198 PolarHBondContact O-N 2.86Å; Y195-L198 WeakPolarHBondContact O-CB 3.2Å; Y195-L198 PolarHBondContact O-N 3.21Å; I196-L198 VanDerWaalsContact C-N 3.33Å; I196-L198 PolarHBondContact O-N 3.41Å; L198-I201 HydrophobicContact CD1-CD1 4.18Å; L198-I201 HydrophobicContact CD1-CG1 4.47Å; L198-I201 VanDerWaalsContact O-CG1 3.27Å; L198-I201 WeakPolarHBondContact O-CG1 3.27Å; L198-L202 HydrophobicContact CD1-CD1 4.11Å; L198-L202 HydrophobicContact CG-CD1 4.1Å; L198-L202 WeakPolarHBondContact O-CB 3.22Å; L198-L202 WeakPolarHBondContact O-CD1 3.44Å; L198-L202 VanDerWaalsContact O-CG 3.27Å; L198-L202 WeakPolarHBondContact O-CG 3.47Å; L198-L202 PolarHBondContact O-N 3.17Å; L198-V804 HydrophobicContact CB-CG1 4.37Å; L198-I808 HydrophobicContact CD1-CD1 3.96Å; L198-I808 HydrophobicContact CD1-CG2 4.06Å; L198-I808 HydrophobicContact CD2-CD1 3.63Å; L198-I808 HydrophobicContact CG-CD1 4.47Å; L198-W812 HydrophobicContact CD1-CE3 4.48Å; L198-W812 HydrophobicContact CD1-CH2 3.37Å; L198-W812 HydrophobicContact CD1-CZ2 4.47Å; L198-W812 HydrophobicContact CD1-CZ3 3.38Å; L198-V837 HydrophobicContact CD2-CG2 3.73Å; L198-V837 HydrophobicContact CG-CG2 4.32Å
199	Y	92.2	Very high	91.7	Very high	81 Å²	81	40.9 Å²	40.9	32%	0.318	23%	0.226	S	C	.	.	H	α-helix	trans	-63.9	-42.2	173.4	176	-99.3	0	0	0	112.1	Y195 I196 W197 I201 L202 A203 L204 A834	Y195-Y199 PolarHBondContact O-N 3.46Å; I196-Y199 WeakPolarHBondContact O-CB 3.35Å; I196-Y199 PolarHBondContact O-N 2.82Å; W197-Y199 VanDerWaalsContact C-N 3.32Å; W197-Y199 PolarHBondContact O-N 2.83Å; Y199-I201 PolarHBondContact O-N 3.45Å; Y199-L202 PolarHBondContact O-N 3.11Å; Y199-A203 HydrophobicContact CD2-CB 4.36Å; Y199-A203 HydrophobicContact CE2-CB 4Å; Y199-A203 WeakPolarHBondContact O-CB 3.36Å; Y199-A203 PolarHBondContact O-N 2.98Å; Y199-L204 HydrophobicContact CD1-CD1 3.76Å; Y199-L204 HydrophobicContact CE1-CD1 3.27Å; Y199-A834 HydrophobicContact CD2-CB 4.04Å; Y199-A834 HydrophobicContact CE2-CB 4.26Å
200	V	92.4	Very high	91.8	Very high	41 Å²	41	36.4 Å²	36.4	25%	0.248	20%	0.203	C	C	.	.	I	π-helix	trans	-60.2	-46.8	178.8	168.9	0	0	0	0	111.5	I196 W197 L202 L204 S205	I196-V200 HydrophobicContact CG2-CG2 4.49Å; I196-V200 WeakPolarHBondContact O-CG2 3.39Å; I196-V200 PolarHBondContact O-N 3.32Å; W197-V200 HydrophobicContact CE3-CG1 4.42Å; W197-V200 HydrophobicContact CZ3-CG1 4.34Å; W197-V200 WeakPolarHBondContact O-CB 3.27Å; W197-V200 PolarHBondContact O-N 3.43Å; W197-V200 VanDerWaalsContact O-N 3.11Å; V200-L202 VanDerWaalsContact C-N 3.34Å; V200-L202 PolarHBondContact O-N 2.95Å; V200-L204 HydrophobicContact CG1-CB 4.36Å; V200-L204 CarbonylContact O-C 3.6Å; V200-L204 WeakPolarHBondContact O-CA 3.36Å; V200-L204 WeakPolarHBondContact O-CB 3.43Å; V200-L204 PolarHBondContact O-N 3.23Å; V200-S205 PolarHBondContact O-N 2.89Å
201	I	92.6	Very high	91.8	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.214	C	C	.	.	I	π-helix	trans	-69.9	-31.4	-179.6	62.5	-176.9	0	0	0	112.5	W197 L198 Y199 E214 W812	W197-I201 HydrophobicContact CD2-CG2 4.19Å; W197-I201 HydrophobicContact CH2-CG2 4.17Å; W197-I201 HydrophobicContact CZ2-CG2 3.59Å; W197-I201 WeakPolarHBondContact O-CG1 3.47Å; W197-I201 PolarHBondContact O-N 3.04Å; L198-I201 HydrophobicContact CD1-CD1 4.18Å; L198-I201 HydrophobicContact CD1-CG1 4.47Å; L198-I201 VanDerWaalsContact O-CG1 3.27Å; L198-I201 WeakPolarHBondContact O-CG1 3.27Å; Y199-I201 PolarHBondContact O-N 3.45Å; I201-E214 HydrophobicContact CG2-CB 4.2Å; I201-E214 HydrophobicContact CG2-CG 4.31Å; I201-W812 HydrophobicContact CD1-CE3 4.03Å; I201-W812 HydrophobicContact CD1-CZ3 3.63Å; I201-W812 HydrophobicContact CG1-CZ3 4.26Å
202	L	90.1	Very high	92.1	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	23%	0.228	C	C	.	.	I	π-helix	trans	-78.9	-36.8	179.7	-72.5	171.7	0	0	0	114	L198 Y199 V200 P207 G208 I210 W812 V828 A830 L833	L198-L202 HydrophobicContact CD1-CD1 4.11Å; L198-L202 HydrophobicContact CG-CD1 4.1Å; L198-L202 WeakPolarHBondContact O-CB 3.22Å; L198-L202 WeakPolarHBondContact O-CD1 3.44Å; L198-L202 VanDerWaalsContact O-CG 3.27Å; L198-L202 WeakPolarHBondContact O-CG 3.47Å; L198-L202 PolarHBondContact O-N 3.17Å; Y199-L202 PolarHBondContact O-N 3.11Å; V200-L202 VanDerWaalsContact C-N 3.34Å; V200-L202 PolarHBondContact O-N 2.95Å; L202-P207 WeakPolarHBondContact O-CA 3.37Å; L202-G208 PolarHBondContact O-N 3.37Å; L202-I210 HydrophobicContact CD2-CD1 4.29Å; L202-W812 HydrophobicContact CD1-CH2 4.24Å; L202-W812 HydrophobicContact CD2-CH2 3.79Å; L202-W812 HydrophobicContact CD2-CZ3 4.31Å; L202-W812 HydrophobicContact CG-CH2 4.16Å; L202-V828 HydrophobicContact CD2-CB 4.13Å; L202-V828 HydrophobicContact CD2-CG1 3.73Å; L202-A830 HydrophobicContact CB-CB 4.04Å; L202-L833 HydrophobicContact CD1-CD2 3.59Å; L202-L833 HydrophobicContact CD1-CG 3.89Å
203	A	87.5	Confident	92.2	Very high	39 Å²	39	45.1 Å²	45.1	32%	0.322	25%	0.245	S	C	.	.	I	π-helix	trans	-119.2	-23	-167.4	0	0	0	0	0	114.8	Y199	Y199-A203 HydrophobicContact CD2-CB 4.36Å; Y199-A203 HydrophobicContact CE2-CB 4Å; Y199-A203 WeakPolarHBondContact O-CB 3.36Å; Y199-A203 PolarHBondContact O-N 2.98Å
204	L	89.6	Confident	92.2	Very high	109 Å²	109	41.8 Å²	41.8	57%	0.571	23%	0.23	S	C	*	.	I	π-helix	trans	-113	-47	-173.1	-78.7	79.3	0	0	0	113.6	Y199 V200	Y199-L204 HydrophobicContact CD1-CD1 3.76Å; Y199-L204 HydrophobicContact CE1-CD1 3.27Å; V200-L204 HydrophobicContact CG1-CB 4.36Å; V200-L204 CarbonylContact O-C 3.6Å; V200-L204 WeakPolarHBondContact O-CA 3.36Å; V200-L204 WeakPolarHBondContact O-CB 3.43Å; V200-L204 PolarHBondContact O-N 3.23Å
205	S	90.4	Very high	92.2	Very high	55 Å²	55	41.8 Å²	41.8	39%	0.385	23%	0.23	S	C	.	.	I	π-helix	trans	-74.7	-68.8	-171.7	-173.7	0	0	0	0	111.2	V200 E214	V200-S205 PolarHBondContact O-N 2.89Å; S205-E214 WeakPolarHBondContact CB-OE1 3.48Å; S205-E214 PolarHBondContact OG-OE1 2.99Å
206	S	88.6	Confident	92.3	Very high	20 Å²	20	45.4 Å²	45.4	14%	0.14	25%	0.249	C	C	.	.	S	Bend	trans	-126.9	94.8	170.1	44.7	0	0	0	0	109.5	G208 V209 E214	S206-G208 PolarHBondContact O-N 3.46Å; S206-G208 VanDerWaalsContact O-N 3.11Å; S206-V209 VanDerWaalsContact CB-O 3.25Å; S206-V209 WeakPolarHBondContact CB-O 3.4Å; S206-V209 PolarHBondContact O-N 3.03Å; S206-V209 PolarHBondContact OG-O 3.16Å; S206-E214 PolarHBondContact OG-OE1 3.23Å; S206-E214 PolarHBondContact OG-OE2 3.3Å
207	P	88.4	Confident	92.4	Very high	97 Å²	97	42.9 Å²	42.9	63%	0.63	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	120.1	-174.1	24.9	-33.3	0	0	0	111.2	L202 V209	L202-P207 WeakPolarHBondContact O-CA 3.37Å; P207-V209 VanDerWaalsContact C-N 3.3Å; P207-V209 PolarHBondContact O-N 3.19Å
208	G	86.5	Confident	92.5	Very high	24 Å²	24	41 Å²	41	25%	0.247	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.7	-1.3	175.4	0	0	0	0	0	116.2	L202 S206 R827 V828	L202-G208 PolarHBondContact O-N 3.37Å; S206-G208 PolarHBondContact O-N 3.46Å; S206-G208 VanDerWaalsContact O-N 3.11Å; G208-R827 WeakPolarHBondContact O-CA 3.39Å; G208-V828 CarbonylContact C-O 3.58Å; G208-V828 VanDerWaalsContact CA-O 3.3Å; G208-V828 WeakPolarHBondContact CA-O 3.3Å; G208-V828 PolarHBondContact O-N 3.23Å
209	V	91.9	Very high	92.6	Very high	29 Å²	29	44 Å²	44	18%	0.176	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-136.8	139.4	179.8	-178.9	0	0	0	0	108.5	S206 P207 E825 F826 R827	S206-V209 VanDerWaalsContact CB-O 3.25Å; S206-V209 WeakPolarHBondContact CB-O 3.4Å; S206-V209 PolarHBondContact O-N 3.03Å; S206-V209 PolarHBondContact OG-O 3.16Å; P207-V209 VanDerWaalsContact C-N 3.3Å; P207-V209 PolarHBondContact O-N 3.19Å; V209-E825 HydrophobicContact CG1-CB 3.94Å; V209-E825 HydrophobicContact CG1-CG 4.36Å; V209-F826 WeakPolarHBondContact CA-O 3.47Å; V209-R827 HydrophobicContact CG2-CG 4.3Å
210	I	94.2	Very high	92.8	Very high	4 Å²	4	44.4 Å²	44.4	2%	0.021	25%	0.253	C	S	.	.			trans	-112.6	116.8	178.4	-57.8	-171	0	0	0	109.4	L202 E214 W812 F826 V828	L202-I210 HydrophobicContact CD2-CD1 4.29Å; I210-E214 WeakPolarHBondContact CA-OE2 3.49Å; I210-E214 HydrophobicContact CG2-CB 4.19Å; I210-W812 HydrophobicContact CD1-CD2 3.46Å; I210-W812 VanDerWaalsContact CD1-CD2 3.46Å; I210-W812 HydrophobicContact CD1-CE3 3.08Å; I210-W812 HydrophobicContact CD1-CG 4.23Å; I210-W812 HydrophobicContact CD1-CH2 3.68Å; I210-W812 HydrophobicContact CD1-CZ2 4.04Å; I210-W812 HydrophobicContact CD1-CZ3 3.19Å; I210-W812 HydrophobicContact CG1-CE3 4.47Å; I210-W812 HydrophobicContact CG2-CE3 4.45Å; I210-F826 HydrophobicContact CB-CD1 3.83Å; I210-F826 HydrophobicContact CB-CE1 4.32Å; I210-F826 HydrophobicContact CD1-CE1 4.2Å; I210-F826 HydrophobicContact CG1-CD1 4.5Å; I210-F826 HydrophobicContact CG2-CD1 4.39Å; I210-F826 PolarHBondContact N-O 2.8Å; I210-V828 HydrophobicContact CD1-CB 3.85Å; I210-V828 HydrophobicContact CD1-CG1 4.36Å; I210-V828 HydrophobicContact CD1-CG2 3.39Å; I210-V828 HydrophobicContact CG1-CB 4.12Å; I210-V828 HydrophobicContact CG1-CG2 3.74Å
211	D	94.2	Very high	92.9	Very high	72 Å²	72	44.6 Å²	44.6	39%	0.385	25%	0.252	S	S	.	.			trans	-72.9	154.4	176.6	-80.3	-21.6	0	0	0	111.4	W213 E214 G215	D211-W213 HydrophobicContact CB-CG 4.26Å; D211-W213 PolarHBondContact O-N 3.22Å; D211-W213 PolarHBondContact OD2-NE1 3.3Å; D211-E214 HydrophobicContact CB-CG 4.07Å; D211-E214 PolarHBondContact N-OE2 3.33Å; D211-E214 VanDerWaalsContact N-OE2 3.07Å; D211-E214 WeakPolarHBondContact O-CB 3.44Å; D211-E214 PolarHBondContact O-N 3.14Å; D211-G215 PolarHBondContact O-N 3.02Å; D211-G215 VanDerWaalsContact O-N 3.13Å
212	V	95.2	Very high	92.9	Very high	54 Å²	54	46 Å²	46	33%	0.327	26%	0.258	S	S	.	.	H	α-helix	trans	-54.9	-39.5	175.4	179.6	0	0	0	0	111.6	L216 A816 V817 A820	V212-L216 VanDerWaalsContact O-CB 3.27Å; V212-L216 WeakPolarHBondContact O-CB 3.44Å; V212-L216 PolarHBondContact O-N 3.47Å; V212-A816 HydrophobicContact CG2-CB 4.08Å; V212-V817 HydrophobicContact CG1-CG2 3.81Å; V212-A820 HydrophobicContact CG2-CB 3.58Å
213	W	95.9	Very high	93.1	Very high	131 Å²	131	49.3 Å²	49.3	50%	0.496	28%	0.28	S	S	.	.	H	α-helix	trans	-70.8	-31.3	-179	74.6	-93.8	0	0	0	112.2	W197 D211 A217	W197-W213 HydrophobicContact CH2-CZ3 4.28Å; D211-W213 HydrophobicContact CB-CG 4.26Å; D211-W213 PolarHBondContact O-N 3.22Å; D211-W213 PolarHBondContact OD2-NE1 3.3Å; W213-A217 HydrophobicContact CE3-CB 4.47Å; W213-A217 WeakPolarHBondContact O-CB 3.47Å; W213-A217 PolarHBondContact O-N 2.92Å
214	E	95.2	Very high	93.3	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-70.9	-45.5	177.8	-66.1	179.5	146.2	0	0	111.1	I201 S205 S206 I210 D211 A217 T218	I201-E214 HydrophobicContact CG2-CB 4.2Å; I201-E214 HydrophobicContact CG2-CG 4.31Å; S205-E214 WeakPolarHBondContact CB-OE1 3.48Å; S205-E214 PolarHBondContact OG-OE1 2.99Å; S206-E214 PolarHBondContact OG-OE1 3.23Å; S206-E214 PolarHBondContact OG-OE2 3.3Å; I210-E214 WeakPolarHBondContact CA-OE2 3.49Å; I210-E214 HydrophobicContact CG2-CB 4.19Å; D211-E214 HydrophobicContact CB-CG 4.07Å; D211-E214 PolarHBondContact N-OE2 3.33Å; D211-E214 VanDerWaalsContact N-OE2 3.07Å; D211-E214 WeakPolarHBondContact O-CB 3.44Å; D211-E214 PolarHBondContact O-N 3.14Å; E214-A217 PolarHBondContact O-N 2.91Å; E214-T218 WeakPolarHBondContact O-CB 3.35Å; E214-T218 PolarHBondContact O-N 2.85Å; E214-T218 PolarHBondContact O-OG1 3.01Å
215	G	94.4	Very high	93.4	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-56.8	-52	171.7	0	0	0	0	0	110.9	D211 A217 T218 F219 T813	D211-G215 PolarHBondContact O-N 3.02Å; D211-G215 VanDerWaalsContact O-N 3.13Å; G215-A217 PolarHBondContact O-N 3.34Å; G215-T218 WeakPolarHBondContact O-CB 3.43Å; G215-T218 PolarHBondContact O-N 3.31Å; G215-F219 PolarHBondContact O-N 3.2Å; G215-T813 PolarHBondContact O-OG1 2.83Å
216	L	96.5	Very high	93.5	Very high	77 Å²	77	44.4 Å²	44.4	40%	0.403	25%	0.245	S	C	.	.	H	α-helix	trans	-63.6	-40.8	-179.1	-175	65.8	0	0	0	112.3	V212 F219 L220 T813	V212-L216 VanDerWaalsContact O-CB 3.27Å; V212-L216 WeakPolarHBondContact O-CB 3.44Å; V212-L216 PolarHBondContact O-N 3.47Å; L216-F219 PolarHBondContact O-N 3.43Å; L216-L220 HydrophobicContact CD1-CD1 4.33Å; L216-L220 HydrophobicContact CD1-CG 4.33Å; L216-L220 HydrophobicContact CD2-CD1 4.45Å; L216-L220 HydrophobicContact CG-CD1 3.94Å; L216-L220 HydrophobicContact CG-CG 4.32Å; L216-L220 WeakPolarHBondContact O-CB 3.23Å; L216-L220 VanDerWaalsContact O-CG 3.26Å; L216-L220 WeakPolarHBondContact O-CG 3.3Å; L216-L220 PolarHBondContact O-N 2.87Å; L216-T813 HydrophobicContact CD1-CG2 4.33Å; L216-T813 PolarHBondContact N-OG1 2.64Å
217	A	96.8	Very high	93.6	Very high	26 Å²	26	47.4 Å²	47.4	22%	0.215	26%	0.259	C	S	.	.	H	α-helix	trans	-62.1	-45.6	176.1	0	0	0	0	0	110.7	W197 W213 E214 G215 F219 L220 M221	W197-A217 HydrophobicContact CZ2-CB 4.31Å; W213-A217 HydrophobicContact CE3-CB 4.47Å; W213-A217 WeakPolarHBondContact O-CB 3.47Å; W213-A217 PolarHBondContact O-N 2.92Å; E214-A217 PolarHBondContact O-N 2.91Å; G215-A217 PolarHBondContact O-N 3.34Å; A217-F219 VanDerWaalsContact C-N 3.29Å; A217-F219 PolarHBondContact O-N 2.99Å; A217-L220 PolarHBondContact O-N 3.48Å; A217-M221 VanDerWaalsContact O-CG 3.27Å; A217-M221 WeakPolarHBondContact O-CG 3.39Å; A217-M221 PolarHBondContact O-N 2.97Å
218	T	95.9	Very high	93.8	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-57	-44.2	175.7	-53.7	0	0	0	0	111	W197 E214 G215 M221 V804 F805	W197-T218 PolarHBondContact NE1-OG1 2.9Å; E214-T218 WeakPolarHBondContact O-CB 3.35Å; E214-T218 PolarHBondContact O-N 2.85Å; E214-T218 PolarHBondContact O-OG1 3.01Å; G215-T218 WeakPolarHBondContact O-CB 3.43Å; G215-T218 PolarHBondContact O-N 3.31Å; T218-M221 PolarHBondContact O-N 3.48Å; T218-V804 HydrophobicContact CG2-CG1 4.4Å; T218-F805 HydrophobicContact CG2-CD1 4.24Å; T218-F805 WeakPolarHBondContact O-CA 3.47Å; T218-F805 WeakPolarHBondContact O-CB 3.23Å; T218-F805 WeakPolarHBondContact O-CD1 3.25Å
219	F	96.1	Very high	93.8	Very high	64 Å²	64	44 Å²	44	28%	0.281	23%	0.231	S	C	.	.	H	α-helix	trans	-65.3	-43.6	175.8	-179.5	-132	0	0	0	113.3	G215 L216 A217 M221 F222 P223 F805 L806 L810	G215-F219 PolarHBondContact O-N 3.2Å; L216-F219 PolarHBondContact O-N 3.43Å; A217-F219 VanDerWaalsContact C-N 3.29Å; A217-F219 PolarHBondContact O-N 2.99Å; F219-M221 VanDerWaalsContact C-N 3.27Å; F219-M221 PolarHBondContact O-N 3.28Å; F219-F222 WeakPolarHBondContact O-CB 3.23Å; F219-F222 PolarHBondContact O-N 3.28Å; F219-P223 WeakPolarHBondContact O-CD 3.05Å; F219-F805 WeakPolarHBondContact CA-O 3.41Å; F219-L806 HydrophobicContact CD2-CD1 4.11Å; F219-L806 HydrophobicContact CE2-CD1 3.57Å; F219-L810 HydrophobicContact CD2-CB 4.28Å; F219-L810 HydrophobicContact CE1-CD1 4.48Å; F219-L810 HydrophobicContact CE2-CB 4.44Å; F219-L810 HydrophobicContact CE2-CD1 4.3Å; F219-L810 HydrophobicContact CZ-CD1 4.24Å
220	L	95.8	Very high	93.6	Very high	90 Å²	90	45.9 Å²	45.9	47%	0.471	24%	0.236	S	C	.	.	H	α-helix	trans	-71	-18.6	179.2	-69.5	176.5	0	0	0	113.7	L216 A217 F222 P223 L224	L216-L220 HydrophobicContact CD1-CD1 4.33Å; L216-L220 HydrophobicContact CD1-CG 4.33Å; L216-L220 HydrophobicContact CD2-CD1 4.45Å; L216-L220 HydrophobicContact CG-CD1 3.94Å; L216-L220 HydrophobicContact CG-CG 4.32Å; L216-L220 WeakPolarHBondContact O-CB 3.23Å; L216-L220 VanDerWaalsContact O-CG 3.26Å; L216-L220 WeakPolarHBondContact O-CG 3.3Å; L216-L220 PolarHBondContact O-N 2.87Å; A217-L220 PolarHBondContact O-N 3.48Å; L220-F222 PolarHBondContact O-N 3.3Å; L220-P223 VanDerWaalsContact O-CD 3.32Å; L220-P223 WeakPolarHBondContact O-CD 3.43Å; L220-L224 WeakPolarHBondContact O-CG 3.49Å; L220-L224 PolarHBondContact O-N 2.93Å
221	M	94.8	Very high	93.3	Very high	44 Å²	44	50 Å²	50	22%	0.217	26%	0.256	C	S	.	.	H	α-helix	trans	-67.2	-20.7	171.7	-73.7	-63.2	175.3	0	0	113	W190 A217 T218 F219 L224 T225 F805	W190-M221 HydrophobicContact CH2-SD 3.65Å; W190-M221 HydrophobicContact CZ3-CB 4.32Å; W190-M221 HydrophobicContact CZ3-CG 4.4Å; W190-M221 HydrophobicContact CZ3-SD 3.7Å; A217-M221 VanDerWaalsContact O-CG 3.27Å; A217-M221 WeakPolarHBondContact O-CG 3.39Å; A217-M221 PolarHBondContact O-N 2.97Å; T218-M221 PolarHBondContact O-N 3.48Å; F219-M221 VanDerWaalsContact C-N 3.27Å; F219-M221 PolarHBondContact O-N 3.28Å; M221-L224 HydrophobicContact CE-CD1 4.36Å; M221-L224 PolarHBondContact O-N 3.2Å; M221-L224 HydrophobicContact SD-CB 4.49Å; M221-L224 HydrophobicContact SD-CD1 3.59Å; M221-L224 VanDerWaalsContact SD-CD1 3.59Å; M221-T225 WeakPolarHBondContact O-CB 3.35Å; M221-T225 PolarHBondContact O-N 2.9Å; M221-T225 PolarHBondContact O-OG1 3.03Å; M221-F805 HydrophobicContact CB-CD1 3.56Å; M221-F805 HydrophobicContact CB-CD2 4.4Å; M221-F805 HydrophobicContact CB-CE1 3.6Å; M221-F805 HydrophobicContact CB-CE2 4.42Å; M221-F805 HydrophobicContact CB-CG 4Å; M221-F805 HydrophobicContact CB-CZ 4.05Å; M221-F805 HydrophobicContact CG-CE1 4.27Å
222	F	93.4	Very high	92.8	Very high	31 Å²	31	46.9 Å²	46.9	14%	0.136	24%	0.24	C	C	.	.	H	α-helix	trans	-64.6	-56.4	174.1	169.8	-119.6	0	0	0	112.1	T118 F219 L220 L224 T225 V226 V802 F805 L806	T118-F222 HydrophobicContact CG2-CZ 4.15Å; F219-F222 WeakPolarHBondContact O-CB 3.23Å; F219-F222 PolarHBondContact O-N 3.28Å; L220-F222 PolarHBondContact O-N 3.3Å; F222-L224 PolarHBondContact O-N 2.97Å; F222-T225 WeakPolarHBondContact O-CB 3.15Å; F222-T225 PolarHBondContact O-N 3.5Å; F222-T225 VanDerWaalsContact O-N 3.15Å; F222-V226 HydrophobicContact CD2-CG2 4.27Å; F222-V226 HydrophobicContact CE2-CG2 3.91Å; F222-V226 HydrophobicContact CZ-CG2 4.29Å; F222-V226 WeakPolarHBondContact O-CG2 3.36Å; F222-V226 PolarHBondContact O-N 3.45Å; F222-V226 VanDerWaalsContact O-N 3.11Å; F222-V802 HydrophobicContact CD2-CG2 4.1Å; F222-V802 HydrophobicContact CE2-CG1 4.4Å; F222-V802 HydrophobicContact CE2-CG2 3.65Å; F222-F805 HydrophobicContact CB-CB 3.66Å; F222-L806 HydrophobicContact CE1-CD2 4.36Å
223	P	93.2	Very high	92.2	Very high	70 Å²	70	45.1 Å²	45.1	46%	0.455	23%	0.229	S	C	.	.	H	α-helix	trans	-54.7	-36.1	171.6	-27.6	32.6	0	0	0	114.1	F219 L220 V226 L227	F219-P223 WeakPolarHBondContact O-CD 3.05Å; L220-P223 VanDerWaalsContact O-CD 3.32Å; L220-P223 WeakPolarHBondContact O-CD 3.43Å; P223-V226 PolarHBondContact O-N 3.4Å; P223-L227 WeakPolarHBondContact O-CB 3.41Å; P223-L227 PolarHBondContact O-N 2.98Å
224	L	92.7	Very high	91.3	Very high	77 Å²	77	45.8 Å²	45.8	40%	0.403	23%	0.232	S	C	.	.	H	α-helix	trans	-66.5	-40.8	177.3	-70.8	172.1	0	0	0	112.4	W190 L220 M221 F222 V226 L227 T228	W190-L224 HydrophobicContact CH2-CB 4.4Å; L220-L224 WeakPolarHBondContact O-CG 3.49Å; L220-L224 PolarHBondContact O-N 2.93Å; M221-L224 HydrophobicContact CE-CD1 4.36Å; M221-L224 PolarHBondContact O-N 3.2Å; M221-L224 HydrophobicContact SD-CB 4.49Å; M221-L224 HydrophobicContact SD-CD1 3.59Å; M221-L224 VanDerWaalsContact SD-CD1 3.59Å; F222-L224 PolarHBondContact O-N 2.97Å; L224-V226 VanDerWaalsContact C-N 3.33Å; L224-V226 PolarHBondContact O-N 3.37Å; L224-L227 PolarHBondContact O-N 3.38Å; L224-T228 WeakPolarHBondContact O-CG2 3.41Å; L224-T228 PolarHBondContact O-N 3.18Å; L224-T228 PolarHBondContact O-OG1 3.43Å
225	T	91.6	Very high	89.8	Confident	6 Å²	6	54.5 Å²	54.5	4%	0.037	26%	0.264	C	S	.	.	H	α-helix	trans	-59.5	-45.8	173.8	-62.4	0	0	0	0	110.7	W190 M221 F222 T228 A229 F805	W190-T225 HydrophobicContact CB-CG2 3.73Å; W190-T225 HydrophobicContact CD2-CG2 4.26Å; W190-T225 VanDerWaalsContact CD2-OG1 3.25Å; W190-T225 VanDerWaalsContact CE3-OG1 3.29Å; W190-T225 HydrophobicContact CG-CG2 3.71Å; M221-T225 WeakPolarHBondContact O-CB 3.35Å; M221-T225 PolarHBondContact O-N 2.9Å; M221-T225 PolarHBondContact O-OG1 3.03Å; F222-T225 WeakPolarHBondContact O-CB 3.15Å; F222-T225 PolarHBondContact O-N 3.5Å; F222-T225 VanDerWaalsContact O-N 3.15Å; T225-T228 PolarHBondContact O-OG1 3.26Å; T225-A229 WeakPolarHBondContact O-CB 3.24Å; T225-A229 PolarHBondContact O-N 3.09Å; T225-F805 VanDerWaalsContact OG1-CE2 3.31Å; T225-F805 WeakPolarHBondContact OG1-CE2 3.31Å
226	V	91.6	Very high	87.9	Confident	17 Å²	17	57.3 Å²	57.3	10%	0.103	28%	0.279	C	S	.	.	H	α-helix	trans	-64.1	-43.9	178.3	176.2	0	0	0	0	111.4	V114 T118 F222 P223 L224 A229 Y230	V114-V226 HydrophobicContact CB-CG1 4.41Å; V114-V226 HydrophobicContact CG1-CG1 3.82Å; V114-V226 HydrophobicContact CG2-CG1 4.2Å; T118-V226 HydrophobicContact CG2-CB 4.2Å; T118-V226 HydrophobicContact CG2-CG1 3.63Å; T118-V226 HydrophobicContact CG2-CG2 3.49Å; T118-V226 VanDerWaalsContact CG2-CG2 3.49Å; F222-V226 HydrophobicContact CD2-CG2 4.27Å; F222-V226 HydrophobicContact CE2-CG2 3.91Å; F222-V226 HydrophobicContact CZ-CG2 4.29Å; F222-V226 WeakPolarHBondContact O-CG2 3.36Å; F222-V226 PolarHBondContact O-N 3.45Å; F222-V226 VanDerWaalsContact O-N 3.11Å; P223-V226 PolarHBondContact O-N 3.4Å; L224-V226 VanDerWaalsContact C-N 3.33Å; L224-V226 PolarHBondContact O-N 3.37Å; V226-A229 PolarHBondContact O-N 3.23Å; V226-Y230 WeakPolarHBondContact O-CB 3.42Å; V226-Y230 PolarHBondContact O-N 3.15Å
227	L	91.5	Very high	85.7	Confident	83 Å²	83	56.4 Å²	56.4	44%	0.435	28%	0.275	S	S	.	.	H	α-helix	trans	-64.6	-45.2	-180	-179.3	62.4	0	0	0	111.9	P223 L224 Y230 M231	P223-L227 WeakPolarHBondContact O-CB 3.41Å; P223-L227 PolarHBondContact O-N 2.98Å; L224-L227 PolarHBondContact O-N 3.38Å; L227-Y230 WeakPolarHBondContact O-CB 3.49Å; L227-Y230 PolarHBondContact O-N 3.06Å; L227-M231 HydrophobicContact CD1-CE 3.99Å; L227-M231 HydrophobicContact CD2-CE 4.17Å; L227-M231 HydrophobicContact CG-CE 3.94Å; L227-M231 VanDerWaalsContact O-CG 3.32Å; L227-M231 WeakPolarHBondContact O-CG 3.43Å; L227-M231 PolarHBondContact O-N 3.42Å
228	T	91.4	Very high	83.1	Confident	48 Å²	48	60.7 Å²	60.7	29%	0.294	29%	0.293	S	S	.	.	H	α-helix	trans	-66.9	-37.9	178.8	54.4	0	0	0	0	111.9	W190 L224 T225 M231 A232	W190-T228 HydrophobicContact CZ2-CG2 4.42Å; W190-T228 PolarHBondContact NE1-OG1 3.19Å; L224-T228 WeakPolarHBondContact O-CG2 3.41Å; L224-T228 PolarHBondContact O-N 3.18Å; L224-T228 PolarHBondContact O-OG1 3.43Å; T225-T228 PolarHBondContact O-OG1 3.26Å; T228-M231 PolarHBondContact O-N 3.28Å; T228-A232 WeakPolarHBondContact O-CB 3.47Å; T228-A232 PolarHBondContact O-N 3.07Å
229	A	87.7	Confident	80.3	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-65.2	-41.3	172.6	0	0	0	0	0	112.3	T113 L117 V186 T225 V226 M231 A232 D233	T113-A229 HydrophobicContact CG2-CB 4.05Å; L117-A229 HydrophobicContact CD1-CB 3.22Å; V186-A229 HydrophobicContact CG1-CB 4.4Å; T225-A229 WeakPolarHBondContact O-CB 3.24Å; T225-A229 PolarHBondContact O-N 3.09Å; V226-A229 PolarHBondContact O-N 3.23Å; A229-M231 PolarHBondContact O-N 3.07Å; A229-A232 WeakPolarHBondContact O-CB 3.45Å; A229-A232 PolarHBondContact O-N 2.93Å; A229-D233 PolarHBondContact O-N 3.16Å
230	Y	87.8	Confident	77.6	Confident	69 Å²	69	74.7 Å²	74.7	27%	0.271	35%	0.354	S	S	.	.	H	α-helix	trans	-61.3	-43.1	173.4	174.3	-106.1	0	0	0	112.2	N111 V114 V226 L227 A232 D233 R234	N111-Y230 HydrophobicContact CB-CD2 3.98Å; N111-Y230 HydrophobicContact CB-CE2 3.87Å; V114-Y230 HydrophobicContact CG2-CD2 3.63Å; V114-Y230 HydrophobicContact CG2-CG 4.03Å; V226-Y230 WeakPolarHBondContact O-CB 3.42Å; V226-Y230 PolarHBondContact O-N 3.15Å; L227-Y230 WeakPolarHBondContact O-CB 3.49Å; L227-Y230 PolarHBondContact O-N 3.06Å; Y230-A232 VanDerWaalsContact C-N 3.32Å; Y230-A232 PolarHBondContact O-N 3.12Å; Y230-D233 PolarHBondContact O-N 3.4Å; Y230-R234 HydrophobicContact CD2-CG 4.39Å; Y230-R234 HydrophobicContact CE1-CG 4.04Å; Y230-R234 HydrophobicContact CE2-CG 3.91Å; Y230-R234 VanDerWaalsContact CZ-CD 3.46Å; Y230-R234 PolarHBondContact O-N 3.23Å; Y230-R234 VanDerWaalsContact OH-CD 3.27Å; Y230-R234 WeakPolarHBondContact OH-CD 3.31Å; Y230-R234 VanDerWaalsContact OH-CZ 3.22Å; Y230-R234 PolarHBondContact OH-NE 3.12Å; Y230-R234 PolarHBondContact OH-NH1 3.39Å; Y230-R234 VanDerWaalsContact OH-NH1 3.11Å
231	M	87.7	Confident	74.5	Confident	91 Å²	91	78.1 Å²	78.1	45%	0.448	37%	0.365	S	S	.	.	H	α-helix	trans	-62.6	-40.1	175.4	-73.1	-176.8	179.4	0	0	111.7	L227 T228 A229 R234 R235	L227-M231 HydrophobicContact CD1-CE 3.99Å; L227-M231 HydrophobicContact CD2-CE 4.17Å; L227-M231 HydrophobicContact CG-CE 3.94Å; L227-M231 VanDerWaalsContact O-CG 3.32Å; L227-M231 WeakPolarHBondContact O-CG 3.43Å; L227-M231 PolarHBondContact O-N 3.42Å; T228-M231 PolarHBondContact O-N 3.28Å; A229-M231 PolarHBondContact O-N 3.07Å; M231-R234 PolarHBondContact O-N 3.3Å; M231-R235 WeakPolarHBondContact O-CG 3.35Å; M231-R235 PolarHBondContact O-N 3.36Å
232	A	84.1	Confident	71.4	Confident	7 Å²	7	80.8 Å²	80.8	6%	0.058	38%	0.384	C	S	.	.	H	α-helix	trans	-62.7	-43.2	175.9	0	0	0	0	0	112	T182 V183 V186 T228 A229 Y230	T182-A232 HydrophobicContact CG2-CB 4.08Å; V183-A232 HydrophobicContact CG2-CB 4.37Å; V186-A232 HydrophobicContact CG2-CB 4.06Å; T228-A232 WeakPolarHBondContact O-CB 3.47Å; T228-A232 PolarHBondContact O-N 3.07Å; A229-A232 WeakPolarHBondContact O-CB 3.45Å; A229-A232 PolarHBondContact O-N 2.93Å; Y230-A232 VanDerWaalsContact C-N 3.32Å; Y230-A232 PolarHBondContact O-N 3.12Å
233	D	82.2	Confident	68.4	Low	17 Å²	17	84.3 Å²	84.3	9%	0.091	41%	0.41	C	S	.	.	H	α-helix	trans	-65.2	-45.9	176.1	-177.5	51.8	0	0	0	112	N111 T113 V183 A229 Y230 R235 I236 N237	N111-D233 PolarHBondContact ND2-OD2 3.11Å; T113-D233 HydrophobicContact CG2-CB 4.42Å; T113-D233 WeakPolarHBondContact OG1-CB 3.18Å; T113-D233 VanDerWaalsContact OG1-CG 3.28Å; V183-D233 HydrophobicContact CG2-CB 4.09Å; A229-D233 PolarHBondContact O-N 3.16Å; Y230-D233 PolarHBondContact O-N 3.4Å; D233-R235 PolarHBondContact O-N 3.23Å; D233-I236 WeakPolarHBondContact O-CB 3.47Å; D233-I236 PolarHBondContact O-N 2.97Å; D233-I236 VanDerWaalsContact O-N 3.15Å; D233-N237 PolarHBondContact O-N 2.93Å
234	R	76.5	Confident	65.2	Low	145 Å²	145	85.5 Å²	85.5	55%	0.547	41%	0.41	S	S	.	.	H	α-helix	trans	-63.6	-36.2	178.5	-80.5	-141.5	129.4	168.4	-4.4	114.2	Y230 M231 I236 N237 L238	Y230-R234 HydrophobicContact CD2-CG 4.39Å; Y230-R234 HydrophobicContact CE1-CG 4.04Å; Y230-R234 HydrophobicContact CE2-CG 3.91Å; Y230-R234 VanDerWaalsContact CZ-CD 3.46Å; Y230-R234 PolarHBondContact O-N 3.23Å; Y230-R234 VanDerWaalsContact OH-CD 3.27Å; Y230-R234 WeakPolarHBondContact OH-CD 3.31Å; Y230-R234 VanDerWaalsContact OH-CZ 3.22Å; Y230-R234 PolarHBondContact OH-NE 3.12Å; Y230-R234 PolarHBondContact OH-NH1 3.39Å; Y230-R234 VanDerWaalsContact OH-NH1 3.11Å; M231-R234 PolarHBondContact O-N 3.3Å; R234-I236 PolarHBondContact O-N 3.34Å; R234-N237 PolarHBondContact O-N 2.94Å; R234-N237 VanDerWaalsContact O-N 3.09Å; R234-L238 PolarHBondContact O-N 2.87Å
235	R	63.4	Low	62	Low	182 Å²	182	93.1 Å²	93.1	69%	0.687	43%	0.434	S	S	*	.	H	α-helix	trans	-59.2	-29.2	176.4	-78.2	-177.1	-158.1	-165	7.3	112.1	M231 D233	M231-R235 WeakPolarHBondContact O-CG 3.35Å; M231-R235 PolarHBondContact O-N 3.36Å; D233-R235 PolarHBondContact O-N 3.23Å
236	I	55.1	Low	59	Low	60 Å²	60	99.5 Å²	99.5	31%	0.308	46%	0.458	S	S	.	.	H	α-helix	trans	-73	-44.9	174.7	-60	171.1	0	0	0	110.1	D233 R234 L238 K239	D233-I236 WeakPolarHBondContact O-CB 3.47Å; D233-I236 PolarHBondContact O-N 2.97Å; D233-I236 VanDerWaalsContact O-N 3.15Å; R234-I236 PolarHBondContact O-N 3.34Å; I236-L238 VanDerWaalsContact C-N 3.33Å; I236-L238 PolarHBondContact O-N 3.46Å; I236-K239 WeakPolarHBondContact O-CB 3.48Å; I236-K239 PolarHBondContact O-N 2.91Å; I236-K239 VanDerWaalsContact O-N 3.11Å
237	N	49.8	Very low	55.8	Low	58 Å²	58	109 Å²	109	31%	0.31	49%	0.492	S	S	.	.	H	α-helix	trans	-67.3	-30.2	-179.9	-79.7	-39.5	0	0	0	113.3	D233 R234 K239 K240 F241	D233-N237 PolarHBondContact O-N 2.93Å; R234-N237 PolarHBondContact O-N 2.94Å; R234-N237 VanDerWaalsContact O-N 3.09Å; N237-K239 PolarHBondContact O-N 2.67Å; N237-K240 CarbonylContact O-C 3.15Å; N237-K240 WeakPolarHBondContact O-CA 3.21Å; N237-K240 WeakPolarHBondContact O-CB 3.46Å; N237-K240 PolarHBondContact O-N 3.25Å; N237-F241 HydrophobicContact CB-CD2 4.41Å; N237-F241 HydrophobicContact CB-CE2 4.4Å; N237-F241 WeakPolarHBondContact O-CD2 3.16Å; N237-F241 PolarHBondContact O-N 3.21Å
238	L	42.6	Very low	52.8	Low	115 Å²	115	108.9 Å²	108.9	60%	0.602	50%	0.503	S	S	*	.	H	α-helix	trans	-57.5	-29.4	171.3	-86.3	151.8	0	0	0	113.2	R234 I236 F241 V242	R234-L238 PolarHBondContact O-N 2.87Å; I236-L238 VanDerWaalsContact C-N 3.33Å; I236-L238 PolarHBondContact O-N 3.46Å; L238-F241 CarbonylContact O-C 3.54Å; L238-F241 PolarHBondContact O-N 3.33Å; L238-V242 PolarHBondContact O-N 3.2Å; L238-V242 VanDerWaalsContact O-N 3.16Å
239	K	37.4	Very low	49.8	Very low	178 Å²	178	113.1 Å²	113.1	77%	0.774	52%	0.524	S	S	*	.	H	α-helix	trans	-72.1	-28.4	172.4	-73	-173.2	176.7	-177.5	0	113.3	I236 N237	I236-K239 WeakPolarHBondContact O-CB 3.48Å; I236-K239 PolarHBondContact O-N 2.91Å; I236-K239 VanDerWaalsContact O-N 3.11Å; N237-K239 PolarHBondContact O-N 2.67Å
240	K	39.5	Very low	47.4	Very low	180 Å²	180	122.5 Å²	122.5	78%	0.783	57%	0.57	S	S	*	*	H	α-helix	trans	-74	-26.5	167.5	-93.7	-176.2	174.9	179.4	0	112.7	N237	N237-K240 CarbonylContact O-C 3.15Å; N237-K240 WeakPolarHBondContact O-CA 3.21Å; N237-K240 WeakPolarHBondContact O-CB 3.46Å; N237-K240 PolarHBondContact O-N 3.25Å
241	F	30.9	Very low	44.9	Very low	163 Å²	163	125.8 Å²	125.8	72%	0.715	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	6.6	178	-75.9	-72.9	0	0	0	114.2	N237 L238 P243	N237-F241 HydrophobicContact CB-CD2 4.41Å; N237-F241 HydrophobicContact CB-CE2 4.4Å; N237-F241 WeakPolarHBondContact O-CD2 3.16Å; N237-F241 PolarHBondContact O-N 3.21Å; L238-F241 CarbonylContact O-C 3.54Å; L238-F241 PolarHBondContact O-N 3.33Å; F241-P243 WeakPolarHBondContact O-CD 3.3Å; F241-P243 VanDerWaalsContact O-N 3.14Å
242	V	29.7	Very low	42.2	Very low	100 Å²	100	123.6 Å²	123.6	61%	0.606	60%	0.598	S	S	*	*	S	Bend	trans	-62.4	118.5	169.3	179.7	0	0	0	0	107.4	L238 M244	L238-V242 PolarHBondContact O-N 3.2Å; L238-V242 VanDerWaalsContact O-N 3.16Å; V242-M244 PolarHBondContact O-N 2.95Å
243	P	29.5	Very low	39.4	Very low	104 Å²	104	129.2 Å²	129.2	68%	0.675	63%	0.626	S	S	*	*			trans	-66.7	130.8	-170.6	25.2	-32.1	0	0	0	110	F241 R245	F241-P243 WeakPolarHBondContact O-CD 3.3Å; F241-P243 VanDerWaalsContact O-N 3.14Å; P243-R245 PolarHBondContact O-N 3.42Å; P243-R245 VanDerWaalsContact O-N 3.12Å
244	M	27.8	Very low	36.9	Very low	95 Å²	95	137.1 Å²	137.1	47%	0.468	66%	0.655	S	S	.	*			trans	-32.8	116	165.9	-75.5	-84.9	-133	0	0	110.2	V242 Y246 A255	V242-M244 PolarHBondContact O-N 2.95Å; M244-Y246 HydrophobicContact CB-CD2 4.36Å; M244-Y246 HydrophobicContact CB-CE2 3.74Å; M244-Y246 WeakPolarHBondContact O-CD2 3.2Å; M244-Y246 VanDerWaalsContact O-CE2 3.28Å; M244-Y246 WeakPolarHBondContact O-CE2 3.17Å; M244-Y246 PolarHBondContact O-N 3.29Å; M244-A255 HydrophobicContact CE-CB 3.65Å; M244-A255 HydrophobicContact SD-CB 4.07Å
245	R	24	Very low	34.7	Very low	238 Å²	238	132.5 Å²	132.5	90%	0.898	65%	0.648	S	S	*	*			trans	-78	106.7	173	-80.2	-175.1	177	-178.4	-1	108.2	P243	P243-R245 PolarHBondContact O-N 3.42Å; P243-R245 VanDerWaalsContact O-N 3.12Å
246	Y	29.7	Very low	33	Very low	139 Å²	139	132.6 Å²	132.6	55%	0.545	65%	0.653	S	S	.	*			trans	-80.7	126.6	175.3	-68.8	-80.4	0	0	0	109.8	M244 L253 A255	M244-Y246 HydrophobicContact CB-CD2 4.36Å; M244-Y246 HydrophobicContact CB-CE2 3.74Å; M244-Y246 WeakPolarHBondContact O-CD2 3.2Å; M244-Y246 VanDerWaalsContact O-CE2 3.28Å; M244-Y246 WeakPolarHBondContact O-CE2 3.17Å; M244-Y246 PolarHBondContact O-N 3.29Å; Y246-L253 HydrophobicContact CD1-CD2 3.48Å; Y246-L253 VanDerWaalsContact CD1-CD2 3.48Å; Y246-L253 HydrophobicContact CE1-CD2 4.45Å; Y246-L253 HydrophobicContact CG-CD2 3.73Å; Y246-A255 HydrophobicContact CE1-CB 4.32Å
247	R	24.6	Very low	31.9	Very low	217 Å²	217	134 Å²	134	82%	0.819	67%	0.669	S	S	*	*	B	Isolated β-bridge	trans	-113	128.6	163.9	-154.9	178.9	-146.8	175.5	5	108.6
248	A	27.1	Very low	30.9	Very low	80 Å²	80	136.6 Å²	136.6	66%	0.661	69%	0.692	S	S	*	*			trans	-81.3	131	177.3	0	0	0	0	0	109.5
249	D	30.1	Very low	30.1	Very low	138 Å²	138	140.1 Å²	140.1	74%	0.738	71%	0.705	S	S	*	*			trans	-130.4	165.1	163.9	-111.3	-23	0	0	0	108.6	V251 G252	D249-V251 PolarHBondContact O-N 2.92Å; D249-G252 PolarHBondContact O-N 2.87Å
250	M	36.8	Very low	29.8	Very low	196 Å²	196	138.6 Å²	138.6	97%	0.966	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.3	-6.5	-165.9	-66.4	-140.9	-158.6	0	0	116.5
251	V	35.4	Very low	29.1	Very low	138 Å²	138	139 Å²	139	84%	0.836	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.2	22.4	178.3	-164.9	0	0	0	0	112.2	D249	D249-V251 PolarHBondContact O-N 2.92Å
252	G	29.7	Very low	28.8	Very low	45 Å²	45	138.5 Å²	138.5	46%	0.464	71%	0.713	S	S	.	*			trans	97.8	163.7	170.8	0	0	0	0	0	115.1	D249 R254	D249-G252 PolarHBondContact O-N 2.87Å; G252-R254 PolarHBondContact O-N 2.93Å
253	L	25.9	Very low	28.6	Very low	126 Å²	126	139.3 Å²	139.3	66%	0.66	72%	0.72	S	S	*	*			trans	-62.9	116.1	-171.3	-84.1	123.2	0	0	0	112.8	Y246	Y246-L253 HydrophobicContact CD1-CD2 3.48Å; Y246-L253 VanDerWaalsContact CD1-CD2 3.48Å; Y246-L253 HydrophobicContact CE1-CD2 4.45Å; Y246-L253 HydrophobicContact CG-CD2 3.73Å
254	R	30	Very low	28.4	Very low	182 Å²	182	143.9 Å²	143.9	69%	0.687	73%	0.73	S	S	*	*	B	Isolated β-bridge	trans	-110.4	122.9	175.8	-143.4	178.2	-72.4	170.2	-2.2	110.4	G252	G252-R254 PolarHBondContact O-N 2.93Å
255	A	29.4	Very low	28.4	Very low	49 Å²	49	144.7 Å²	144.7	41%	0.405	74%	0.74	S	S	.	*	P	Polyproline II helix	trans	-90.9	126.8	176.8	0	0	0	0	0	110.3	M244 Y246	M244-A255 HydrophobicContact CE-CB 3.65Å; M244-A255 HydrophobicContact SD-CB 4.07Å; Y246-A255 HydrophobicContact CE1-CB 4.32Å
256	F	27.9	Very low	28.8	Very low	183 Å²	183	140.4 Å²	140.4	80%	0.803	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-96.2	118.6	172.3	-93.1	-89.9	0	0	0	110
257	S	33.3	Very low	29.2	Very low	91 Å²	91	143 Å²	143	64%	0.636	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-86.9	120.3	162.3	53.4	0	0	0	0	109.2	Q259	S257-Q259 PolarHBondContact O-N 3.12Å
258	S	27.9	Very low	29.7	Very low	112 Å²	112	139.9 Å²	139.9	78%	0.783	75%	0.751	S	S	*	*			trans	-71.1	113.7	166.3	59.3	0	0	0	0	109.1
259	Q	25.9	Very low	30	Very low	189 Å²	189	139.8 Å²	139.8	88%	0.883	76%	0.758	S	S	*	*			trans	50.7	73.2	158.7	-64.6	175.2	-16.3	0	0	115.2	S257	S257-Q259 PolarHBondContact O-N 3.12Å
260	L	30.9	Very low	30.4	Very low	146 Å²	146	139 Å²	139	76%	0.764	76%	0.759	S	S	*	*			trans	-90.3	110.2	146.2	-156.4	80.7	0	0	0	105.4	L262	L260-L262 PolarHBondContact O-N 2.99Å
261	E	24	Very low	30.4	Very low	187 Å²	187	136.1 Å²	136.1	87%	0.874	75%	0.745	S	S	*	*			trans	-59.2	106.4	169.5	-68.7	178.5	164	0	0	107.4
262	L	25.5	Very low	30.5	Very low	153 Å²	153	134.3 Å²	134.3	80%	0.801	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-64.6	138.9	168.3	-84.7	116.3	0	0	0	108.5	L260	L260-L262 PolarHBondContact O-N 2.99Å
263	P	25.4	Very low	30.8	Very low	117 Å²	117	139.2 Å²	139.2	76%	0.76	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-55.9	142.4	173.6	-18.5	30.2	0	0	0	110.4
264	K	25.2	Very low	31.1	Very low	200 Å²	200	140.8 Å²	140.8	87%	0.87	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-59.4	136.9	177.2	-70.9	179.6	176.1	-179.5	0	110.1	D266	K264-D266 PolarHBondContact O-N 3.29Å
265	V	28	Very low	31.5	Very low	112 Å²	112	136.6 Å²	136.6	68%	0.679	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-66.1	121.2	176.5	177.8	0	0	0	0	109
266	D	31.6	Very low	31.9	Very low	148 Å²	148	139.7 Å²	139.7	79%	0.791	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-83.9	145.3	159.7	-73	-31.5	0	0	0	108.6	K264 D268	K264-D266 PolarHBondContact O-N 3.29Å; D266-D268 PolarHBondContact O-N 2.94Å
267	E	38.6	Very low	32.2	Very low	195 Å²	195	138.8 Å²	138.8	91%	0.911	75%	0.746	S	S	*	*	S	Bend	trans	-68.5	10	-159.9	-72.9	-175.4	147.7	0	0	117.5	G269	E267-G269 PolarHBondContact O-N 3.13Å; E267-G269 VanDerWaalsContact O-N 3.13Å
268	D	34.3	Very low	32.3	Very low	151 Å²	151	141 Å²	141	81%	0.807	75%	0.746	S	S	*	*			trans	-90.2	77.5	174.8	-72	-28.3	0	0	0	111.5	D266 T270	D266-D268 PolarHBondContact O-N 2.94Å; D268-T270 VanDerWaalsContact C-N 3.35Å; D268-T270 PolarHBondContact O-N 3.46Å
269	G	34.8	Very low	32.6	Very low	77 Å²	77	143.8 Å²	143.8	79%	0.794	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	51.1	-168.9	0	0	0	0	0	118.2	E267	E267-G269 PolarHBondContact O-N 3.13Å; E267-G269 VanDerWaalsContact O-N 3.13Å
270	T	38.9	Very low	33.1	Very low	123 Å²	123	138.5 Å²	138.5	76%	0.755	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.1	-12.5	175.6	2.8	0	0	0	0	115.6	D268	D268-T270 VanDerWaalsContact C-N 3.35Å; D268-T270 PolarHBondContact O-N 3.46Å
271	I	35.6	Very low	33.3	Very low	134 Å²	134	142.4 Å²	142.4	69%	0.687	75%	0.745	S	S	*	*	S	Bend	trans	-99.7	-17.5	-169.1	-58.8	179.7	0	0	0	113.7
272	D	38.6	Very low	33.8	Very low	100 Å²	100	139 Å²	139	54%	0.535	73%	0.733	S	S	.	*	H	α-helix	trans	-82.8	-12.4	-177.5	-106.1	-11	0	0	0	115.1	M274 L275 L276	D272-M274 VanDerWaalsContact C-N 3.29Å; D272-M274 PolarHBondContact O-N 3.16Å; D272-L275 PolarHBondContact O-N 2.78Å; D272-L275 WeakPolarHBondContact OD1-CD1 3.24Å; D272-L276 PolarHBondContact O-N 2.99Å
273	Q	35.7	Very low	34.5	Very low	148 Å²	148	138.3 Å²	138.3	69%	0.692	72%	0.724	S	S	*	*	H	α-helix	trans	-70.8	-25.8	179.4	-155.1	171.2	7.1	0	0	112.5
274	M	31.7	Very low	35.4	Very low	160 Å²	160	135.6 Å²	135.6	79%	0.788	70%	0.703	S	S	*	*	H	α-helix	trans	-72.9	-32.2	173.4	-78.2	-173	166.3	0	0	112.9	D272 L276 Q277	D272-M274 VanDerWaalsContact C-N 3.29Å; D272-M274 PolarHBondContact O-N 3.16Å; M274-L276 VanDerWaalsContact C-N 3.29Å; M274-L276 PolarHBondContact O-N 3.34Å; M274-Q277 PolarHBondContact O-N 2.99Å
275	L	37.8	Very low	36.4	Very low	94 Å²	94	131.8 Å²	131.8	49%	0.492	69%	0.691	S	S	.	*	H	α-helix	trans	-69	-27.6	177.1	-97.1	155.8	0	0	0	112.5	D272	D272-L275 PolarHBondContact O-N 2.78Å; D272-L275 WeakPolarHBondContact OD1-CD1 3.24Å
276	L	38.2	Very low	37	Very low	114 Å²	114	130.6 Å²	130.6	60%	0.597	68%	0.678	S	S	*	*	H	α-helix	trans	-77.8	-26	177.8	-80.7	163	0	0	0	113.8	D272 M274	D272-L276 PolarHBondContact O-N 2.99Å; M274-L276 VanDerWaalsContact C-N 3.29Å; M274-L276 PolarHBondContact O-N 3.34Å
277	Q	35.1	Very low	37.8	Very low	163 Å²	163	128.8 Å²	128.8	76%	0.762	67%	0.665	S	S	*	*	H	α-helix	trans	-92	-17.1	-175.3	-73.7	-170.8	-3.9	0	0	115.1	M274 K279	M274-Q277 PolarHBondContact O-N 2.99Å; Q277-K279 VanDerWaalsContact C-N 3.26Å; Q277-K279 PolarHBondContact O-N 2.84Å
278	Q	35.6	Very low	38.4	Very low	137 Å²	137	120.9 Å²	120.9	64%	0.64	63%	0.633	S	S	*	*			trans	-88.4	36.8	177.7	-91	-173.9	-13.4	0	0	114.5	G280	Q278-G280 PolarHBondContact O-N 3.49Å; Q278-G280 VanDerWaalsContact O-N 3.14Å
279	K	33.2	Very low	39.1	Very low	172 Å²	172	118.9 Å²	118.9	75%	0.748	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	75.5	173.3	-74.3	179.3	178.4	170.4	0	111	Q277	Q277-K279 VanDerWaalsContact C-N 3.26Å; Q277-K279 PolarHBondContact O-N 2.84Å
280	G	37	Very low	39.9	Very low	78 Å²	78	119 Å²	119	80%	0.804	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-174.1	-10.7	175.8	0	0	0	0	0	118.6	Q278	Q278-G280 PolarHBondContact O-N 3.49Å; Q278-G280 VanDerWaalsContact O-N 3.14Å
281	R	33.9	Very low	40.6	Very low	227 Å²	227	116.1 Å²	116.1	86%	0.857	58%	0.575	S	S	*	*	S	Bend	trans	-101	142.6	176.4	-97.3	-179.8	173.7	168	-0.9	111.6	F283	R281-F283 PolarHBondContact O-N 3.11Å
282	N	35.8	Very low	41.6	Very low	116 Å²	116	116.1 Å²	116.1	62%	0.62	57%	0.572	S	S	*	*			trans	-48.5	98.3	167.1	-89.3	-8.7	0	0	0	109.7	D99 N284	D99-N282 PolarHBondContact OD2-ND2 3.46Å; N282-N284 PolarHBondContact O-N 3.39Å
283	F	39.1	Very low	42.4	Very low	139 Å²	139	115 Å²	115	61%	0.61	56%	0.563	S	S	*	*			trans	-60.3	107.3	179.1	-115.9	-98.4	0	0	0	108.9	R281 I285 A288	R281-F283 PolarHBondContact O-N 3.11Å; F283-I285 PolarHBondContact O-N 3.23Å; F283-A288 HydrophobicContact CD1-CB 3.94Å; F283-A288 HydrophobicContact CE1-CB 3.76Å
284	N	45	Very low	43.4	Very low	59 Å²	59	110 Å²	110	32%	0.316	54%	0.538	S	S	.	.			trans	-79.7	113.5	163.2	-85.4	-24	0	0	0	107	K97 N282 E286 E287 A288	K97-N284 PolarHBondContact NZ-OD1 2.78Å; N282-N284 PolarHBondContact O-N 3.39Å; N284-E286 PolarHBondContact O-N 3.47Å; N284-E287 HydrophobicContact CB-CB 3.76Å; N284-E287 PolarHBondContact O-N 3.05Å; N284-A288 PolarHBondContact O-N 3.39Å
285	I	46.5	Very low	44.9	Very low	121 Å²	121	108.7 Å²	108.7	62%	0.621	53%	0.525	S	S	*	.	H	α-helix	trans	-55	-39.3	178.4	-63	169.1	0	0	0	110.5	F283 E287 A288 E289	F283-I285 PolarHBondContact O-N 3.23Å; I285-E287 VanDerWaalsContact C-N 3.33Å; I285-E287 PolarHBondContact O-N 2.93Å; I285-A288 PolarHBondContact O-N 3.44Å; I285-E289 HydrophobicContact CG2-CG 4.24Å; I285-E289 WeakPolarHBondContact O-CB 3.37Å; I285-E289 VanDerWaalsContact O-CG 3.32Å; I285-E289 WeakPolarHBondContact O-CG 3.49Å; I285-E289 PolarHBondContact O-N 3.31Å
286	E	40.9	Very low	46.2	Very low	86 Å²	86	107.8 Å²	107.8	40%	0.402	52%	0.518	S	S	.	.	H	α-helix	trans	-63.9	-37	177.1	-66.4	177.3	179.6	0	0	112.8	I105 N284 F290	I105-E286 WeakPolarHBondContact CA-OE1 3.4Å; N284-E286 PolarHBondContact O-N 3.47Å; E286-F290 WeakPolarHBondContact O-CB 3.29Å; E286-F290 PolarHBondContact O-N 3.45Å
287	E	48.1	Very low	47.5	Very low	111 Å²	111	102.7 Å²	102.7	52%	0.519	49%	0.491	S	S	.	.	H	α-helix	trans	-73.7	-39.6	179.2	-162.2	155	-165.8	0	0	110.3	N284 I285 F290 E291	N284-E287 HydrophobicContact CB-CB 3.76Å; N284-E287 PolarHBondContact O-N 3.05Å; I285-E287 VanDerWaalsContact C-N 3.33Å; I285-E287 PolarHBondContact O-N 2.93Å; E287-F290 PolarHBondContact O-N 3.12Å; E287-E291 VanDerWaalsContact O-CB 3.27Å; E287-E291 WeakPolarHBondContact O-CB 3.15Å; E287-E291 VanDerWaalsContact O-CG 3.24Å; E287-E291 WeakPolarHBondContact O-CG 3.15Å; E287-E291 PolarHBondContact O-N 2.85Å
288	A	50.6	Low	48.7	Very low	29 Å²	29	95.8 Å²	95.8	24%	0.24	46%	0.459	C	S	.	.	H	α-helix	trans	-65.6	-41.2	172.7	0	0	0	0	0	112.9	F283 N284 I285 E291 Q292	F283-A288 HydrophobicContact CD1-CB 3.94Å; F283-A288 HydrophobicContact CE1-CB 3.76Å; N284-A288 PolarHBondContact O-N 3.39Å; I285-A288 PolarHBondContact O-N 3.44Å; A288-E291 PolarHBondContact O-N 3.31Å; A288-Q292 VanDerWaalsContact O-CB 3.29Å; A288-Q292 WeakPolarHBondContact O-CB 3.28Å; A288-Q292 PolarHBondContact O-N 3.35Å
289	E	48.7	Very low	50.5	Low	108 Å²	108	92 Å²	92	51%	0.505	45%	0.448	S	S	.	.	H	α-helix	trans	-67.1	-42.3	175.3	-76.5	179.6	175.9	0	0	111.4	I285 Q292 Q293	I285-E289 HydrophobicContact CG2-CG 4.24Å; I285-E289 WeakPolarHBondContact O-CB 3.37Å; I285-E289 VanDerWaalsContact O-CG 3.32Å; I285-E289 WeakPolarHBondContact O-CG 3.49Å; I285-E289 PolarHBondContact O-N 3.31Å; E289-Q292 PolarHBondContact O-N 2.92Å; E289-Q293 WeakPolarHBondContact O-CG 3.48Å; E289-Q293 PolarHBondContact O-N 2.91Å
290	F	51.8	Low	52.2	Low	80 Å²	80	84 Å²	84	35%	0.351	41%	0.413	S	S	.	.	H	α-helix	trans	-61	-45.6	173.5	178.9	-88.2	0	0	0	111.1	E286 E287 Q293 R294 I657	E286-F290 WeakPolarHBondContact O-CB 3.29Å; E286-F290 PolarHBondContact O-N 3.45Å; E287-F290 PolarHBondContact O-N 3.12Å; F290-Q293 PolarHBondContact O-N 3.42Å; F290-R294 WeakPolarHBondContact O-CB 3.25Å; F290-R294 PolarHBondContact O-N 3.23Å; F290-I657 HydrophobicContact CD2-CB 4.25Å; F290-I657 HydrophobicContact CD2-CD1 4.34Å; F290-I657 HydrophobicContact CD2-CG2 3.25Å; F290-I657 HydrophobicContact CE1-CD1 4.01Å; F290-I657 HydrophobicContact CE2-CB 3.67Å; F290-I657 HydrophobicContact CE2-CD1 3.64Å; F290-I657 HydrophobicContact CE2-CG1 4.24Å; F290-I657 HydrophobicContact CE2-CG2 3.17Å; F290-I657 HydrophobicContact CG-CG2 4.27Å; F290-I657 HydrophobicContact CZ-CB 4.32Å; F290-I657 HydrophobicContact CZ-CD1 3.42Å; F290-I657 VanDerWaalsContact CZ-CD1 3.42Å; F290-I657 HydrophobicContact CZ-CG1 4.47Å; F290-I657 HydrophobicContact CZ-CG2 4.14Å
291	E	53.4	Low	53.7	Low	62 Å²	62	80.4 Å²	80.4	29%	0.29	38%	0.375	S	S	.	.	H	α-helix	trans	-63	-40	174.7	-80.7	-178.1	-160.6	0	0	112.3	E287 A288 R294 R295	E287-E291 VanDerWaalsContact O-CB 3.27Å; E287-E291 WeakPolarHBondContact O-CB 3.15Å; E287-E291 VanDerWaalsContact O-CG 3.24Å; E287-E291 WeakPolarHBondContact O-CG 3.15Å; E287-E291 PolarHBondContact O-N 2.85Å; A288-E291 PolarHBondContact O-N 3.31Å; E291-R294 WeakPolarHBondContact O-CB 3.47Å; E291-R294 PolarHBondContact O-N 2.91Å; E291-R295 VanDerWaalsContact O-CG 3.31Å; E291-R295 WeakPolarHBondContact O-CG 3.21Å; E291-R295 PolarHBondContact O-N 3.31Å; E291-R295 IonicContact OE2-NH2 2.67Å; E291-R295 PolarHBondContact OE2-NH2 2.85Å
292	Q	58.2	Low	55.4	Low	134 Å²	134	74.7 Å²	74.7	63%	0.626	35%	0.354	S	S	*	.	H	α-helix	trans	-65.2	-47.3	177.5	-174.3	177.1	2.2	0	0	111	A288 E289 R294 R295 E296	A288-Q292 VanDerWaalsContact O-CB 3.29Å; A288-Q292 WeakPolarHBondContact O-CB 3.28Å; A288-Q292 PolarHBondContact O-N 3.35Å; E289-Q292 PolarHBondContact O-N 2.92Å; Q292-R294 VanDerWaalsContact C-N 3.29Å; Q292-R294 PolarHBondContact O-N 2.91Å; Q292-R295 PolarHBondContact O-N 3.43Å; Q292-E296 PolarHBondContact O-N 3.5Å
293	Q	54	Low	57.2	Low	76 Å²	76	73.3 Å²	73.3	36%	0.355	34%	0.344	S	S	.	.	H	α-helix	trans	-60.5	-40.1	174.5	-74.3	-174.1	4.1	0	0	111.7	E289 F290 E296 Y297 T660	E289-Q293 WeakPolarHBondContact O-CG 3.48Å; E289-Q293 PolarHBondContact O-N 2.91Å; F290-Q293 PolarHBondContact O-N 3.42Å; Q293-E296 PolarHBondContact O-N 2.76Å; Q293-Y297 PolarHBondContact O-N 3.35Å; Q293-T660 PolarHBondContact OE1-OG1 3.5Å; Q293-T660 VanDerWaalsContact OE1-OG1 3.05Å
294	R	57.3	Low	58.7	Low	43 Å²	43	67.2 Å²	67.2	16%	0.162	32%	0.318	C	S	.	.	H	α-helix	trans	-60.8	-47.7	174.8	173.6	-177.7	157.3	-166.1	-6.2	111.4	F290 E291 Q292 E296 Y297 L298 E586 I657	F290-R294 WeakPolarHBondContact O-CB 3.25Å; F290-R294 PolarHBondContact O-N 3.23Å; E291-R294 WeakPolarHBondContact O-CB 3.47Å; E291-R294 PolarHBondContact O-N 2.91Å; Q292-R294 VanDerWaalsContact C-N 3.29Å; Q292-R294 PolarHBondContact O-N 2.91Å; R294-E296 VanDerWaalsContact C-N 3.31Å; R294-E296 PolarHBondContact O-N 2.7Å; R294-Y297 PolarHBondContact O-N 2.89Å; R294-L298 HydrophobicContact CG-CD1 4.25Å; R294-L298 WeakPolarHBondContact O-CG 3.33Å; R294-L298 PolarHBondContact O-N 2.86Å; R294-E586 IonicContact CZ-OE2 3.65Å; R294-E586 IonicContact NH1-OE2 3.46Å; R294-E586 PolarHBondContact NH1-OE2 3.44Å; R294-E586 IonicContact NH2-OE2 3.58Å; R294-E586 PolarHBondContact NH2-OE2 3.14Å; R294-E586 VanDerWaalsContact NH2-OE2 3.11Å; R294-I657 HydrophobicContact CB-CD1 4.06Å
295	R	62.6	Low	59.8	Low	133 Å²	133	67.5 Å²	67.5	50%	0.502	31%	0.314	S	S	.	.	H	α-helix	trans	-60.8	-41.9	177.5	-73.5	178.7	-144.4	-173.9	5.3	111.4	E291 Q292 L298 S299	E291-R295 VanDerWaalsContact O-CG 3.31Å; E291-R295 WeakPolarHBondContact O-CG 3.21Å; E291-R295 PolarHBondContact O-N 3.31Å; E291-R295 IonicContact OE2-NH2 2.67Å; E291-R295 PolarHBondContact OE2-NH2 2.85Å; Q292-R295 PolarHBondContact O-N 3.43Å; R295-L298 PolarHBondContact O-N 2.97Å; R295-S299 PolarHBondContact O-N 2.84Å
296	E	65.2	Low	61	Low	76 Å²	76	69.5 Å²	69.5	36%	0.355	32%	0.321	S	S	.	.	H	α-helix	trans	-63.5	-45.8	177	-167.9	173.2	-172.4	0	0	111.4	Q292 Q293 R294 L298 S299 I300	Q292-E296 PolarHBondContact O-N 3.5Å; Q293-E296 PolarHBondContact O-N 2.76Å; R294-E296 VanDerWaalsContact C-N 3.31Å; R294-E296 PolarHBondContact O-N 2.7Å; E296-L298 PolarHBondContact O-N 3.42Å; E296-S299 PolarHBondContact O-N 2.62Å; E296-S299 PolarHBondContact O-OG 2.99Å; E296-I300 HydrophobicContact CG-CD1 4.11Å; E296-I300 WeakPolarHBondContact O-CG1 3.24Å; E296-I300 PolarHBondContact O-N 3.49Å
297	Y	64.9	Low	62.6	Low	6 Å²	6	70.1 Å²	70.1	2%	0.024	32%	0.324	C	S	.	.	H	α-helix	trans	-58.1	-46.2	175	-179.8	-93.3	0	0	0	112.6	Q293 R294 S299 I300 L301 A320 L324 V653 L656	Q293-Y297 PolarHBondContact O-N 3.35Å; R294-Y297 PolarHBondContact O-N 2.89Å; Y297-S299 VanDerWaalsContact C-N 3.32Å; Y297-S299 PolarHBondContact O-N 3.44Å; Y297-I300 PolarHBondContact O-N 3.28Å; Y297-L301 HydrophobicContact CE1-CB 4.35Å; Y297-L301 HydrophobicContact CE1-CD2 3.71Å; Y297-L301 WeakPolarHBondContact O-CB 3.27Å; Y297-L301 PolarHBondContact O-N 3.37Å; Y297-A320 HydrophobicContact CD2-CB 4.43Å; Y297-A320 HydrophobicContact CE2-CB 3.71Å; Y297-L324 HydrophobicContact CD2-CD1 3.91Å; Y297-L324 HydrophobicContact CG-CD1 4.32Å; Y297-V653 HydrophobicContact CD1-CG1 4.41Å; Y297-V653 HydrophobicContact CD1-CG2 3.86Å; Y297-V653 HydrophobicContact CE1-CG2 3.52Å; Y297-L656 HydrophobicContact CE2-CD1 3.84Å
298	L	62	Low	63.7	Low	19 Å²	19	67.3 Å²	67.3	10%	0.099	31%	0.311	C	S	.	.	H	α-helix	trans	-61.1	-40.9	178	-69	173.4	0	0	0	111.8	R294 R295 E296 L301 R302 F649	R294-L298 HydrophobicContact CG-CD1 4.25Å; R294-L298 WeakPolarHBondContact O-CG 3.33Å; R294-L298 PolarHBondContact O-N 2.86Å; R295-L298 PolarHBondContact O-N 2.97Å; E296-L298 PolarHBondContact O-N 3.42Å; L298-L301 PolarHBondContact O-N 2.69Å; L298-R302 WeakPolarHBondContact O-CB 3.41Å; L298-R302 VanDerWaalsContact O-CG 3.3Å; L298-R302 WeakPolarHBondContact O-CG 3.18Å; L298-R302 PolarHBondContact O-N 3.05Å; L298-F649 HydrophobicContact CD2-CE1 3.6Å; L298-F649 HydrophobicContact CD2-CZ 3.39Å
299	S	72	Confident	64.8	Low	58 Å²	58	70.5 Å²	70.5	41%	0.406	33%	0.33	S	S	.	.	H	α-helix	trans	-62.8	-43.9	176.5	72.7	0	0	0	0	112.4	R295 E296 Y297 R302 Q303	R295-S299 PolarHBondContact O-N 2.84Å; E296-S299 PolarHBondContact O-N 2.62Å; E296-S299 PolarHBondContact O-OG 2.99Å; Y297-S299 VanDerWaalsContact C-N 3.32Å; Y297-S299 PolarHBondContact O-N 3.44Å; S299-R302 PolarHBondContact O-N 3.15Å; S299-Q303 WeakPolarHBondContact O-CB 3.47Å; S299-Q303 PolarHBondContact O-N 3.19Å
300	I	70	Confident	65.8	Low	3 Å²	3	73.1 Å²	73.1	2%	0.015	35%	0.347	C	S	.	.	H	α-helix	trans	-66	-43.4	178.5	-68.5	168.4	0	0	0	110.5	E296 Y297 Q303 L304 A320 E323 L324	E296-I300 HydrophobicContact CG-CD1 4.11Å; E296-I300 WeakPolarHBondContact O-CG1 3.24Å; E296-I300 PolarHBondContact O-N 3.49Å; Y297-I300 PolarHBondContact O-N 3.28Å; I300-Q303 PolarHBondContact O-N 3.25Å; I300-L304 HydrophobicContact CG2-CD1 3.81Å; I300-L304 HydrophobicContact CG2-CG 4.36Å; I300-L304 WeakPolarHBondContact O-CB 3.12Å; I300-L304 VanDerWaalsContact O-CG 3.28Å; I300-L304 WeakPolarHBondContact O-CG 3.42Å; I300-L304 PolarHBondContact O-N 3.23Å; I300-A320 HydrophobicContact CG2-CB 4.32Å; I300-E323 HydrophobicContact CG2-CB 3.85Å; I300-L324 HydrophobicContact CD1-CB 4.39Å; I300-L324 HydrophobicContact CD1-CD1 4.4Å
301	L	68.8	Low	66.8	Low	2 Å²	2	70.2 Å²	70.2	1%	0.01	34%	0.338	C	S	.	.	H	α-helix	trans	-66.8	-37.8	-179.6	-172.6	62.2	0	0	0	112.3	Y297 L298 L304 R305 L316 A320 F649	Y297-L301 HydrophobicContact CE1-CB 4.35Å; Y297-L301 HydrophobicContact CE1-CD2 3.71Å; Y297-L301 WeakPolarHBondContact O-CB 3.27Å; Y297-L301 PolarHBondContact O-N 3.37Å; L298-L301 PolarHBondContact O-N 2.69Å; L301-L304 PolarHBondContact O-N 3.32Å; L301-R305 WeakPolarHBondContact O-CB 3.36Å; L301-R305 PolarHBondContact O-N 3.42Å; L301-L316 HydrophobicContact CD1-CB 4.05Å; L301-A320 HydrophobicContact CD1-CB 4.1Å; L301-F649 HydrophobicContact CD2-CD2 4.17Å; L301-F649 HydrophobicContact CD2-CE2 3.26Å; L301-F649 HydrophobicContact CD2-CZ 3.86Å
302	R	68.6	Low	67.6	Low	108 Å²	108	73.6 Å²	73.6	41%	0.408	35%	0.354	S	S	.	.	H	α-helix	trans	-63.1	-46.6	172.6	-75.6	175.6	-174.7	159.6	1.4	111.6	L298 S299 L304 R305 Q306 E583	L298-R302 WeakPolarHBondContact O-CB 3.41Å; L298-R302 VanDerWaalsContact O-CG 3.3Å; L298-R302 WeakPolarHBondContact O-CG 3.18Å; L298-R302 PolarHBondContact O-N 3.05Å; S299-R302 PolarHBondContact O-N 3.15Å; R302-L304 VanDerWaalsContact C-N 3.33Å; R302-L304 PolarHBondContact O-N 3.21Å; R302-R305 PolarHBondContact O-N 2.84Å; R302-Q306 WeakPolarHBondContact O-CG 3.21Å; R302-Q306 PolarHBondContact O-N 3.31Å; R302-E583 PolarHBondContact NH2-O 3.44Å; R302-E583 VanDerWaalsContact NH2-O 3.08Å
303	Q	74.2	Confident	68.1	Low	86 Å²	86	69.9 Å²	69.9	40%	0.402	34%	0.338	S	S	.	.	H	α-helix	trans	-58.5	-46.3	175.7	-174	-176.3	-9.8	0	0	111	S299 I300 R305 Q306 E307	S299-Q303 WeakPolarHBondContact O-CB 3.47Å; S299-Q303 PolarHBondContact O-N 3.19Å; I300-Q303 PolarHBondContact O-N 3.25Å; Q303-R305 VanDerWaalsContact C-N 3.32Å; Q303-R305 PolarHBondContact O-N 3.5Å; Q303-Q306 WeakPolarHBondContact O-CB 3.4Å; Q303-Q306 PolarHBondContact O-N 3.06Å; Q303-E307 WeakPolarHBondContact CG-OE1 3.44Å; Q303-E307 PolarHBondContact NE2-OE1 2.87Å; Q303-E307 WeakPolarHBondContact O-CG 3.27Å; Q303-E307 PolarHBondContact O-N 3.34Å
304	L	70.4	Confident	68.6	Low	12 Å²	12	68.1 Å²	68.1	6%	0.063	33%	0.334	C	S	.	.	H	α-helix	trans	-65.1	-33.6	179.2	-74.6	169.9	0	0	0	113.4	I300 L301 R302 M308 L316 K319 A320	I300-L304 HydrophobicContact CG2-CD1 3.81Å; I300-L304 HydrophobicContact CG2-CG 4.36Å; I300-L304 WeakPolarHBondContact O-CB 3.12Å; I300-L304 VanDerWaalsContact O-CG 3.28Å; I300-L304 WeakPolarHBondContact O-CG 3.42Å; I300-L304 PolarHBondContact O-N 3.23Å; L301-L304 PolarHBondContact O-N 3.32Å; R302-L304 VanDerWaalsContact C-N 3.33Å; R302-L304 PolarHBondContact O-N 3.21Å; L304-M308 WeakPolarHBondContact O-CB 3.31Å; L304-M308 PolarHBondContact O-N 3.03Å; L304-L316 HydrophobicContact CB-CD2 4.06Å; L304-K319 HydrophobicContact CD1-CB 3.77Å; L304-K319 HydrophobicContact CD2-CB 3.94Å; L304-K319 HydrophobicContact CD2-CD 4.1Å; L304-K319 HydrophobicContact CG-CB 4.48Å; L304-A320 VanDerWaalsContact CD1-CA 3.41Å; L304-A320 HydrophobicContact CD1-CB 3.71Å
305	R	67.6	Low	69.4	Low	65 Å²	65	68.2 Å²	68.2	25%	0.245	34%	0.34	C	S	.	.	H	α-helix	trans	-73.5	-32.9	174.8	-178	171.4	-79.3	154.8	-5.2	112.2	L301 R302 Q303 M308 P309 L316 E583	L301-R305 WeakPolarHBondContact O-CB 3.36Å; L301-R305 PolarHBondContact O-N 3.42Å; R302-R305 PolarHBondContact O-N 2.84Å; Q303-R305 VanDerWaalsContact C-N 3.32Å; Q303-R305 PolarHBondContact O-N 3.5Å; R305-M308 CarbonylContact O-C 3.54Å; R305-M308 PolarHBondContact O-N 3.15Å; R305-P309 WeakPolarHBondContact O-CA 3.28Å; R305-L316 HydrophobicContact CB-CD1 4.46Å; R305-E583 WeakPolarHBondContact CD-OE1 3.21Å; R305-E583 IonicContact CZ-OE1 2.79Å; R305-E583 IonicContact CZ-OE2 2.8Å; R305-E583 IonicContact NE-OE1 3.23Å; R305-E583 IonicContact NH1-OE1 2.62Å; R305-E583 PolarHBondContact NH1-OE1 3.06Å; R305-E583 IonicContact NH1-OE2 3.08Å; R305-E583 PolarHBondContact NH1-OE2 2.83Å
306	Q	71.5	Confident	69.6	Low	163 Å²	163	62 Å²	62	76%	0.762	32%	0.316	S	S	*	.	H	α-helix	trans	-66.8	-41.5	170.9	-74	178	-13.1	0	0	111.6	R302 Q303	R302-Q306 WeakPolarHBondContact O-CG 3.21Å; R302-Q306 PolarHBondContact O-N 3.31Å; Q303-Q306 WeakPolarHBondContact O-CB 3.4Å; Q303-Q306 PolarHBondContact O-N 3.06Å
307	E	75.4	Confident	69.7	Low	99 Å²	99	60.7 Å²	60.7	46%	0.463	31%	0.31	S	S	.	.	H	α-helix	trans	-69.2	-34.4	175.4	-70.7	170.9	-173.5	0	0	111.7	Q303	Q303-E307 WeakPolarHBondContact CG-OE1 3.44Å; Q303-E307 PolarHBondContact NE2-OE1 2.87Å; Q303-E307 WeakPolarHBondContact O-CG 3.27Å; Q303-E307 PolarHBondContact O-N 3.34Å
308	M	70.9	Confident	69.9	Low	51 Å²	51	62.4 Å²	62.4	25%	0.251	32%	0.318	S	S	.	.			trans	-132.7	84.7	-178.2	-55.5	-176.9	86.6	0	0	112.9	L304 R305 D310 A311 L316 K319	L304-M308 WeakPolarHBondContact O-CB 3.31Å; L304-M308 PolarHBondContact O-N 3.03Å; R305-M308 CarbonylContact O-C 3.54Å; R305-M308 PolarHBondContact O-N 3.15Å; M308-D310 PolarHBondContact O-N 3.1Å; M308-A311 HydrophobicContact CB-CB 3.71Å; M308-A311 HydrophobicContact CE-CB 3.84Å; M308-A311 HydrophobicContact SD-CB 3.99Å; M308-L316 HydrophobicContact CB-CD2 4.23Å; M308-K319 HydrophobicContact SD-CD 3.54Å; M308-K319 VanDerWaalsContact SD-CD 3.54Å; M308-K319 WeakPolarHBondContact SD-CE 3.38Å; M308-K319 PolarHBondContact SD-NZ 3.33Å
309	P	73	Confident	70.3	Confident	97 Å²	97	64.6 Å²	64.6	63%	0.63	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-35	179.4	24.5	-32.9	0	0	0	113.1	R305	R305-P309 WeakPolarHBondContact O-CA 3.28Å
310	D	71.2	Confident	70.1	Confident	162 Å²	162	61.9 Å²	61.9	87%	0.866	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	1.2	-173.8	-58.1	-34.5	0	0	0	114.1	M308	M308-D310 PolarHBondContact O-N 3.1Å
311	A	71.7	Confident	69.9	Low	20 Å²	20	62.7 Å²	62.7	17%	0.165	31%	0.313	C	S	.	.			trans	-75.2	133.8	-176	0	0	0	0	0	112	M308 L316	M308-A311 HydrophobicContact CB-CB 3.71Å; M308-A311 HydrophobicContact CE-CB 3.84Å; M308-A311 HydrophobicContact SD-CB 3.99Å; A311-L316 HydrophobicContact CB-CD1 4.41Å; A311-L316 HydrophobicContact CB-CD2 3.93Å; A311-L316 HydrophobicContact CB-CG 3.8Å
312	E	71	Confident	69.9	Low	133 Å²	133	65.2 Å²	65.2	62%	0.621	32%	0.323	S	S	*	.			trans	-53.2	143.4	171	-68.7	-174.4	172.6	0	0	111.6	S314 T315 L316	E312-S314 PolarHBondContact O-N 3.44Å; E312-S314 PolarHBondContact OE2-OG 2.92Å; E312-T315 HydrophobicContact CB-CG2 4.44Å; E312-T315 PolarHBondContact N-OG1 3.33Å; E312-T315 PolarHBondContact O-N 3.32Å; E312-T315 PolarHBondContact O-OG1 3.5Å; E312-L316 PolarHBondContact O-N 3.37Å
313	L	67	Low	70	Confident	55 Å²	55	62.2 Å²	62.2	29%	0.288	31%	0.314	S	S	.	.	H	α-helix	trans	-52.8	-33.1	177.1	-178.6	63.8	0	0	0	112.4	Q317	L313-Q317 HydrophobicContact CD1-CG 4.47Å; L313-Q317 HydrophobicContact CG-CG 4.47Å; L313-Q317 WeakPolarHBondContact O-CB 3.08Å; L313-Q317 WeakPolarHBondContact O-CG 3.5Å; L313-Q317 PolarHBondContact O-N 3.29Å
314	S	66.1	Low	69.6	Low	40 Å²	40	59 Å²	59	28%	0.28	30%	0.299	S	S	.	.	H	α-helix	trans	-67.1	-36.1	178.2	82.4	0	0	0	0	113.4	E312 E318	E312-S314 PolarHBondContact O-N 3.44Å; E312-S314 PolarHBondContact OE2-OG 2.92Å; S314-E318 PolarHBondContact O-N 2.94Å; S314-E318 VanDerWaalsContact O-N 3.1Å
315	T	72.8	Confident	69.3	Low	45 Å²	45	59 Å²	59	28%	0.276	30%	0.299	S	S	.	.	H	α-helix	trans	-79.5	-36.8	178.4	58.1	0	0	0	0	111	E312 E318 K319	E312-T315 HydrophobicContact CB-CG2 4.44Å; E312-T315 PolarHBondContact N-OG1 3.33Å; E312-T315 PolarHBondContact O-N 3.32Å; E312-T315 PolarHBondContact O-OG1 3.5Å; T315-E318 WeakPolarHBondContact O-CB 3.48Å; T315-E318 PolarHBondContact O-N 2.83Å; T315-K319 PolarHBondContact O-N 3.08Å
316	L	67.9	Low	69.2	Low	2 Å²	2	60.7 Å²	60.7	1%	0.01	31%	0.308	C	S	.	.	H	α-helix	trans	-60.2	-44.8	170.5	-73.6	173.9	0	0	0	111.5	L301 L304 R305 M308 A311 E312 K319 A320	L301-L316 HydrophobicContact CD1-CB 4.05Å; L304-L316 HydrophobicContact CB-CD2 4.06Å; R305-L316 HydrophobicContact CB-CD1 4.46Å; M308-L316 HydrophobicContact CB-CD2 4.23Å; A311-L316 HydrophobicContact CB-CD1 4.41Å; A311-L316 HydrophobicContact CB-CD2 3.93Å; A311-L316 HydrophobicContact CB-CG 3.8Å; E312-L316 PolarHBondContact O-N 3.37Å; L316-K319 PolarHBondContact O-N 3.05Å; L316-A320 VanDerWaalsContact O-CB 3.3Å; L316-A320 WeakPolarHBondContact O-CB 3.35Å; L316-A320 PolarHBondContact O-N 2.77Å
317	Q	66.9	Low	68.7	Low	48 Å²	48	58.8 Å²	58.8	22%	0.224	29%	0.294	C	S	.	.	H	α-helix	trans	-57.7	-49.8	173.2	-77.8	171	6.3	0	0	110.6	L313 K319 A320 T321	L313-Q317 HydrophobicContact CD1-CG 4.47Å; L313-Q317 HydrophobicContact CG-CG 4.47Å; L313-Q317 WeakPolarHBondContact O-CB 3.08Å; L313-Q317 WeakPolarHBondContact O-CG 3.5Å; L313-Q317 PolarHBondContact O-N 3.29Å; Q317-K319 PolarHBondContact O-N 3.06Å; Q317-A320 PolarHBondContact O-N 3.09Å; Q317-T321 WeakPolarHBondContact O-CG2 3.28Å; Q317-T321 PolarHBondContact O-N 3.4Å
318	E	68.3	Low	68	Low	42 Å²	42	55.3 Å²	55.3	20%	0.196	28%	0.283	C	S	.	.	H	α-helix	trans	-55.6	-49.7	178	-175.3	171.8	175.1	0	0	112.2	S314 T315 A320 T321 Y322 V354 K355 S358	S314-E318 PolarHBondContact O-N 2.94Å; S314-E318 VanDerWaalsContact O-N 3.1Å; T315-E318 WeakPolarHBondContact O-CB 3.48Å; T315-E318 PolarHBondContact O-N 2.83Å; E318-A320 PolarHBondContact O-N 2.88Å; E318-T321 PolarHBondContact O-N 2.69Å; E318-T321 PolarHBondContact O-OG1 3.45Å; E318-Y322 PolarHBondContact O-N 3.27Å; E318-V354 HydrophobicContact CG-CG1 3.7Å; E318-V354 WeakPolarHBondContact O-CG1 3.49Å; E318-K355 WeakPolarHBondContact OE1-CG 3.42Å; E318-S358 WeakPolarHBondContact CG-OG 3.42Å
319	K	70.5	Confident	67.1	Low	66 Å²	66	62.8 Å²	62.8	29%	0.287	31%	0.314	S	S	.	.	H	α-helix	trans	-61.8	-41.5	176.1	-73.9	-167.8	175.9	-162.9	0	112.4	L304 M308 T315 L316 Q317 T321 Y322 E323 E690	L304-K319 HydrophobicContact CD1-CB 3.77Å; L304-K319 HydrophobicContact CD2-CB 3.94Å; L304-K319 HydrophobicContact CD2-CD 4.1Å; L304-K319 HydrophobicContact CG-CB 4.48Å; M308-K319 HydrophobicContact SD-CD 3.54Å; M308-K319 VanDerWaalsContact SD-CD 3.54Å; M308-K319 WeakPolarHBondContact SD-CE 3.38Å; M308-K319 PolarHBondContact SD-NZ 3.33Å; T315-K319 PolarHBondContact O-N 3.08Å; L316-K319 PolarHBondContact O-N 3.05Å; Q317-K319 PolarHBondContact O-N 3.06Å; K319-T321 VanDerWaalsContact C-N 3.35Å; K319-T321 PolarHBondContact O-N 3.48Å; K319-Y322 WeakPolarHBondContact O-CB 3.32Å; K319-Y322 PolarHBondContact O-N 3.43Å; K319-E323 PolarHBondContact O-N 2.9Å; K319-E690 IonicContact NZ-OE1 2.9Å; K319-E690 PolarHBondContact NZ-OE1 3.09Å
320	A	68.9	Low	66.5	Low	0 Å²	0	60.4 Å²	60.4	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-64.1	-41.1	177.8	0	0	0	0	0	111.4	Y297 I300 L301 L304 L316 Q317 E318 Y322 E323 L324	Y297-A320 HydrophobicContact CD2-CB 4.43Å; Y297-A320 HydrophobicContact CE2-CB 3.71Å; I300-A320 HydrophobicContact CG2-CB 4.32Å; L301-A320 HydrophobicContact CD1-CB 4.1Å; L304-A320 VanDerWaalsContact CD1-CA 3.41Å; L304-A320 HydrophobicContact CD1-CB 3.71Å; L316-A320 VanDerWaalsContact O-CB 3.3Å; L316-A320 WeakPolarHBondContact O-CB 3.35Å; L316-A320 PolarHBondContact O-N 2.77Å; Q317-A320 PolarHBondContact O-N 3.09Å; E318-A320 PolarHBondContact O-N 2.88Å; A320-Y322 VanDerWaalsContact C-N 3.31Å; A320-Y322 PolarHBondContact O-N 2.86Å; A320-E323 PolarHBondContact O-N 3.32Å; A320-L324 VanDerWaalsContact O-CB 3.25Å; A320-L324 WeakPolarHBondContact O-CB 3.42Å; A320-L324 PolarHBondContact O-N 3.19Å
321	T	65.1	Low	65.9	Low	21 Å²	21	53.8 Å²	53.8	13%	0.129	26%	0.26	C	S	.	.	H	α-helix	trans	-63.6	-38	174.6	69.5	0	0	0	0	111.8	Q317 E318 K319 T325 V354 L656	Q317-T321 WeakPolarHBondContact O-CG2 3.28Å; Q317-T321 PolarHBondContact O-N 3.4Å; E318-T321 PolarHBondContact O-N 2.69Å; E318-T321 PolarHBondContact O-OG1 3.45Å; K319-T321 VanDerWaalsContact C-N 3.35Å; K319-T321 PolarHBondContact O-N 3.48Å; T321-T325 VanDerWaalsContact O-CB 3.23Å; T321-T325 WeakPolarHBondContact O-CB 3.05Å; T321-T325 PolarHBondContact O-N 3.36Å; T321-T325 PolarHBondContact O-OG1 3.11Å; T321-V354 WeakPolarHBondContact OG1-CG1 3.17Å; T321-L656 HydrophobicContact CG2-CD1 3.48Å; T321-L656 VanDerWaalsContact CG2-CD1 3.48Å; T321-L656 HydrophobicContact CG2-CD2 3.29Å; T321-L656 HydrophobicContact CG2-CG 3.91Å
322	Y	69.2	Low	65.4	Low	55 Å²	55	54.4 Å²	54.4	22%	0.216	26%	0.258	C	S	.	.	H	α-helix	trans	-64.2	-51.5	176.4	176.2	-105.1	0	0	0	112	E318 K319 A320 L324 T325 K326 V350 E351	E318-Y322 PolarHBondContact O-N 3.27Å; K319-Y322 WeakPolarHBondContact O-CB 3.32Å; K319-Y322 PolarHBondContact O-N 3.43Å; A320-Y322 VanDerWaalsContact C-N 3.31Å; A320-Y322 PolarHBondContact O-N 2.86Å; Y322-L324 VanDerWaalsContact C-N 3.35Å; Y322-L324 PolarHBondContact O-N 3.43Å; Y322-T325 PolarHBondContact O-N 3.24Å; Y322-K326 HydrophobicContact CE1-CD 4.22Å; Y322-K326 VanDerWaalsContact O-CB 3.23Å; Y322-K326 WeakPolarHBondContact O-CB 3.28Å; Y322-K326 PolarHBondContact O-N 2.89Å; Y322-V350 HydrophobicContact CD2-CG1 3.76Å; Y322-V350 HydrophobicContact CE2-CB 4.18Å; Y322-V350 HydrophobicContact CE2-CG1 3.82Å; Y322-E351 HydrophobicContact CD2-CB 4.19Å; Y322-E351 HydrophobicContact CD2-CG 4.38Å; Y322-E351 HydrophobicContact CE2-CB 3.66Å; Y322-E351 HydrophobicContact CE2-CG 4.04Å
323	E	70	Confident	64.6	Low	45 Å²	45	48 Å²	48	21%	0.21	23%	0.228	C	C	.	.	H	α-helix	trans	-62.8	-41.3	178.7	-79.1	-59.8	140.1	0	0	111.8	I300 K319 A320 K326 R327	I300-E323 HydrophobicContact CG2-CB 3.85Å; K319-E323 PolarHBondContact O-N 2.9Å; A320-E323 PolarHBondContact O-N 3.32Å; E323-K326 WeakPolarHBondContact O-CB 3.18Å; E323-K326 PolarHBondContact O-N 2.76Å; E323-K326 IonicContact OE1-NZ 3.63Å; E323-K326 PolarHBondContact OE1-NZ 3.46Å; E323-R327 WeakPolarHBondContact O-CG 3.02Å; E323-R327 PolarHBondContact O-N 2.65Å
324	L	66.5	Low	64.6	Low	18 Å²	18	45.5 Å²	45.5	9%	0.094	22%	0.215	C	C	.	.	H	α-helix	trans	-68.2	-39.5	177.9	-161.9	135.4	0	0	0	112.1	Y297 I300 A320 Y322 K326 R327 A328 T660	Y297-L324 HydrophobicContact CD2-CD1 3.91Å; Y297-L324 HydrophobicContact CG-CD1 4.32Å; I300-L324 HydrophobicContact CD1-CB 4.39Å; I300-L324 HydrophobicContact CD1-CD1 4.4Å; A320-L324 VanDerWaalsContact O-CB 3.25Å; A320-L324 WeakPolarHBondContact O-CB 3.42Å; A320-L324 PolarHBondContact O-N 3.19Å; Y322-L324 VanDerWaalsContact C-N 3.35Å; Y322-L324 PolarHBondContact O-N 3.43Å; L324-K326 VanDerWaalsContact C-N 3.32Å; L324-K326 PolarHBondContact O-N 3.41Å; L324-R327 PolarHBondContact O-N 3.4Å; L324-A328 WeakPolarHBondContact O-CB 3.44Å; L324-A328 PolarHBondContact O-N 3Å; L324-T660 HydrophobicContact CD2-CG2 3.31Å
325	T	63.7	Low	64.3	Low	12 Å²	12	45.3 Å²	45.3	7%	0.074	21%	0.208	C	C	.	.	H	α-helix	trans	-68.5	-32.2	174.7	-53.9	0	0	0	0	111.8	T321 Y322 V350 V662	T321-T325 VanDerWaalsContact O-CB 3.23Å; T321-T325 WeakPolarHBondContact O-CB 3.05Å; T321-T325 PolarHBondContact O-N 3.36Å; T321-T325 PolarHBondContact O-OG1 3.11Å; Y322-T325 PolarHBondContact O-N 3.24Å; T325-V350 HydrophobicContact CG2-CG1 3.66Å; T325-V662 HydrophobicContact CG2-CG1 4.24Å; T325-V662 HydrophobicContact CG2-CG2 4.2Å
326	K	65.1	Low	63.7	Low	100 Å²	100	43.6 Å²	43.6	44%	0.435	20%	0.197	S	C	.	.	H	α-helix	trans	-69.2	-40	176.1	-179.3	-177.7	170.9	-168.2	0	111.8	Y322 E323 L324 K330	Y322-K326 HydrophobicContact CE1-CD 4.22Å; Y322-K326 VanDerWaalsContact O-CB 3.23Å; Y322-K326 WeakPolarHBondContact O-CB 3.28Å; Y322-K326 PolarHBondContact O-N 2.89Å; E323-K326 WeakPolarHBondContact O-CB 3.18Å; E323-K326 PolarHBondContact O-N 2.76Å; E323-K326 IonicContact OE1-NZ 3.63Å; E323-K326 PolarHBondContact OE1-NZ 3.46Å; L324-K326 VanDerWaalsContact C-N 3.32Å; L324-K326 PolarHBondContact O-N 3.41Å; K326-K330 WeakPolarHBondContact O-CE 3.39Å; K326-K330 PolarHBondContact O-NZ 3.48Å
327	R	61.7	Low	63.5	Low	124 Å²	124	44 Å²	44	47%	0.468	20%	0.199	S	C	.	.	H	α-helix	trans	-78.4	-28	177	-69.3	179.9	-172.3	-165.8	2.8	113.4	E323 L324	E323-R327 WeakPolarHBondContact O-CG 3.02Å; E323-R327 PolarHBondContact O-N 2.65Å; L324-R327 PolarHBondContact O-N 3.4Å
328	A	60.3	Low	63.4	Low	26 Å²	26	42.1 Å²	42.1	22%	0.215	19%	0.19	C	C	.	.	S	Bend	trans	-61.6	149.6	-179.6	0	0	0	0	0	112.5	L324 K330 V662	L324-A328 WeakPolarHBondContact O-CB 3.44Å; L324-A328 PolarHBondContact O-N 3Å; A328-K330 PolarHBondContact O-N 3.18Å; A328-V662 HydrophobicContact CB-CG2 3.26Å
329	K	52.9	Low	62.9	Low	208 Å²	208	40.4 Å²	40.4	90%	0.904	18%	0.184	S	C	*	.			trans	-62.7	112	179.8	-66.6	-178.6	-175.9	172.7	0	109.5
330	K	60.6	Low	62.4	Low	46 Å²	46	38.2 Å²	38.2	20%	0.2	18%	0.176	C	C	.	.			trans	-83.6	147.4	176.9	-70.4	141.7	173.5	164.6	0	110.2	K326 A328 F334 Y335 V662	K326-K330 WeakPolarHBondContact O-CE 3.39Å; K326-K330 PolarHBondContact O-NZ 3.48Å; A328-K330 PolarHBondContact O-N 3.18Å; K330-F334 HydrophobicContact CB-CB 4.43Å; K330-F334 HydrophobicContact CB-CD1 3.56Å; K330-F334 HydrophobicContact CB-CE1 4.13Å; K330-F334 HydrophobicContact CB-CG 4.13Å; K330-F334 HydrophobicContact CD-CD1 3.8Å; K330-F334 HydrophobicContact CD-CE1 3.42Å; K330-F334 VanDerWaalsContact CD-CE1 3.42Å; K330-F334 HydrophobicContact CD-CZ 4.06Å; K330-F334 HydrophobicContact CG-CD1 3.61Å; K330-F334 HydrophobicContact CG-CE1 3.71Å; K330-F334 HydrophobicContact CG-CG 4.18Å; K330-F334 HydrophobicContact CG-CZ 4.28Å; K330-Y335 HydrophobicContact CB-CD1 4.46Å; K330-Y335 HydrophobicContact CB-CE1 3.87Å; K330-Y335 HydrophobicContact CB-CE2 3.82Å; K330-Y335 HydrophobicContact CD-CD1 4.47Å; K330-Y335 HydrophobicContact CD-CE1 3.58Å; K330-Y335 HydrophobicContact CG-CE1 4.33Å; K330-V662 HydrophobicContact CG-CG1 4.13Å
331	S	58.1	Low	62.4	Low	24 Å²	24	39.5 Å²	39.5	17%	0.168	18%	0.181	C	C	.	.			trans	-73.9	154.1	173.2	162.9	0	0	0	0	110.3	E84 A333 F334 Y335	E84-S331 WeakPolarHBondContact OE1-CB 3.46Å; E84-S331 PolarHBondContact OE1-OG 3.24Å; S331-A333 VanDerWaalsContact C-N 3.28Å; S331-A333 PolarHBondContact O-N 3.28Å; S331-F334 WeakPolarHBondContact O-CB 2.97Å; S331-F334 PolarHBondContact O-N 2.93Å; S331-F334 VanDerWaalsContact O-N 3.12Å; S331-Y335 WeakPolarHBondContact O-CD2 3.17Å
332	R	60.5	Low	62.4	Low	32 Å²	32	43.3 Å²	43.3	12%	0.121	19%	0.193	C	C	.	.	H	α-helix	trans	-61	-36	-178.5	-71.7	176.3	56.8	167.5	-6.9	112.7	N116 Y335 R336 S791	N116-R332 VanDerWaalsContact CG-NH1 3.31Å; N116-R332 PolarHBondContact ND2-NH1 2.88Å; N116-R332 PolarHBondContact OD1-NE 3.35Å; N116-R332 PolarHBondContact OD1-NH1 3.26Å; R332-Y335 PolarHBondContact O-N 3Å; R332-R336 PolarHBondContact O-N 3.22Å; R332-S791 VanDerWaalsContact CZ-CA 3.44Å; R332-S791 VanDerWaalsContact CZ-OG 3.24Å; R332-S791 PolarHBondContact NE-OG 2.86Å; R332-S791 PolarHBondContact NH1-OG 3.5Å; R332-S791 PolarHBondContact NH2-O 2.9Å
333	A	55.5	Low	62	Low	0 Å²	0	45 Å²	45	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-76.8	-22.2	177.8	0	0	0	0	0	113.3	E84 S331 Y335 R336 V337	E84-A333 HydrophobicContact CB-CB 3.77Å; E84-A333 VanDerWaalsContact CD-CB 3.5Å; E84-A333 HydrophobicContact CG-CB 3.32Å; S331-A333 VanDerWaalsContact C-N 3.28Å; S331-A333 PolarHBondContact O-N 3.28Å; A333-Y335 PolarHBondContact O-N 3.5Å; A333-R336 WeakPolarHBondContact O-CB 3.46Å; A333-R336 PolarHBondContact O-N 3.47Å; A333-R336 VanDerWaalsContact O-N 3.13Å; A333-V337 WeakPolarHBondContact O-CG2 3.46Å; A333-V337 PolarHBondContact O-N 2.94Å
334	F	65.8	Low	61.8	Low	1 Å²	1	43.5 Å²	43.5	0%	0.004	20%	0.198	C	C	.	.	H	α-helix	trans	-55.6	-45.2	169.1	160.6	-87.8	0	0	0	111.5	E84 K330 S331 R336 V337 Q338 I349 V350 L666	E84-F334 PolarHBondContact OE2-N 3.49Å; K330-F334 HydrophobicContact CB-CB 4.43Å; K330-F334 HydrophobicContact CB-CD1 3.56Å; K330-F334 HydrophobicContact CB-CE1 4.13Å; K330-F334 HydrophobicContact CB-CG 4.13Å; K330-F334 HydrophobicContact CD-CD1 3.8Å; K330-F334 HydrophobicContact CD-CE1 3.42Å; K330-F334 VanDerWaalsContact CD-CE1 3.42Å; K330-F334 HydrophobicContact CD-CZ 4.06Å; K330-F334 HydrophobicContact CG-CD1 3.61Å; K330-F334 HydrophobicContact CG-CE1 3.71Å; K330-F334 HydrophobicContact CG-CG 4.18Å; K330-F334 HydrophobicContact CG-CZ 4.28Å; S331-F334 WeakPolarHBondContact O-CB 2.97Å; S331-F334 PolarHBondContact O-N 2.93Å; S331-F334 VanDerWaalsContact O-N 3.12Å; F334-R336 VanDerWaalsContact C-N 3.32Å; F334-R336 PolarHBondContact O-N 2.99Å; F334-V337 PolarHBondContact O-N 3.05Å; F334-Q338 WeakPolarHBondContact O-CB 3.38Å; F334-Q338 PolarHBondContact O-N 3.5Å; F334-I349 HydrophobicContact CD2-CB 4.39Å; F334-I349 HydrophobicContact CD2-CD1 4.32Å; F334-I349 HydrophobicContact CD2-CG2 4.11Å; F334-I349 HydrophobicContact CE2-CB 3.78Å; F334-I349 HydrophobicContact CE2-CD1 4.37Å; F334-I349 HydrophobicContact CE2-CG2 3.85Å; F334-V350 HydrophobicContact CE2-CG2 3.54Å; F334-V350 HydrophobicContact CZ-CG2 3.43Å; F334-V350 VanDerWaalsContact CZ-CG2 3.43Å; F334-L666 HydrophobicContact CB-CD1 3.71Å; F334-L666 HydrophobicContact CB-CD2 3.47Å; F334-L666 VanDerWaalsContact CB-CD2 3.47Å; F334-L666 HydrophobicContact CB-CG 4.1Å; F334-L666 HydrophobicContact CD2-CD1 3.35Å; F334-L666 HydrophobicContact CD2-CD2 3.54Å; F334-L666 HydrophobicContact CD2-CG 3.55Å; F334-L666 HydrophobicContact CE2-CD1 4.31Å; F334-L666 HydrophobicContact CG-CD1 3.85Å; F334-L666 HydrophobicContact CG-CD2 3.96Å; F334-L666 HydrophobicContact CG-CG 4.27Å
335	Y	60.1	Low	61.5	Low	37 Å²	37	42.8 Å²	42.8	15%	0.145	20%	0.196	C	C	.	.	H	α-helix	trans	-64.2	-40.1	179.9	-66.2	-50.8	0	0	0	111.4	K330 S331 R332 A333 Q338 A339 V781 Q785	K330-Y335 HydrophobicContact CB-CD1 4.46Å; K330-Y335 HydrophobicContact CB-CE1 3.87Å; K330-Y335 HydrophobicContact CB-CE2 3.82Å; K330-Y335 HydrophobicContact CD-CD1 4.47Å; K330-Y335 HydrophobicContact CD-CE1 3.58Å; K330-Y335 HydrophobicContact CG-CE1 4.33Å; S331-Y335 WeakPolarHBondContact O-CD2 3.17Å; R332-Y335 PolarHBondContact O-N 3Å; A333-Y335 PolarHBondContact O-N 3.5Å; Y335-Q338 PolarHBondContact O-N 3.47Å; Y335-A339 PolarHBondContact O-N 3.43Å; Y335-V781 VanDerWaalsContact O-CG1 3.31Å; Y335-V781 WeakPolarHBondContact O-CG1 3.37Å; Y335-Q785 HydrophobicContact CD1-CB 4.07Å; Y335-Q785 HydrophobicContact CD1-CG 4.3Å; Y335-Q785 HydrophobicContact CE1-CB 3.96Å; Y335-Q785 HydrophobicContact CE1-CG 4.4Å; Y335-Q785 HydrophobicContact CG-CB 4.39Å
336	R	60.4	Low	61.5	Low	9 Å²	9	42.9 Å²	42.9	3%	0.034	20%	0.196	C	C	.	.	H	α-helix	trans	-61.2	-50.3	174.6	-61.2	-179	178	-165.4	-8.5	111.7	M120 R332 A333 F334 Q338 A339 T340 A778 N795	M120-R336 PolarHBondContact O-NH1 3.42Å; M120-R336 VanDerWaalsContact O-NH1 3.13Å; R332-R336 PolarHBondContact O-N 3.22Å; A333-R336 WeakPolarHBondContact O-CB 3.46Å; A333-R336 PolarHBondContact O-N 3.47Å; A333-R336 VanDerWaalsContact O-N 3.13Å; F334-R336 VanDerWaalsContact C-N 3.32Å; F334-R336 PolarHBondContact O-N 2.99Å; R336-Q338 VanDerWaalsContact C-N 3.26Å; R336-Q338 PolarHBondContact O-N 3.3Å; R336-A339 WeakPolarHBondContact O-CB 3.46Å; R336-A339 PolarHBondContact O-N 3.13Å; R336-A339 VanDerWaalsContact O-N 3.1Å; R336-T340 PolarHBondContact O-N 2.82Å; R336-T340 PolarHBondContact O-OG1 2.86Å; R336-A778 HydrophobicContact CG-CB 3.91Å; R336-N795 VanDerWaalsContact NH2-CG 3.26Å; R336-N795 PolarHBondContact NH2-OD1 2.81Å
337	V	63	Low	61.4	Low	10 Å²	10	38.2 Å²	38.2	6%	0.061	18%	0.175	C	C	.	.	H	α-helix	trans	-63.5	-36.2	-179.8	-179.6	0	0	0	0	111.3	D77 A333 F334 A339 R341 I349	D77-V337 VanDerWaalsContact OD1-CA 3.29Å; D77-V337 WeakPolarHBondContact OD1-CA 3.01Å; A333-V337 WeakPolarHBondContact O-CG2 3.46Å; A333-V337 PolarHBondContact O-N 2.94Å; F334-V337 PolarHBondContact O-N 3.05Å; V337-A339 VanDerWaalsContact C-N 3.3Å; V337-A339 PolarHBondContact O-N 2.76Å; V337-R341 WeakPolarHBondContact O-CB 3.31Å; V337-R341 VanDerWaalsContact O-CG 3.28Å; V337-R341 WeakPolarHBondContact O-CG 3.42Å; V337-R341 PolarHBondContact O-N 3.27Å; V337-R341 VanDerWaalsContact O-N 3.13Å; V337-I349 HydrophobicContact CB-CD1 3.9Å; V337-I349 HydrophobicContact CG1-CD1 3.64Å
338	Q	64.8	Low	61.6	Low	8 Å²	8	33.2 Å²	33.2	4%	0.037	16%	0.158	C	C	.	.	H	α-helix	trans	-67	-34.1	177.4	-166.2	-179.2	34	0	0	111.9	F334 Y335 R336 R342 N348 I349	F334-Q338 WeakPolarHBondContact O-CB 3.38Å; F334-Q338 PolarHBondContact O-N 3.5Å; Y335-Q338 PolarHBondContact O-N 3.47Å; R336-Q338 VanDerWaalsContact C-N 3.26Å; R336-Q338 PolarHBondContact O-N 3.3Å; Q338-R342 WeakPolarHBondContact O-CG 3.32Å; Q338-R342 PolarHBondContact O-N 3.24Å; Q338-R342 VanDerWaalsContact O-N 3.15Å; Q338-N348 PolarHBondContact NE2-OD1 3.09Å; Q338-I349 HydrophobicContact CB-CD1 3.8Å; Q338-I349 HydrophobicContact CB-CG1 4.29Å; Q338-I349 HydrophobicContact CG-CD1 4.43Å; Q338-I349 HydrophobicContact CG-CG1 4.38Å
339	A	57.7	Low	61.8	Low	7 Å²	7	32.3 Å²	32.3	6%	0.058	15%	0.15	C	C	.	.	H	α-helix	trans	-62.1	-56.1	177.2	0	0	0	0	0	111.7	Y335 R336 V337 R341 R342 L343 F777 V781	Y335-A339 PolarHBondContact O-N 3.43Å; R336-A339 WeakPolarHBondContact O-CB 3.46Å; R336-A339 PolarHBondContact O-N 3.13Å; R336-A339 VanDerWaalsContact O-N 3.1Å; V337-A339 VanDerWaalsContact C-N 3.3Å; V337-A339 PolarHBondContact O-N 2.76Å; A339-R341 VanDerWaalsContact C-N 3.29Å; A339-R341 PolarHBondContact O-N 3.41Å; A339-R342 PolarHBondContact O-N 2.98Å; A339-L343 PolarHBondContact O-N 3.39Å; A339-F777 HydrophobicContact CB-CB 4.45Å; A339-V781 HydrophobicContact CB-CB 3.83Å; A339-V781 HydrophobicContact CB-CG1 4.11Å; A339-V781 HydrophobicContact CB-CG2 3.23Å
340	T	61	Low	62.3	Low	19 Å²	19	22.6 Å²	22.6	12%	0.117	11%	0.108	C	C	.	.	H	α-helix	trans	-58.2	-46.6	-178.6	-37.5	0	0	0	0	109.5	D77 R336 R342 L343 I344	D77-T340 HydrophobicContact CB-CG2 3.7Å; D77-T340 WeakPolarHBondContact OD1-CB 3.46Å; D77-T340 PolarHBondContact OD1-OG1 3.4Å; R336-T340 PolarHBondContact O-N 2.82Å; R336-T340 PolarHBondContact O-OG1 2.86Å; T340-R342 PolarHBondContact O-N 2.9Å; T340-L343 PolarHBondContact O-N 2.73Å; T340-I344 HydrophobicContact CG2-CD1 3.48Å; T340-I344 VanDerWaalsContact CG2-CD1 3.48Å; T340-I344 HydrophobicContact CG2-CG1 4.36Å; T340-I344 WeakPolarHBondContact O-CD1 3.4Å; T340-I344 WeakPolarHBondContact O-CG1 3.28Å; T340-I344 PolarHBondContact O-N 2.74Å; T340-I344 VanDerWaalsContact O-N 3.14Å
341	R	68.2	Low	62.5	Low	27 Å²	27	22 Å²	22	10%	0.102	11%	0.105	C	C	.	.	H	α-helix	trans	-58.8	-39.4	178.7	-77.9	-176.8	151.6	148.4	-1.7	114.4	V337 A339 L343 I344 G345 D346	V337-R341 WeakPolarHBondContact O-CB 3.31Å; V337-R341 VanDerWaalsContact O-CG 3.28Å; V337-R341 WeakPolarHBondContact O-CG 3.42Å; V337-R341 PolarHBondContact O-N 3.27Å; V337-R341 VanDerWaalsContact O-N 3.13Å; A339-R341 VanDerWaalsContact C-N 3.29Å; A339-R341 PolarHBondContact O-N 3.41Å; R341-L343 VanDerWaalsContact C-N 3.3Å; R341-L343 PolarHBondContact O-N 2.92Å; R341-I344 CarbonylContact O-C 3.56Å; R341-I344 PolarHBondContact O-N 3.23Å; R341-G345 PolarHBondContact O-N 3.39Å; R341-D346 HydrophobicContact CB-CB 3.99Å; R341-D346 WeakPolarHBondContact CD-OD2 3.05Å; R341-D346 HydrophobicContact CG-CB 3.95Å; R341-D346 IonicContact CZ-OD2 2.96Å; R341-D346 IonicContact NE-OD2 3.68Å; R341-D346 PolarHBondContact NE-OD2 3Å; R341-D346 IonicContact NH2-OD2 3.16Å; R341-D346 PolarHBondContact O-N 2.98Å
342	R	64.7	Low	62.8	Low	101 Å²	101	21.8 Å²	21.8	38%	0.381	10%	0.102	S	C	.	.	H	α-helix	trans	-63.2	-35.7	178.7	-79.6	175.6	172.3	-178.1	-4.7	112.7	Q338 A339 T340 G345 N686	Q338-R342 WeakPolarHBondContact O-CG 3.32Å; Q338-R342 PolarHBondContact O-N 3.24Å; Q338-R342 VanDerWaalsContact O-N 3.15Å; A339-R342 PolarHBondContact O-N 2.98Å; T340-R342 PolarHBondContact O-N 2.9Å; R342-G345 PolarHBondContact O-N 3.11Å; R342-N686 PolarHBondContact NH2-OD1 2.9Å; R342-N686 VanDerWaalsContact NH2-OD1 3.15Å
343	L	60.6	Low	62.9	Low	91 Å²	91	20.8 Å²	20.8	48%	0.476	10%	0.099	S	C	.	.	H	α-helix	trans	-73.5	-41.1	177.6	-66.5	164.7	0	0	0	111.9	A339 T340 R341 G345 V704 F777	A339-L343 PolarHBondContact O-N 3.39Å; T340-L343 PolarHBondContact O-N 2.73Å; R341-L343 VanDerWaalsContact C-N 3.3Å; R341-L343 PolarHBondContact O-N 2.92Å; L343-G345 PolarHBondContact O-N 3.39Å; L343-V704 WeakPolarHBondContact O-CG1 3.34Å; L343-F777 HydrophobicContact CD1-CD1 3.64Å; L343-F777 HydrophobicContact CD1-CD2 3.99Å; L343-F777 HydrophobicContact CD1-CE1 3.24Å; L343-F777 HydrophobicContact CD1-CE2 3.55Å; L343-F777 HydrophobicContact CD1-CG 4.03Å; L343-F777 HydrophobicContact CD1-CZ 3.19Å; L343-F777 HydrophobicContact CG-CE1 4.44Å
344	I	67.1	Low	63.3	Low	13 Å²	13	21 Å²	21	7%	0.067	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-1.1	179.7	-44.4	159.9	0	0	0	111.1	I74 T340 R341 T708 K712	I74-I344 HydrophobicContact CG1-CD1 3.72Å; I74-I344 HydrophobicContact CG1-CG1 4.3Å; T340-I344 HydrophobicContact CG2-CD1 3.48Å; T340-I344 VanDerWaalsContact CG2-CD1 3.48Å; T340-I344 HydrophobicContact CG2-CG1 4.36Å; T340-I344 WeakPolarHBondContact O-CD1 3.4Å; T340-I344 WeakPolarHBondContact O-CG1 3.28Å; T340-I344 PolarHBondContact O-N 2.74Å; T340-I344 VanDerWaalsContact O-N 3.14Å; R341-I344 CarbonylContact O-C 3.56Å; R341-I344 PolarHBondContact O-N 3.23Å; I344-T708 HydrophobicContact CG2-CG2 3.84Å; I344-T708 WeakPolarHBondContact CG2-OG1 3.04Å; I344-K712 HydrophobicContact CG2-CD 4.28Å; I344-K712 HydrophobicContact CG2-CG 4.4Å; I344-K712 PolarHBondContact O-NZ 3.01Å
345	G	59.7	Low	63.2	Low	4 Å²	4	26 Å²	26	4%	0.041	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.2	24.1	178.5	0	0	0	0	0	115.2	R341 R342 L343 G347 M681	R341-G345 PolarHBondContact O-N 3.39Å; R342-G345 PolarHBondContact O-N 3.11Å; L343-G345 PolarHBondContact O-N 3.39Å; G345-G347 VanDerWaalsContact C-N 3.26Å; G345-G347 PolarHBondContact O-N 3.42Å; G345-M681 VanDerWaalsContact O-CG 3.25Å; G345-M681 WeakPolarHBondContact O-CG 3.3Å
346	D	63.3	Low	63.3	Low	14 Å²	14	26.5 Å²	26.5	8%	0.075	13%	0.126	C	C	.	.			trans	-86.2	10.5	178.7	-168.8	26.3	0	0	0	113.2	R341 K352	R341-D346 HydrophobicContact CB-CB 3.99Å; R341-D346 WeakPolarHBondContact CD-OD2 3.05Å; R341-D346 HydrophobicContact CG-CB 3.95Å; R341-D346 IonicContact CZ-OD2 2.96Å; R341-D346 IonicContact NE-OD2 3.68Å; R341-D346 PolarHBondContact NE-OD2 3Å; R341-D346 IonicContact NH2-OD2 3.16Å; R341-D346 PolarHBondContact O-N 2.98Å; D346-K352 IonicContact OD1-NZ 3.49Å; D346-K352 PolarHBondContact OD1-NZ 3.24Å; D346-K352 IonicContact OD2-NZ 3.97Å
347	G	62.9	Low	63.1	Low	1 Å²	1	28 Å²	28	1%	0.01	14%	0.137	C	C	.	.			trans	69.1	-162.6	171.9	0	0	0	0	0	115.1	G345	G345-G347 VanDerWaalsContact C-N 3.26Å; G345-G347 PolarHBondContact O-N 3.42Å
348	N	66.1	Low	62.9	Low	19 Å²	19	28.3 Å²	28.3	10%	0.102	14%	0.139	C	C	.	.			trans	-91.2	123.3	-174.9	-172.6	-5.5	0	0	0	112.5	Q338 V350 E351 K352	Q338-N348 PolarHBondContact NE2-OD1 3.09Å; N348-V350 PolarHBondContact O-N 2.83Å; N348-V350 PolarHBondContact OD1-N 2.77Å; N348-E351 HydrophobicContact CB-CB 4.38Å; N348-K352 WeakPolarHBondContact O-CB 3.2Å; N348-K352 PolarHBondContact O-N 3.1Å
349	I	65.6	Low	62.8	Low	8 Å²	8	30.3 Å²	30.3	4%	0.041	15%	0.154	C	C	.	.	H	α-helix	trans	-57.5	-45.2	-178.5	-58.1	-178.7	0	0	0	112.7	F334 V337 Q338 K352 S353 L666	F334-I349 HydrophobicContact CD2-CB 4.39Å; F334-I349 HydrophobicContact CD2-CD1 4.32Å; F334-I349 HydrophobicContact CD2-CG2 4.11Å; F334-I349 HydrophobicContact CE2-CB 3.78Å; F334-I349 HydrophobicContact CE2-CD1 4.37Å; F334-I349 HydrophobicContact CE2-CG2 3.85Å; V337-I349 HydrophobicContact CB-CD1 3.9Å; V337-I349 HydrophobicContact CG1-CD1 3.64Å; Q338-I349 HydrophobicContact CB-CD1 3.8Å; Q338-I349 HydrophobicContact CB-CG1 4.29Å; Q338-I349 HydrophobicContact CG-CD1 4.43Å; Q338-I349 HydrophobicContact CG-CG1 4.38Å; I349-K352 PolarHBondContact O-N 3.4Å; I349-S353 VanDerWaalsContact O-CB 3.26Å; I349-S353 WeakPolarHBondContact O-CB 3.47Å; I349-S353 PolarHBondContact O-N 2.96Å; I349-S353 PolarHBondContact O-OG 3.38Å; I349-L666 HydrophobicContact CG2-CG 4.23Å
350	V	62.7	Low	62.8	Low	4 Å²	4	34.8 Å²	34.8	2%	0.024	17%	0.169	C	C	.	.	H	α-helix	trans	-64.3	-50.2	-173	178.2	0	0	0	0	110.3	Y322 T325 F334 N348 K352 S353 V354	Y322-V350 HydrophobicContact CD2-CG1 3.76Å; Y322-V350 HydrophobicContact CE2-CB 4.18Å; Y322-V350 HydrophobicContact CE2-CG1 3.82Å; T325-V350 HydrophobicContact CG2-CG1 3.66Å; F334-V350 HydrophobicContact CE2-CG2 3.54Å; F334-V350 HydrophobicContact CZ-CG2 3.43Å; F334-V350 VanDerWaalsContact CZ-CG2 3.43Å; N348-V350 PolarHBondContact O-N 2.83Å; N348-V350 PolarHBondContact OD1-N 2.77Å; V350-K352 VanDerWaalsContact C-N 3.34Å; V350-K352 PolarHBondContact O-N 2.89Å; V350-S353 PolarHBondContact O-N 2.95Å; V350-S353 PolarHBondContact O-OG 3.42Å; V350-V354 VanDerWaalsContact O-CG2 3.32Å; V350-V354 WeakPolarHBondContact O-CG2 3.29Å; V350-V354 PolarHBondContact O-N 3.4Å
351	E	65.3	Low	62.4	Low	32 Å²	32	37.8 Å²	37.8	15%	0.15	18%	0.184	C	C	.	.	H	α-helix	trans	-60.9	-44.7	-178.8	-162.6	-169.9	151.6	0	0	111.6	Y322 N348 V354 K355	Y322-E351 HydrophobicContact CD2-CB 4.19Å; Y322-E351 HydrophobicContact CD2-CG 4.38Å; Y322-E351 HydrophobicContact CE2-CB 3.66Å; Y322-E351 HydrophobicContact CE2-CG 4.04Å; N348-E351 HydrophobicContact CB-CB 4.38Å; E351-V354 PolarHBondContact O-N 3.17Å; E351-K355 HydrophobicContact CG-CD 4.36Å; E351-K355 WeakPolarHBondContact O-CB 3.32Å; E351-K355 WeakPolarHBondContact O-CG 3.22Å; E351-K355 PolarHBondContact O-N 3.45Å; E351-K355 WeakPolarHBondContact OE1-CE 3.49Å; E351-K355 IonicContact OE1-NZ 2.81Å; E351-K355 PolarHBondContact OE1-NZ 3.38Å
352	K	63.7	Low	61.7	Low	20 Å²	20	41.6 Å²	41.6	9%	0.087	20%	0.202	C	C	.	.	H	α-helix	trans	-61.7	-46.1	177.6	-168	178.3	-168.2	174.6	0	111.8	D346 N348 I349 V350 V354 K355 Q356 D677 N682	D346-K352 IonicContact OD1-NZ 3.49Å; D346-K352 PolarHBondContact OD1-NZ 3.24Å; D346-K352 IonicContact OD2-NZ 3.97Å; N348-K352 WeakPolarHBondContact O-CB 3.2Å; N348-K352 PolarHBondContact O-N 3.1Å; I349-K352 PolarHBondContact O-N 3.4Å; V350-K352 VanDerWaalsContact C-N 3.34Å; V350-K352 PolarHBondContact O-N 2.89Å; K352-V354 VanDerWaalsContact C-N 3.31Å; K352-V354 PolarHBondContact O-N 2.78Å; K352-K355 PolarHBondContact O-N 3.36Å; K352-Q356 WeakPolarHBondContact O-CB 2.77Å; K352-Q356 VanDerWaalsContact O-CG 3.28Å; K352-Q356 WeakPolarHBondContact O-CG 3.12Å; K352-Q356 PolarHBondContact O-N 2.91Å; K352-D677 WeakPolarHBondContact CE-OD1 3.47Å; K352-D677 WeakPolarHBondContact CE-OD2 3.13Å; K352-D677 IonicContact NZ-OD1 3.6Å; K352-D677 PolarHBondContact NZ-OD1 3.06Å; K352-D677 IonicContact NZ-OD2 2.67Å; K352-D677 PolarHBondContact NZ-OD2 3.5Å; K352-N682 WeakPolarHBondContact CE-ND2 3.45Å
353	S	62.7	Low	61.2	Low	11 Å²	11	43 Å²	43	8%	0.077	21%	0.211	C	C	.	.	H	α-helix	trans	-63.8	-37.2	-179.2	72.7	0	0	0	0	112.4	I349 V350 T357 L665	I349-S353 VanDerWaalsContact O-CB 3.26Å; I349-S353 WeakPolarHBondContact O-CB 3.47Å; I349-S353 PolarHBondContact O-N 2.96Å; I349-S353 PolarHBondContact O-OG 3.38Å; V350-S353 PolarHBondContact O-N 2.95Å; V350-S353 PolarHBondContact O-OG 3.42Å; S353-T357 WeakPolarHBondContact O-CB 3.45Å; S353-T357 PolarHBondContact O-N 3.24Å; S353-T357 PolarHBondContact O-OG1 3.15Å; S353-L665 WeakPolarHBondContact OG-CD2 3.39Å
354	V	63.7	Low	60.5	Low	5 Å²	5	48.1 Å²	48.1	3%	0.03	22%	0.223	C	C	.	.	H	α-helix	trans	-68.7	-51.9	175.7	167.1	0	0	0	0	110.7	E318 T321 V350 E351 K352 Q356 T357 S358	E318-V354 HydrophobicContact CG-CG1 3.7Å; E318-V354 WeakPolarHBondContact O-CG1 3.49Å; T321-V354 WeakPolarHBondContact OG1-CG1 3.17Å; V350-V354 VanDerWaalsContact O-CG2 3.32Å; V350-V354 WeakPolarHBondContact O-CG2 3.29Å; V350-V354 PolarHBondContact O-N 3.4Å; E351-V354 PolarHBondContact O-N 3.17Å; K352-V354 VanDerWaalsContact C-N 3.31Å; K352-V354 PolarHBondContact O-N 2.78Å; V354-Q356 VanDerWaalsContact C-N 3.31Å; V354-Q356 PolarHBondContact O-N 3.27Å; V354-T357 PolarHBondContact O-N 3.41Å; V354-T357 VanDerWaalsContact O-N 3.09Å; V354-S358 PolarHBondContact O-N 3.19Å; V354-S358 PolarHBondContact O-OG 3.26Å
355	K	64.9	Low	59.6	Low	105 Å²	105	52.1 Å²	52.1	46%	0.457	25%	0.253	S	S	.	.	H	α-helix	trans	-54.6	-45.5	176	-78	174.1	172.2	173.2	0	112.1	E318 E351 K352 S358 S359	E318-K355 WeakPolarHBondContact OE1-CG 3.42Å; E351-K355 HydrophobicContact CG-CD 4.36Å; E351-K355 WeakPolarHBondContact O-CB 3.32Å; E351-K355 WeakPolarHBondContact O-CG 3.22Å; E351-K355 PolarHBondContact O-N 3.45Å; E351-K355 WeakPolarHBondContact OE1-CE 3.49Å; E351-K355 IonicContact OE1-NZ 2.81Å; E351-K355 PolarHBondContact OE1-NZ 3.38Å; K352-K355 PolarHBondContact O-N 3.36Å; K355-S358 PolarHBondContact O-N 3.41Å; K355-S359 WeakPolarHBondContact O-CB 3.47Å; K355-S359 PolarHBondContact O-N 2.92Å
356	Q	61.9	Low	58.8	Low	48 Å²	48	60.4 Å²	60.4	22%	0.224	29%	0.288	C	S	.	.	H	α-helix	trans	-62.7	-44.3	177.1	-76.7	176.4	-12.7	0	0	111.8	K352 V354 S359 R360	K352-Q356 WeakPolarHBondContact O-CB 2.77Å; K352-Q356 VanDerWaalsContact O-CG 3.28Å; K352-Q356 WeakPolarHBondContact O-CG 3.12Å; K352-Q356 PolarHBondContact O-N 2.91Å; V354-Q356 VanDerWaalsContact C-N 3.31Å; V354-Q356 PolarHBondContact O-N 3.27Å; Q356-S359 PolarHBondContact O-N 2.89Å; Q356-S359 PolarHBondContact O-OG 3.45Å; Q356-R360 PolarHBondContact O-N 2.94Å
357	T	55.9	Low	57.8	Low	42 Å²	42	66.2 Å²	66.2	26%	0.258	32%	0.319	S	S	.	.	H	α-helix	trans	-63.9	-45.8	178.6	-59.7	0	0	0	0	111.6	S353 V354 S359 R360 L361	S353-T357 WeakPolarHBondContact O-CB 3.45Å; S353-T357 PolarHBondContact O-N 3.24Å; S353-T357 PolarHBondContact O-OG1 3.15Å; V354-T357 PolarHBondContact O-N 3.41Å; V354-T357 VanDerWaalsContact O-N 3.09Å; T357-S359 VanDerWaalsContact C-N 3.29Å; T357-S359 PolarHBondContact O-N 2.88Å; T357-R360 PolarHBondContact O-N 2.97Å; T357-R360 VanDerWaalsContact O-N 3.14Å; T357-L361 HydrophobicContact CG2-CD1 4.45Å; T357-L361 PolarHBondContact O-N 3.04Å
358	S	59.6	Low	56.7	Low	16 Å²	16	72.2 Å²	72.2	11%	0.112	36%	0.355	C	S	.	.	H	α-helix	trans	-58.8	-41.2	174.8	-62.1	0	0	0	0	111.5	E318 V354 K355 R360 L361 K362	E318-S358 WeakPolarHBondContact CG-OG 3.42Å; V354-S358 PolarHBondContact O-N 3.19Å; V354-S358 PolarHBondContact O-OG 3.26Å; K355-S358 PolarHBondContact O-N 3.41Å; S358-R360 PolarHBondContact O-N 3.33Å; S358-L361 PolarHBondContact O-N 3.5Å; S358-K362 WeakPolarHBondContact O-CG 3.19Å; S358-K362 PolarHBondContact O-N 2.99Å
359	S	61.6	Low	55	Low	50 Å²	50	80.2 Å²	80.2	35%	0.35	39%	0.389	S	S	.	.	H	α-helix	trans	-64.2	-35.5	176	84.1	0	0	0	0	113.4	K355 Q356 T357 K363	K355-S359 WeakPolarHBondContact O-CB 3.47Å; K355-S359 PolarHBondContact O-N 2.92Å; Q356-S359 PolarHBondContact O-N 2.89Å; Q356-S359 PolarHBondContact O-OG 3.45Å; T357-S359 VanDerWaalsContact C-N 3.29Å; T357-S359 PolarHBondContact O-N 2.88Å; S359-K363 WeakPolarHBondContact O-CG 3.42Å; S359-K363 PolarHBondContact O-N 3.25Å
360	R	57.2	Low	53.8	Low	100 Å²	100	85.5 Å²	85.5	38%	0.377	42%	0.423	S	S	.	.	H	α-helix	trans	-69.2	-40.4	175.7	-73	-178.2	-176.8	178.4	4.9	111.3	Q356 T357 S358 K363 R364 T668 E673	Q356-R360 PolarHBondContact O-N 2.94Å; T357-R360 PolarHBondContact O-N 2.97Å; T357-R360 VanDerWaalsContact O-N 3.14Å; S358-R360 PolarHBondContact O-N 3.33Å; R360-K363 PolarHBondContact O-N 3.47Å; R360-R364 PolarHBondContact O-N 2.88Å; R360-R364 VanDerWaalsContact O-N 3.07Å; R360-T668 PolarHBondContact NH2-O 3.35Å; R360-T668 VanDerWaalsContact NH2-O 3.1Å; R360-E673 IonicContact CZ-OE1 3.57Å; R360-E673 IonicContact NE-OE1 3.03Å; R360-E673 VanDerWaalsContact NH2-CD 3.26Å; R360-E673 IonicContact NH2-OE1 3.49Å; R360-E673 PolarHBondContact NH2-OE1 2.91Å; R360-E673 IonicContact NH2-OE2 3.64Å; R360-E673 PolarHBondContact NH2-OE2 3.07Å
361	L	52.5	Low	52.3	Low	82 Å²	82	94.8 Å²	94.8	43%	0.429	46%	0.464	S	S	.	.	H	α-helix	trans	-63.1	-45.8	175.1	-71.5	168.2	0	0	0	111.3	T357 S358 K363 R364 S365	T357-L361 HydrophobicContact CG2-CD1 4.45Å; T357-L361 PolarHBondContact O-N 3.04Å; S358-L361 PolarHBondContact O-N 3.5Å; L361-K363 VanDerWaalsContact C-N 3.25Å; L361-K363 PolarHBondContact O-N 3.22Å; L361-R364 PolarHBondContact O-N 3.09Å; L361-R364 VanDerWaalsContact O-N 3.11Å; L361-S365 PolarHBondContact O-N 2.84Å; L361-S365 VanDerWaalsContact O-N 3.15Å; L361-S365 PolarHBondContact O-OG 3.5Å
362	K	55	Low	50.9	Low	107 Å²	107	102.8 Å²	102.8	47%	0.465	50%	0.501	S	S	.	.	H	α-helix	trans	-58.3	-34.5	175.7	-74.2	-179.7	178.1	-179.8	0	113	S358	S358-K362 WeakPolarHBondContact O-CG 3.19Å; S358-K362 PolarHBondContact O-N 2.99Å
363	K	53.3	Low	49.8	Very low	131 Å²	131	107.7 Å²	107.7	57%	0.57	53%	0.533	S	S	*	.	H	α-helix	trans	-71.8	-42.4	174.4	-75	174.9	-179.4	171.1	0	112.4	S359 R360 L361 S365 K366	S359-K363 WeakPolarHBondContact O-CG 3.42Å; S359-K363 PolarHBondContact O-N 3.25Å; R360-K363 PolarHBondContact O-N 3.47Å; L361-K363 VanDerWaalsContact C-N 3.25Å; L361-K363 PolarHBondContact O-N 3.22Å; K363-S365 PolarHBondContact O-N 3.31Å; K363-K366 PolarHBondContact O-N 3.38Å
364	R	46.8	Very low	49.3	Very low	198 Å²	198	109.9 Å²	109.9	75%	0.747	56%	0.557	S	S	*	*	H	α-helix	trans	-68.2	-31.5	-176.1	-147.4	175	-172.4	178.5	1.8	113.3	R360 L361 K366 D367	R360-R364 PolarHBondContact O-N 2.88Å; R360-R364 VanDerWaalsContact O-N 3.07Å; L361-R364 PolarHBondContact O-N 3.09Å; L361-R364 VanDerWaalsContact O-N 3.11Å; R364-K366 VanDerWaalsContact C-N 3.26Å; R364-K366 PolarHBondContact O-N 3.46Å; R364-D367 PolarHBondContact O-N 2.91Å
365	S	46.5	Very low	49.3	Very low	98 Å²	98	115.1 Å²	115.1	69%	0.685	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-68.4	-20.6	174.8	-61.6	0	0	0	0	113.9	L361 K363	L361-S365 PolarHBondContact O-N 2.84Å; L361-S365 VanDerWaalsContact O-N 3.15Å; L361-S365 PolarHBondContact O-OG 3.5Å; K363-S365 PolarHBondContact O-N 3.31Å
366	K	44.4	Very low	49.8	Very low	178 Å²	178	111.9 Å²	111.9	77%	0.774	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-81.3	-14.3	178.8	-70	-173.5	175.5	-172.9	0	114.2	K363 R364	K363-K366 PolarHBondContact O-N 3.38Å; R364-K366 VanDerWaalsContact C-N 3.26Å; R364-K366 PolarHBondContact O-N 3.46Å
367	D	42.7	Very low	50.8	Low	136 Å²	136	109.6 Å²	109.6	73%	0.727	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-95.7	3	-173.1	-73.9	-32.2	0	0	0	114.8	R364 K369	R364-D367 PolarHBondContact O-N 2.91Å; D367-K369 PolarHBondContact O-N 3Å; D367-K369 VanDerWaalsContact O-N 3.1Å
368	V	38.1	Very low	52.2	Low	126 Å²	126	111.2 Å²	111.2	76%	0.764	57%	0.571	S	S	*	*			trans	-83.7	84.1	174.8	-172.4	0	0	0	0	109.8
369	K	31.6	Very low	53.7	Low	187 Å²	187	110.5 Å²	110.5	81%	0.813	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-81.7	133.7	165.7	-68.8	-175	-179.7	-179.1	0	109.9	D367	D367-K369 PolarHBondContact O-N 3Å; D367-K369 VanDerWaalsContact O-N 3.1Å
370	P	38.9	Very low	54.9	Low	119 Å²	119	108.4 Å²	108.4	77%	0.773	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-64.5	135.2	-178.8	24.4	-31.4	0	0	0	111.2	Q372	P370-Q372 PolarHBondContact O-N 3.47Å
371	K	32.3	Very low	56.2	Low	199 Å²	199	103.7 Å²	103.7	87%	0.865	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-57.2	117.4	-179.6	-77.2	176.4	173.2	176.3	0	110.8
372	Q	35	Very low	57.4	Low	200 Å²	200	103.5 Å²	103.5	94%	0.935	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-74.1	122.5	169.5	-71.7	178.9	-13	0	0	110.1	P370	P370-Q372 PolarHBondContact O-N 3.47Å
373	T	41.6	Very low	57.9	Low	123 Å²	123	101.5 Å²	101.5	76%	0.755	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-103.2	125.1	-171.9	45.9	0	0	0	0	112.5
374	G	51.7	Low	58.9	Low	57 Å²	57	98 Å²	98	59%	0.588	52%	0.522	S	S	*	.			trans	76.3	125.2	146.9	0	0	0	0	0	119.6	T376 G404	G374-T376 VanDerWaalsContact C-N 3.33Å; G374-T376 PolarHBondContact O-N 3.14Å; G374-G404 PolarHBondContact O-N 2.88Å
375	T	64.4	Low	59.8	Low	116 Å²	116	92.8 Å²	92.8	71%	0.712	51%	0.506	S	S	*	.	S	Bend	trans	-77.7	-4.8	176.4	39.4	0	0	0	0	115.3	G404	T375-G404 WeakPolarHBondContact O-CA 3.3Å
376	T	75.9	Confident	61.3	Low	37 Å²	37	89.6 Å²	89.6	23%	0.227	48%	0.479	C	S	.	.	S	Bend	trans	-101.5	132.6	-172.8	62.7	0	0	0	0	111.8	G374 G403 G404 R487	G374-T376 VanDerWaalsContact C-N 3.33Å; G374-T376 PolarHBondContact O-N 3.14Å; T376-G403 CarbonylContact O-C 3.52Å; T376-G404 PolarHBondContact O-N 3.13Å; T376-R487 WeakPolarHBondContact CB-O 3.43Å; T376-R487 WeakPolarHBondContact CG2-O 3.41Å
377	C	81.7	Confident	62.7	Low	0 Å²	0	84.4 Å²	84.4	0%	0	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	129.4	172.8	-73.8	0	0	0	0	110.8	G403 G404 R405 I410 L488 A489 A490	C377-G403 WeakPolarHBondContact CA-O 3.39Å; C377-G403 PolarHBondContact SG-O 2.66Å; C377-G404 VanDerWaalsContact SG-CA 3.57Å; C377-R405 PolarHBondContact SG-N 2.94Å; C377-R405 PolarHBondContact SG-O 3.46Å; C377-I410 HydrophobicContact CB-CD1 3.81Å; C377-L488 PolarHBondContact N-O 3.37Å; C377-A489 HydrophobicContact CB-CB 4.07Å; C377-A489 CarbonylContact O-C 3.53Å; C377-A489 WeakPolarHBondContact O-CA 3.44Å; C377-A490 PolarHBondContact O-N 2.81Å
378	K	86	Confident	64.4	Low	76 Å²	76	78.9 Å²	78.9	33%	0.33	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	132.5	-178.7	-57.4	-168.9	-175.2	176.8	0	110.3	R401 C402 A490 E492	K378-R401 CarbonylContact O-C 3.6Å; K378-R401 VanDerWaalsContact O-CA 3.26Å; K378-R401 WeakPolarHBondContact O-CA 3.43Å; K378-C402 PolarHBondContact N-O 3.24Å; K378-C402 PolarHBondContact O-N 3.23Å; K378-A490 WeakPolarHBondContact CA-O 3.4Å; K378-E492 HydrophobicContact CB-CB 3.95Å; K378-E492 VanDerWaalsContact CB-OE2 3.28Å; K378-E492 WeakPolarHBondContact CB-OE2 3.19Å; K378-E492 HydrophobicContact CD-CB 4.24Å; K378-E492 HydrophobicContact CD-CG 4.22Å; K378-E492 WeakPolarHBondContact CD-OE1 3.41Å; K378-E492 WeakPolarHBondContact CD-OE2 3.47Å; K378-E492 WeakPolarHBondContact CE-OE1 3.49Å; K378-E492 IonicContact NZ-OE1 3.43Å; K378-E492 PolarHBondContact NZ-OE1 3.19Å; K378-E492 IonicContact NZ-OE2 3.11Å
379	V	89.8	Confident	66.2	Low	0 Å²	0	74.6 Å²	74.6	0%	0	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	128.5	178.3	179.2	0	0	0	0	108.8	V399 Q400 I410 M436 L465 L468 A490 L491 E492	V379-V399 HydrophobicContact CG1-CG1 3.67Å; V379-Q400 WeakPolarHBondContact CA-O 3.39Å; V379-I410 HydrophobicContact CG2-CD1 4.12Å; V379-I410 HydrophobicContact CG2-CG2 3.98Å; V379-M436 HydrophobicContact CB-CE 4.26Å; V379-M436 HydrophobicContact CG1-CE 3.63Å; V379-M436 HydrophobicContact CG2-CE 3.53Å; V379-L465 HydrophobicContact CG1-CD1 4.48Å; V379-L468 HydrophobicContact CB-CD1 4.09Å; V379-L468 HydrophobicContact CG2-CD1 3.88Å; V379-A490 PolarHBondContact N-O 3.05Å; V379-L491 HydrophobicContact CB-CD1 4.39Å; V379-L491 HydrophobicContact CG1-CD1 4.38Å; V379-L491 WeakPolarHBondContact O-CD1 3.31Å; V379-E492 PolarHBondContact O-N 3.41Å
380	S	86.8	Confident	68.4	Low	6 Å²	6	66.2 Å²	66.2	4%	0.042	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	166.3	179.1	76.1	0	0	0	0	110.9	Q400 E492	S380-Q400 PolarHBondContact N-O 3.11Å; S380-Q400 VanDerWaalsContact N-O 3.09Å; S380-Q400 WeakPolarHBondContact O-CG 3.44Å; S380-Q400 PolarHBondContact O-N 3.38Å; S380-Q400 PolarHBondContact OG-NE2 2.93Å; S380-E492 WeakPolarHBondContact CB-O 3.22Å
381	F	85.3	Confident	70.2	Confident	2 Å²	2	63.4 Å²	63.4	1%	0.009	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	147.9	162.1	-70.3	-71.5	0	0	0	110.9	C384 V397 V399 I445 I463 L465 P494 S495 I496 A497	F381-C384 HydrophobicContact CB-CB 4.46Å; F381-V397 HydrophobicContact CD1-CG1 3.63Å; F381-V397 HydrophobicContact CE1-CG1 3.49Å; F381-V397 VanDerWaalsContact CE1-CG1 3.49Å; F381-V399 HydrophobicContact CD1-CG2 3.81Å; F381-V399 HydrophobicContact CE1-CG2 3.59Å; F381-V399 HydrophobicContact CZ-CG2 4.47Å; F381-I445 HydrophobicContact CE1-CD1 4.11Å; F381-I445 HydrophobicContact CZ-CD1 4.44Å; F381-I463 HydrophobicContact CE1-CG2 4.38Å; F381-I463 VanDerWaalsContact CE2-O 3.25Å; F381-I463 WeakPolarHBondContact CE2-O 3.49Å; F381-I463 HydrophobicContact CZ-CB 4.07Å; F381-I463 HydrophobicContact CZ-CG2 3.81Å; F381-L465 HydrophobicContact CD1-CD1 4.4Å; F381-L465 HydrophobicContact CD2-CD1 3.89Å; F381-L465 HydrophobicContact CD2-CG 4.2Å; F381-L465 HydrophobicContact CE1-CD1 4.21Å; F381-L465 HydrophobicContact CE1-CD2 4.48Å; F381-L465 HydrophobicContact CE1-CG 4.19Å; F381-L465 HydrophobicContact CE2-CB 4.33Å; F381-L465 HydrophobicContact CE2-CD1 3.72Å; F381-L465 HydrophobicContact CE2-CD2 4.5Å; F381-L465 HydrophobicContact CE2-CG 3.5Å; F381-L465 VanDerWaalsContact CE2-CG 3.5Å; F381-L465 HydrophobicContact CG-CD1 4.25Å; F381-L465 HydrophobicContact CZ-CD1 3.89Å; F381-L465 HydrophobicContact CZ-CD2 4.03Å; F381-L465 HydrophobicContact CZ-CG 3.5Å; F381-L465 VanDerWaalsContact CZ-CG 3.5Å; F381-P494 HydrophobicContact CB-CG 4.43Å; F381-P494 PolarHBondContact N-O 3.33Å; F381-S495 WeakPolarHBondContact CE2-O 3.38Å; F381-I496 VanDerWaalsContact CD2-C 3.4Å; F381-A497 HydrophobicContact CB-CB 4.25Å; F381-A497 HydrophobicContact CD1-CB 3.69Å; F381-A497 HydrophobicContact CD2-CB 3.76Å; F381-A497 VanDerWaalsContact CD2-N 3.34Å; F381-A497 HydrophobicContact CE1-CB 3.84Å; F381-A497 HydrophobicContact CE2-CB 3.87Å; F381-A497 VanDerWaalsContact CE2-N 3.3Å; F381-A497 HydrophobicContact CG-CB 3.65Å; F381-A497 HydrophobicContact CZ-CB 3.91Å
382	N	77.6	Confident	72.6	Confident	77 Å²	77	56.9 Å²	56.9	41%	0.412	33%	0.325	S	S	.	.	S	Bend	trans	-157.5	111.3	168	-174.1	12.5	0	0	0	111.4	R398 Q400	N382-R398 PolarHBondContact N-O 3.38Å; N382-R398 WeakPolarHBondContact O-CD 3.34Å; N382-Q400 HydrophobicContact CB-CG 3.72Å; N382-Q400 VanDerWaalsContact ND2-CD 3.31Å; N382-Q400 PolarHBondContact ND2-NE2 3.48Å; N382-Q400 PolarHBondContact ND2-OE1 3.02Å
383	P	66	Low	75	Confident	66 Å²	66	48.8 Å²	48.8	43%	0.429	30%	0.295	S	S	.	.	S	Bend	cis	-67.6	172.3	-5.2	29.7	-36.9	0	0	0	112.7	Y386	P383-Y386 WeakPolarHBondContact CD-OH 3.31Å; P383-Y386 HydrophobicContact CG-CE1 4.06Å; P383-Y386 HydrophobicContact CG-CE2 4.22Å; P383-Y386 VanDerWaalsContact O-CE2 3.26Å; P383-Y386 WeakPolarHBondContact O-CE2 3.2Å; P383-Y386 PolarHBondContact O-OH 3.43Å
384	C	74.2	Confident	77.3	Confident	56 Å²	56	46.1 Å²	46.1	38%	0.378	28%	0.279	S	S	.	.	S	Bend	trans	-97.6	-0.8	171.7	60.3	0	0	0	0	114.5	F381 P494 A497 T498	F381-C384 HydrophobicContact CB-CB 4.46Å; C384-P494 HydrophobicContact CB-CB 3.48Å; C384-P494 VanDerWaalsContact CB-CB 3.48Å; C384-P494 HydrophobicContact CB-CG 3.37Å; C384-A497 CarbonylContact O-C 3.58Å; C384-A497 VanDerWaalsContact O-CA 3.29Å; C384-A497 WeakPolarHBondContact O-CA 3.29Å; C384-T498 PolarHBondContact O-N 2.92Å
385	H	65.7	Low	79.2	Confident	90 Å²	90	43.7 Å²	43.7	42%	0.417	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	130.4	175.4	-165	-63.1	0	0	0	107.9	T387 T498	H385-T387 PolarHBondContact CE1-OG1 3.23Å; H385-T387 PolarHBondContact ND1-OG1 3.2Å; H385-T498 CarbonylContact C-O 3.55Å; H385-T498 WeakPolarHBondContact CA-O 3.09Å
386	Y	78.5	Confident	80.5	Confident	30 Å²	30	45.2 Å²	45.2	12%	0.118	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	140.7	172.6	-67	-95.7	0	0	0	107.5	P383 V397 R398 A497 T498 V499 M500	P383-Y386 WeakPolarHBondContact CD-OH 3.31Å; P383-Y386 HydrophobicContact CG-CE1 4.06Å; P383-Y386 HydrophobicContact CG-CE2 4.22Å; P383-Y386 VanDerWaalsContact O-CE2 3.26Å; P383-Y386 WeakPolarHBondContact O-CE2 3.2Å; P383-Y386 PolarHBondContact O-OH 3.43Å; Y386-V397 HydrophobicContact CD1-CG2 4.38Å; Y386-V397 HydrophobicContact CD2-CG1 4.25Å; Y386-V397 HydrophobicContact CD2-CG2 3.93Å; Y386-V397 HydrophobicContact CE1-CG2 4.44Å; Y386-V397 HydrophobicContact CE2-CB 4.18Å; Y386-V397 HydrophobicContact CE2-CG1 3.61Å; Y386-V397 HydrophobicContact CE2-CG2 4.02Å; Y386-V397 HydrophobicContact CG-CG2 4.13Å; Y386-R398 PolarHBondContact OH-N 2.67Å; Y386-A497 HydrophobicContact CD2-CB 4.44Å; Y386-A497 HydrophobicContact CE2-CB 4.34Å; Y386-T498 PolarHBondContact N-O 2.89Å; Y386-V499 CarbonylContact O-C 3.58Å; Y386-V499 WeakPolarHBondContact O-CA 3.48Å; Y386-M500 PolarHBondContact O-N 3.3Å
387	T	72.3	Confident	81.2	Confident	69 Å²	69	43.5 Å²	43.5	42%	0.423	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	123.5	174.8	-53.6	0	0	0	0	106.1	H385 M500 L502	H385-T387 PolarHBondContact CE1-OG1 3.23Å; H385-T387 PolarHBondContact ND1-OG1 3.2Å; T387-M500 CarbonylContact C-O 3.6Å; T387-M500 WeakPolarHBondContact CA-O 3.21Å; T387-M500 HydrophobicContact CG2-CB 4.46Å; T387-M500 HydrophobicContact CG2-CE 3.41Å; T387-M500 VanDerWaalsContact CG2-CE 3.41Å; T387-M500 WeakPolarHBondContact OG1-CE 3.32Å; T387-L502 HydrophobicContact CG2-CD1 3.33Å; T387-L502 HydrophobicContact CG2-CD2 4.07Å; T387-L502 HydrophobicContact CG2-CG 3.48Å; T387-L502 VanDerWaalsContact CG2-CG 3.48Å
388	V	78.5	Confident	81.6	Confident	20 Å²	20	48.2 Å²	48.2	12%	0.121	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	150.6	-178	-65.5	0	0	0	0	109.6	V392 V395 I449 V499 M500 I501 L502	V388-V392 HydrophobicContact CB-CB 4.24Å; V388-V392 HydrophobicContact CB-CG1 3.87Å; V388-V392 HydrophobicContact CB-CG2 4.45Å; V388-V392 HydrophobicContact CG1-CG1 4.41Å; V388-V392 HydrophobicContact CG1-CG2 4.49Å; V388-V392 HydrophobicContact CG2-CG1 4.08Å; V388-V395 HydrophobicContact CG1-CB 4.01Å; V388-V395 HydrophobicContact CG1-CG2 3.61Å; V388-I449 HydrophobicContact CG2-CG1 4.29Å; V388-V499 HydrophobicContact CG2-CG1 3.98Å; V388-M500 PolarHBondContact N-O 2.88Å; V388-I501 CarbonylContact O-C 3.01Å; V388-I501 WeakPolarHBondContact O-CA 3.45Å; V388-L502 PolarHBondContact O-N 2.82Å
389	L	76.8	Confident	81.9	Confident	36 Å²	36	44.6 Å²	44.6	19%	0.188	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	152.8	167.8	-60.5	170.8	0	0	0	108.9	N391 V392 L502 D504	L389-N391 WeakPolarHBondContact CB-OD1 3.41Å; L389-N391 PolarHBondContact O-N 3.4Å; L389-V392 VanDerWaalsContact O-CB 3.26Å; L389-V392 WeakPolarHBondContact O-CB 3.18Å; L389-V392 VanDerWaalsContact O-CG1 3.27Å; L389-V392 WeakPolarHBondContact O-CG1 3.49Å; L389-V392 PolarHBondContact O-N 3.39Å; L389-V392 VanDerWaalsContact O-N 3.13Å; L389-L502 WeakPolarHBondContact CA-O 3.36Å; L389-L502 HydrophobicContact CD2-CB 4.16Å; L389-D504 HydrophobicContact CD2-CB 4.02Å
390	E	76.7	Confident	81.9	Confident	12 Å²	12	46.5 Å²	46.5	6%	0.056	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-53.8	-44.1	175.4	-157.4	-172.9	154.9	0	0	111.9	V392 I449 I450 D451 D452 I501 L502	E390-V392 PolarHBondContact O-N 3.18Å; E390-I449 WeakPolarHBondContact O-CG2 3.43Å; E390-I450 VanDerWaalsContact CG-O 3.31Å; E390-I450 WeakPolarHBondContact CG-O 3.47Å; E390-D451 WeakPolarHBondContact OE1-CA 3.33Å; E390-D452 PolarHBondContact OE1-N 2.89Å; E390-I501 HydrophobicContact CB-CG2 4.15Å; E390-I501 HydrophobicContact CG-CG2 4.18Å; E390-L502 PolarHBondContact N-O 2.96Å; E390-L502 VanDerWaalsContact N-O 3.08Å
391	N	78	Confident	81.8	Confident	59 Å²	59	46.6 Å²	46.6	32%	0.316	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-67.8	-0.1	178.6	75.8	12.2	0	0	0	116.4	L389 G393 D451 D504	L389-N391 WeakPolarHBondContact CB-OD1 3.41Å; L389-N391 PolarHBondContact O-N 3.4Å; N391-G393 PolarHBondContact O-N 3.36Å; N391-G393 VanDerWaalsContact O-N 3.14Å; N391-D451 WeakPolarHBondContact CA-OD1 3.11Å; N391-D451 PolarHBondContact N-OD1 2.94Å; N391-D504 VanDerWaalsContact CG-OD2 3.24Å; N391-D504 PolarHBondContact ND2-OD2 2.89Å
392	V	82.7	Confident	81.6	Confident	62 Å²	62	49.1 Å²	49.1	38%	0.376	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-63.3	-24.2	-175.8	77.2	0	0	0	0	112.5	V388 L389 E390 T394 I449	V388-V392 HydrophobicContact CB-CB 4.24Å; V388-V392 HydrophobicContact CB-CG1 3.87Å; V388-V392 HydrophobicContact CB-CG2 4.45Å; V388-V392 HydrophobicContact CG1-CG1 4.41Å; V388-V392 HydrophobicContact CG1-CG2 4.49Å; V388-V392 HydrophobicContact CG2-CG1 4.08Å; L389-V392 VanDerWaalsContact O-CB 3.26Å; L389-V392 WeakPolarHBondContact O-CB 3.18Å; L389-V392 VanDerWaalsContact O-CG1 3.27Å; L389-V392 WeakPolarHBondContact O-CG1 3.49Å; L389-V392 PolarHBondContact O-N 3.39Å; L389-V392 VanDerWaalsContact O-N 3.13Å; E390-V392 PolarHBondContact O-N 3.18Å; V392-T394 PolarHBondContact O-N 3.19Å; V392-I449 HydrophobicContact CG1-CB 4.05Å; V392-I449 HydrophobicContact CG1-CG1 3.76Å
393	G	85.9	Confident	81.5	Confident	30 Å²	30	47.6 Å²	47.6	31%	0.309	27%	0.266	S	S	.	.			trans	69.6	-45.1	-176.7	0	0	0	0	0	115	N391 T448 I449	N391-G393 PolarHBondContact O-N 3.36Å; N391-G393 VanDerWaalsContact O-N 3.14Å; G393-T448 WeakPolarHBondContact O-CA 3.38Å; G393-T448 WeakPolarHBondContact O-CG2 3.28Å; G393-I449 PolarHBondContact O-N 3.38Å
394	T	89.6	Confident	81.9	Confident	68 Å²	68	45.9 Å²	45.9	42%	0.417	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	123.1	176	-61.2	0	0	0	0	112.3	V392 D446 I447	V392-T394 PolarHBondContact O-N 3.19Å; T394-D446 HydrophobicContact CG2-CB 3.9Å; T394-I447 CarbonylContact C-O 3.55Å; T394-I447 VanDerWaalsContact CA-O 3.31Å; T394-I447 WeakPolarHBondContact CA-O 3.47Å; T394-I447 WeakPolarHBondContact CG2-O 3.18Å
395	V	90.3	Very high	81.7	Confident	5 Å²	5	50.3 Å²	50.3	3%	0.03	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	131.9	173.5	63.6	0	0	0	0	111	V388 V397 D446 I447 I449 F461 V499	V388-V395 HydrophobicContact CG1-CB 4.01Å; V388-V395 HydrophobicContact CG1-CG2 3.61Å; V395-V397 HydrophobicContact CG2-CG2 4.15Å; V395-D446 WeakPolarHBondContact O-CA 3.38Å; V395-I447 HydrophobicContact CG1-CB 3.81Å; V395-I447 HydrophobicContact CG1-CG2 4.43Å; V395-I447 WeakPolarHBondContact CG1-O 2.99Å; V395-I447 PolarHBondContact N-O 3.04Å; V395-I447 PolarHBondContact O-N 2.84Å; V395-I449 HydrophobicContact CG1-CD1 4.04Å; V395-I449 HydrophobicContact CG1-CG1 4.29Å; V395-F461 HydrophobicContact CG1-CZ 4.31Å; V395-V499 HydrophobicContact CG1-CG1 4.24Å; V395-V499 HydrophobicContact CG2-CG1 4.24Å
396	R	91.6	Very high	82	Confident	149 Å²	149	48.4 Å²	48.4	56%	0.562	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.9	106.6	177.7	177.4	167.1	-69.8	159.5	4.2	111.3	F444 D446	R396-F444 HydrophobicContact CG-CB 3.79Å; R396-F444 HydrophobicContact CG-CD1 3.48Å; R396-F444 VanDerWaalsContact CG-CD1 3.48Å; R396-F444 HydrophobicContact CG-CE1 4.32Å; R396-F444 HydrophobicContact CG-CG 3.85Å; R396-D446 WeakPolarHBondContact CB-OD1 3.25Å; R396-D446 VanDerWaalsContact CG-OD1 3.25Å; R396-D446 WeakPolarHBondContact CG-OD1 3.31Å; R396-D446 IonicContact CZ-OD1 2.64Å; R396-D446 IonicContact CZ-OD2 2.87Å; R396-D446 IonicContact NE-OD1 3.73Å; R396-D446 PolarHBondContact NE-OD1 3.17Å; R396-D446 IonicContact NE-OD2 2.97Å; R396-D446 IonicContact NH2-OD1 3.66Å; R396-D446 IonicContact NH2-OD2 3.76Å; R396-D446 PolarHBondContact NH2-OD2 3.35Å
397	V	91.7	Very high	81.8	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	129.7	-178	173.8	0	0	0	0	111.3	F381 Y386 V395 F444 I445 I463 A497 V499	F381-V397 HydrophobicContact CD1-CG1 3.63Å; F381-V397 HydrophobicContact CE1-CG1 3.49Å; F381-V397 VanDerWaalsContact CE1-CG1 3.49Å; Y386-V397 HydrophobicContact CD1-CG2 4.38Å; Y386-V397 HydrophobicContact CD2-CG1 4.25Å; Y386-V397 HydrophobicContact CD2-CG2 3.93Å; Y386-V397 HydrophobicContact CE1-CG2 4.44Å; Y386-V397 HydrophobicContact CE2-CB 4.18Å; Y386-V397 HydrophobicContact CE2-CG1 3.61Å; Y386-V397 HydrophobicContact CE2-CG2 4.02Å; Y386-V397 HydrophobicContact CG-CG2 4.13Å; V395-V397 HydrophobicContact CG2-CG2 4.15Å; V397-F444 CarbonylContact O-C 3.59Å; V397-F444 VanDerWaalsContact O-CA 3.27Å; V397-F444 WeakPolarHBondContact O-CA 3.27Å; V397-I445 HydrophobicContact CB-CB 4.41Å; V397-I445 PolarHBondContact N-O 3.37Å; V397-I445 PolarHBondContact O-N 2.98Å; V397-I463 HydrophobicContact CB-CD1 3.93Å; V397-I463 HydrophobicContact CG1-CD1 3.94Å; V397-I463 HydrophobicContact CG2-CD1 3.5Å; V397-A497 HydrophobicContact CG1-CB 4.07Å; V397-V499 HydrophobicContact CG2-CG2 4.09Å
398	R	90	Very high	82.1	Confident	100 Å²	100	47.8 Å²	47.8	38%	0.377	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	128.5	-174.3	-173.6	-171.4	-62.7	-158.7	8	111.6	N382 Y386 E442 F444	N382-R398 PolarHBondContact N-O 3.38Å; N382-R398 WeakPolarHBondContact O-CD 3.34Å; Y386-R398 PolarHBondContact OH-N 2.67Å; R398-E442 WeakPolarHBondContact CD-OE2 3.48Å; R398-E442 HydrophobicContact CG-CB 4.28Å; R398-E442 IonicContact CZ-OE2 3.53Å; R398-E442 VanDerWaalsContact CZ-OE2 3.23Å; R398-E442 IonicContact NE-OE2 3.4Å; R398-E442 PolarHBondContact NE-OE2 2.99Å; R398-E442 IonicContact NH1-OE2 3.55Å; R398-E442 PolarHBondContact NH1-OE2 3.03Å; R398-F444 HydrophobicContact CB-CD1 4Å; R398-F444 HydrophobicContact CB-CE1 3.79Å; R398-F444 HydrophobicContact CG-CD1 4.26Å; R398-F444 HydrophobicContact CG-CE1 3.76Å; R398-F444 HydrophobicContact CG-CZ 4.34Å
399	V	92.1	Very high	82.4	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	122	169.6	-179.1	0	0	0	0	108.4	V379 F381 L434 E442 T443 I445 L465	V379-V399 HydrophobicContact CG1-CG1 3.67Å; F381-V399 HydrophobicContact CD1-CG2 3.81Å; F381-V399 HydrophobicContact CE1-CG2 3.59Å; F381-V399 HydrophobicContact CZ-CG2 4.47Å; V399-L434 HydrophobicContact CB-CD1 3.97Å; V399-L434 HydrophobicContact CG1-CD1 4.31Å; V399-L434 HydrophobicContact CG2-CD1 3.62Å; V399-E442 CarbonylContact O-C 3.47Å; V399-E442 VanDerWaalsContact O-CA 3.31Å; V399-E442 WeakPolarHBondContact O-CA 3.34Å; V399-T443 PolarHBondContact N-O 2.82Å; V399-T443 PolarHBondContact O-N 3.39Å; V399-I445 HydrophobicContact CG2-CD1 3.96Å; V399-I445 HydrophobicContact CG2-CG1 4.41Å; V399-L465 HydrophobicContact CG1-CD1 3.75Å; V399-L465 HydrophobicContact CG1-CD2 4.38Å; V399-L465 HydrophobicContact CG2-CD1 4.07Å; V399-L465 HydrophobicContact CG2-CD2 4Å
400	Q	89	Confident	82.9	Confident	40 Å²	40	46.8 Å²	46.8	19%	0.187	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	155.7	-176.9	67.2	171	7.3	0	0	112.5	V379 S380 N382 F441	V379-Q400 WeakPolarHBondContact CA-O 3.39Å; S380-Q400 PolarHBondContact N-O 3.11Å; S380-Q400 VanDerWaalsContact N-O 3.09Å; S380-Q400 WeakPolarHBondContact O-CG 3.44Å; S380-Q400 PolarHBondContact O-N 3.38Å; S380-Q400 PolarHBondContact OG-NE2 2.93Å; N382-Q400 HydrophobicContact CB-CG 3.72Å; N382-Q400 VanDerWaalsContact ND2-CD 3.31Å; N382-Q400 PolarHBondContact ND2-NE2 3.48Å; N382-Q400 PolarHBondContact ND2-OE1 3.02Å; Q400-F441 CarbonylContact C-O 3.54Å; Q400-F441 WeakPolarHBondContact CA-O 3.48Å
401	R	85.2	Confident	83.5	Confident	7 Å²	7	46.4 Å²	46.4	3%	0.026	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	120.3	172.4	171	-168.7	170	172.6	4.2	109.8	K378 R405 S406 L408 I410 M436 G437 F441	K378-R401 CarbonylContact O-C 3.6Å; K378-R401 VanDerWaalsContact O-CA 3.26Å; K378-R401 WeakPolarHBondContact O-CA 3.43Å; R401-R405 PolarHBondContact NH2-O 3.48Å; R401-S406 VanDerWaalsContact NH2-C 3.26Å; R401-S406 VanDerWaalsContact NH2-CA 3.32Å; R401-S406 PolarHBondContact NH2-O 3.46Å; R401-L408 PolarHBondContact NH1-O 3.35Å; R401-L408 PolarHBondContact NH2-O 2.59Å; R401-L408 VanDerWaalsContact NH2-O 3.11Å; R401-I410 HydrophobicContact CG-CD1 4.22Å; R401-M436 HydrophobicContact CB-SD 3.81Å; R401-G437 PolarHBondContact NH1-O 2.95Å; R401-F441 PolarHBondContact N-O 2.88Å
402	C	81.8	Confident	84.2	Confident	55 Å²	55	43.6 Å²	43.6	37%	0.372	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	140.1	178.2	-65.5	0	0	0	0	112.4	K378	K378-C402 PolarHBondContact N-O 3.24Å; K378-C402 PolarHBondContact O-N 3.23Å
403	G	75.9	Confident	84.7	Confident	46 Å²	46	42.2 Å²	42.2	47%	0.474	23%	0.231	S	C	.	.	S	Bend	trans	71.7	178.4	175.3	0	0	0	0	0	115	T376 C377	T376-G403 CarbonylContact O-C 3.52Å; C377-G403 WeakPolarHBondContact CA-O 3.39Å; C377-G403 PolarHBondContact SG-O 2.66Å
404	G	72.7	Confident	85.2	Confident	29 Å²	29	42.5 Å²	42.5	30%	0.299	22%	0.222	S	C	.	.	S	Bend	trans	66.8	-168.2	-177	0	0	0	0	0	114.7	G374 T375 T376 C377	G374-G404 PolarHBondContact O-N 2.88Å; T375-G404 WeakPolarHBondContact O-CA 3.3Å; T376-G404 PolarHBondContact O-N 3.13Å; C377-G404 VanDerWaalsContact SG-CA 3.57Å
405	R	70.5	Confident	85.4	Confident	150 Å²	150	44 Å²	44	57%	0.566	22%	0.221	S	C	*	.			trans	-76.4	131.9	-177	-58.4	172	54	155.3	0.5	110.9	C377 R401 D407 L408	C377-R405 PolarHBondContact SG-N 2.94Å; C377-R405 PolarHBondContact SG-O 3.46Å; R401-R405 PolarHBondContact NH2-O 3.48Å; R405-D407 VanDerWaalsContact C-N 3.29Å; R405-D407 WeakPolarHBondContact CB-OD1 3.43Å; R405-D407 IonicContact CZ-OD1 3.88Å; R405-D407 IonicContact CZ-OD2 3.56Å; R405-D407 IonicContact NE-OD1 3.77Å; R405-D407 PolarHBondContact NE-OD1 3.28Å; R405-D407 IonicContact NE-OD2 3.4Å; R405-D407 IonicContact NH2-OD1 2.68Å; R405-D407 IonicContact NH2-OD2 2.83Å; R405-D407 PolarHBondContact NH2-OD2 3.16Å; R405-D407 PolarHBondContact O-N 3.49Å; R405-L408 HydrophobicContact CB-CD1 4.43Å
406	S	72.2	Confident	85.6	Confident	50 Å²	50	44.7 Å²	44.7	35%	0.35	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-8.8	-178	66.8	0	0	0	0	114.6	R401 P438 N439	R401-S406 VanDerWaalsContact NH2-C 3.26Å; R401-S406 VanDerWaalsContact NH2-CA 3.32Å; R401-S406 PolarHBondContact NH2-O 3.46Å; S406-P438 CarbonylContact O-C 3.58Å; S406-P438 WeakPolarHBondContact O-CA 3.45Å; S406-N439 VanDerWaalsContact CB-OD1 3.27Å; S406-N439 WeakPolarHBondContact CB-OD1 3.15Å; S406-N439 PolarHBondContact O-N 3.1Å; S406-N439 PolarHBondContact OG-OD1 2.85Å
407	D	75.4	Confident	85.6	Confident	69 Å²	69	42.1 Å²	42.1	37%	0.369	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-6.6	-173.8	67.9	-38.4	0	0	0	115	R405	R405-D407 VanDerWaalsContact C-N 3.29Å; R405-D407 WeakPolarHBondContact CB-OD1 3.43Å; R405-D407 IonicContact CZ-OD1 3.88Å; R405-D407 IonicContact CZ-OD2 3.56Å; R405-D407 IonicContact NE-OD1 3.77Å; R405-D407 PolarHBondContact NE-OD1 3.28Å; R405-D407 IonicContact NE-OD2 3.4Å; R405-D407 IonicContact NH2-OD1 2.68Å; R405-D407 IonicContact NH2-OD2 2.83Å; R405-D407 PolarHBondContact NH2-OD2 3.16Å; R405-D407 PolarHBondContact O-N 3.49Å
408	L	78.3	Confident	85.5	Confident	17 Å²	17	45.7 Å²	45.7	9%	0.089	24%	0.238	C	C	.	.			trans	-84.1	146.1	178.4	-61.8	169.5	0	0	0	112	R401 R405 V470 L488	R401-L408 PolarHBondContact NH1-O 3.35Å; R401-L408 PolarHBondContact NH2-O 2.59Å; R401-L408 VanDerWaalsContact NH2-O 3.11Å; R405-L408 HydrophobicContact CB-CD1 4.43Å; L408-V470 HydrophobicContact CB-CG1 4.31Å; L408-V470 HydrophobicContact CD1-CG1 4.35Å; L408-V470 HydrophobicContact CD2-CG1 4.29Å; L408-L488 HydrophobicContact CD1-CD2 4.03Å
409	T	84.2	Confident	85.1	Confident	34 Å²	34	42.7 Å²	42.7	21%	0.209	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	125.1	169	-59.9	0	0	0	0	109.1	T435 M436 K471	T409-T435 HydrophobicContact CG2-CG2 3.71Å; T409-M436 CarbonylContact C-O 3.47Å; T409-M436 VanDerWaalsContact CA-O 3.32Å; T409-M436 WeakPolarHBondContact CA-O 3.42Å; T409-K471 PolarHBondContact N-O 3.4Å; T409-K471 PolarHBondContact O-N 3.32Å
410	I	88	Confident	84.3	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	129.7	-177.7	-55.5	175.5	0	0	0	108.7	C377 V379 R401 M436 L468 A489	C377-I410 HydrophobicContact CB-CD1 3.81Å; V379-I410 HydrophobicContact CG2-CD1 4.12Å; V379-I410 HydrophobicContact CG2-CG2 3.98Å; R401-I410 HydrophobicContact CG-CD1 4.22Å; I410-M436 HydrophobicContact CB-CE 4.14Å; I410-M436 HydrophobicContact CG2-CE 4.05Å; I410-M436 PolarHBondContact N-O 2.67Å; I410-M436 PolarHBondContact O-N 2.99Å; I410-L468 HydrophobicContact CG2-CD1 3.42Å; I410-L468 VanDerWaalsContact CG2-CD1 3.42Å; I410-L468 HydrophobicContact CG2-CG 4.18Å; I410-A489 HydrophobicContact CD1-CB 4.28Å
411	T	89.2	Confident	84.2	Confident	4 Å²	4	44.1 Å²	44.1	3%	0.025	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	134.3	173.2	53.1	0	0	0	0	110.2	L434 T435 R469	T411-L434 CarbonylContact C-O 3.58Å; T411-L434 WeakPolarHBondContact CA-O 3.08Å; T411-T435 HydrophobicContact CG2-CG2 3.79Å; T411-T435 WeakPolarHBondContact CG2-OG1 3.31Å; T411-R469 PolarHBondContact N-O 3.16Å; T411-R469 PolarHBondContact O-N 3.4Å; T411-R469 WeakPolarHBondContact OG1-CB 3.5Å; T411-R469 PolarHBondContact OG1-O 3.43Å
412	V	92.8	Very high	84.3	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	138.6	178.6	64.8	0	0	0	0	108.8	T433 L434 M436 L465 D466 L468 L491	V412-T433 CarbonylContact O-C 3.52Å; V412-T433 WeakPolarHBondContact O-CA 3.33Å; V412-L434 HydrophobicContact CG1-CB 3.89Å; V412-L434 HydrophobicContact CG1-CD1 4.22Å; V412-L434 PolarHBondContact N-O 3.12Å; V412-L434 PolarHBondContact O-N 2.99Å; V412-M436 HydrophobicContact CG1-CE 4.48Å; V412-L465 HydrophobicContact CG1-CD2 4Å; V412-L465 HydrophobicContact CG2-CB 3.95Å; V412-L465 HydrophobicContact CG2-CD2 4.05Å; V412-L465 HydrophobicContact CG2-CG 4.49Å; V412-D466 VanDerWaalsContact CG2-O 3.29Å; V412-D466 WeakPolarHBondContact CG2-O 3.47Å; V412-L468 HydrophobicContact CB-CD1 4.1Å; V412-L468 HydrophobicContact CG2-CD1 4.27Å; V412-L491 HydrophobicContact CG2-CD1 4.41Å
413	D	92.6	Very high	84.7	Confident	34 Å²	34	46.4 Å²	46.4	18%	0.182	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	148.2	176.9	-60.5	-25.3	0	0	0	109.5	G432 T433 L465 D466 N467 R469	D413-G432 CarbonylContact C-O 3.52Å; D413-G432 WeakPolarHBondContact CA-O 3.33Å; D413-T433 WeakPolarHBondContact OD1-CB 3.12Å; D413-T433 VanDerWaalsContact OD1-CG2 3.22Å; D413-T433 WeakPolarHBondContact OD1-CG2 2.95Å; D413-T433 PolarHBondContact OD1-OG1 3.11Å; D413-L465 CarbonylContact O-C 3.57Å; D413-L465 WeakPolarHBondContact O-CA 3.44Å; D413-D466 PolarHBondContact N-O 3.45Å; D413-D466 PolarHBondContact O-N 2.9Å; D413-N467 HydrophobicContact CB-CB 4.21Å; D413-N467 VanDerWaalsContact OD2-CB 3.3Å; D413-N467 WeakPolarHBondContact OD2-CB 3.37Å; D413-N467 PolarHBondContact OD2-ND2 2.88Å; D413-R469 IonicContact OD1-CZ 3.63Å; D413-R469 IonicContact OD1-NH1 3.99Å; D413-R469 PolarHBondContact OD1-NH1 3.07Å; D413-R469 IonicContact OD1-NH2 3.69Å; D413-R469 PolarHBondContact OD1-NH2 3.09Å; D413-R469 IonicContact OD2-CZ 2.83Å; D413-R469 IonicContact OD2-NH1 3.98Å; D413-R469 PolarHBondContact OD2-NH1 3.28Å; D413-R469 IonicContact OD2-NH2 2.76Å
414	Y	95.6	Very high	85.2	Confident	35 Å²	35	47 Å²	47	14%	0.137	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	151.2	172.7	73.3	-88.4	0	0	0	111.8	R431 G432 L434 I445 F464	Y414-R431 VanDerWaalsContact O-CA 3.32Å; Y414-R431 WeakPolarHBondContact O-CA 3.48Å; Y414-G432 WeakPolarHBondContact CD1-O 3.25Å; Y414-G432 PolarHBondContact N-O 2.98Å; Y414-G432 PolarHBondContact O-N 3.48Å; Y414-L434 HydrophobicContact CD1-CD1 4.39Å; Y414-L434 HydrophobicContact CD1-CD2 4.36Å; Y414-L434 HydrophobicContact CD1-CG 3.84Å; Y414-L434 HydrophobicContact CE1-CD2 4.16Å; Y414-L434 HydrophobicContact CE1-CG 4.13Å; Y414-I445 HydrophobicContact CD1-CD1 4.06Å; Y414-I445 HydrophobicContact CD1-CG1 4.12Å; Y414-I445 HydrophobicContact CD2-CD1 3.9Å; Y414-I445 HydrophobicContact CD2-CG1 4.25Å; Y414-I445 HydrophobicContact CD2-CG2 3.72Å; Y414-I445 HydrophobicContact CE1-CG1 4.27Å; Y414-I445 HydrophobicContact CE2-CG1 4.43Å; Y414-I445 HydrophobicContact CE2-CG2 3.41Å; Y414-I445 VanDerWaalsContact CE2-CG2 3.41Å; Y414-I445 HydrophobicContact CG-CD1 3.62Å; Y414-I445 HydrophobicContact CG-CG1 4.09Å; Y414-I445 HydrophobicContact CG-CG2 4.41Å; Y414-F464 WeakPolarHBondContact CA-O 3.4Å; Y414-F464 WeakPolarHBondContact CB-O 3.32Å
415	R	94.3	Very high	85.8	Confident	101 Å²	101	48.6 Å²	48.6	38%	0.381	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	149.1	170.6	64.3	171.6	-179.7	-76.8	-11.4	110.4	R431 I463 F464 D466	R415-R431 HydrophobicContact CB-CB 4.16Å; R415-I463 WeakPolarHBondContact O-CA 3.45Å; R415-F464 HydrophobicContact CG-CB 4.16Å; R415-F464 PolarHBondContact N-O 3.49Å; R415-F464 PolarHBondContact O-N 2.84Å; R415-D466 IonicContact CZ-OD2 2.92Å; R415-D466 IonicContact NH1-OD2 2.61Å; R415-D466 PolarHBondContact NH1-OD2 3.41Å; R415-D466 IonicContact NH2-OD2 3.39Å; R415-D466 PolarHBondContact NH2-OD2 3.28Å
416	T	94.9	Very high	86.7	Confident	18 Å²	18	42.2 Å²	42.2	11%	0.11	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	153.3	165.6	59.8	0	0	0	0	110.9	Y427 A429 N430 I447 F461 Y462 I463	T416-Y427 HydrophobicContact CG2-CE2 4.1Å; T416-A429 WeakPolarHBondContact OG1-CA 3.39Å; T416-N430 HydrophobicContact CG2-CB 4.31Å; T416-N430 PolarHBondContact N-O 3.31Å; T416-N430 PolarHBondContact OG1-N 3.47Å; T416-N430 PolarHBondContact OG1-O 2.81Å; T416-I447 HydrophobicContact CG2-CD1 3.49Å; T416-I447 VanDerWaalsContact CG2-CD1 3.49Å; T416-I447 HydrophobicContact CG2-CG1 4.2Å; T416-F461 HydrophobicContact CG2-CE2 4.46Å; T416-Y462 CarbonylContact C-O 3.58Å; T416-Y462 VanDerWaalsContact CA-O 3.25Å; T416-Y462 WeakPolarHBondContact CA-O 3.1Å; T416-I463 HydrophobicContact CG2-CG1 4.4Å
417	E	91.5	Very high	87.7	Confident	95 Å²	95	39.9 Å²	39.9	44%	0.444	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	137.5	173.5	-165	171.5	145.5	0	0	108.7	Y462 F464	E417-Y462 PolarHBondContact N-O 3.09Å; E417-Y462 PolarHBondContact O-N 3.41Å; E417-F464 HydrophobicContact CB-CD2 4.08Å; E417-F464 HydrophobicContact CB-CE2 3.66Å; E417-F464 HydrophobicContact CG-CE2 4.32Å; E417-F464 VanDerWaalsContact OE2-CE2 3.23Å; E417-F464 WeakPolarHBondContact OE2-CE2 3.49Å
418	D	88.7	Confident	88.6	Confident	76 Å²	76	40.1 Å²	40.1	41%	0.406	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	143.6	-179.6	-60.6	-18.8	0	0	0	110.8	A421 A423 Y427	D418-A421 WeakPolarHBondContact CA-O 3.3Å; D418-A421 WeakPolarHBondContact CB-O 3.34Å; D418-A423 WeakPolarHBondContact OD1-CB 3.4Å; D418-A423 PolarHBondContact OD1-N 2.89Å; D418-Y427 PolarHBondContact N-OH 3.36Å; D418-Y427 WeakPolarHBondContact OD1-CE1 3.4Å; D418-Y427 PolarHBondContact OD1-OH 2.95Å
419	G	81.2	Confident	89.2	Confident	36 Å²	36	42.2 Å²	42.2	37%	0.371	26%	0.263	S	S	.	.	S	Bend	trans	-115	-112.9	171.1	0	0	0	0	0	109.4	A421 H460	G419-A421 PolarHBondContact N-O 2.81Å; G419-A421 VanDerWaalsContact N-O 3.16Å; G419-H460 CarbonylContact C-O 3.51Å; G419-H460 WeakPolarHBondContact CA-O 3.45Å; G419-H460 PolarHBondContact N-O 3.32Å
420	T	76	Confident	89.7	Confident	71 Å²	71	43.1 Å²	43.1	44%	0.436	27%	0.267	S	S	.	.	S	Bend	trans	-79.7	-32.5	160.5	51.1	0	0	0	0	111	E459 H460	T420-E459 VanDerWaalsContact OG1-CA 3.25Å; T420-E459 WeakPolarHBondContact OG1-CA 3.32Å; T420-H460 PolarHBondContact N-O 3.25Å; T420-H460 PolarHBondContact OG1-N 3.5Å
421	A	86.4	Confident	90	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	31%	0.306	C	S	.	.	S	Bend	trans	-75.6	132.9	170.7	0	0	0	0	0	111.2	D418 G419 D426 Y427 E459 H460 F461 I501	D418-A421 WeakPolarHBondContact CA-O 3.3Å; D418-A421 WeakPolarHBondContact CB-O 3.34Å; G419-A421 PolarHBondContact N-O 2.81Å; G419-A421 VanDerWaalsContact N-O 3.16Å; A421-D426 VanDerWaalsContact CA-OD2 3.26Å; A421-D426 WeakPolarHBondContact CA-OD2 3.48Å; A421-D426 HydrophobicContact CB-CB 4.13Å; A421-Y427 HydrophobicContact CB-CD1 4.33Å; A421-E459 VanDerWaalsContact CA-OE2 3.26Å; A421-E459 WeakPolarHBondContact CA-OE2 2.95Å; A421-E459 HydrophobicContact CB-CB 3.84Å; A421-H460 PolarHBondContact N-O 3.39Å; A421-F461 HydrophobicContact CB-CB 4.32Å; A421-F461 HydrophobicContact CB-CD1 4.44Å; A421-I501 HydrophobicContact CB-CD1 4.17Å
422	T	88.1	Confident	90.2	Very high	73 Å²	73	54.5 Å²	54.5	45%	0.448	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-103.1	132.2	-178.3	-52	0	0	0	0	111.7	G424 S425 D426	T422-G424 PolarHBondContact O-N 3.11Å; T422-S425 PolarHBondContact O-N 3.04Å; T422-S425 PolarHBondContact O-OG 3.41Å; T422-D426 PolarHBondContact N-OD2 2.95Å; T422-D426 PolarHBondContact O-N 3.48Å
423	A	89.8	Confident	90.2	Very high	37 Å²	37	58 Å²	58	31%	0.306	34%	0.339	S	S	.	.	B	Isolated β-bridge	trans	-62.1	121.3	174.2	0	0	0	0	0	112.1	D418 Y427 A429	D418-A423 WeakPolarHBondContact OD1-CB 3.4Å; D418-A423 PolarHBondContact OD1-N 2.89Å; A423-Y427 CarbonylContact C-O 3.5Å; A423-Y427 WeakPolarHBondContact CA-O 3.38Å; A423-Y427 HydrophobicContact CB-CE1 4.04Å; A423-Y427 HydrophobicContact CB-CE2 4.4Å; A423-A429 HydrophobicContact CB-CB 3.71Å
424	G	86.4	Confident	90.2	Very high	59 Å²	59	57.3 Å²	57.3	61%	0.608	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	108.6	-22.1	176.5	0	0	0	0	0	114.9	T422 Y427 I450	T422-G424 PolarHBondContact O-N 3.11Å; G424-Y427 PolarHBondContact N-O 3.07Å; G424-I450 WeakPolarHBondContact O-CD1 3.27Å
425	S	86.2	Confident	89.9	Confident	61 Å²	61	59.6 Å²	59.6	43%	0.427	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-51.9	165.2	49.5	0	0	0	0	110.1	T422 I450	T422-S425 PolarHBondContact O-N 3.04Å; T422-S425 PolarHBondContact O-OG 3.41Å; S425-I450 WeakPolarHBondContact O-CB 3.46Å; S425-I450 WeakPolarHBondContact O-CD1 3.29Å; S425-I450 VanDerWaalsContact O-CG2 3.23Å; S425-I450 WeakPolarHBondContact O-CG2 3.39Å
426	D	88.2	Confident	89.6	Confident	16 Å²	16	54.8 Å²	54.8	9%	0.086	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	-26.7	-165.5	-25.3	-46.4	0	0	0	111.5	A421 T422 I450 I501	A421-D426 VanDerWaalsContact CA-OD2 3.26Å; A421-D426 WeakPolarHBondContact CA-OD2 3.48Å; A421-D426 HydrophobicContact CB-CB 4.13Å; T422-D426 PolarHBondContact N-OD2 2.95Å; T422-D426 PolarHBondContact O-N 3.48Å; D426-I450 PolarHBondContact O-N 3.48Å; D426-I501 HydrophobicContact CB-CD1 3.99Å
427	Y	94.5	Very high	89.1	Confident	1 Å²	1	54.9 Å²	54.9	0%	0.004	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-150.7	161.8	175.8	81.4	-78	0	0	0	113.2	T416 D418 A421 A423 G424 I447 T448 F461	T416-Y427 HydrophobicContact CG2-CE2 4.1Å; D418-Y427 PolarHBondContact N-OH 3.36Å; D418-Y427 WeakPolarHBondContact OD1-CE1 3.4Å; D418-Y427 PolarHBondContact OD1-OH 2.95Å; A421-Y427 HydrophobicContact CB-CD1 4.33Å; A423-Y427 CarbonylContact C-O 3.5Å; A423-Y427 WeakPolarHBondContact CA-O 3.38Å; A423-Y427 HydrophobicContact CB-CE1 4.04Å; A423-Y427 HydrophobicContact CB-CE2 4.4Å; G424-Y427 PolarHBondContact N-O 3.07Å; Y427-I447 HydrophobicContact CD2-CG2 3.95Å; Y427-T448 WeakPolarHBondContact CA-O 3.39Å; Y427-F461 HydrophobicContact CD1-CB 4.15Å; Y427-F461 AromaticContact CD1-CD1 3.84Å; Y427-F461 HydrophobicContact CD1-CD1 3.84Å; Y427-F461 HydrophobicContact CD1-CE1 4.44Å; Y427-F461 AromaticContact CD1-CG 3.99Å; Y427-F461 HydrophobicContact CD1-CG 3.99Å; Y427-F461 HydrophobicContact CD2-CD1 4.33Å; Y427-F461 HydrophobicContact CD2-CD2 4.22Å; Y427-F461 HydrophobicContact CD2-CE1 4.36Å; Y427-F461 HydrophobicContact CD2-CE2 4.27Å; Y427-F461 HydrophobicContact CD2-CG 4.26Å; Y427-F461 HydrophobicContact CD2-CZ 4.32Å; Y427-F461 HydrophobicContact CE1-CB 3.68Å; Y427-F461 HydrophobicContact CE1-CD1 4.24Å; Y427-F461 AromaticContact CE1-CG 3.92Å; Y427-F461 HydrophobicContact CE1-CG 3.92Å; Y427-F461 HydrophobicContact CE2-CD2 4.01Å; Y427-F461 HydrophobicContact CE2-CE2 4.39Å; Y427-F461 HydrophobicContact CE2-CG 4.17Å; Y427-F461 AromaticContact CG-CD1 3.9Å; Y427-F461 HydrophobicContact CG-CD1 3.9Å; Y427-F461 HydrophobicContact CG-CE1 4.05Å; Y427-F461 HydrophobicContact CG-CG 4.17Å; Y427-F461 HydrophobicContact CG-CZ 4.45Å
428	V	93.5	Very high	88.6	Confident	74 Å²	74	53.9 Å²	53.9	45%	0.448	34%	0.341	S	S	.	.			trans	-93.3	115.8	175.6	-176.5	0	0	0	0	110.5	N430 T448 I450	V428-N430 PolarHBondContact O-N 3.11Å; V428-T448 HydrophobicContact CG2-CG2 4.27Å; V428-T448 PolarHBondContact N-O 3.04Å; V428-I450 HydrophobicContact CG2-CD1 4.31Å; V428-I450 HydrophobicContact CG2-CG1 4.37Å
429	A	92.2	Very high	88.1	Confident	61 Å²	61	55.2 Å²	55.2	50%	0.504	35%	0.348	S	S	.	.			trans	-56.2	132.1	176.3	0	0	0	0	0	112.5	T416 A423	T416-A429 WeakPolarHBondContact OG1-CA 3.39Å; A423-A429 HydrophobicContact CB-CB 3.71Å
430	N	93.8	Very high	88.2	Confident	54 Å²	54	55.4 Å²	55.4	29%	0.289	34%	0.344	S	S	.	.			trans	-133.8	142.6	-176.9	-165.7	0.2	0	0	0	111.5	T416 V428 D446 I447	T416-N430 HydrophobicContact CG2-CB 4.31Å; T416-N430 PolarHBondContact N-O 3.31Å; T416-N430 PolarHBondContact OG1-N 3.47Å; T416-N430 PolarHBondContact OG1-O 2.81Å; V428-N430 PolarHBondContact O-N 3.11Å; N430-D446 PolarHBondContact ND2-O 3.35Å; N430-D446 VanDerWaalsContact ND2-O 3.11Å; N430-I447 HydrophobicContact CB-CG1 4.49Å
431	R	94.6	Very high	88.6	Confident	217 Å²	217	57.7 Å²	57.7	82%	0.819	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.5	139.9	174	66.4	179.7	-177.5	-176.6	-2.2	110.8	Y414 R415	Y414-R431 VanDerWaalsContact O-CA 3.32Å; Y414-R431 WeakPolarHBondContact O-CA 3.48Å; R415-R431 HydrophobicContact CB-CB 4.16Å
432	G	93	Very high	88.8	Confident	25 Å²	25	61.9 Å²	61.9	26%	0.258	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.4	-171.7	-178.3	0	0	0	0	0	114.4	D413 Y414	D413-G432 CarbonylContact C-O 3.52Å; D413-G432 WeakPolarHBondContact CA-O 3.33Å; Y414-G432 WeakPolarHBondContact CD1-O 3.25Å; Y414-G432 PolarHBondContact N-O 2.98Å; Y414-G432 PolarHBondContact O-N 3.48Å
433	T	92.5	Very high	88.9	Confident	75 Å²	75	59.4 Å²	59.4	46%	0.46	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	122.1	176	-57	0	0	0	0	109.6	V412 D413	V412-T433 CarbonylContact O-C 3.52Å; V412-T433 WeakPolarHBondContact O-CA 3.33Å; D413-T433 WeakPolarHBondContact OD1-CB 3.12Å; D413-T433 VanDerWaalsContact OD1-CG2 3.22Å; D413-T433 WeakPolarHBondContact OD1-CG2 2.95Å; D413-T433 PolarHBondContact OD1-OG1 3.11Å
434	L	92	Very high	89.1	Confident	18 Å²	18	61.6 Å²	61.6	9%	0.094	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	136.3	170.9	-65	173.4	0	0	0	110.1	V399 T411 V412 Y414 I445 L465	V399-L434 HydrophobicContact CB-CD1 3.97Å; V399-L434 HydrophobicContact CG1-CD1 4.31Å; V399-L434 HydrophobicContact CG2-CD1 3.62Å; T411-L434 CarbonylContact C-O 3.58Å; T411-L434 WeakPolarHBondContact CA-O 3.08Å; V412-L434 HydrophobicContact CG1-CB 3.89Å; V412-L434 HydrophobicContact CG1-CD1 4.22Å; V412-L434 PolarHBondContact N-O 3.12Å; V412-L434 PolarHBondContact O-N 2.99Å; Y414-L434 HydrophobicContact CD1-CD1 4.39Å; Y414-L434 HydrophobicContact CD1-CD2 4.36Å; Y414-L434 HydrophobicContact CD1-CG 3.84Å; Y414-L434 HydrophobicContact CE1-CD2 4.16Å; Y414-L434 HydrophobicContact CE1-CG 4.13Å; L434-I445 HydrophobicContact CD1-CD1 3.93Å; L434-I445 HydrophobicContact CD1-CG1 3.76Å; L434-I445 HydrophobicContact CD2-CG1 4.11Å; L434-I445 HydrophobicContact CG-CG1 4.27Å; L434-L465 HydrophobicContact CD1-CD2 4.34Å
435	T	90	Very high	89.5	Confident	83 Å²	83	58.9 Å²	58.9	51%	0.509	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	106.7	173.2	-56.9	0	0	0	0	109.5	T409 T411	T409-T435 HydrophobicContact CG2-CG2 3.71Å; T411-T435 HydrophobicContact CG2-CG2 3.79Å; T411-T435 WeakPolarHBondContact CG2-OG1 3.31Å
436	M	88.9	Confident	89.8	Confident	0 Å²	0	59 Å²	59	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	107.3	170.8	-71.8	174.1	-71	0	0	109.2	V379 R401 T409 I410 V412 T443	V379-M436 HydrophobicContact CB-CE 4.26Å; V379-M436 HydrophobicContact CG1-CE 3.63Å; V379-M436 HydrophobicContact CG2-CE 3.53Å; R401-M436 HydrophobicContact CB-SD 3.81Å; T409-M436 CarbonylContact C-O 3.47Å; T409-M436 VanDerWaalsContact CA-O 3.32Å; T409-M436 WeakPolarHBondContact CA-O 3.42Å; I410-M436 HydrophobicContact CB-CE 4.14Å; I410-M436 HydrophobicContact CG2-CE 4.05Å; I410-M436 PolarHBondContact N-O 2.67Å; I410-M436 PolarHBondContact O-N 2.99Å; V412-M436 HydrophobicContact CG1-CE 4.48Å; M436-T443 HydrophobicContact CG-CG2 3.59Å
437	G	83.3	Confident	90.1	Very high	21 Å²	21	58.3 Å²	58.3	22%	0.216	32%	0.319	C	S	.	.			trans	-67.7	178.8	175.2	0	0	0	0	0	114	R401 N439 C440	R401-G437 PolarHBondContact NH1-O 2.95Å; G437-N439 PolarHBondContact O-N 2.96Å; G437-C440 WeakPolarHBondContact O-CB 3.25Å; G437-C440 PolarHBondContact O-N 2.86Å
438	P	81.3	Confident	90.1	Very high	74 Å²	74	61.5 Å²	61.5	48%	0.481	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	137.8	172.1	26.3	-33.4	0	0	0	110.4	S406 C440	S406-P438 CarbonylContact O-C 3.58Å; S406-P438 WeakPolarHBondContact O-CA 3.45Å; P438-C440 PolarHBondContact O-N 3.27Å; P438-C440 VanDerWaalsContact O-N 3.12Å
439	N	79.1	Confident	90	Very high	103 Å²	103	58.3 Å²	58.3	55%	0.551	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.8	15.4	-175.9	-53.8	-38.1	0	0	0	115.4	S406 G437 F441	S406-N439 VanDerWaalsContact CB-OD1 3.27Å; S406-N439 WeakPolarHBondContact CB-OD1 3.15Å; S406-N439 PolarHBondContact O-N 3.1Å; S406-N439 PolarHBondContact OG-OD1 2.85Å; G437-N439 PolarHBondContact O-N 2.96Å; N439-F441 WeakPolarHBondContact O-CD2 3.33Å
440	C	82.6	Confident	89.8	Confident	41 Å²	41	58.1 Å²	58.1	28%	0.277	31%	0.309	S	S	.	.			trans	-93.6	112.1	169	-174.4	0	0	0	0	108.5	G437 P438 E442	G437-C440 WeakPolarHBondContact O-CB 3.25Å; G437-C440 PolarHBondContact O-N 2.86Å; P438-C440 PolarHBondContact O-N 3.27Å; P438-C440 VanDerWaalsContact O-N 3.12Å; C440-E442 PolarHBondContact SG-O 2.92Å
441	F	85.2	Confident	89.3	Confident	118 Å²	118	59.9 Å²	59.9	52%	0.518	32%	0.318	S	S	.	.			trans	-97.4	-12.9	-175.5	-60.4	-73.6	0	0	0	113.4	Q400 R401 N439	Q400-F441 CarbonylContact C-O 3.54Å; Q400-F441 WeakPolarHBondContact CA-O 3.48Å; R401-F441 PolarHBondContact N-O 2.88Å; N439-F441 WeakPolarHBondContact O-CD2 3.33Å
442	E	89.2	Confident	88.5	Confident	88 Å²	88	52.6 Å²	52.6	41%	0.411	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	145.2	179.7	60.1	-173.2	-177.4	0	0	111.5	R398 V399 C440	R398-E442 WeakPolarHBondContact CD-OE2 3.48Å; R398-E442 HydrophobicContact CG-CB 4.28Å; R398-E442 IonicContact CZ-OE2 3.53Å; R398-E442 VanDerWaalsContact CZ-OE2 3.23Å; R398-E442 IonicContact NE-OE2 3.4Å; R398-E442 PolarHBondContact NE-OE2 2.99Å; R398-E442 IonicContact NH1-OE2 3.55Å; R398-E442 PolarHBondContact NH1-OE2 3.03Å; V399-E442 CarbonylContact O-C 3.47Å; V399-E442 VanDerWaalsContact O-CA 3.31Å; V399-E442 WeakPolarHBondContact O-CA 3.34Å; C440-E442 PolarHBondContact SG-O 2.92Å
443	T	91.1	Very high	87.6	Confident	21 Å²	21	58.4 Å²	58.4	13%	0.129	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	165	173.9	50	0	0	0	0	109.1	V399 M436	V399-T443 PolarHBondContact N-O 2.82Å; V399-T443 PolarHBondContact O-N 3.39Å; M436-T443 HydrophobicContact CG-CG2 3.59Å
444	F	93.3	Very high	86.7	Confident	84 Å²	84	60.1 Å²	60.1	37%	0.368	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	144.4	-171.3	-62.3	-79.5	0	0	0	111.7	R396 V397 R398	R396-F444 HydrophobicContact CG-CB 3.79Å; R396-F444 HydrophobicContact CG-CD1 3.48Å; R396-F444 VanDerWaalsContact CG-CD1 3.48Å; R396-F444 HydrophobicContact CG-CE1 4.32Å; R396-F444 HydrophobicContact CG-CG 3.85Å; V397-F444 CarbonylContact O-C 3.59Å; V397-F444 VanDerWaalsContact O-CA 3.27Å; V397-F444 WeakPolarHBondContact O-CA 3.27Å; R398-F444 HydrophobicContact CB-CD1 4Å; R398-F444 HydrophobicContact CB-CE1 3.79Å; R398-F444 HydrophobicContact CG-CD1 4.26Å; R398-F444 HydrophobicContact CG-CE1 3.76Å; R398-F444 HydrophobicContact CG-CZ 4.34Å
445	I	94.3	Very high	85.4	Confident	2 Å²	2	64.8 Å²	64.8	1%	0.01	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	121.4	170	-57.8	168.1	0	0	0	106.5	F381 V397 V399 Y414 L434 I447 I463 L465	F381-I445 HydrophobicContact CE1-CD1 4.11Å; F381-I445 HydrophobicContact CZ-CD1 4.44Å; V397-I445 HydrophobicContact CB-CB 4.41Å; V397-I445 PolarHBondContact N-O 3.37Å; V397-I445 PolarHBondContact O-N 2.98Å; V399-I445 HydrophobicContact CG2-CD1 3.96Å; V399-I445 HydrophobicContact CG2-CG1 4.41Å; Y414-I445 HydrophobicContact CD1-CD1 4.06Å; Y414-I445 HydrophobicContact CD1-CG1 4.12Å; Y414-I445 HydrophobicContact CD2-CD1 3.9Å; Y414-I445 HydrophobicContact CD2-CG1 4.25Å; Y414-I445 HydrophobicContact CD2-CG2 3.72Å; Y414-I445 HydrophobicContact CE1-CG1 4.27Å; Y414-I445 HydrophobicContact CE2-CG1 4.43Å; Y414-I445 HydrophobicContact CE2-CG2 3.41Å; Y414-I445 VanDerWaalsContact CE2-CG2 3.41Å; Y414-I445 HydrophobicContact CG-CD1 3.62Å; Y414-I445 HydrophobicContact CG-CG1 4.09Å; Y414-I445 HydrophobicContact CG-CG2 4.41Å; L434-I445 HydrophobicContact CD1-CD1 3.93Å; L434-I445 HydrophobicContact CD1-CG1 3.76Å; L434-I445 HydrophobicContact CD2-CG1 4.11Å; L434-I445 HydrophobicContact CG-CG1 4.27Å; I445-I447 HydrophobicContact CG2-CD1 4.29Å; I445-I447 HydrophobicContact CG2-CG1 4.06Å; I445-I463 HydrophobicContact CD1-CG2 3.98Å; I445-L465 HydrophobicContact CD1-CD2 4.49Å
446	D	93.9	Very high	84.5	Confident	63 Å²	63	64 Å²	64	34%	0.337	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	125.9	176.7	-68.9	-9.4	0	0	0	108.6	T394 V395 R396 N430	T394-D446 HydrophobicContact CG2-CB 3.9Å; V395-D446 WeakPolarHBondContact O-CA 3.38Å; R396-D446 WeakPolarHBondContact CB-OD1 3.25Å; R396-D446 VanDerWaalsContact CG-OD1 3.25Å; R396-D446 WeakPolarHBondContact CG-OD1 3.31Å; R396-D446 IonicContact CZ-OD1 2.64Å; R396-D446 IonicContact CZ-OD2 2.87Å; R396-D446 IonicContact NE-OD1 3.73Å; R396-D446 PolarHBondContact NE-OD1 3.17Å; R396-D446 IonicContact NE-OD2 2.97Å; R396-D446 IonicContact NH2-OD1 3.66Å; R396-D446 IonicContact NH2-OD2 3.76Å; R396-D446 PolarHBondContact NH2-OD2 3.35Å; N430-D446 PolarHBondContact ND2-O 3.35Å; N430-D446 VanDerWaalsContact ND2-O 3.11Å
447	I	94.4	Very high	83.4	Confident	1 Å²	1	71.9 Å²	71.9	1%	0.005	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	131.3	178.6	-61.3	170	0	0	0	108.3	T394 V395 T416 Y427 N430 I445 F461 I463	T394-I447 CarbonylContact C-O 3.55Å; T394-I447 VanDerWaalsContact CA-O 3.31Å; T394-I447 WeakPolarHBondContact CA-O 3.47Å; T394-I447 WeakPolarHBondContact CG2-O 3.18Å; V395-I447 HydrophobicContact CG1-CB 3.81Å; V395-I447 HydrophobicContact CG1-CG2 4.43Å; V395-I447 WeakPolarHBondContact CG1-O 2.99Å; V395-I447 PolarHBondContact N-O 3.04Å; V395-I447 PolarHBondContact O-N 2.84Å; T416-I447 HydrophobicContact CG2-CD1 3.49Å; T416-I447 VanDerWaalsContact CG2-CD1 3.49Å; T416-I447 HydrophobicContact CG2-CG1 4.2Å; Y427-I447 HydrophobicContact CD2-CG2 3.95Å; N430-I447 HydrophobicContact CB-CG1 4.49Å; I445-I447 HydrophobicContact CG2-CD1 4.29Å; I445-I447 HydrophobicContact CG2-CG1 4.06Å; I447-F461 HydrophobicContact CD1-CE2 3.71Å; I447-F461 HydrophobicContact CD1-CZ 4.2Å; I447-F461 HydrophobicContact CG2-CE2 4.18Å; I447-F461 HydrophobicContact CG2-CZ 3.91Å; I447-I463 HydrophobicContact CD1-CD1 3.28Å; I447-I463 HydrophobicContact CD1-CG1 3.6Å
448	T	93.3	Very high	83	Confident	68 Å²	68	73.6 Å²	73.6	42%	0.417	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	131.4	179.6	-55.6	0	0	0	0	110.2	G393 Y427 V428	G393-T448 WeakPolarHBondContact O-CA 3.38Å; G393-T448 WeakPolarHBondContact O-CG2 3.28Å; Y427-T448 WeakPolarHBondContact CA-O 3.39Å; V428-T448 HydrophobicContact CG2-CG2 4.27Å; V428-T448 PolarHBondContact N-O 3.04Å
449	I	91.4	Very high	83	Confident	7 Å²	7	72.3 Å²	72.3	4%	0.036	36%	0.364	C	S	.	.	B	Isolated β-bridge	trans	-100	141.1	173	-53.4	-56.6	0	0	0	107.5	V388 E390 V392 G393 V395 F461 I501	V388-I449 HydrophobicContact CG2-CG1 4.29Å; E390-I449 WeakPolarHBondContact O-CG2 3.43Å; V392-I449 HydrophobicContact CG1-CB 4.05Å; V392-I449 HydrophobicContact CG1-CG1 3.76Å; G393-I449 PolarHBondContact O-N 3.38Å; V395-I449 HydrophobicContact CG1-CD1 4.04Å; V395-I449 HydrophobicContact CG1-CG1 4.29Å; I449-F461 HydrophobicContact CD1-CE1 3.7Å; I449-F461 HydrophobicContact CD1-CZ 4.06Å; I449-I501 HydrophobicContact CD1-CD1 4.12Å; I449-I501 HydrophobicContact CD1-CG1 4.3Å; I449-I501 HydrophobicContact CG2-CD1 4.19Å; I449-I501 HydrophobicContact CG2-CG1 4.47Å; I449-I501 HydrophobicContact CG2-CG2 4.19Å
450	I	89.2	Confident	83	Confident	58 Å²	58	70 Å²	70	30%	0.297	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-98.2	141.1	178.7	-59.4	169.3	0	0	0	107.1	E390 G424 S425 D426 V428	E390-I450 VanDerWaalsContact CG-O 3.31Å; E390-I450 WeakPolarHBondContact CG-O 3.47Å; G424-I450 WeakPolarHBondContact O-CD1 3.27Å; S425-I450 WeakPolarHBondContact O-CB 3.46Å; S425-I450 WeakPolarHBondContact O-CD1 3.29Å; S425-I450 VanDerWaalsContact O-CG2 3.23Å; S425-I450 WeakPolarHBondContact O-CG2 3.39Å; D426-I450 PolarHBondContact O-N 3.48Å; V428-I450 HydrophobicContact CG2-CD1 4.31Å; V428-I450 HydrophobicContact CG2-CG1 4.37Å
451	D	82.2	Confident	83.2	Confident	91 Å²	91	68 Å²	68	49%	0.487	34%	0.337	S	S	.	.			trans	-122.2	128.1	-170.9	-175.5	47	0	0	0	109.6	E390 N391	E390-D451 WeakPolarHBondContact OE1-CA 3.33Å; N391-D451 WeakPolarHBondContact CA-OD1 3.11Å; N391-D451 PolarHBondContact N-OD1 2.94Å
452	D	78.3	Confident	83.3	Confident	64 Å²	64	65.9 Å²	65.9	34%	0.342	33%	0.326	S	S	.	.			trans	-127.3	-163.9	171.9	82.2	42.9	0	0	0	114.2	E390 I454	E390-D452 PolarHBondContact OE1-N 2.89Å; D452-I454 WeakPolarHBondContact OD1-CB 3.49Å; D452-I454 PolarHBondContact OD1-N 2.87Å
453	D	73.9	Confident	83.4	Confident	147 Å²	147	61.7 Å²	61.7	79%	0.786	31%	0.306	S	S	*	.	S	Bend	trans	-125.7	20	-173.2	-73	-58.6	0	0	0	111.1	D505	D453-D505 VanDerWaalsContact CA-OD2 3.26Å; D453-D505 WeakPolarHBondContact CA-OD2 3.24Å
454	I	72.9	Confident	83.4	Confident	110 Å²	110	62.4 Å²	62.4	56%	0.564	31%	0.308	S	S	*	.	S	Bend	trans	-115.9	126.2	-175.9	-58.9	176.5	0	0	0	108.6	D452 E456 D505	D452-I454 WeakPolarHBondContact OD1-CB 3.49Å; D452-I454 PolarHBondContact OD1-N 2.87Å; I454-E456 PolarHBondContact O-N 3.24Å; I454-E456 VanDerWaalsContact O-N 3.14Å; I454-D505 PolarHBondContact N-OD2 3.1Å
455	F	65.2	Low	83.2	Confident	116 Å²	116	58.5 Å²	58.5	51%	0.509	29%	0.291	S	S	.	.			trans	-58.4	117.9	173.4	176.4	-100.9	0	0	0	112.5	D503 H506	F455-D503 VanDerWaalsContact CA-OD1 3.32Å; F455-D503 WeakPolarHBondContact CA-OD1 3.27Å; F455-D503 WeakPolarHBondContact CD2-OD2 3.26Å; F455-D503 WeakPolarHBondContact CE2-OD2 3.5Å; F455-H506 HydrophobicContact CD2-CB 3.7Å; F455-H506 HydrophobicContact CE2-CB 3.55Å; F455-H506 AromaticContact CE2-CG 3.98Å
456	E	70.8	Confident	82.8	Confident	67 Å²	67	61.1 Å²	61.1	31%	0.313	31%	0.305	S	S	.	.			trans	-116.9	169	174.7	-63.5	-168.7	152.8	0	0	112	I454 D503	I454-E456 PolarHBondContact O-N 3.24Å; I454-E456 VanDerWaalsContact O-N 3.14Å; E456-D503 PolarHBondContact N-OD1 2.83Å; E456-D503 WeakPolarHBondContact O-CB 3.44Å
457	E	66.3	Low	82.3	Confident	165 Å²	165	62.9 Å²	62.9	77%	0.771	31%	0.314	S	S	*	.			trans	-76.8	154.6	171.2	-67.6	-171	166.7	0	0	109.5	E459	E457-E459 WeakPolarHBondContact O-CG 3.46Å; E457-E459 PolarHBondContact O-N 3.28Å; E457-E459 VanDerWaalsContact O-N 3.17Å
458	D	74.5	Confident	81.9	Confident	57 Å²	57	64.2 Å²	64.2	31%	0.305	32%	0.321	S	S	.	.			trans	-60.6	122.4	173.5	-65.5	-25.2	0	0	0	110	L502 D503	D458-L502 HydrophobicContact CB-CD2 4.2Å; D458-L502 VanDerWaalsContact CG-CD2 3.43Å; D458-L502 WeakPolarHBondContact OD1-CD2 3.33Å; D458-L502 WeakPolarHBondContact OD2-CD2 3.38Å; D458-D503 PolarHBondContact OD1-N 3.31Å
459	E	81.9	Confident	81.5	Confident	47 Å²	47	64 Å²	64	22%	0.22	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	164.3	-176.3	-68.8	-172.7	162.3	0	0	113.1	T420 A421 E457 M500 I501	T420-E459 VanDerWaalsContact OG1-CA 3.25Å; T420-E459 WeakPolarHBondContact OG1-CA 3.32Å; A421-E459 VanDerWaalsContact CA-OE2 3.26Å; A421-E459 WeakPolarHBondContact CA-OE2 2.95Å; A421-E459 HydrophobicContact CB-CB 3.84Å; E457-E459 WeakPolarHBondContact O-CG 3.46Å; E457-E459 PolarHBondContact O-N 3.28Å; E457-E459 VanDerWaalsContact O-N 3.17Å; E459-M500 CarbonylContact O-C 3.58Å; E459-M500 WeakPolarHBondContact O-CA 3.45Å; E459-I501 PolarHBondContact N-O 3.49Å; E459-I501 VanDerWaalsContact N-O 3.13Å; E459-I501 PolarHBondContact O-N 2.96Å
460	H	78.3	Confident	81	Confident	54 Å²	54	63.8 Å²	63.8	25%	0.25	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	153.1	179.1	67.3	65.2	0	0	0	113.3	G419 T420 A421 Y462 T498 V499	G419-H460 CarbonylContact C-O 3.51Å; G419-H460 WeakPolarHBondContact CA-O 3.45Å; G419-H460 PolarHBondContact N-O 3.32Å; T420-H460 PolarHBondContact N-O 3.25Å; T420-H460 PolarHBondContact OG1-N 3.5Å; A421-H460 PolarHBondContact N-O 3.39Å; H460-Y462 AromaticContact CE1-CE2 3.88Å; H460-Y462 AromaticContact CE1-CZ 3.58Å; H460-Y462 PolarHBondContact CE1-OH 2.9Å; H460-Y462 AromaticContact ND1-CE2 3.89Å; H460-Y462 AromaticContact ND1-CZ 3.65Å; H460-T498 HydrophobicContact CB-CG2 4.13Å; H460-V499 CarbonylContact C-O 3.58Å; H460-V499 WeakPolarHBondContact CA-O 3.27Å; H460-V499 WeakPolarHBondContact CB-O 3.5Å
461	F	88.2	Confident	80.5	Confident	0 Å²	0	65 Å²	65	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	167.5	168.4	68.8	-90.8	0	0	0	111.1	V395 T416 A421 Y427 I447 I449 I463 V499 I501	V395-F461 HydrophobicContact CG1-CZ 4.31Å; T416-F461 HydrophobicContact CG2-CE2 4.46Å; A421-F461 HydrophobicContact CB-CB 4.32Å; A421-F461 HydrophobicContact CB-CD1 4.44Å; Y427-F461 HydrophobicContact CD1-CB 4.15Å; Y427-F461 AromaticContact CD1-CD1 3.84Å; Y427-F461 HydrophobicContact CD1-CD1 3.84Å; Y427-F461 HydrophobicContact CD1-CE1 4.44Å; Y427-F461 AromaticContact CD1-CG 3.99Å; Y427-F461 HydrophobicContact CD1-CG 3.99Å; Y427-F461 HydrophobicContact CD2-CD1 4.33Å; Y427-F461 HydrophobicContact CD2-CD2 4.22Å; Y427-F461 HydrophobicContact CD2-CE1 4.36Å; Y427-F461 HydrophobicContact CD2-CE2 4.27Å; Y427-F461 HydrophobicContact CD2-CG 4.26Å; Y427-F461 HydrophobicContact CD2-CZ 4.32Å; Y427-F461 HydrophobicContact CE1-CB 3.68Å; Y427-F461 HydrophobicContact CE1-CD1 4.24Å; Y427-F461 AromaticContact CE1-CG 3.92Å; Y427-F461 HydrophobicContact CE1-CG 3.92Å; Y427-F461 HydrophobicContact CE2-CD2 4.01Å; Y427-F461 HydrophobicContact CE2-CE2 4.39Å; Y427-F461 HydrophobicContact CE2-CG 4.17Å; Y427-F461 AromaticContact CG-CD1 3.9Å; Y427-F461 HydrophobicContact CG-CD1 3.9Å; Y427-F461 HydrophobicContact CG-CE1 4.05Å; Y427-F461 HydrophobicContact CG-CG 4.17Å; Y427-F461 HydrophobicContact CG-CZ 4.45Å; I447-F461 HydrophobicContact CD1-CE2 3.71Å; I447-F461 HydrophobicContact CD1-CZ 4.2Å; I447-F461 HydrophobicContact CG2-CE2 4.18Å; I447-F461 HydrophobicContact CG2-CZ 3.91Å; I449-F461 HydrophobicContact CD1-CE1 3.7Å; I449-F461 HydrophobicContact CD1-CZ 4.06Å; F461-I463 HydrophobicContact CD2-CG1 4.41Å; F461-I463 HydrophobicContact CE2-CD1 4.28Å; F461-I463 HydrophobicContact CE2-CG1 3.98Å; F461-V499 HydrophobicContact CD1-CB 4.16Å; F461-V499 HydrophobicContact CD2-CB 4.41Å; F461-V499 HydrophobicContact CE1-CB 3.62Å; F461-V499 HydrophobicContact CE1-CG1 3.67Å; F461-V499 HydrophobicContact CE1-CG2 4.34Å; F461-V499 HydrophobicContact CE2-CB 3.88Å; F461-V499 HydrophobicContact CE2-CG2 3.77Å; F461-V499 HydrophobicContact CZ-CB 3.47Å; F461-V499 VanDerWaalsContact CZ-CB 3.47Å; F461-V499 HydrophobicContact CZ-CG1 3.7Å; F461-V499 HydrophobicContact CZ-CG2 3.66Å; F461-V499 PolarHBondContact N-O 2.95Å; F461-V499 PolarHBondContact O-N 3.46Å; F461-I501 HydrophobicContact CD1-CD1 4.1Å; F461-I501 HydrophobicContact CD1-CG1 4.45Å; F461-I501 HydrophobicContact CE1-CD1 4.1Å; F461-I501 HydrophobicContact CE1-CG1 4.27Å
462	Y	86.1	Confident	79.7	Confident	73 Å²	73	62.8 Å²	62.8	29%	0.286	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	149.5	-174.7	-58.1	-71.7	0	0	0	112.6	T416 E417 H460 I496 A497 T498	T416-Y462 CarbonylContact C-O 3.58Å; T416-Y462 VanDerWaalsContact CA-O 3.25Å; T416-Y462 WeakPolarHBondContact CA-O 3.1Å; E417-Y462 PolarHBondContact N-O 3.09Å; E417-Y462 PolarHBondContact O-N 3.41Å; H460-Y462 AromaticContact CE1-CE2 3.88Å; H460-Y462 AromaticContact CE1-CZ 3.58Å; H460-Y462 PolarHBondContact CE1-OH 2.9Å; H460-Y462 AromaticContact ND1-CE2 3.89Å; H460-Y462 AromaticContact ND1-CZ 3.65Å; Y462-I496 HydrophobicContact CD1-CG2 4.12Å; Y462-A497 WeakPolarHBondContact CA-O 3.32Å; Y462-T498 HydrophobicContact CD1-CG2 4.17Å; Y462-T498 HydrophobicContact CE1-CG2 3.87Å
463	I	92.2	Very high	79.1	Confident	0 Å²	0	71 Å²	71	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	122	171.5	-48.4	165	0	0	0	108.3	F381 V397 R415 T416 I445 I447 F461 I496 A497 V499	F381-I463 HydrophobicContact CE1-CG2 4.38Å; F381-I463 VanDerWaalsContact CE2-O 3.25Å; F381-I463 WeakPolarHBondContact CE2-O 3.49Å; F381-I463 HydrophobicContact CZ-CB 4.07Å; F381-I463 HydrophobicContact CZ-CG2 3.81Å; V397-I463 HydrophobicContact CB-CD1 3.93Å; V397-I463 HydrophobicContact CG1-CD1 3.94Å; V397-I463 HydrophobicContact CG2-CD1 3.5Å; R415-I463 WeakPolarHBondContact O-CA 3.45Å; T416-I463 HydrophobicContact CG2-CG1 4.4Å; I445-I463 HydrophobicContact CD1-CG2 3.98Å; I447-I463 HydrophobicContact CD1-CD1 3.28Å; I447-I463 HydrophobicContact CD1-CG1 3.6Å; F461-I463 HydrophobicContact CD2-CG1 4.41Å; F461-I463 HydrophobicContact CE2-CD1 4.28Å; F461-I463 HydrophobicContact CE2-CG1 3.98Å; I463-I496 WeakPolarHBondContact O-CA 3.4Å; I463-A497 HydrophobicContact CB-CB 4.39Å; I463-A497 PolarHBondContact N-O 2.96Å; I463-A497 PolarHBondContact O-N 3.37Å; I463-V499 HydrophobicContact CD1-CG2 3.81Å; I463-V499 HydrophobicContact CG1-CG2 4.44Å
464	F	90.4	Very high	78.7	Confident	37 Å²	37	71.6 Å²	71.6	16%	0.162	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	139.5	-179.9	-68.9	-94.8	0	0	0	110.9	Y414 R415 E417 I496	Y414-F464 WeakPolarHBondContact CA-O 3.4Å; Y414-F464 WeakPolarHBondContact CB-O 3.32Å; R415-F464 HydrophobicContact CG-CB 4.16Å; R415-F464 PolarHBondContact N-O 3.49Å; R415-F464 PolarHBondContact O-N 2.84Å; E417-F464 HydrophobicContact CB-CD2 4.08Å; E417-F464 HydrophobicContact CB-CE2 3.66Å; E417-F464 HydrophobicContact CG-CE2 4.32Å; E417-F464 VanDerWaalsContact OE2-CE2 3.23Å; E417-F464 WeakPolarHBondContact OE2-CE2 3.49Å; F464-I496 HydrophobicContact CD1-CD1 4.01Å; F464-I496 HydrophobicContact CD1-CG1 3.69Å; F464-I496 HydrophobicContact CE1-CD1 3.45Å; F464-I496 VanDerWaalsContact CE1-CD1 3.45Å; F464-I496 HydrophobicContact CE1-CG1 3.64Å; F464-I496 HydrophobicContact CE1-CG2 4.28Å; F464-I496 HydrophobicContact CZ-CD1 4.24Å; F464-I496 HydrophobicContact CZ-CG2 4.37Å
465	L	89.7	Confident	78.1	Confident	1 Å²	1	68.8 Å²	68.8	1%	0.005	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	127.4	161.7	-68.3	172.5	0	0	0	109.4	V379 F381 V399 V412 D413 L434 I445 L491 S495	V379-L465 HydrophobicContact CG1-CD1 4.48Å; F381-L465 HydrophobicContact CD1-CD1 4.4Å; F381-L465 HydrophobicContact CD2-CD1 3.89Å; F381-L465 HydrophobicContact CD2-CG 4.2Å; F381-L465 HydrophobicContact CE1-CD1 4.21Å; F381-L465 HydrophobicContact CE1-CD2 4.48Å; F381-L465 HydrophobicContact CE1-CG 4.19Å; F381-L465 HydrophobicContact CE2-CB 4.33Å; F381-L465 HydrophobicContact CE2-CD1 3.72Å; F381-L465 HydrophobicContact CE2-CD2 4.5Å; F381-L465 HydrophobicContact CE2-CG 3.5Å; F381-L465 VanDerWaalsContact CE2-CG 3.5Å; F381-L465 HydrophobicContact CG-CD1 4.25Å; F381-L465 HydrophobicContact CZ-CD1 3.89Å; F381-L465 HydrophobicContact CZ-CD2 4.03Å; F381-L465 HydrophobicContact CZ-CG 3.5Å; F381-L465 VanDerWaalsContact CZ-CG 3.5Å; V399-L465 HydrophobicContact CG1-CD1 3.75Å; V399-L465 HydrophobicContact CG1-CD2 4.38Å; V399-L465 HydrophobicContact CG2-CD1 4.07Å; V399-L465 HydrophobicContact CG2-CD2 4Å; V412-L465 HydrophobicContact CG1-CD2 4Å; V412-L465 HydrophobicContact CG2-CB 3.95Å; V412-L465 HydrophobicContact CG2-CD2 4.05Å; V412-L465 HydrophobicContact CG2-CG 4.49Å; D413-L465 CarbonylContact O-C 3.57Å; D413-L465 WeakPolarHBondContact O-CA 3.44Å; L434-L465 HydrophobicContact CD1-CD2 4.34Å; I445-L465 HydrophobicContact CD1-CD2 4.49Å; L465-L491 HydrophobicContact CB-CD1 3.8Å; L465-L491 HydrophobicContact CB-CD2 4.33Å; L465-L491 HydrophobicContact CD1-CD1 4.19Å; L465-L491 WeakPolarHBondContact O-CD2 3.45Å; L465-S495 PolarHBondContact N-O 2.78Å
466	D	86.8	Confident	78.1	Confident	58 Å²	58	70.1 Å²	70.1	31%	0.31	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	169.5	-180	-81.6	-42.4	0	0	0	112.1	V412 D413 R415 L468	V412-D466 VanDerWaalsContact CG2-O 3.29Å; V412-D466 WeakPolarHBondContact CG2-O 3.47Å; D413-D466 PolarHBondContact N-O 3.45Å; D413-D466 PolarHBondContact O-N 2.9Å; R415-D466 IonicContact CZ-OD2 2.92Å; R415-D466 IonicContact NH1-OD2 2.61Å; R415-D466 PolarHBondContact NH1-OD2 3.41Å; R415-D466 IonicContact NH2-OD2 3.39Å; R415-D466 PolarHBondContact NH2-OD2 3.28Å; D466-L468 PolarHBondContact O-N 2.94Å
467	N	82.4	Confident	77.5	Confident	99 Å²	99	72.6 Å²	72.6	53%	0.529	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	55.6	50.6	168	-160	1	0	0	0	113.7	D413 R469	D413-N467 HydrophobicContact CB-CB 4.21Å; D413-N467 VanDerWaalsContact OD2-CB 3.3Å; D413-N467 WeakPolarHBondContact OD2-CB 3.37Å; D413-N467 PolarHBondContact OD2-ND2 2.88Å; N467-R469 PolarHBondContact ND2-NH1 3.39Å; N467-R469 PolarHBondContact O-N 3.35Å; N467-R469 PolarHBondContact O-NH1 2.65Å; N467-R469 VanDerWaalsContact O-NH1 3.14Å; N467-R469 PolarHBondContact OD1-NH1 3.17Å
468	L	85.8	Confident	77.3	Confident	29 Å²	29	66.5 Å²	66.5	15%	0.152	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	120.8	175.7	-172.3	84.7	0	0	0	111.1	V379 I410 V412 D466 A489	V379-L468 HydrophobicContact CB-CD1 4.09Å; V379-L468 HydrophobicContact CG2-CD1 3.88Å; I410-L468 HydrophobicContact CG2-CD1 3.42Å; I410-L468 VanDerWaalsContact CG2-CD1 3.42Å; I410-L468 HydrophobicContact CG2-CG 4.18Å; V412-L468 HydrophobicContact CB-CD1 4.1Å; V412-L468 HydrophobicContact CG2-CD1 4.27Å; D466-L468 PolarHBondContact O-N 2.94Å; L468-A489 HydrophobicContact CD2-CB 3.91Å
469	R	84.7	Confident	76.5	Confident	65 Å²	65	66.5 Å²	66.5	25%	0.245	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	139.5	177.9	-58.9	172.5	-64.1	-92.3	5.4	110.3	T411 D413 N467 L477	T411-R469 PolarHBondContact N-O 3.16Å; T411-R469 PolarHBondContact O-N 3.4Å; T411-R469 WeakPolarHBondContact OG1-CB 3.5Å; T411-R469 PolarHBondContact OG1-O 3.43Å; D413-R469 IonicContact OD1-CZ 3.63Å; D413-R469 IonicContact OD1-NH1 3.99Å; D413-R469 PolarHBondContact OD1-NH1 3.07Å; D413-R469 IonicContact OD1-NH2 3.69Å; D413-R469 PolarHBondContact OD1-NH2 3.09Å; D413-R469 IonicContact OD2-CZ 2.83Å; D413-R469 IonicContact OD2-NH1 3.98Å; D413-R469 PolarHBondContact OD2-NH1 3.28Å; D413-R469 IonicContact OD2-NH2 2.76Å; N467-R469 PolarHBondContact ND2-NH1 3.39Å; N467-R469 PolarHBondContact O-N 3.35Å; N467-R469 PolarHBondContact O-NH1 2.65Å; N467-R469 VanDerWaalsContact O-NH1 3.14Å; N467-R469 PolarHBondContact OD1-NH1 3.17Å; R469-L477 HydrophobicContact CB-CD2 4.22Å
470	V	81.9	Confident	75.3	Confident	1 Å²	1	66.1 Å²	66.1	1%	0.006	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	130.8	177.7	-176.4	0	0	0	0	109.6	L408 V478 A489	L408-V470 HydrophobicContact CB-CG1 4.31Å; L408-V470 HydrophobicContact CD1-CG1 4.35Å; L408-V470 HydrophobicContact CD2-CG1 4.29Å; V470-V478 PolarHBondContact O-N 3.46Å; V470-A489 HydrophobicContact CG2-CB 3.5Å
471	K	77	Confident	74.1	Confident	84 Å²	84	70 Å²	70	37%	0.365	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	132.1	171.5	-69.5	-178.8	179.5	178.6	0	109.9	T409 L477	T409-K471 PolarHBondContact N-O 3.4Å; T409-K471 PolarHBondContact O-N 3.32Å; K471-L477 HydrophobicContact CG-CD2 4.1Å
472	S	66.6	Low	71.9	Confident	45 Å²	45	74.5 Å²	74.5	32%	0.315	38%	0.376	S	S	.	.			trans	-70.9	168.3	171	-175.9	0	0	0	0	111.3	E474 G475 F476	S472-E474 PolarHBondContact O-N 2.95Å; S472-E474 VanDerWaalsContact O-N 3.16Å; S472-G475 PolarHBondContact O-N 2.83Å; S472-F476 PolarHBondContact N-O 2.95Å
473	R	66	Low	70	Confident	237 Å²	237	75.6 Å²	75.6	89%	0.894	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-28.8	173.6	-170.3	177.4	179.9	-176.7	0	112.9
474	E	64	Low	67.9	Low	158 Å²	158	79.9 Å²	79.9	74%	0.738	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	5.8	178.5	-65.6	179.5	-178.4	0	0	113.9	S472 F476	S472-E474 PolarHBondContact O-N 2.95Å; S472-E474 VanDerWaalsContact O-N 3.16Å; E474-F476 VanDerWaalsContact C-N 3.29Å; E474-F476 HydrophobicContact CB-CD2 3.79Å; E474-F476 HydrophobicContact CB-CE2 4.05Å; E474-F476 PolarHBondContact O-N 3.39Å
475	G	61.9	Low	66	Low	51 Å²	51	85.8 Å²	85.8	53%	0.526	46%	0.464	S	S	.	.	S	Bend	trans	83.2	-7.4	176.1	0	0	0	0	0	115.7	S472	S472-G475 PolarHBondContact O-N 2.83Å
476	F	63.6	Low	64.3	Low	144 Å²	144	88.1 Å²	88.1	63%	0.632	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-68.2	136.6	173.9	-63.6	-77.5	0	0	0	111.7	S472 E474 V478	S472-F476 PolarHBondContact N-O 2.95Å; E474-F476 VanDerWaalsContact C-N 3.29Å; E474-F476 HydrophobicContact CB-CD2 3.79Å; E474-F476 HydrophobicContact CB-CE2 4.05Å; E474-F476 PolarHBondContact O-N 3.39Å; F476-V478 PolarHBondContact O-N 3.38Å
477	L	59.9	Low	63.1	Low	119 Å²	119	91.9 Å²	91.9	62%	0.623	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.9	117.7	169.7	-74.5	164.1	0	0	0	108.6	R469 K471	R469-L477 HydrophobicContact CB-CD2 4.22Å; K471-L477 HydrophobicContact CG-CD2 4.1Å
478	V	62.4	Low	62.5	Low	37 Å²	37	89 Å²	89	22%	0.224	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	121.4	172.9	-173.3	0	0	0	0	106.7	V470 F476 L488	V470-V478 PolarHBondContact O-N 3.46Å; F476-V478 PolarHBondContact O-N 3.38Å; V478-L488 HydrophobicContact CG1-CD1 3.65Å
479	S	57.1	Low	62	Low	58 Å²	58	87.7 Å²	87.7	41%	0.406	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-56.9	130.7	170	41.5	0	0	0	0	108.5	E481 T482	S479-E481 PolarHBondContact O-N 3.17Å; S479-T482 WeakPolarHBondContact CB-OG1 3.47Å; S479-T482 PolarHBondContact O-N 3.44Å; S479-T482 WeakPolarHBondContact OG-CB 3.45Å; S479-T482 PolarHBondContact OG-OG1 3.3Å
480	P	56.2	Low	61.9	Low	39 Å²	39	85.8 Å²	85.8	25%	0.253	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-11.9	-177.3	18.2	-28.4	0	0	0	113.8	R487 L488	P480-R487 WeakPolarHBondContact O-CG 3.47Å; P480-L488 PolarHBondContact O-N 2.84Å
481	E	52.6	Low	61.9	Low	135 Å²	135	88.6 Å²	88.6	63%	0.631	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.3	-2.9	-173.2	-63.6	-176.3	166.5	0	0	115.6	S479 R487	S479-E481 PolarHBondContact O-N 3.17Å; E481-R487 IonicContact OE1-CZ 3.54Å; E481-R487 IonicContact OE1-NE 2.64Å; E481-R487 IonicContact OE1-NH2 3.52Å; E481-R487 PolarHBondContact OE1-NH2 2.93Å
482	T	43.3	Very low	61.9	Low	95 Å²	95	87.6 Å²	87.6	58%	0.583	48%	0.48	S	S	*	.			trans	-125.1	61.8	-163.4	-29.3	0	0	0	0	115.3	S479	S479-T482 WeakPolarHBondContact CB-OG1 3.47Å; S479-T482 PolarHBondContact O-N 3.44Å; S479-T482 WeakPolarHBondContact OG-CB 3.45Å; S479-T482 PolarHBondContact OG-OG1 3.3Å
483	V	44.8	Very low	62.1	Low	96 Å²	96	91.3 Å²	91.3	58%	0.582	50%	0.501	S	S	*	.	S	Bend	trans	-146	119.3	146.9	-175	0	0	0	0	108.5	T485	V483-T485 PolarHBondContact O-N 2.78Å
484	A	48.7	Very low	62	Low	90 Å²	90	82.1 Å²	82.1	74%	0.744	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	20.2	89.3	167.7	0	0	0	0	0	117.1	A486	A484-A486 VanDerWaalsContact C-N 3.35Å; A484-A486 PolarHBondContact O-N 3.21Å; A484-A486 VanDerWaalsContact O-N 3.11Å
485	T	49.9	Very low	62.7	Low	160 Å²	160	76.4 Å²	76.4	98%	0.982	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	9.5	162.4	57.3	0	0	0	0	119.8	V483	V483-T485 PolarHBondContact O-N 2.78Å
486	A	54.1	Low	63.6	Low	50 Å²	50	77.2 Å²	77.2	41%	0.413	44%	0.441	S	S	.	.	S	Bend	trans	-138.7	123.4	170.9	0	0	0	0	0	112.6	A484 L488	A484-A486 VanDerWaalsContact C-N 3.35Å; A484-A486 PolarHBondContact O-N 3.21Å; A484-A486 VanDerWaalsContact O-N 3.11Å; A486-L488 PolarHBondContact O-N 3.34Å
487	R	62	Low	64.5	Low	138 Å²	138	70.3 Å²	70.3	52%	0.521	41%	0.411	S	S	.	.			trans	-64.1	119.4	176	-147.8	176.3	-162.8	171.8	6.1	109.1	T376 P480 E481	T376-R487 WeakPolarHBondContact CB-O 3.43Å; T376-R487 WeakPolarHBondContact CG2-O 3.41Å; P480-R487 WeakPolarHBondContact O-CG 3.47Å; E481-R487 IonicContact OE1-CZ 3.54Å; E481-R487 IonicContact OE1-NE 2.64Å; E481-R487 IonicContact OE1-NH2 3.52Å; E481-R487 PolarHBondContact OE1-NH2 2.93Å
488	L	70	Confident	65.2	Low	39 Å²	39	66.3 Å²	66.3	20%	0.204	39%	0.391	C	S	.	.	S	Bend	trans	-69.3	-43.4	-172.3	-81.7	154.4	0	0	0	112.4	C377 L408 V478 P480 A486	C377-L488 PolarHBondContact N-O 3.37Å; L408-L488 HydrophobicContact CD1-CD2 4.03Å; V478-L488 HydrophobicContact CG1-CD1 3.65Å; P480-L488 PolarHBondContact O-N 2.84Å; A486-L488 PolarHBondContact O-N 3.34Å
489	A	76.3	Confident	66.3	Low	1 Å²	1	64.5 Å²	64.5	1%	0.008	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	149.5	174.2	0	0	0	0	0	111.4	C377 I410 L468 V470	C377-A489 HydrophobicContact CB-CB 4.07Å; C377-A489 CarbonylContact O-C 3.53Å; C377-A489 WeakPolarHBondContact O-CA 3.44Å; I410-A489 HydrophobicContact CD1-CB 4.28Å; L468-A489 HydrophobicContact CD2-CB 3.91Å; V470-A489 HydrophobicContact CG2-CB 3.5Å
490	A	82.5	Confident	67.3	Low	24 Å²	24	64.4 Å²	64.4	20%	0.198	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	147.5	175.9	0	0	0	0	0	110.5	C377 K378 V379 E492	C377-A490 PolarHBondContact O-N 2.81Å; K378-A490 WeakPolarHBondContact CA-O 3.4Å; V379-A490 PolarHBondContact N-O 3.05Å; A490-E492 PolarHBondContact O-N 2.86Å
491	L	80.6	Confident	68.3	Low	60 Å²	60	63 Å²	63	31%	0.314	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	120.3	166.3	-166	71.3	0	0	0	107.1	V379 V412 L465 S495	V379-L491 HydrophobicContact CB-CD1 4.39Å; V379-L491 HydrophobicContact CG1-CD1 4.38Å; V379-L491 WeakPolarHBondContact O-CD1 3.31Å; V412-L491 HydrophobicContact CG2-CD1 4.41Å; L465-L491 HydrophobicContact CB-CD1 3.8Å; L465-L491 HydrophobicContact CB-CD2 4.33Å; L465-L491 HydrophobicContact CD1-CD1 4.19Å; L465-L491 WeakPolarHBondContact O-CD2 3.45Å; L491-S495 VanDerWaalsContact CD2-CB 3.44Å
492	E	78.3	Confident	69.1	Low	64 Å²	64	57.6 Å²	57.6	30%	0.299	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-99.1	147.3	179.8	179.8	165.8	-128.1	0	0	109.6	K378 V379 S380 A490 P494	K378-E492 HydrophobicContact CB-CB 3.95Å; K378-E492 VanDerWaalsContact CB-OE2 3.28Å; K378-E492 WeakPolarHBondContact CB-OE2 3.19Å; K378-E492 HydrophobicContact CD-CB 4.24Å; K378-E492 HydrophobicContact CD-CG 4.22Å; K378-E492 WeakPolarHBondContact CD-OE1 3.41Å; K378-E492 WeakPolarHBondContact CD-OE2 3.47Å; K378-E492 WeakPolarHBondContact CE-OE1 3.49Å; K378-E492 IonicContact NZ-OE1 3.43Å; K378-E492 PolarHBondContact NZ-OE1 3.19Å; K378-E492 IonicContact NZ-OE2 3.11Å; V379-E492 PolarHBondContact O-N 3.41Å; S380-E492 WeakPolarHBondContact CB-O 3.22Å; A490-E492 PolarHBondContact O-N 2.86Å; E492-P494 CarbonylContact O-C 3.55Å; E492-P494 VanDerWaalsContact O-C 3.29Å
493	T	70.6	Confident	70.4	Confident	122 Å²	122	53.3 Å²	53.3	75%	0.748	31%	0.313	S	S	*	.	S	Bend	trans	-70	126.5	171.8	50	0	0	0	0	108.8
494	P	63.3	Low	71.6	Confident	45 Å²	45	49.8 Å²	49.8	29%	0.292	29%	0.291	S	S	.	.	P	Polyproline II helix	cis	-91.7	126.1	15.1	30.7	-29.8	0	0	0	114.1	F381 C384 E492	F381-P494 HydrophobicContact CB-CG 4.43Å; F381-P494 PolarHBondContact N-O 3.33Å; C384-P494 HydrophobicContact CB-CB 3.48Å; C384-P494 VanDerWaalsContact CB-CB 3.48Å; C384-P494 HydrophobicContact CB-CG 3.37Å; E492-P494 CarbonylContact O-C 3.55Å; E492-P494 VanDerWaalsContact O-C 3.29Å
495	S	78.7	Confident	72.5	Confident	37 Å²	37	46.8 Å²	46.8	26%	0.259	26%	0.263	S	S	.	.			trans	-93.7	-0.4	173.1	56.3	0	0	0	0	113.7	F381 L465 L491	F381-S495 WeakPolarHBondContact CE2-O 3.38Å; L465-S495 PolarHBondContact N-O 2.78Å; L491-S495 VanDerWaalsContact CD2-CB 3.44Å
496	I	81.4	Confident	73.7	Confident	68 Å²	68	40.9 Å²	40.9	35%	0.349	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	131.9	178.6	-54.2	172.2	0	0	0	106.7	F381 Y462 I463 F464	F381-I496 VanDerWaalsContact CD2-C 3.4Å; Y462-I496 HydrophobicContact CD1-CG2 4.12Å; I463-I496 WeakPolarHBondContact O-CA 3.4Å; F464-I496 HydrophobicContact CD1-CD1 4.01Å; F464-I496 HydrophobicContact CD1-CG1 3.69Å; F464-I496 HydrophobicContact CE1-CD1 3.45Å; F464-I496 VanDerWaalsContact CE1-CD1 3.45Å; F464-I496 HydrophobicContact CE1-CG1 3.64Å; F464-I496 HydrophobicContact CE1-CG2 4.28Å; F464-I496 HydrophobicContact CZ-CD1 4.24Å; F464-I496 HydrophobicContact CZ-CG2 4.37Å
497	A	81.3	Confident	74.5	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	137.2	165.8	0	0	0	0	0	109.1	F381 C384 Y386 V397 Y462 I463	F381-A497 HydrophobicContact CB-CB 4.25Å; F381-A497 HydrophobicContact CD1-CB 3.69Å; F381-A497 HydrophobicContact CD2-CB 3.76Å; F381-A497 VanDerWaalsContact CD2-N 3.34Å; F381-A497 HydrophobicContact CE1-CB 3.84Å; F381-A497 HydrophobicContact CE2-CB 3.87Å; F381-A497 VanDerWaalsContact CE2-N 3.3Å; F381-A497 HydrophobicContact CG-CB 3.65Å; F381-A497 HydrophobicContact CZ-CB 3.91Å; C384-A497 CarbonylContact O-C 3.58Å; C384-A497 VanDerWaalsContact O-CA 3.29Å; C384-A497 WeakPolarHBondContact O-CA 3.29Å; Y386-A497 HydrophobicContact CD2-CB 4.44Å; Y386-A497 HydrophobicContact CE2-CB 4.34Å; V397-A497 HydrophobicContact CG1-CB 4.07Å; Y462-A497 WeakPolarHBondContact CA-O 3.32Å; I463-A497 HydrophobicContact CB-CB 4.39Å; I463-A497 PolarHBondContact N-O 2.96Å; I463-A497 PolarHBondContact O-N 3.37Å
498	T	76.1	Confident	75.4	Confident	34 Å²	34	32.4 Å²	32.4	21%	0.209	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	130.9	170.9	-51	0	0	0	0	107.9	C384 H385 Y386 H460 Y462	C384-T498 PolarHBondContact O-N 2.92Å; H385-T498 CarbonylContact C-O 3.55Å; H385-T498 WeakPolarHBondContact CA-O 3.09Å; Y386-T498 PolarHBondContact N-O 2.89Å; H460-T498 HydrophobicContact CB-CG2 4.13Å; Y462-T498 HydrophobicContact CD1-CG2 4.17Å; Y462-T498 HydrophobicContact CE1-CG2 3.87Å
499	V	84.7	Confident	76.2	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	119	170.6	-175.7	0	0	0	0	107	Y386 V388 V395 V397 H460 F461 I463	Y386-V499 CarbonylContact O-C 3.58Å; Y386-V499 WeakPolarHBondContact O-CA 3.48Å; V388-V499 HydrophobicContact CG2-CG1 3.98Å; V395-V499 HydrophobicContact CG1-CG1 4.24Å; V395-V499 HydrophobicContact CG2-CG1 4.24Å; V397-V499 HydrophobicContact CG2-CG2 4.09Å; H460-V499 CarbonylContact C-O 3.58Å; H460-V499 WeakPolarHBondContact CA-O 3.27Å; H460-V499 WeakPolarHBondContact CB-O 3.5Å; F461-V499 HydrophobicContact CD1-CB 4.16Å; F461-V499 HydrophobicContact CD2-CB 4.41Å; F461-V499 HydrophobicContact CE1-CB 3.62Å; F461-V499 HydrophobicContact CE1-CG1 3.67Å; F461-V499 HydrophobicContact CE1-CG2 4.34Å; F461-V499 HydrophobicContact CE2-CB 3.88Å; F461-V499 HydrophobicContact CE2-CG2 3.77Å; F461-V499 HydrophobicContact CZ-CB 3.47Å; F461-V499 VanDerWaalsContact CZ-CB 3.47Å; F461-V499 HydrophobicContact CZ-CG1 3.7Å; F461-V499 HydrophobicContact CZ-CG2 3.66Å; F461-V499 PolarHBondContact N-O 2.95Å; F461-V499 PolarHBondContact O-N 3.46Å; I463-V499 HydrophobicContact CD1-CG2 3.81Å; I463-V499 HydrophobicContact CG1-CG2 4.44Å
500	M	78.9	Confident	76.9	Confident	55 Å²	55	31.9 Å²	31.9	27%	0.271	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	123.9	173.3	-173.5	168.8	69.4	0	0	108.3	Y386 T387 V388 E459 L502	Y386-M500 PolarHBondContact O-N 3.3Å; T387-M500 CarbonylContact C-O 3.6Å; T387-M500 WeakPolarHBondContact CA-O 3.21Å; T387-M500 HydrophobicContact CG2-CB 4.46Å; T387-M500 HydrophobicContact CG2-CE 3.41Å; T387-M500 VanDerWaalsContact CG2-CE 3.41Å; T387-M500 WeakPolarHBondContact OG1-CE 3.32Å; V388-M500 PolarHBondContact N-O 2.88Å; E459-M500 CarbonylContact O-C 3.58Å; E459-M500 WeakPolarHBondContact O-CA 3.45Å; M500-L502 HydrophobicContact CE-CD2 3.87Å; M500-L502 HydrophobicContact CG-CD2 4.3Å; M500-L502 HydrophobicContact SD-CD2 4.42Å
501	I	76.9	Confident	77.3	Confident	10 Å²	10	31 Å²	31	5%	0.051	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	120.7	172.8	-53.5	172.3	0	0	0	105.8	V388 E390 A421 D426 I449 E459 F461	V388-I501 CarbonylContact O-C 3.01Å; V388-I501 WeakPolarHBondContact O-CA 3.45Å; E390-I501 HydrophobicContact CB-CG2 4.15Å; E390-I501 HydrophobicContact CG-CG2 4.18Å; A421-I501 HydrophobicContact CB-CD1 4.17Å; D426-I501 HydrophobicContact CB-CD1 3.99Å; I449-I501 HydrophobicContact CD1-CD1 4.12Å; I449-I501 HydrophobicContact CD1-CG1 4.3Å; I449-I501 HydrophobicContact CG2-CD1 4.19Å; I449-I501 HydrophobicContact CG2-CG1 4.47Å; I449-I501 HydrophobicContact CG2-CG2 4.19Å; E459-I501 PolarHBondContact N-O 3.49Å; E459-I501 VanDerWaalsContact N-O 3.13Å; E459-I501 PolarHBondContact O-N 2.96Å; F461-I501 HydrophobicContact CD1-CD1 4.1Å; F461-I501 HydrophobicContact CD1-CG1 4.45Å; F461-I501 HydrophobicContact CE1-CD1 4.1Å; F461-I501 HydrophobicContact CE1-CG1 4.27Å
502	L	68.6	Low	77.9	Confident	21 Å²	21	28.2 Å²	28.2	11%	0.11	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	123	174.8	-66.5	-178.6	0	0	0	108.1	T387 V388 L389 E390 D458 M500 D504	T387-L502 HydrophobicContact CG2-CD1 3.33Å; T387-L502 HydrophobicContact CG2-CD2 4.07Å; T387-L502 HydrophobicContact CG2-CG 3.48Å; T387-L502 VanDerWaalsContact CG2-CG 3.48Å; V388-L502 PolarHBondContact O-N 2.82Å; L389-L502 WeakPolarHBondContact CA-O 3.36Å; L389-L502 HydrophobicContact CD2-CB 4.16Å; E390-L502 PolarHBondContact N-O 2.96Å; E390-L502 VanDerWaalsContact N-O 3.08Å; D458-L502 HydrophobicContact CB-CD2 4.2Å; D458-L502 VanDerWaalsContact CG-CD2 3.43Å; D458-L502 WeakPolarHBondContact OD1-CD2 3.33Å; D458-L502 WeakPolarHBondContact OD2-CD2 3.38Å; M500-L502 HydrophobicContact CE-CD2 3.87Å; M500-L502 HydrophobicContact CG-CD2 4.3Å; M500-L502 HydrophobicContact SD-CD2 4.42Å; L502-D504 PolarHBondContact O-N 2.85Å
503	D	71.5	Confident	78.4	Confident	5 Å²	5	29.8 Å²	29.8	3%	0.027	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-59.3	128.9	165.3	174	96.3	0	0	0	108.5	F455 E456 D458 D505 G535	F455-D503 VanDerWaalsContact CA-OD1 3.32Å; F455-D503 WeakPolarHBondContact CA-OD1 3.27Å; F455-D503 WeakPolarHBondContact CD2-OD2 3.26Å; F455-D503 WeakPolarHBondContact CE2-OD2 3.5Å; E456-D503 PolarHBondContact N-OD1 2.83Å; E456-D503 WeakPolarHBondContact O-CB 3.44Å; D458-D503 PolarHBondContact OD1-N 3.31Å; D503-D505 PolarHBondContact OD2-N 2.95Å; D503-D505 VanDerWaalsContact OD2-N 3.13Å; D503-G535 VanDerWaalsContact O-CA 3.23Å; D503-G535 WeakPolarHBondContact O-CA 3.25Å; D503-G535 PolarHBondContact O-N 3.35Å
504	D	68.7	Low	79.2	Confident	22 Å²	22	27.6 Å²	27.6	12%	0.118	15%	0.15	C	C	.	.			trans	-103.7	-1.4	-178	74.8	-13.4	0	0	0	113.4	L389 N391 L502 H506 C536	L389-D504 HydrophobicContact CD2-CB 4.02Å; N391-D504 VanDerWaalsContact CG-OD2 3.24Å; N391-D504 PolarHBondContact ND2-OD2 2.89Å; L502-D504 PolarHBondContact O-N 2.85Å; D504-H506 PolarHBondContact O-N 2.64Å; D504-C536 PolarHBondContact O-N 2.93Å
505	D	68	Low	80.5	Confident	28 Å²	28	30.1 Å²	30.1	15%	0.15	16%	0.161	C	C	.	.	S	Bend	trans	-82.7	-12.4	-169.1	-106.3	-29.7	0	0	0	115.1	D453 I454 D503 R537	D453-D505 VanDerWaalsContact CA-OD2 3.26Å; D453-D505 WeakPolarHBondContact CA-OD2 3.24Å; I454-D505 PolarHBondContact N-OD2 3.1Å; D503-D505 PolarHBondContact OD2-N 2.95Å; D503-D505 VanDerWaalsContact OD2-N 3.13Å; D505-R537 IonicContact OD1-CZ 3.99Å; D505-R537 IonicContact OD1-NH1 3.2Å; D505-R537 PolarHBondContact OD1-NH1 3.22Å
506	H	74.7	Confident	81	Confident	36 Å²	36	30.5 Å²	30.5	17%	0.167	16%	0.162	C	C	.	.	S	Bend	trans	-91.9	155.2	174.6	-167.6	84.7	0	0	0	113	F455 D504 G508 T534 G535 C536 R537 M628	F455-H506 HydrophobicContact CD2-CB 3.7Å; F455-H506 HydrophobicContact CE2-CB 3.55Å; F455-H506 AromaticContact CE2-CG 3.98Å; D504-H506 PolarHBondContact O-N 2.64Å; H506-G508 PolarHBondContact CD2-N 3Å; H506-G508 VanDerWaalsContact CD2-N 3.34Å; H506-G508 PolarHBondContact O-N 3.26Å; H506-T534 WeakPolarHBondContact CB-O 3.4Å; H506-T534 PolarHBondContact CD2-O 3.32Å; H506-G535 CarbonylContact O-C 3.59Å; H506-G535 WeakPolarHBondContact O-CA 3.37Å; H506-C536 PolarHBondContact O-N 3.16Å; H506-R537 PolarHBondContact O-N 3.48Å; H506-M628 PolarHBondContact CE1-O 3.24Å; H506-M628 VanDerWaalsContact CE1-O 3.26Å
507	P	72.4	Confident	81.5	Confident	10 Å²	10	28.8 Å²	28.8	7%	0.065	15%	0.151	C	C	.	.			trans	-70.2	-6.2	176.2	26.3	-37.1	0	0	0	115.6	R532 R537 P631	P507-R532 VanDerWaalsContact O-CZ 3.3Å; P507-R532 PolarHBondContact O-NE 3.15Å; P507-R532 PolarHBondContact O-NH2 2.64Å; P507-R537 VanDerWaalsContact CA-O 3.31Å; P507-R537 WeakPolarHBondContact CA-O 3.26Å; P507-P631 HydrophobicContact CB-CB 4.47Å
508	G	81	Confident	81.9	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.178	C	C	.	.			trans	94.8	152.2	173.5	0	0	0	0	0	116.7	H506 Q533 T534 G535 P631 T632	H506-G508 PolarHBondContact CD2-N 3Å; H506-G508 VanDerWaalsContact CD2-N 3.34Å; H506-G508 PolarHBondContact O-N 3.26Å; G508-Q533 CarbonylContact C-O 3.51Å; G508-Q533 VanDerWaalsContact CA-O 3.29Å; G508-Q533 WeakPolarHBondContact CA-O 2.96Å; G508-T534 WeakPolarHBondContact CA-O 3.35Å; G508-G535 WeakPolarHBondContact CA-O 3.29Å; G508-G535 PolarHBondContact N-O 3.3Å; G508-P631 WeakPolarHBondContact O-CA 3.45Å; G508-T632 PolarHBondContact O-N 3.32Å
509	V	85.3	Confident	82.5	Confident	28 Å²	28	33.5 Å²	33.5	17%	0.17	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	125.2	172.1	176	0	0	0	0	108.7	R532 Q533 T534 T632	V509-R532 CarbonylContact O-C 3.58Å; V509-R532 WeakPolarHBondContact O-CA 3.49Å; V509-Q533 PolarHBondContact N-O 3.49Å; V509-Q533 PolarHBondContact O-N 3.4Å; V509-T534 WeakPolarHBondContact CG2-OG1 3.28Å; V509-T632 WeakPolarHBondContact CA-O 3.42Å; V509-T632 WeakPolarHBondContact CG2-OG1 3.34Å
510	F	90.9	Very high	82.4	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	125.9	-173.7	-63.5	-94	0	0	0	112.2	V531 R532 V540 V542 F566 P598 P631 T632 G634	F510-V531 WeakPolarHBondContact CA-O 3.28Å; F510-R532 HydrophobicContact CD1-CB 3.97Å; F510-R532 HydrophobicContact CD1-CG 4.13Å; F510-R532 HydrophobicContact CE1-CB 3.72Å; F510-R532 HydrophobicContact CE1-CG 3.57Å; F510-R532 HydrophobicContact CE2-CG 4.23Å; F510-R532 HydrophobicContact CZ-CB 4.3Å; F510-R532 HydrophobicContact CZ-CG 3.62Å; F510-V540 HydrophobicContact CD2-CG1 4.35Å; F510-V540 HydrophobicContact CE1-CB 4.38Å; F510-V540 HydrophobicContact CE1-CG1 4.38Å; F510-V540 HydrophobicContact CE2-CB 4.01Å; F510-V540 HydrophobicContact CE2-CG1 3.54Å; F510-V540 HydrophobicContact CE2-CG2 4.15Å; F510-V540 HydrophobicContact CZ-CB 3.54Å; F510-V540 HydrophobicContact CZ-CG1 3.54Å; F510-V540 HydrophobicContact CZ-CG2 3.87Å; F510-V542 HydrophobicContact CB-CG1 4.34Å; F510-V542 HydrophobicContact CB-CG2 4.17Å; F510-V542 HydrophobicContact CD1-CG2 3.43Å; F510-V542 VanDerWaalsContact CD1-CG2 3.43Å; F510-V542 HydrophobicContact CD2-CG2 4.23Å; F510-V542 HydrophobicContact CE1-CG2 3.78Å; F510-V542 HydrophobicContact CG-CG2 3.66Å; F510-V542 HydrophobicContact CZ-CG2 4.34Å; F510-F566 AromaticContact CD1-CD2 3.97Å; F510-F566 HydrophobicContact CD1-CD2 3.97Å; F510-F566 HydrophobicContact CD1-CE1 4.45Å; F510-F566 AromaticContact CD1-CE2 3.84Å; F510-F566 HydrophobicContact CD1-CE2 3.84Å; F510-F566 HydrophobicContact CD1-CG 4.35Å; F510-F566 HydrophobicContact CD1-CZ 4.09Å; F510-F566 HydrophobicContact CE1-CB 4.06Å; F510-F566 AromaticContact CE1-CD1 3.95Å; F510-F566 HydrophobicContact CE1-CD1 3.95Å; F510-F566 AromaticContact CE1-CD2 3.57Å; F510-F566 HydrophobicContact CE1-CD2 3.57Å; F510-F566 HydrophobicContact CE1-CE1 4.25Å; F510-F566 AromaticContact CE1-CE2 3.92Å; F510-F566 HydrophobicContact CE1-CE2 3.92Å; F510-F566 AromaticContact CE1-CG 3.59Å; F510-F566 HydrophobicContact CE1-CG 3.59Å; F510-F566 HydrophobicContact CE1-CZ 4.24Å; F510-P598 HydrophobicContact CD2-CB 3.92Å; F510-P598 HydrophobicContact CD2-CG 4.04Å; F510-P598 HydrophobicContact CE2-CB 4.26Å; F510-P631 HydrophobicContact CD2-CB 4.36Å; F510-P631 HydrophobicContact CE2-CB 3.81Å; F510-T632 PolarHBondContact N-O 3.3Å; F510-G634 PolarHBondContact O-N 3.36Å
511	S	90.5	Very high	82.6	Confident	6 Å²	6	33.2 Å²	33.2	4%	0.042	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	163.5	178.1	61.8	0	0	0	0	112.7	V530 V531 I636	S511-V530 CarbonylContact O-C 3.58Å; S511-V530 WeakPolarHBondContact O-CA 3.45Å; S511-V531 PolarHBondContact N-O 3.16Å; S511-V531 PolarHBondContact O-N 2.84Å; S511-I636 WeakPolarHBondContact CA-O 2.91Å; S511-I636 WeakPolarHBondContact CB-O 3.39Å
512	F	93.6	Very high	82.6	Confident	2 Å²	2	36.7 Å²	36.7	1%	0.009	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	146.4	170	-65.3	-70	0	0	0	111.2	N514 I528 K529 V530 L575 V593 L595 I636 C639	F512-N514 VanDerWaalsContact C-N 3.3Å; F512-N514 PolarHBondContact O-N 3.44Å; F512-I528 HydrophobicContact CD1-CG2 3.62Å; F512-I528 HydrophobicContact CE1-CG2 3.85Å; F512-K529 WeakPolarHBondContact CA-O 2.81Å; F512-V530 HydrophobicContact CD1-CG2 3.76Å; F512-V530 HydrophobicContact CE1-CG2 3.75Å; F512-L575 HydrophobicContact CE1-CD1 4.24Å; F512-V593 HydrophobicContact CE1-CG1 4.24Å; F512-V593 VanDerWaalsContact CE2-O 3.24Å; F512-V593 WeakPolarHBondContact CE2-O 3.5Å; F512-V593 HydrophobicContact CZ-CB 3.91Å; F512-V593 HydrophobicContact CZ-CG1 3.73Å; F512-L595 HydrophobicContact CD1-CD1 4.44Å; F512-L595 HydrophobicContact CD2-CD1 4.12Å; F512-L595 HydrophobicContact CD2-CG 4.22Å; F512-L595 HydrophobicContact CE1-CD1 4.33Å; F512-L595 HydrophobicContact CE1-CD2 4.04Å; F512-L595 HydrophobicContact CE1-CG 4.1Å; F512-L595 HydrophobicContact CE2-CD1 4.02Å; F512-L595 HydrophobicContact CE2-CD2 4.35Å; F512-L595 HydrophobicContact CE2-CG 3.61Å; F512-L595 HydrophobicContact CG-CD1 4.34Å; F512-L595 HydrophobicContact CZ-CD1 4.12Å; F512-L595 HydrophobicContact CZ-CD2 3.75Å; F512-L595 HydrophobicContact CZ-CG 3.53Å; F512-I636 HydrophobicContact CB-CG2 3.96Å; F512-I636 HydrophobicContact CD2-CG2 4.5Å; F512-I636 WeakPolarHBondContact CD2-O 3.48Å; F512-I636 PolarHBondContact N-O 2.81Å; F512-C639 HydrophobicContact CB-CB 4.22Å; F512-C639 HydrophobicContact CD1-CB 4.04Å; F512-C639 HydrophobicContact CD2-CB 3.43Å; F512-C639 VanDerWaalsContact CD2-CB 3.43Å; F512-C639 HydrophobicContact CE1-CB 4.23Å; F512-C639 HydrophobicContact CE2-CB 3.63Å; F512-C639 HydrophobicContact CG-CB 3.64Å; F512-C639 HydrophobicContact CZ-CB 4.03Å
513	E	89.4	Confident	83.2	Confident	97 Å²	97	38.4 Å²	38.4	45%	0.453	21%	0.213	S	C	.	.	S	Bend	trans	-59.7	-41.1	175.3	-176.2	-173.2	-169.5	0	0	112	K529 V531	E513-K529 HydrophobicContact CB-CB 4.08Å; E513-K529 PolarHBondContact N-O 3.44Å; E513-K529 WeakPolarHBondContact OE2-CD 3.27Å; E513-V531 HydrophobicContact CB-CG2 3.84Å; E513-V531 HydrophobicContact CG-CG2 4.4Å
514	N	88.4	Confident	83.7	Confident	75 Å²	75	39.9 Å²	39.9	40%	0.401	23%	0.229	S	C	.	.			trans	-131.3	146	179.8	-63.9	-64.3	0	0	0	109.9	F512 T516 Y517	F512-N514 VanDerWaalsContact C-N 3.3Å; F512-N514 PolarHBondContact O-N 3.44Å; N514-T516 VanDerWaalsContact C-N 3.27Å; N514-Y517 HydrophobicContact CB-CD2 4.27Å; N514-Y517 HydrophobicContact CB-CE2 3.72Å; N514-Y517 WeakPolarHBondContact O-CE2 3.46Å
515	D	89.3	Confident	84.6	Confident	99 Å²	99	42 Å²	42	53%	0.529	24%	0.241	S	C	.	.	S	Bend	trans	-74.7	-19.1	175.2	69.7	-2.4	0	0	0	113	I636 C639 I640	D515-I636 HydrophobicContact CB-CG2 3.96Å; D515-C639 CarbonylContact O-C 3.48Å; D515-C639 WeakPolarHBondContact O-CA 3.23Å; D515-I640 PolarHBondContact O-N 3.24Å
516	T	90.2	Very high	85.7	Confident	45 Å²	45	41 Å²	41	28%	0.276	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	130.9	-174.5	-48.8	0	0	0	0	111.1	N514 I640 K642	N514-T516 VanDerWaalsContact C-N 3.27Å; T516-I640 CarbonylContact C-O 3.56Å; T516-I640 VanDerWaalsContact CA-O 3.23Å; T516-I640 WeakPolarHBondContact CA-O 3Å; T516-K642 HydrophobicContact CG2-CD 3.95Å; T516-K642 HydrophobicContact CG2-CG 4.25Å
517	Y	91.2	Very high	86.6	Confident	32 Å²	32	44.3 Å²	44.3	13%	0.125	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	142.9	170.9	-74	-106.8	0	0	0	110.1	N514 I528 K529 C639 I640 I641 K642	N514-Y517 HydrophobicContact CB-CD2 4.27Å; N514-Y517 HydrophobicContact CB-CE2 3.72Å; N514-Y517 WeakPolarHBondContact O-CE2 3.46Å; Y517-I528 HydrophobicContact CD2-CG2 4.39Å; Y517-I528 HydrophobicContact CE2-CG2 3.83Å; Y517-K529 PolarHBondContact OH-N 2.81Å; Y517-C639 WeakPolarHBondContact CD2-SG 3.29Å; Y517-I640 PolarHBondContact N-O 3Å; Y517-I641 WeakPolarHBondContact O-CA 3.43Å; Y517-K642 PolarHBondContact O-N 3.05Å
518	E	88.9	Confident	87.5	Confident	119 Å²	119	43.9 Å²	43.9	56%	0.556	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.2	122.5	173.1	-60.6	-166.3	157.8	0	0	109.9	K642 K644	E518-K642 WeakPolarHBondContact CA-O 3.45Å; E518-K642 HydrophobicContact CG-CB 4.39Å; E518-K644 VanDerWaalsContact OE1-CE 3.24Å; E518-K644 WeakPolarHBondContact OE1-CE 3.27Å; E518-K644 IonicContact OE1-NZ 2.93Å; E518-K644 PolarHBondContact OE1-NZ 2.8Å; E518-K644 WeakPolarHBondContact OE2-CE 3.34Å; E518-K644 IonicContact OE2-NZ 2.8Å; E518-K644 PolarHBondContact OE2-NZ 3.47Å
519	V	89.4	Confident	88.1	Confident	14 Å²	14	47 Å²	47	9%	0.085	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	140.8	-178.5	68.5	0	0	0	0	110.5	A523 V526 I579 I641 K642 I643 K644	V519-A523 HydrophobicContact CG2-CB 3.6Å; V519-V526 HydrophobicContact CB-CB 4.26Å; V519-V526 HydrophobicContact CB-CG2 4.18Å; V519-V526 HydrophobicContact CG1-CB 4.34Å; V519-V526 HydrophobicContact CG1-CG2 4.5Å; V519-V526 HydrophobicContact CG2-CB 4.14Å; V519-V526 HydrophobicContact CG2-CG2 4.44Å; V519-I579 HydrophobicContact CG1-CD1 4.08Å; V519-I579 HydrophobicContact CG1-CG1 4.02Å; V519-I579 HydrophobicContact CG2-CG1 4.39Å; V519-I641 HydrophobicContact CG1-CG2 3.85Å; V519-K642 PolarHBondContact N-O 2.84Å; V519-I643 HydrophobicContact CG1-CG1 4.23Å; V519-I643 WeakPolarHBondContact O-CA 3.28Å; V519-K644 PolarHBondContact O-N 2.82Å
520	S	83.5	Confident	88.5	Confident	45 Å²	45	45.7 Å²	45.7	32%	0.315	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	138.3	170.8	177.4	0	0	0	0	109.1	V522 A523	S520-V522 PolarHBondContact O-N 3.02Å; S520-A523 VanDerWaalsContact O-CB 3.28Å; S520-A523 WeakPolarHBondContact O-CB 3.17Å; S520-A523 PolarHBondContact O-N 3.39Å
521	E	81.7	Confident	88.4	Confident	3 Å²	3	47.1 Å²	47.1	1%	0.014	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-17.4	176.4	69.4	177.1	161.6	0	0	114.3	N581 E583 Q584 R587 I643 K644	E521-N581 WeakPolarHBondContact O-CB 3.37Å; E521-E583 PolarHBondContact OE2-N 2.82Å; E521-Q584 PolarHBondContact OE1-N 3.14Å; E521-Q584 PolarHBondContact OE2-N 2.99Å; E521-R587 IonicContact OE2-NH1 3.84Å; E521-I643 HydrophobicContact CB-CG2 3.98Å; E521-K644 PolarHBondContact N-O 3.15Å
522	V	78.4	Confident	88.3	Confident	83 Å²	83	47 Å²	47	50%	0.503	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-7.3	-179.5	-167.9	0	0	0	0	112.3	S520 G524	S520-V522 PolarHBondContact O-N 3.02Å; V522-G524 PolarHBondContact O-N 3.47Å; V522-G524 VanDerWaalsContact O-N 3.15Å
523	A	80	Confident	87.7	Confident	58 Å²	58	51.5 Å²	51.5	48%	0.479	28%	0.284	S	S	.	.	S	Bend	trans	-64.3	-20	-177.1	0	0	0	0	0	113.2	V519 S520 D525	V519-A523 HydrophobicContact CG2-CB 3.6Å; S520-A523 VanDerWaalsContact O-CB 3.28Å; S520-A523 WeakPolarHBondContact O-CB 3.17Å; S520-A523 PolarHBondContact O-N 3.39Å; A523-D525 PolarHBondContact O-N 3.24Å
524	G	82.3	Confident	86.9	Confident	35 Å²	35	48.9 Å²	48.9	36%	0.361	28%	0.275	S	S	.	.	S	Bend	trans	79.9	-49.7	-176.8	0	0	0	0	0	111.8	V522 I579	V522-G524 PolarHBondContact O-N 3.47Å; V522-G524 VanDerWaalsContact O-N 3.15Å; G524-I579 PolarHBondContact O-N 3.31Å
525	D	87.7	Confident	86.2	Confident	68 Å²	68	45.5 Å²	45.5	36%	0.364	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	151.8	179.8	-60	-56.8	0	0	0	112.6	A523 Q576 I577 G578	A523-D525 PolarHBondContact O-N 3.24Å; D525-Q576 HydrophobicContact CB-CG 3.64Å; D525-Q576 VanDerWaalsContact CG-NE2 3.28Å; D525-Q576 PolarHBondContact OD2-NE2 3.21Å; D525-I577 CarbonylContact C-O 3.59Å; D525-I577 WeakPolarHBondContact CA-O 3.21Å; D525-G578 WeakPolarHBondContact OD1-CA 3.43Å
526	V	92	Very high	85.7	Confident	6 Å²	6	40.9 Å²	40.9	4%	0.036	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	131	165	64.5	0	0	0	0	109.8	V519 I528 Q576 I577 I579 F591 I641	V519-V526 HydrophobicContact CB-CB 4.26Å; V519-V526 HydrophobicContact CB-CG2 4.18Å; V519-V526 HydrophobicContact CG1-CB 4.34Å; V519-V526 HydrophobicContact CG1-CG2 4.5Å; V519-V526 HydrophobicContact CG2-CB 4.14Å; V519-V526 HydrophobicContact CG2-CG2 4.44Å; V526-I528 HydrophobicContact CG1-CD1 4.16Å; V526-I528 HydrophobicContact CG1-CG1 4.34Å; V526-I528 HydrophobicContact CG2-CG1 4.09Å; V526-Q576 WeakPolarHBondContact O-CA 3.21Å; V526-I577 HydrophobicContact CG1-CB 3.81Å; V526-I577 PolarHBondContact N-O 2.99Å; V526-I577 PolarHBondContact O-N 3.02Å; V526-I579 HydrophobicContact CB-CD1 4.33Å; V526-I579 HydrophobicContact CB-CG1 4.27Å; V526-I579 HydrophobicContact CG1-CD1 3.92Å; V526-I579 HydrophobicContact CG1-CG1 4.29Å; V526-F591 HydrophobicContact CG1-CZ 4.41Å; V526-I641 HydrophobicContact CB-CG2 4.47Å; V526-I641 HydrophobicContact CG1-CD1 4.29Å; V526-I641 HydrophobicContact CG1-CG2 4.22Å; V526-I641 HydrophobicContact CG2-CG2 4.17Å
527	I	92.2	Very high	85.1	Confident	106 Å²	106	45.2 Å²	45.2	54%	0.544	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	120	175.7	-56.5	175	0	0	0	108.3	L575	I527-L575 CarbonylContact C-O 3.59Å; I527-L575 WeakPolarHBondContact CA-O 3.46Å
528	I	92.7	Very high	84.5	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	124.5	-176.1	-54	159.9	0	0	0	108.4	F512 Y517 V526 S574 L575 I577 V593 I641	F512-I528 HydrophobicContact CD1-CG2 3.62Å; F512-I528 HydrophobicContact CE1-CG2 3.85Å; Y517-I528 HydrophobicContact CD2-CG2 4.39Å; Y517-I528 HydrophobicContact CE2-CG2 3.83Å; V526-I528 HydrophobicContact CG1-CD1 4.16Å; V526-I528 HydrophobicContact CG1-CG1 4.34Å; V526-I528 HydrophobicContact CG2-CG1 4.09Å; I528-S574 CarbonylContact O-C 3.57Å; I528-S574 WeakPolarHBondContact O-CA 3.46Å; I528-L575 HydrophobicContact CB-CB 4.34Å; I528-L575 PolarHBondContact N-O 3.47Å; I528-L575 PolarHBondContact O-N 3.37Å; I528-I577 HydrophobicContact CD1-CD1 3.62Å; I528-I577 HydrophobicContact CD1-CG1 4.32Å; I528-V593 HydrophobicContact CD1-CG2 3.97Å; I528-I641 HydrophobicContact CD1-CD1 3.38Å; I528-I641 HydrophobicContact CD1-CG1 4Å; I528-I641 HydrophobicContact CG1-CD1 4.38Å
529	K	92.5	Very high	84.4	Confident	67 Å²	67	43.5 Å²	43.5	29%	0.291	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	135.7	179	-69.9	-174.8	163.1	-152.1	0	112.4	F512 E513 Y517 E572 K573	F512-K529 WeakPolarHBondContact CA-O 2.81Å; E513-K529 HydrophobicContact CB-CB 4.08Å; E513-K529 PolarHBondContact N-O 3.44Å; E513-K529 WeakPolarHBondContact OE2-CD 3.27Å; Y517-K529 PolarHBondContact OH-N 2.81Å; K529-E572 VanDerWaalsContact NZ-CD 3.32Å; K529-E572 IonicContact NZ-OE1 2.66Å; K529-E572 PolarHBondContact NZ-OE1 3.17Å; K529-E572 IonicContact NZ-OE2 2.65Å; K529-E572 PolarHBondContact NZ-OE2 2.92Å; K529-K573 WeakPolarHBondContact CA-O 3.32Å
530	V	92.9	Very high	84.3	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	127.2	168.6	-179.1	0	0	0	0	107.4	S511 F512 L564 F566 E572 K573 L575 L595	S511-V530 CarbonylContact O-C 3.58Å; S511-V530 WeakPolarHBondContact O-CA 3.45Å; F512-V530 HydrophobicContact CD1-CG2 3.76Å; F512-V530 HydrophobicContact CE1-CG2 3.75Å; V530-L564 HydrophobicContact CB-CD1 3.83Å; V530-L564 HydrophobicContact CG1-CD1 4.28Å; V530-L564 HydrophobicContact CG2-CD1 3.57Å; V530-F566 HydrophobicContact CB-CZ 4.16Å; V530-F566 HydrophobicContact CG1-CE2 4.19Å; V530-F566 HydrophobicContact CG1-CZ 3.88Å; V530-E572 CarbonylContact O-C 3.53Å; V530-E572 VanDerWaalsContact O-CA 3.28Å; V530-E572 WeakPolarHBondContact O-CA 3.45Å; V530-K573 PolarHBondContact N-O 2.92Å; V530-K573 PolarHBondContact O-N 3.21Å; V530-L575 HydrophobicContact CG2-CD1 4.17Å; V530-L595 HydrophobicContact CG1-CD1 3.87Å; V530-L595 HydrophobicContact CG2-CD1 4.31Å; V530-L595 HydrophobicContact CG2-CD2 4.06Å
531	V	90.4	Very high	84.7	Confident	29 Å²	29	43.3 Å²	43.3	18%	0.176	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	138.9	-175.7	-166.9	0	0	0	0	108.9	F510 S511 E513 Q533 I571	F510-V531 WeakPolarHBondContact CA-O 3.28Å; S511-V531 PolarHBondContact N-O 3.16Å; S511-V531 PolarHBondContact O-N 2.84Å; E513-V531 HydrophobicContact CB-CG2 3.84Å; E513-V531 HydrophobicContact CG-CG2 4.4Å; V531-Q533 HydrophobicContact CG1-CG 4.16Å; V531-I571 CarbonylContact C-O 3.53Å; V531-I571 WeakPolarHBondContact CA-O 3.3Å
532	R	87.3	Confident	85.2	Confident	5 Å²	5	43.1 Å²	43.1	2%	0.019	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	121.9	170.2	-176.3	-173.8	-166.8	175.8	-0.8	107.8	P507 V509 F510 G535 C536 R537 G538 F566 E567 E570 I571	P507-R532 VanDerWaalsContact O-CZ 3.3Å; P507-R532 PolarHBondContact O-NE 3.15Å; P507-R532 PolarHBondContact O-NH2 2.64Å; V509-R532 CarbonylContact O-C 3.58Å; V509-R532 WeakPolarHBondContact O-CA 3.49Å; F510-R532 HydrophobicContact CD1-CB 3.97Å; F510-R532 HydrophobicContact CD1-CG 4.13Å; F510-R532 HydrophobicContact CE1-CB 3.72Å; F510-R532 HydrophobicContact CE1-CG 3.57Å; F510-R532 HydrophobicContact CE2-CG 4.23Å; F510-R532 HydrophobicContact CZ-CB 4.3Å; F510-R532 HydrophobicContact CZ-CG 3.62Å; R532-G535 WeakPolarHBondContact CG-O 3.21Å; R532-G535 PolarHBondContact NE-O 3.21Å; R532-C536 VanDerWaalsContact CZ-CA 3.46Å; R532-C536 PolarHBondContact NH1-O 2.69Å; R532-C536 PolarHBondContact NH2-O 3.28Å; R532-R537 VanDerWaalsContact NH2-C 3.26Å; R532-R537 PolarHBondContact NH2-O 3.26Å; R532-G538 PolarHBondContact NH1-O 3.36Å; R532-G538 PolarHBondContact NH2-O 3.42Å; R532-F566 HydrophobicContact CB-CD1 4.44Å; R532-F566 HydrophobicContact CB-CE1 4.32Å; R532-E567 PolarHBondContact NH1-O 3Å; R532-E567 VanDerWaalsContact NH1-O 3.16Å; R532-E570 WeakPolarHBondContact CD-O 3.48Å; R532-E570 PolarHBondContact NH1-O 3.27Å; R532-I571 PolarHBondContact N-O 2.64Å
533	Q	80.4	Confident	86	Confident	95 Å²	95	40.9 Å²	40.9	44%	0.444	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	164.3	-178.2	-65.7	-178.8	-25.1	0	0	110.2	G508 V509 V531	G508-Q533 CarbonylContact C-O 3.51Å; G508-Q533 VanDerWaalsContact CA-O 3.29Å; G508-Q533 WeakPolarHBondContact CA-O 2.96Å; V509-Q533 PolarHBondContact N-O 3.49Å; V509-Q533 PolarHBondContact O-N 3.4Å; V531-Q533 HydrophobicContact CG1-CG 4.16Å
534	T	74.5	Confident	86.7	Confident	42 Å²	42	39.6 Å²	39.6	26%	0.258	21%	0.205	S	C	.	.	S	Bend	trans	48.8	65.1	178.5	66.9	0	0	0	0	111.7	H506 G508 V509	H506-T534 WeakPolarHBondContact CB-O 3.4Å; H506-T534 PolarHBondContact CD2-O 3.32Å; G508-T534 WeakPolarHBondContact CA-O 3.35Å; V509-T534 WeakPolarHBondContact CG2-OG1 3.28Å
535	G	72.2	Confident	87.3	Confident	5 Å²	5	41.7 Å²	41.7	5%	0.052	21%	0.206	C	C	.	.			trans	104.2	143.4	179.9	0	0	0	0	0	116.9	D503 H506 G508 R532	D503-G535 VanDerWaalsContact O-CA 3.23Å; D503-G535 WeakPolarHBondContact O-CA 3.25Å; D503-G535 PolarHBondContact O-N 3.35Å; H506-G535 CarbonylContact O-C 3.59Å; H506-G535 WeakPolarHBondContact O-CA 3.37Å; G508-G535 WeakPolarHBondContact CA-O 3.29Å; G508-G535 PolarHBondContact N-O 3.3Å; R532-G535 WeakPolarHBondContact CG-O 3.21Å; R532-G535 PolarHBondContact NE-O 3.21Å
536	C	79.2	Confident	87.7	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.007	20%	0.195	C	C	.	.			trans	-127.2	18.8	178	61.3	0	0	0	0	115.3	D504 H506 R532 E569 I571	D504-C536 PolarHBondContact O-N 2.93Å; H506-C536 PolarHBondContact O-N 3.16Å; R532-C536 VanDerWaalsContact CZ-CA 3.46Å; R532-C536 PolarHBondContact NH1-O 2.69Å; R532-C536 PolarHBondContact NH2-O 3.28Å; C536-E569 PolarHBondContact O-N 3.13Å; C536-I571 HydrophobicContact CB-CG2 3.99Å
537	R	76.8	Confident	87.7	Confident	137 Å²	137	40.8 Å²	40.8	52%	0.517	21%	0.206	S	C	.	.			trans	-82.3	125.6	-172.3	-162.4	166.5	-177.8	166.4	3.3	115.2	D505 H506 P507 R532	D505-R537 IonicContact OD1-CZ 3.99Å; D505-R537 IonicContact OD1-NH1 3.2Å; D505-R537 PolarHBondContact OD1-NH1 3.22Å; H506-R537 PolarHBondContact O-N 3.48Å; P507-R537 VanDerWaalsContact CA-O 3.31Å; P507-R537 WeakPolarHBondContact CA-O 3.26Å; R532-R537 VanDerWaalsContact NH2-C 3.26Å; R532-R537 PolarHBondContact NH2-O 3.26Å
538	G	79.9	Confident	87.7	Confident	18 Å²	18	39.4 Å²	39.4	19%	0.186	20%	0.2	C	C	.	.	S	Bend	trans	82.7	165.1	175.8	0	0	0	0	0	114.9	R532 D568	R532-G538 PolarHBondContact NH1-O 3.36Å; R532-G538 PolarHBondContact NH2-O 3.42Å; G538-D568 WeakPolarHBondContact CA-OD1 2.99Å; G538-D568 PolarHBondContact N-OD1 3.44Å
539	K	85.9	Confident	87.6	Confident	96 Å²	96	40.3 Å²	40.3	42%	0.417	21%	0.209	S	C	.	.			trans	-78.5	127.8	177.8	-58.7	-168.6	-173.3	-145.5	0	111.6	F566 E567 L601	K539-F566 CarbonylContact C-O 3.54Å; K539-F566 VanDerWaalsContact CA-O 3.31Å; K539-F566 WeakPolarHBondContact CA-O 3.4Å; K539-E567 VanDerWaalsContact CD-OE2 3.28Å; K539-E567 WeakPolarHBondContact CD-OE2 3.16Å; K539-E567 WeakPolarHBondContact CE-OE2 2.9Å; K539-E567 IonicContact NZ-OE1 3.16Å; K539-E567 IonicContact NZ-OE2 2.85Å; K539-E567 PolarHBondContact NZ-OE2 2.83Å; K539-L601 HydrophobicContact CB-CB 4.28Å; K539-L601 PolarHBondContact O-N 3.02Å
540	V	88.4	Confident	87.3	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	131.5	-177.3	-177	0	0	0	0	110.8	F510 V542 F566 P598 P631	F510-V540 HydrophobicContact CD2-CG1 4.35Å; F510-V540 HydrophobicContact CE1-CB 4.38Å; F510-V540 HydrophobicContact CE1-CG1 4.38Å; F510-V540 HydrophobicContact CE2-CB 4.01Å; F510-V540 HydrophobicContact CE2-CG1 3.54Å; F510-V540 HydrophobicContact CE2-CG2 4.15Å; F510-V540 HydrophobicContact CZ-CB 3.54Å; F510-V540 HydrophobicContact CZ-CG1 3.54Å; F510-V540 HydrophobicContact CZ-CG2 3.87Å; V540-V542 HydrophobicContact CG1-CG2 4.27Å; V540-F566 PolarHBondContact N-O 2.99Å; V540-F566 PolarHBondContact O-N 3.17Å; V540-P598 HydrophobicContact CG1-CB 3.59Å; V540-P631 HydrophobicContact CG1-CB 3.88Å; V540-P631 HydrophobicContact CG1-CG 3.88Å; V540-P631 HydrophobicContact CG2-CB 4.17Å; V540-P631 HydrophobicContact CG2-CG 4.28Å
541	L	91.2	Very high	87.1	Confident	55 Å²	55	40.8 Å²	40.8	29%	0.288	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	123	173.8	-165.5	103.9	0	0	0	109.8	P543 A563 L564 L565 P598 V599	L541-P543 HydrophobicContact CD2-CG 4.49Å; L541-A563 HydrophobicContact CD1-CB 4.03Å; L541-A563 HydrophobicContact CD2-CB 3.61Å; L541-A563 HydrophobicContact CG-CB 3.65Å; L541-L564 CarbonylContact C-O 3.54Å; L541-L564 WeakPolarHBondContact CA-O 3.28Å; L541-L565 HydrophobicContact CD1-CB 4.36Å; L541-L565 HydrophobicContact CD1-CD1 4.45Å; L541-P598 CarbonylContact O-C 3.5Å; L541-P598 VanDerWaalsContact O-CA 3.3Å; L541-P598 WeakPolarHBondContact O-CA 3.48Å; L541-V599 PolarHBondContact N-O 3.01Å; L541-V599 PolarHBondContact O-N 2.97Å
542	V	93	Very high	87.1	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	100.6	179.8	-169.5	0	0	0	0	109.9	F510 V540 A563 L564 F566 L595 P598	F510-V542 HydrophobicContact CB-CG1 4.34Å; F510-V542 HydrophobicContact CB-CG2 4.17Å; F510-V542 HydrophobicContact CD1-CG2 3.43Å; F510-V542 VanDerWaalsContact CD1-CG2 3.43Å; F510-V542 HydrophobicContact CD2-CG2 4.23Å; F510-V542 HydrophobicContact CE1-CG2 3.78Å; F510-V542 HydrophobicContact CG-CG2 3.66Å; F510-V542 HydrophobicContact CZ-CG2 4.34Å; V540-V542 HydrophobicContact CG1-CG2 4.27Å; V542-A563 CarbonylContact O-C 3.56Å; V542-A563 WeakPolarHBondContact O-CA 3.12Å; V542-L564 HydrophobicContact CB-CB 4.36Å; V542-L564 PolarHBondContact N-O 3.25Å; V542-L564 PolarHBondContact O-N 3.25Å; V542-F566 HydrophobicContact CB-CE2 4.47Å; V542-F566 HydrophobicContact CG2-CD2 3.8Å; V542-F566 HydrophobicContact CG2-CE2 3.88Å; V542-L595 HydrophobicContact CG1-CB 4.45Å; V542-L595 HydrophobicContact CG1-CD2 4.09Å; V542-P598 HydrophobicContact CG2-CB 4.16Å
543	P	94.9	Very high	87.2	Confident	36 Å²	36	45.5 Å²	45.5	23%	0.234	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	144.1	177.1	-11.5	26.2	0	0	0	111.7	L541 G562 A563 S596 K597	L541-P543 HydrophobicContact CD2-CG 4.49Å; P543-G562 CarbonylContact C-O 3.17Å; P543-G562 WeakPolarHBondContact CA-O 3.42Å; P543-A563 HydrophobicContact CB-CB 4.24Å; P543-A563 HydrophobicContact CG-CB 4.45Å; P543-S596 PolarHBondContact O-N 3.31Å; P543-K597 WeakPolarHBondContact CD-O 3.2Å
544	Y	94.9	Very high	87.5	Confident	30 Å²	30	43.7 Å²	43.7	12%	0.118	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	151.2	179	70.4	-89.5	0	0	0	111.3	M560 E561 G562 L564 L575 N594	Y544-M560 HydrophobicContact CE2-CB 4.43Å; Y544-M560 HydrophobicContact CE2-CG 3.79Å; Y544-M560 HydrophobicContact CE2-SD 4.01Å; Y544-E561 WeakPolarHBondContact O-CA 3.34Å; Y544-G562 WeakPolarHBondContact CD1-O 3.43Å; Y544-G562 VanDerWaalsContact CE1-C 3.41Å; Y544-G562 PolarHBondContact N-O 3.31Å; Y544-G562 PolarHBondContact O-N 2.96Å; Y544-L564 HydrophobicContact CD1-CG 3.97Å; Y544-L564 HydrophobicContact CE1-CD2 4.34Å; Y544-L564 HydrophobicContact CE1-CG 4.08Å; Y544-L575 HydrophobicContact CD1-CD1 4.47Å; Y544-L575 HydrophobicContact CD1-CD2 3.8Å; Y544-L575 HydrophobicContact CD2-CD1 4.01Å; Y544-L575 HydrophobicContact CD2-CD2 4Å; Y544-L575 HydrophobicContact CE1-CD2 3.41Å; Y544-L575 VanDerWaalsContact CE1-CD2 3.41Å; Y544-L575 HydrophobicContact CE2-CD1 4.37Å; Y544-L575 HydrophobicContact CE2-CD2 3.63Å; Y544-L575 HydrophobicContact CG-CD1 4.07Å; Y544-L575 HydrophobicContact CG-CD2 4.08Å; Y544-N594 VanDerWaalsContact CA-O 3.24Å; Y544-N594 WeakPolarHBondContact CA-O 3.27Å
545	E	94.4	Very high	88	Confident	79 Å²	79	46.3 Å²	46.3	37%	0.369	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	146.7	178.7	57.5	169.3	-160.9	0	0	111.1	E561 V593 N594	E545-E561 HydrophobicContact CB-CG 4.29Å; E545-V593 WeakPolarHBondContact O-CA 3.24Å; E545-N594 HydrophobicContact CG-CB 4.01Å; E545-N594 PolarHBondContact N-O 3.34Å; E545-N594 PolarHBondContact O-N 2.85Å; E545-N594 PolarHBondContact OE1-ND2 2.87Å
546	T	95.2	Very high	88.8	Confident	23 Å²	23	46.2 Å²	46.2	14%	0.141	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	139.5	168.5	58.6	0	0	0	0	111.5	Y557 M560 I577 F591 V592 V593	T546-Y557 HydrophobicContact CG2-CE2 4.14Å; T546-M560 HydrophobicContact CG2-CB 4.03Å; T546-M560 WeakPolarHBondContact CG2-O 3.35Å; T546-M560 PolarHBondContact N-O 3.23Å; T546-M560 PolarHBondContact OG1-N 3.25Å; T546-M560 PolarHBondContact OG1-O 3.43Å; T546-I577 HydrophobicContact CG2-CD1 3.82Å; T546-F591 HydrophobicContact CG2-CE2 4.43Å; T546-V592 CarbonylContact C-O 3.57Å; T546-V592 WeakPolarHBondContact CA-O 3.1Å; T546-V593 HydrophobicContact CG2-CG2 4.28Å
547	A	92.8	Very high	89.4	Confident	32 Å²	32	46.2 Å²	46.2	26%	0.264	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	141.8	176.4	0	0	0	0	0	111.9	V592	A547-V592 HydrophobicContact CB-CB 4.49Å; A547-V592 PolarHBondContact N-O 3.44Å; A547-V592 PolarHBondContact O-N 2.72Å
548	D	92.9	Very high	90.2	Very high	77 Å²	77	45.3 Å²	45.3	41%	0.412	26%	0.261	S	S	.	.			trans	-60.7	135.1	179.1	-81.6	-0.1	0	0	0	112.5	K552 A553 Y557	D548-K552 HydrophobicContact CB-CD 4.22Å; D548-K552 WeakPolarHBondContact OD2-CD 3.36Å; D548-K552 IonicContact OD2-NZ 3.57Å; D548-K552 PolarHBondContact OD2-NZ 3.33Å; D548-K552 VanDerWaalsContact OD2-NZ 3.16Å; D548-A553 WeakPolarHBondContact OD1-CB 2.9Å; D548-A553 PolarHBondContact OD1-N 2.98Å; D548-Y557 PolarHBondContact N-OH 3.17Å; D548-Y557 PolarHBondContact OD1-OH 3.37Å
549	G	90.3	Very high	90.7	Very high	19 Å²	19	48.5 Å²	48.5	20%	0.196	28%	0.279	C	S	.	.	S	Bend	trans	-109	-128.3	164.7	0	0	0	0	0	110.7	G551 Y590	G549-G551 VanDerWaalsContact C-N 3.3Å; G549-G551 PolarHBondContact N-O 3.24Å; G549-G551 VanDerWaalsContact N-O 3.14Å; G549-Y590 CarbonylContact C-O 3.53Å; G549-Y590 VanDerWaalsContact CA-O 3.23Å; G549-Y590 WeakPolarHBondContact CA-O 3.31Å
550	T	86.7	Confident	91	Very high	78 Å²	78	46.2 Å²	46.2	48%	0.479	27%	0.27	S	S	.	.	S	Bend	trans	-72.9	-27.8	163.7	61.2	0	0	0	0	111.5	E589 Y590	T550-E589 VanDerWaalsContact OG1-CA 3.32Å; T550-E589 WeakPolarHBondContact OG1-CA 3.16Å; T550-Y590 HydrophobicContact CG2-CD1 4.16Å; T550-Y590 HydrophobicContact CG2-CE1 3.68Å; T550-Y590 PolarHBondContact N-O 3.11Å; T550-Y590 PolarHBondContact OG1-N 3.06Å
551	G	87.5	Confident	91.2	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	31%	0.307	C	S	.	.	S	Bend	trans	-82.2	143	168.2	0	0	0	0	0	111.2	G549 D556 Y590	G549-G551 VanDerWaalsContact C-N 3.3Å; G549-G551 PolarHBondContact N-O 3.24Å; G549-G551 VanDerWaalsContact N-O 3.14Å; G551-D556 WeakPolarHBondContact CA-OD2 3.32Å; G551-Y590 PolarHBondContact N-O 3.08Å
552	K	90.9	Very high	91.2	Very high	93 Å²	93	52.8 Å²	52.8	40%	0.404	31%	0.307	S	S	.	.			trans	-112.1	134.9	-173	-64.9	-58.8	-174.3	-171.4	0	113	D548 I555 D556	D548-K552 HydrophobicContact CB-CD 4.22Å; D548-K552 WeakPolarHBondContact OD2-CD 3.36Å; D548-K552 IonicContact OD2-NZ 3.57Å; D548-K552 PolarHBondContact OD2-NZ 3.33Å; D548-K552 VanDerWaalsContact OD2-NZ 3.16Å; K552-I555 HydrophobicContact CB-CB 4.35Å; K552-I555 HydrophobicContact CB-CD1 3.99Å; K552-I555 HydrophobicContact CB-CG1 4.15Å; K552-I555 PolarHBondContact O-N 3.44Å; K552-I555 VanDerWaalsContact O-N 3.12Å; K552-D556 PolarHBondContact N-OD2 2.7Å; K552-D556 PolarHBondContact O-N 3.21Å
553	A	89.5	Confident	91.1	Very high	39 Å²	39	54.9 Å²	54.9	32%	0.322	32%	0.324	S	S	.	.	B	Isolated β-bridge	trans	-53.6	136.7	175.1	0	0	0	0	0	112.3	D548 I555 Y557 P559	D548-A553 WeakPolarHBondContact OD1-CB 2.9Å; D548-A553 PolarHBondContact OD1-N 2.98Å; A553-I555 PolarHBondContact O-N 3.12Å; A553-I555 VanDerWaalsContact O-N 3.09Å; A553-Y557 HydrophobicContact CB-CE1 4.35Å; A553-Y557 HydrophobicContact CB-CE2 4.25Å; A553-P559 HydrophobicContact CB-CB 4.09Å; A553-P559 HydrophobicContact CB-CG 4.42Å
554	G	86.8	Confident	91	Very high	57 Å²	57	53.9 Å²	53.9	59%	0.588	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.3	-16	-178.2	0	0	0	0	0	114.4	Y557	G554-Y557 PolarHBondContact N-O 3.49Å
555	I	85.5	Confident	90.9	Very high	97 Å²	97	55.2 Å²	55.2	50%	0.497	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-47.7	176.9	-37.2	-176.1	0	0	0	110.3	K552 A553 V580 K582	K552-I555 HydrophobicContact CB-CB 4.35Å; K552-I555 HydrophobicContact CB-CD1 3.99Å; K552-I555 HydrophobicContact CB-CG1 4.15Å; K552-I555 PolarHBondContact O-N 3.44Å; K552-I555 VanDerWaalsContact O-N 3.12Å; A553-I555 PolarHBondContact O-N 3.12Å; A553-I555 VanDerWaalsContact O-N 3.09Å; I555-V580 WeakPolarHBondContact O-CB 3.35Å; I555-V580 WeakPolarHBondContact O-CG1 3.39Å; I555-K582 VanDerWaalsContact C-CE 3.48Å; I555-K582 VanDerWaalsContact CG2-CE 3.41Å; I555-K582 WeakPolarHBondContact O-CE 3.35Å
556	D	87.9	Confident	90.7	Very high	4 Å²	4	51.4 Å²	51.4	2%	0.021	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-29	-174.1	-69.4	-60.3	0	0	0	114.4	G551 K552 V580 K582 R587 I643	G551-D556 WeakPolarHBondContact CA-OD2 3.32Å; K552-D556 PolarHBondContact N-OD2 2.7Å; K552-D556 PolarHBondContact O-N 3.21Å; D556-V580 PolarHBondContact O-N 3.4Å; D556-K582 WeakPolarHBondContact OD1-CE 3.11Å; D556-K582 IonicContact OD1-NZ 2.77Å; D556-K582 PolarHBondContact OD1-NZ 2.97Å; D556-K582 IonicContact OD2-NZ 2.79Å; D556-K582 PolarHBondContact OD2-NZ 3.25Å; D556-R587 PolarHBondContact O-NH2 3.23Å; D556-R587 IonicContact OD1-CZ 2.77Å; D556-R587 IonicContact OD1-NE 3.59Å; D556-R587 IonicContact OD1-NH2 3.36Å; D556-R587 PolarHBondContact OD1-NH2 3.47Å; D556-I643 HydrophobicContact CB-CD1 4.31Å
557	Y	92.8	Very high	90.4	Very high	1 Å²	1	53.7 Å²	53.7	0%	0.004	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-152.2	158.6	-179.5	69.3	-85.8	0	0	0	109.6	T546 D548 A553 G554 I577 G578 F591	T546-Y557 HydrophobicContact CG2-CE2 4.14Å; D548-Y557 PolarHBondContact N-OH 3.17Å; D548-Y557 PolarHBondContact OD1-OH 3.37Å; A553-Y557 HydrophobicContact CB-CE1 4.35Å; A553-Y557 HydrophobicContact CB-CE2 4.25Å; G554-Y557 PolarHBondContact N-O 3.49Å; Y557-I577 HydrophobicContact CD2-CG2 4.46Å; Y557-G578 CarbonylContact C-O 3.58Å; Y557-G578 WeakPolarHBondContact CA-O 3.5Å; Y557-F591 HydrophobicContact CD1-CB 3.71Å; Y557-F591 AromaticContact CD1-CD1 3.65Å; Y557-F591 HydrophobicContact CD1-CD1 3.65Å; Y557-F591 AromaticContact CD1-CD2 3.97Å; Y557-F591 HydrophobicContact CD1-CD2 3.97Å; Y557-F591 HydrophobicContact CD1-CE1 4.2Å; Y557-F591 HydrophobicContact CD1-CE2 4.46Å; Y557-F591 AromaticContact CD1-CG 3.51Å; Y557-F591 HydrophobicContact CD1-CG 3.51Å; Y557-F591 AromaticContact CD2-CD2 3.8Å; Y557-F591 HydrophobicContact CD2-CD2 3.8Å; Y557-F591 AromaticContact CD2-CE2 3.77Å; Y557-F591 HydrophobicContact CD2-CE2 3.77Å; Y557-F591 HydrophobicContact CD2-CG 4.21Å; Y557-F591 HydrophobicContact CD2-CZ 4.17Å; Y557-F591 HydrophobicContact CE1-CB 3.33Å; Y557-F591 HydrophobicContact CE1-CD1 4.2Å; Y557-F591 AromaticContact CE1-CD2 3.96Å; Y557-F591 HydrophobicContact CE1-CD2 3.96Å; Y557-F591 AromaticContact CE1-CG 3.6Å; Y557-F591 HydrophobicContact CE1-CG 3.6Å; Y557-F591 AromaticContact CE2-CD2 3.81Å; Y557-F591 HydrophobicContact CE2-CD2 3.81Å; Y557-F591 HydrophobicContact CE2-CE2 4.16Å; Y557-F591 HydrophobicContact CE2-CG 4.3Å; Y557-F591 HydrophobicContact CG-CB 4.48Å; Y557-F591 AromaticContact CG-CD1 3.86Å; Y557-F591 HydrophobicContact CG-CD1 3.86Å; Y557-F591 AromaticContact CG-CD2 3.89Å; Y557-F591 HydrophobicContact CG-CD2 3.89Å; Y557-F591 AromaticContact CG-CE1 3.94Å; Y557-F591 HydrophobicContact CG-CE1 3.94Å; Y557-F591 AromaticContact CG-CE2 3.94Å; Y557-F591 HydrophobicContact CG-CE2 3.94Å; Y557-F591 AromaticContact CG-CG 3.83Å; Y557-F591 HydrophobicContact CG-CG 3.83Å; Y557-F591 AromaticContact CG-CZ 3.96Å; Y557-F591 HydrophobicContact CG-CZ 3.96Å; Y557-F591 AromaticContact CZ-CD2 3.86Å; Y557-F591 AromaticContact CZ-CG 3.99Å
558	E	92	Very high	89.9	Confident	117 Å²	117	56.3 Å²	56.3	55%	0.547	33%	0.326	S	S	.	.			trans	-80.2	121	174.8	-64.5	-172.6	166.6	0	0	110.1	M560 G578	E558-M560 PolarHBondContact O-N 3.13Å; E558-G578 PolarHBondContact N-O 3.48Å
559	P	91.2	Very high	89.2	Confident	85 Å²	85	58.4 Å²	58.4	55%	0.552	33%	0.334	S	S	*	.			trans	-63.1	135	178.4	26.1	-32.1	0	0	0	110.4	A553	A553-P559 HydrophobicContact CB-CB 4.09Å; A553-P559 HydrophobicContact CB-CG 4.42Å
560	M	91.9	Very high	88.9	Confident	49 Å²	49	60.1 Å²	60.1	24%	0.241	34%	0.337	C	S	.	.			trans	-133.6	130.2	-179.2	-163.5	175.3	-72.4	0	0	110.4	Y544 T546 E558 Q576 I577	Y544-M560 HydrophobicContact CE2-CB 4.43Å; Y544-M560 HydrophobicContact CE2-CG 3.79Å; Y544-M560 HydrophobicContact CE2-SD 4.01Å; T546-M560 HydrophobicContact CG2-CB 4.03Å; T546-M560 WeakPolarHBondContact CG2-O 3.35Å; T546-M560 PolarHBondContact N-O 3.23Å; T546-M560 PolarHBondContact OG1-N 3.25Å; T546-M560 PolarHBondContact OG1-O 3.43Å; E558-M560 PolarHBondContact O-N 3.13Å; M560-Q576 WeakPolarHBondContact CE-O 3.49Å; M560-I577 HydrophobicContact CE-CG1 4.45Å; M560-I577 HydrophobicContact SD-CG1 4.17Å
561	E	92.6	Very high	88.9	Confident	165 Å²	165	60 Å²	60	77%	0.771	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.8	133.8	174.1	-173.2	-176.9	168.3	0	0	107.9	Y544 E545	Y544-E561 WeakPolarHBondContact O-CA 3.34Å; E545-E561 HydrophobicContact CB-CG 4.29Å
562	G	92.2	Very high	89	Confident	27 Å²	27	64.3 Å²	64.3	28%	0.278	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.7	-166.8	-177	0	0	0	0	0	112.3	P543 Y544	P543-G562 CarbonylContact C-O 3.17Å; P543-G562 WeakPolarHBondContact CA-O 3.42Å; Y544-G562 WeakPolarHBondContact CD1-O 3.43Å; Y544-G562 VanDerWaalsContact CE1-C 3.41Å; Y544-G562 PolarHBondContact N-O 3.31Å; Y544-G562 PolarHBondContact O-N 2.96Å
563	A	90.6	Very high	89	Confident	44 Å²	44	62.9 Å²	62.9	36%	0.364	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	134.7	173.6	0	0	0	0	0	111.7	L541 V542 P543	L541-A563 HydrophobicContact CD1-CB 4.03Å; L541-A563 HydrophobicContact CD2-CB 3.61Å; L541-A563 HydrophobicContact CG-CB 3.65Å; V542-A563 CarbonylContact O-C 3.56Å; V542-A563 WeakPolarHBondContact O-CA 3.12Å; P543-A563 HydrophobicContact CB-CB 4.24Å; P543-A563 HydrophobicContact CG-CB 4.45Å
564	L	92.5	Very high	89.1	Confident	16 Å²	16	64.7 Å²	64.7	8%	0.084	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	112.4	174.5	-68.7	174.1	0	0	0	108.9	V530 L541 V542 Y544 F566 K573 L575	V530-L564 HydrophobicContact CB-CD1 3.83Å; V530-L564 HydrophobicContact CG1-CD1 4.28Å; V530-L564 HydrophobicContact CG2-CD1 3.57Å; L541-L564 CarbonylContact C-O 3.54Å; L541-L564 WeakPolarHBondContact CA-O 3.28Å; V542-L564 HydrophobicContact CB-CB 4.36Å; V542-L564 PolarHBondContact N-O 3.25Å; V542-L564 PolarHBondContact O-N 3.25Å; Y544-L564 HydrophobicContact CD1-CG 3.97Å; Y544-L564 HydrophobicContact CE1-CD2 4.34Å; Y544-L564 HydrophobicContact CE1-CG 4.08Å; L564-F566 HydrophobicContact CB-CD2 4.2Å; L564-F566 HydrophobicContact CB-CE2 3.83Å; L564-F566 HydrophobicContact CD1-CE2 4.22Å; L564-F566 PolarHBondContact O-N 2.9Å; L564-K573 HydrophobicContact CD1-CB 4.31Å; L564-K573 HydrophobicContact CD2-CB 4.15Å; L564-K573 HydrophobicContact CD2-CD 4.13Å; L564-L575 HydrophobicContact CD1-CD1 4.32Å; L564-L575 HydrophobicContact CD1-CD2 3.99Å; L564-L575 HydrophobicContact CD1-CG 4.06Å; L564-L575 HydrophobicContact CD2-CD2 3.6Å; L564-L575 HydrophobicContact CD2-CG 4.35Å; L564-L575 HydrophobicContact CG-CD2 3.9Å
565	L	91.9	Very high	89.4	Confident	57 Å²	57	62.1 Å²	62.1	30%	0.298	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	109.2	169	175.1	63.4	0	0	0	108.8	L541 E567 K573 L601	L541-L565 HydrophobicContact CD1-CB 4.36Å; L541-L565 HydrophobicContact CD1-CD1 4.45Å; L565-E567 WeakPolarHBondContact CD2-OE1 3.19Å; L565-K573 WeakPolarHBondContact O-CE 3.47Å; L565-K573 PolarHBondContact O-NZ 3.07Å; L565-L601 HydrophobicContact CD1-CD1 3.52Å
566	F	91.1	Very high	89.7	Confident	0 Å²	0	63 Å²	63	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	124.5	166.5	-74.9	-103.4	0	0	0	108.8	F510 V530 R532 K539 V540 V542 L564 E570 K573	F510-F566 AromaticContact CD1-CD2 3.97Å; F510-F566 HydrophobicContact CD1-CD2 3.97Å; F510-F566 HydrophobicContact CD1-CE1 4.45Å; F510-F566 AromaticContact CD1-CE2 3.84Å; F510-F566 HydrophobicContact CD1-CE2 3.84Å; F510-F566 HydrophobicContact CD1-CG 4.35Å; F510-F566 HydrophobicContact CD1-CZ 4.09Å; F510-F566 HydrophobicContact CE1-CB 4.06Å; F510-F566 AromaticContact CE1-CD1 3.95Å; F510-F566 HydrophobicContact CE1-CD1 3.95Å; F510-F566 AromaticContact CE1-CD2 3.57Å; F510-F566 HydrophobicContact CE1-CD2 3.57Å; F510-F566 HydrophobicContact CE1-CE1 4.25Å; F510-F566 AromaticContact CE1-CE2 3.92Å; F510-F566 HydrophobicContact CE1-CE2 3.92Å; F510-F566 AromaticContact CE1-CG 3.59Å; F510-F566 HydrophobicContact CE1-CG 3.59Å; F510-F566 HydrophobicContact CE1-CZ 4.24Å; V530-F566 HydrophobicContact CB-CZ 4.16Å; V530-F566 HydrophobicContact CG1-CE2 4.19Å; V530-F566 HydrophobicContact CG1-CZ 3.88Å; R532-F566 HydrophobicContact CB-CD1 4.44Å; R532-F566 HydrophobicContact CB-CE1 4.32Å; K539-F566 CarbonylContact C-O 3.54Å; K539-F566 VanDerWaalsContact CA-O 3.31Å; K539-F566 WeakPolarHBondContact CA-O 3.4Å; V540-F566 PolarHBondContact N-O 2.99Å; V540-F566 PolarHBondContact O-N 3.17Å; V542-F566 HydrophobicContact CB-CE2 4.47Å; V542-F566 HydrophobicContact CG2-CD2 3.8Å; V542-F566 HydrophobicContact CG2-CE2 3.88Å; L564-F566 HydrophobicContact CB-CD2 4.2Å; L564-F566 HydrophobicContact CB-CE2 3.83Å; L564-F566 HydrophobicContact CD1-CE2 4.22Å; L564-F566 PolarHBondContact O-N 2.9Å; F566-E570 WeakPolarHBondContact CA-OE2 3.07Å; F566-E570 HydrophobicContact CD1-CB 4.33Å; F566-E570 HydrophobicContact CD1-CG 4.17Å; F566-E570 WeakPolarHBondContact CD1-O 3.24Å; F566-K573 HydrophobicContact CD1-CG 4.5Å; F566-K573 HydrophobicContact CE1-CB 4.16Å; F566-K573 HydrophobicContact CE1-CG 4.23Å; F566-K573 HydrophobicContact CE2-CB 4.3Å; F566-K573 HydrophobicContact CZ-CB 3.83Å; F566-K573 HydrophobicContact CZ-CG 4.28Å
567	E	88.4	Confident	89.9	Confident	71 Å²	71	62.8 Å²	62.8	33%	0.332	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-72.2	171.2	170.8	-65.8	-64.8	159.4	0	0	111	R532 K539 L565 E569 E570	R532-E567 PolarHBondContact NH1-O 3Å; R532-E567 VanDerWaalsContact NH1-O 3.16Å; K539-E567 VanDerWaalsContact CD-OE2 3.28Å; K539-E567 WeakPolarHBondContact CD-OE2 3.16Å; K539-E567 WeakPolarHBondContact CE-OE2 2.9Å; K539-E567 IonicContact NZ-OE1 3.16Å; K539-E567 IonicContact NZ-OE2 2.85Å; K539-E567 PolarHBondContact NZ-OE2 2.83Å; L565-E567 WeakPolarHBondContact CD2-OE1 3.19Å; E567-E569 PolarHBondContact O-N 3.37Å; E567-E570 HydrophobicContact CB-CB 4.27Å; E567-E570 PolarHBondContact N-OE2 3.12Å; E567-E570 WeakPolarHBondContact O-CB 3.04Å; E567-E570 PolarHBondContact O-N 3.1Å
568	D	81.8	Confident	89.8	Confident	86 Å²	86	62.9 Å²	62.9	46%	0.46	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	137.4	170.9	-160.4	28.9	0	0	0	109.6	G538 E570	G538-D568 WeakPolarHBondContact CA-OD1 2.99Å; G538-D568 PolarHBondContact N-OD1 3.44Å; D568-E570 PolarHBondContact O-N 3.33Å
569	E	79.7	Confident	89.8	Confident	121 Å²	121	57.9 Å²	57.9	57%	0.565	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.8	4.4	-176.3	-56.1	174	-179.5	0	0	115.8	C536 E567 I571	C536-E569 PolarHBondContact O-N 3.13Å; E567-E569 PolarHBondContact O-N 3.37Å; E569-I571 PolarHBondContact O-N 3.48Å
570	E	84.2	Confident	89.6	Confident	56 Å²	56	56.1 Å²	56.1	26%	0.262	30%	0.296	S	S	.	.			trans	-80.8	120	176.5	-166.4	173.6	-160.4	0	0	110.8	R532 F566 E567 D568 K573	R532-E570 WeakPolarHBondContact CD-O 3.48Å; R532-E570 PolarHBondContact NH1-O 3.27Å; F566-E570 WeakPolarHBondContact CA-OE2 3.07Å; F566-E570 HydrophobicContact CD1-CB 4.33Å; F566-E570 HydrophobicContact CD1-CG 4.17Å; F566-E570 WeakPolarHBondContact CD1-O 3.24Å; E567-E570 HydrophobicContact CB-CB 4.27Å; E567-E570 PolarHBondContact N-OE2 3.12Å; E567-E570 WeakPolarHBondContact O-CB 3.04Å; E567-E570 PolarHBondContact O-N 3.1Å; D568-E570 PolarHBondContact O-N 3.33Å; E570-K573 WeakPolarHBondContact OE1-CE 3.4Å; E570-K573 WeakPolarHBondContact OE1-CG 3.41Å; E570-K573 IonicContact OE1-NZ 2.6Å; E570-K573 WeakPolarHBondContact OE2-CE 3.46Å; E570-K573 IonicContact OE2-NZ 3.72Å
571	I	85	Confident	89	Confident	75 Å²	75	57 Å²	57	39%	0.385	30%	0.302	S	S	.	.			trans	-102.4	-18.5	-174.6	61	167.7	0	0	0	115.1	V531 R532 C536 E569	V531-I571 CarbonylContact C-O 3.53Å; V531-I571 WeakPolarHBondContact CA-O 3.3Å; R532-I571 PolarHBondContact N-O 2.64Å; C536-I571 HydrophobicContact CB-CG2 3.99Å; E569-I571 PolarHBondContact O-N 3.48Å
572	E	90	Very high	88.2	Confident	91 Å²	91	51.9 Å²	51.9	43%	0.425	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	145.9	178.1	62.7	166.7	-158.4	0	0	113.1	K529 V530	K529-E572 VanDerWaalsContact NZ-CD 3.32Å; K529-E572 IonicContact NZ-OE1 2.66Å; K529-E572 PolarHBondContact NZ-OE1 3.17Å; K529-E572 IonicContact NZ-OE2 2.65Å; K529-E572 PolarHBondContact NZ-OE2 2.92Å; V530-E572 CarbonylContact O-C 3.53Å; V530-E572 VanDerWaalsContact O-CA 3.28Å; V530-E572 WeakPolarHBondContact O-CA 3.45Å
573	K	92	Very high	86.9	Confident	63 Å²	63	52.2 Å²	52.2	27%	0.274	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	148.2	167.2	-85.4	-155.3	172.1	-175.3	0	111.7	K529 V530 L564 L565 F566 E570	K529-K573 WeakPolarHBondContact CA-O 3.32Å; V530-K573 PolarHBondContact N-O 2.92Å; V530-K573 PolarHBondContact O-N 3.21Å; L564-K573 HydrophobicContact CD1-CB 4.31Å; L564-K573 HydrophobicContact CD2-CB 4.15Å; L564-K573 HydrophobicContact CD2-CD 4.13Å; L565-K573 WeakPolarHBondContact O-CE 3.47Å; L565-K573 PolarHBondContact O-NZ 3.07Å; F566-K573 HydrophobicContact CD1-CG 4.5Å; F566-K573 HydrophobicContact CE1-CB 4.16Å; F566-K573 HydrophobicContact CE1-CG 4.23Å; F566-K573 HydrophobicContact CE2-CB 4.3Å; F566-K573 HydrophobicContact CZ-CB 3.83Å; F566-K573 HydrophobicContact CZ-CG 4.28Å; E570-K573 WeakPolarHBondContact OE1-CE 3.4Å; E570-K573 WeakPolarHBondContact OE1-CG 3.41Å; E570-K573 IonicContact OE1-NZ 2.6Å; E570-K573 WeakPolarHBondContact OE2-CE 3.46Å; E570-K573 IonicContact OE2-NZ 3.72Å
574	S	92	Very high	85.6	Confident	76 Å²	76	52.9 Å²	52.9	53%	0.531	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	136.1	177.9	58.4	0	0	0	0	112.9	I528	I528-S574 CarbonylContact O-C 3.57Å; I528-S574 WeakPolarHBondContact O-CA 3.46Å
575	L	91.6	Very high	84	Confident	4 Å²	4	52.7 Å²	52.7	2%	0.021	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	136.1	168.1	-63.7	169.5	0	0	0	109.5	F512 I527 I528 V530 Y544 L564 V593	F512-L575 HydrophobicContact CE1-CD1 4.24Å; I527-L575 CarbonylContact C-O 3.59Å; I527-L575 WeakPolarHBondContact CA-O 3.46Å; I528-L575 HydrophobicContact CB-CB 4.34Å; I528-L575 PolarHBondContact N-O 3.47Å; I528-L575 PolarHBondContact O-N 3.37Å; V530-L575 HydrophobicContact CG2-CD1 4.17Å; Y544-L575 HydrophobicContact CD1-CD1 4.47Å; Y544-L575 HydrophobicContact CD1-CD2 3.8Å; Y544-L575 HydrophobicContact CD2-CD1 4.01Å; Y544-L575 HydrophobicContact CD2-CD2 4Å; Y544-L575 HydrophobicContact CE1-CD2 3.41Å; Y544-L575 VanDerWaalsContact CE1-CD2 3.41Å; Y544-L575 HydrophobicContact CE2-CD1 4.37Å; Y544-L575 HydrophobicContact CE2-CD2 3.63Å; Y544-L575 HydrophobicContact CG-CD1 4.07Å; Y544-L575 HydrophobicContact CG-CD2 4.08Å; L564-L575 HydrophobicContact CD1-CD1 4.32Å; L564-L575 HydrophobicContact CD1-CD2 3.99Å; L564-L575 HydrophobicContact CD1-CG 4.06Å; L564-L575 HydrophobicContact CD2-CD2 3.6Å; L564-L575 HydrophobicContact CD2-CG 4.35Å; L564-L575 HydrophobicContact CG-CD2 3.9Å; L575-V593 HydrophobicContact CD1-CG1 4.41Å
576	Q	91.5	Very high	82.8	Confident	114 Å²	114	55.1 Å²	55.1	53%	0.533	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	112.9	174.5	-174.2	176.4	-6.3	0	0	108.2	D525 V526 M560	D525-Q576 HydrophobicContact CB-CG 3.64Å; D525-Q576 VanDerWaalsContact CG-NE2 3.28Å; D525-Q576 PolarHBondContact OD2-NE2 3.21Å; V526-Q576 WeakPolarHBondContact O-CA 3.21Å; M560-Q576 WeakPolarHBondContact CE-O 3.49Å
577	I	92.9	Very high	81.9	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	128	-179.3	-57.1	174.6	0	0	0	109.3	D525 V526 I528 T546 Y557 M560 F591 V593 I641	D525-I577 CarbonylContact C-O 3.59Å; D525-I577 WeakPolarHBondContact CA-O 3.21Å; V526-I577 HydrophobicContact CG1-CB 3.81Å; V526-I577 PolarHBondContact N-O 2.99Å; V526-I577 PolarHBondContact O-N 3.02Å; I528-I577 HydrophobicContact CD1-CD1 3.62Å; I528-I577 HydrophobicContact CD1-CG1 4.32Å; T546-I577 HydrophobicContact CG2-CD1 3.82Å; Y557-I577 HydrophobicContact CD2-CG2 4.46Å; M560-I577 HydrophobicContact CE-CG1 4.45Å; M560-I577 HydrophobicContact SD-CG1 4.17Å; I577-F591 HydrophobicContact CD1-CE2 4.21Å; I577-F591 HydrophobicContact CG2-CE2 4.1Å; I577-F591 HydrophobicContact CG2-CZ 4.02Å; I577-V593 HydrophobicContact CD1-CG2 3.59Å; I577-I641 HydrophobicContact CD1-CD1 4.36Å
578	G	91.1	Very high	81.5	Confident	4 Å²	4	57.8 Å²	57.8	4%	0.041	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	129.3	177.2	0	0	0	0	0	112.6	D525 Y557 E558	D525-G578 WeakPolarHBondContact OD1-CA 3.43Å; Y557-G578 CarbonylContact C-O 3.58Å; Y557-G578 WeakPolarHBondContact CA-O 3.5Å; E558-G578 PolarHBondContact N-O 3.48Å
579	I	91	Very high	81.8	Confident	11 Å²	11	55.6 Å²	55.6	6%	0.056	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-103.7	122.2	175.6	-57.3	-60.5	0	0	0	109	V519 G524 V526 N581 F591 I643	V519-I579 HydrophobicContact CG1-CD1 4.08Å; V519-I579 HydrophobicContact CG1-CG1 4.02Å; V519-I579 HydrophobicContact CG2-CG1 4.39Å; G524-I579 PolarHBondContact O-N 3.31Å; V526-I579 HydrophobicContact CB-CD1 4.33Å; V526-I579 HydrophobicContact CB-CG1 4.27Å; V526-I579 HydrophobicContact CG1-CD1 3.92Å; V526-I579 HydrophobicContact CG1-CG1 4.29Å; I579-N581 PolarHBondContact O-N 2.98Å; I579-F591 HydrophobicContact CD1-CE1 3.62Å; I579-F591 HydrophobicContact CD1-CZ 3.82Å; I579-I643 HydrophobicContact CD1-CD1 4.38Å; I579-I643 HydrophobicContact CD1-CG1 4.41Å; I579-I643 HydrophobicContact CG2-CD1 4.21Å; I579-I643 HydrophobicContact CG2-CG1 4.41Å; I579-I643 HydrophobicContact CG2-CG2 4.08Å
580	V	87	Confident	82.4	Confident	49 Å²	49	54.2 Å²	54.2	30%	0.297	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-80.3	119.8	179.2	-176.2	0	0	0	0	109.3	I555 D556 K582 R587	I555-V580 WeakPolarHBondContact O-CB 3.35Å; I555-V580 WeakPolarHBondContact O-CG1 3.39Å; D556-V580 PolarHBondContact O-N 3.4Å; V580-K582 PolarHBondContact O-N 3.02Å; V580-R587 PolarHBondContact O-NH1 3.3Å
581	N	81	Confident	82.8	Confident	68 Å²	68	51.5 Å²	51.5	36%	0.364	26%	0.256	S	S	.	.			trans	-79.8	114.9	176.4	-172.6	-2.3	0	0	0	110.7	E521 I579 E583	E521-N581 WeakPolarHBondContact O-CB 3.37Å; I579-N581 PolarHBondContact O-N 2.98Å; N581-E583 PolarHBondContact OD1-N 3.37Å
582	K	74.7	Confident	83.3	Confident	56 Å²	56	49.1 Å²	49.1	24%	0.243	25%	0.245	C	C	.	.			trans	-102.7	-2.2	176.9	-68.7	-176.1	-178.8	173.9	0	113.8	I555 D556 V580 Q584	I555-K582 VanDerWaalsContact C-CE 3.48Å; I555-K582 VanDerWaalsContact CG2-CE 3.41Å; I555-K582 WeakPolarHBondContact O-CE 3.35Å; D556-K582 WeakPolarHBondContact OD1-CE 3.11Å; D556-K582 IonicContact OD1-NZ 2.77Å; D556-K582 PolarHBondContact OD1-NZ 2.97Å; D556-K582 IonicContact OD2-NZ 2.79Å; D556-K582 PolarHBondContact OD2-NZ 3.25Å; V580-K582 PolarHBondContact O-N 3.02Å; K582-Q584 HydrophobicContact CB-CG 4.01Å
583	E	65.4	Low	83.5	Confident	35 Å²	35	44.8 Å²	44.8	16%	0.164	23%	0.225	C	C	.	.			trans	53.8	57.4	-177.5	-49.2	-174.3	170.5	0	0	112.5	R302 R305 E521 N581	R302-E583 PolarHBondContact NH2-O 3.44Å; R302-E583 VanDerWaalsContact NH2-O 3.08Å; R305-E583 WeakPolarHBondContact CD-OE1 3.21Å; R305-E583 IonicContact CZ-OE1 2.79Å; R305-E583 IonicContact CZ-OE2 2.8Å; R305-E583 IonicContact NE-OE1 3.23Å; R305-E583 IonicContact NH1-OE1 2.62Å; R305-E583 PolarHBondContact NH1-OE1 3.06Å; R305-E583 IonicContact NH1-OE2 3.08Å; R305-E583 PolarHBondContact NH1-OE2 2.83Å; E521-E583 PolarHBondContact OE2-N 2.82Å; N581-E583 PolarHBondContact OD1-N 3.37Å
584	Q	63.3	Low	83.6	Confident	57 Å²	57	43 Å²	43	27%	0.266	22%	0.218	S	C	.	.			trans	-101.9	125.9	178.9	-68.8	-176.4	5.2	0	0	110.6	E521 K582 E586 R587	E521-Q584 PolarHBondContact OE1-N 3.14Å; E521-Q584 PolarHBondContact OE2-N 2.99Å; K582-Q584 HydrophobicContact CB-CG 4.01Å; Q584-E586 VanDerWaalsContact C-N 3.33Å; Q584-E586 PolarHBondContact O-N 3.48Å; Q584-R587 HydrophobicContact CB-CB 4.08Å; Q584-R587 HydrophobicContact CB-CG 4.47Å
585	Y	59	Low	83.7	Confident	13 Å²	13	39.8 Å²	39.8	5%	0.051	20%	0.195	C	C	.	.	S	Bend	trans	-64.6	-34.6	-176.7	170.7	-79.6	0	0	0	114	E645 F649 K650 V653 D654	Y585-E645 WeakPolarHBondContact O-CB 3.26Å; Y585-F649 HydrophobicContact CD2-CE1 4.47Å; Y585-K650 HydrophobicContact CE2-CG 4.07Å; Y585-V653 HydrophobicContact CD2-CB 3.91Å; Y585-V653 HydrophobicContact CD2-CG1 3.72Å; Y585-V653 HydrophobicContact CD2-CG2 4.09Å; Y585-V653 HydrophobicContact CE2-CB 3.64Å; Y585-V653 HydrophobicContact CE2-CG1 3.39Å; Y585-V653 HydrophobicContact CE2-CG2 4.33Å; Y585-D654 PolarHBondContact OH-OD1 3.18Å
586	E	66	Low	83.7	Confident	108 Å²	108	42 Å²	42	51%	0.505	21%	0.21	S	C	.	.	S	Bend	trans	-126.5	100.1	173.4	-91	161	165.6	0	0	106.4	R294 Q584 E645	R294-E586 IonicContact CZ-OE2 3.65Å; R294-E586 IonicContact NH1-OE2 3.46Å; R294-E586 PolarHBondContact NH1-OE2 3.44Å; R294-E586 IonicContact NH2-OE2 3.58Å; R294-E586 PolarHBondContact NH2-OE2 3.14Å; R294-E586 VanDerWaalsContact NH2-OE2 3.11Å; Q584-E586 VanDerWaalsContact C-N 3.33Å; Q584-E586 PolarHBondContact O-N 3.48Å; E586-E645 VanDerWaalsContact CA-OE2 3.3Å; E586-E645 WeakPolarHBondContact CA-OE2 3.43Å
587	R	71.5	Confident	83.5	Confident	2 Å²	2	44.7 Å²	44.7	1%	0.008	22%	0.221	C	C	.	.			trans	-117.6	122.2	178.3	-164.6	171.1	-178.8	-164.4	-3.7	107.8	E521 D556 V580 Q584 E589 I643 K644 E645	E521-R587 IonicContact OE2-NH1 3.84Å; D556-R587 PolarHBondContact O-NH2 3.23Å; D556-R587 IonicContact OD1-CZ 2.77Å; D556-R587 IonicContact OD1-NE 3.59Å; D556-R587 IonicContact OD1-NH2 3.36Å; D556-R587 PolarHBondContact OD1-NH2 3.47Å; V580-R587 PolarHBondContact O-NH1 3.3Å; Q584-R587 HydrophobicContact CB-CB 4.08Å; Q584-R587 HydrophobicContact CB-CG 4.47Å; R587-E589 HydrophobicContact CG-CG 4.46Å; R587-E589 IonicContact CZ-OE2 2.68Å; R587-E589 IonicContact NE-OE2 2.82Å; R587-E589 PolarHBondContact NE-OE2 3.19Å; R587-E589 IonicContact NH2-OE2 3.49Å; R587-E589 PolarHBondContact NH2-OE2 3.37Å; R587-I643 CarbonylContact C-O 3.52Å; R587-I643 HydrophobicContact CG-CG2 4.5Å; R587-K644 WeakPolarHBondContact O-CA 3.38Å; R587-E645 PolarHBondContact N-OE2 3.45Å; R587-E645 PolarHBondContact O-N 3.42Å
588	N	80.4	Confident	83.3	Confident	125 Å²	125	45.4 Å²	45.4	67%	0.668	23%	0.225	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-144.3	72.1	174.7	-171.4	27.5	0	0	0	107.8
589	E	88.3	Confident	83.1	Confident	40 Å²	40	48.9 Å²	48.9	19%	0.187	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	156	178.9	-68.4	165.5	162.4	0	0	108.9	T550 R587 K642 I643	T550-E589 VanDerWaalsContact OG1-CA 3.32Å; T550-E589 WeakPolarHBondContact OG1-CA 3.16Å; R587-E589 HydrophobicContact CG-CG 4.46Å; R587-E589 IonicContact CZ-OE2 2.68Å; R587-E589 IonicContact NE-OE2 2.82Å; R587-E589 PolarHBondContact NE-OE2 3.19Å; R587-E589 IonicContact NH2-OE2 3.49Å; R587-E589 PolarHBondContact NH2-OE2 3.37Å; E589-K642 CarbonylContact O-C 3.57Å; E589-K642 WeakPolarHBondContact O-CA 3.35Å; E589-I643 PolarHBondContact N-O 3.39Å; E589-I643 PolarHBondContact O-N 2.94Å
590	Y	91.9	Very high	82.5	Confident	91 Å²	91	52.5 Å²	52.5	36%	0.357	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	155.5	174	74	-87.8	0	0	0	112.3	G549 T550 G551 V592 I640 I641	G549-Y590 CarbonylContact C-O 3.53Å; G549-Y590 VanDerWaalsContact CA-O 3.23Å; G549-Y590 WeakPolarHBondContact CA-O 3.31Å; T550-Y590 HydrophobicContact CG2-CD1 4.16Å; T550-Y590 HydrophobicContact CG2-CE1 3.68Å; T550-Y590 PolarHBondContact N-O 3.11Å; T550-Y590 PolarHBondContact OG1-N 3.06Å; G551-Y590 PolarHBondContact N-O 3.08Å; Y590-V592 HydrophobicContact CD2-CG2 4.33Å; Y590-V592 HydrophobicContact CE2-CG2 4.22Å; Y590-I640 HydrophobicContact CD2-CG2 3.6Å; Y590-I640 HydrophobicContact CE2-CG2 4.43Å; Y590-I640 HydrophobicContact CG-CG2 3.88Å; Y590-I641 WeakPolarHBondContact CA-O 3.34Å; Y590-I641 VanDerWaalsContact CB-O 3.24Å; Y590-I641 WeakPolarHBondContact CB-O 3.37Å
591	F	94.2	Very high	82.1	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	170.3	166.8	68.6	-81.9	0	0	0	109.5	V526 T546 Y557 I577 I579 V593 I641 I643	V526-F591 HydrophobicContact CG1-CZ 4.41Å; T546-F591 HydrophobicContact CG2-CE2 4.43Å; Y557-F591 HydrophobicContact CD1-CB 3.71Å; Y557-F591 AromaticContact CD1-CD1 3.65Å; Y557-F591 HydrophobicContact CD1-CD1 3.65Å; Y557-F591 AromaticContact CD1-CD2 3.97Å; Y557-F591 HydrophobicContact CD1-CD2 3.97Å; Y557-F591 HydrophobicContact CD1-CE1 4.2Å; Y557-F591 HydrophobicContact CD1-CE2 4.46Å; Y557-F591 AromaticContact CD1-CG 3.51Å; Y557-F591 HydrophobicContact CD1-CG 3.51Å; Y557-F591 AromaticContact CD2-CD2 3.8Å; Y557-F591 HydrophobicContact CD2-CD2 3.8Å; Y557-F591 AromaticContact CD2-CE2 3.77Å; Y557-F591 HydrophobicContact CD2-CE2 3.77Å; Y557-F591 HydrophobicContact CD2-CG 4.21Å; Y557-F591 HydrophobicContact CD2-CZ 4.17Å; Y557-F591 HydrophobicContact CE1-CB 3.33Å; Y557-F591 HydrophobicContact CE1-CD1 4.2Å; Y557-F591 AromaticContact CE1-CD2 3.96Å; Y557-F591 HydrophobicContact CE1-CD2 3.96Å; Y557-F591 AromaticContact CE1-CG 3.6Å; Y557-F591 HydrophobicContact CE1-CG 3.6Å; Y557-F591 AromaticContact CE2-CD2 3.81Å; Y557-F591 HydrophobicContact CE2-CD2 3.81Å; Y557-F591 HydrophobicContact CE2-CE2 4.16Å; Y557-F591 HydrophobicContact CE2-CG 4.3Å; Y557-F591 HydrophobicContact CG-CB 4.48Å; Y557-F591 AromaticContact CG-CD1 3.86Å; Y557-F591 HydrophobicContact CG-CD1 3.86Å; Y557-F591 AromaticContact CG-CD2 3.89Å; Y557-F591 HydrophobicContact CG-CD2 3.89Å; Y557-F591 AromaticContact CG-CE1 3.94Å; Y557-F591 HydrophobicContact CG-CE1 3.94Å; Y557-F591 AromaticContact CG-CE2 3.94Å; Y557-F591 HydrophobicContact CG-CE2 3.94Å; Y557-F591 AromaticContact CG-CG 3.83Å; Y557-F591 HydrophobicContact CG-CG 3.83Å; Y557-F591 AromaticContact CG-CZ 3.96Å; Y557-F591 HydrophobicContact CG-CZ 3.96Å; Y557-F591 AromaticContact CZ-CD2 3.86Å; Y557-F591 AromaticContact CZ-CG 3.99Å; I577-F591 HydrophobicContact CD1-CE2 4.21Å; I577-F591 HydrophobicContact CG2-CE2 4.1Å; I577-F591 HydrophobicContact CG2-CZ 4.02Å; I579-F591 HydrophobicContact CD1-CE1 3.62Å; I579-F591 HydrophobicContact CD1-CZ 3.82Å; F591-V593 HydrophobicContact CE2-CG2 4.21Å; F591-I641 HydrophobicContact CD1-CB 4.09Å; F591-I641 HydrophobicContact CD1-CG2 4.29Å; F591-I641 HydrophobicContact CD2-CD1 3.94Å; F591-I641 HydrophobicContact CE1-CB 3.71Å; F591-I641 HydrophobicContact CE1-CD1 4.04Å; F591-I641 HydrophobicContact CE1-CG2 3.55Å; F591-I641 HydrophobicContact CE2-CB 4.36Å; F591-I641 HydrophobicContact CE2-CD1 3.24Å; F591-I641 HydrophobicContact CE2-CG1 4.42Å; F591-I641 HydrophobicContact CZ-CB 3.87Å; F591-I641 HydrophobicContact CZ-CD1 3.31Å; F591-I641 HydrophobicContact CZ-CG1 4.2Å; F591-I641 HydrophobicContact CZ-CG2 3.87Å; F591-I641 PolarHBondContact N-O 3.05Å; F591-I641 VanDerWaalsContact N-O 3.11Å; F591-I641 PolarHBondContact O-N 3.11Å; F591-I643 HydrophobicContact CD1-CD1 4.1Å; F591-I643 HydrophobicContact CD1-CG1 4.44Å; F591-I643 HydrophobicContact CE1-CD1 4.09Å; F591-I643 HydrophobicContact CE1-CG1 4.28Å
592	V	94.3	Very high	81.3	Confident	25 Å²	25	56.8 Å²	56.8	15%	0.152	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	145.7	-171.8	-173.8	0	0	0	0	110	T546 A547 Y590 N594 K638 C639 I640	T546-V592 CarbonylContact C-O 3.57Å; T546-V592 WeakPolarHBondContact CA-O 3.1Å; A547-V592 HydrophobicContact CB-CB 4.49Å; A547-V592 PolarHBondContact N-O 3.44Å; A547-V592 PolarHBondContact O-N 2.72Å; Y590-V592 HydrophobicContact CD2-CG2 4.33Å; Y590-V592 HydrophobicContact CE2-CG2 4.22Å; V592-N594 WeakPolarHBondContact CG1-OD1 3.42Å; V592-K638 HydrophobicContact CG1-CB 4.37Å; V592-C639 CarbonylContact C-O 3.58Å; V592-C639 VanDerWaalsContact CA-O 3.27Å; V592-C639 WeakPolarHBondContact CA-O 3.41Å; V592-I640 HydrophobicContact CG2-CG1 4.4Å
593	V	95	Very high	80	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	129.1	168.3	-169	0	0	0	0	108	F512 I528 E545 T546 L575 I577 F591 K638 C639 I641	F512-V593 HydrophobicContact CE1-CG1 4.24Å; F512-V593 VanDerWaalsContact CE2-O 3.24Å; F512-V593 WeakPolarHBondContact CE2-O 3.5Å; F512-V593 HydrophobicContact CZ-CB 3.91Å; F512-V593 HydrophobicContact CZ-CG1 3.73Å; I528-V593 HydrophobicContact CD1-CG2 3.97Å; E545-V593 WeakPolarHBondContact O-CA 3.24Å; T546-V593 HydrophobicContact CG2-CG2 4.28Å; L575-V593 HydrophobicContact CD1-CG1 4.41Å; I577-V593 HydrophobicContact CD1-CG2 3.59Å; F591-V593 HydrophobicContact CE2-CG2 4.21Å; V593-K638 WeakPolarHBondContact O-CA 3.33Å; V593-C639 PolarHBondContact N-O 3.32Å; V593-C639 PolarHBondContact O-N 3.19Å; V593-I641 HydrophobicContact CG2-CD1 3.4Å
594	N	94.1	Very high	78.7	Confident	25 Å²	25	62.5 Å²	62.5	13%	0.134	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	140.4	179.9	-56.5	-42.6	0	0	0	110.2	Y544 E545 V592 N637 K638	Y544-N594 VanDerWaalsContact CA-O 3.24Å; Y544-N594 WeakPolarHBondContact CA-O 3.27Å; E545-N594 HydrophobicContact CG-CB 4.01Å; E545-N594 PolarHBondContact N-O 3.34Å; E545-N594 PolarHBondContact O-N 2.85Å; E545-N594 PolarHBondContact OE1-ND2 2.87Å; V592-N594 WeakPolarHBondContact CG1-OD1 3.42Å; N594-N637 WeakPolarHBondContact CA-O 3.41Å; N594-K638 WeakPolarHBondContact OD1-CG 3.49Å
595	L	93.3	Very high	77.4	Confident	8 Å²	8	64.9 Å²	64.9	4%	0.042	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	135.5	164.2	-61	175.1	0	0	0	109.7	F512 V530 V542 L633 N637	F512-L595 HydrophobicContact CD1-CD1 4.44Å; F512-L595 HydrophobicContact CD2-CD1 4.12Å; F512-L595 HydrophobicContact CD2-CG 4.22Å; F512-L595 HydrophobicContact CE1-CD1 4.33Å; F512-L595 HydrophobicContact CE1-CD2 4.04Å; F512-L595 HydrophobicContact CE1-CG 4.1Å; F512-L595 HydrophobicContact CE2-CD1 4.02Å; F512-L595 HydrophobicContact CE2-CD2 4.35Å; F512-L595 HydrophobicContact CE2-CG 3.61Å; F512-L595 HydrophobicContact CG-CD1 4.34Å; F512-L595 HydrophobicContact CZ-CD1 4.12Å; F512-L595 HydrophobicContact CZ-CD2 3.75Å; F512-L595 HydrophobicContact CZ-CG 3.53Å; V530-L595 HydrophobicContact CG1-CD1 3.87Å; V530-L595 HydrophobicContact CG2-CD1 4.31Å; V530-L595 HydrophobicContact CG2-CD2 4.06Å; V542-L595 HydrophobicContact CG1-CB 4.45Å; V542-L595 HydrophobicContact CG1-CD2 4.09Å; L595-L633 HydrophobicContact CB-CD2 3.52Å; L595-N637 HydrophobicContact CB-CB 4.48Å; L595-N637 PolarHBondContact N-O 3.38Å
596	S	91.3	Very high	76.2	Confident	50 Å²	50	69.3 Å²	69.3	35%	0.35	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-98.1	173.4	174	-73.1	0	0	0	0	111.4	P543	P543-S596 PolarHBondContact O-N 3.31Å
597	K	88.4	Confident	74.5	Confident	172 Å²	172	72.2 Å²	72.2	75%	0.748	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-56.7	127.5	-174.9	-70.1	-174.8	178.2	-175.1	0	111	P543 L633	P543-K597 WeakPolarHBondContact CD-O 3.2Å; K597-L633 HydrophobicContact CG-CD1 4.15Å
598	P	89.1	Confident	72.7	Confident	14 Å²	14	80.8 Å²	80.8	9%	0.091	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-68.9	148.4	175.4	29.3	-37.5	0	0	0	111.2	F510 V540 L541 V542 P631	F510-P598 HydrophobicContact CD2-CB 3.92Å; F510-P598 HydrophobicContact CD2-CG 4.04Å; F510-P598 HydrophobicContact CE2-CB 4.26Å; V540-P598 HydrophobicContact CG1-CB 3.59Å; L541-P598 CarbonylContact O-C 3.5Å; L541-P598 VanDerWaalsContact O-CA 3.3Å; L541-P598 WeakPolarHBondContact O-CA 3.48Å; V542-P598 HydrophobicContact CG2-CB 4.16Å; P598-P631 HydrophobicContact CB-CB 3.93Å; P598-P631 HydrophobicContact CB-CG 4.04Å; P598-P631 HydrophobicContact CG-CB 3.79Å; P598-P631 HydrophobicContact CG-CG 4.11Å; P598-P631 WeakPolarHBondContact CG-O 3.21Å
599	V	85.7	Confident	70.2	Confident	77 Å²	77	83.3 Å²	83.3	47%	0.467	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	119.5	-180	-177.9	0	0	0	0	108.8	L541	L541-V599 PolarHBondContact N-O 3.01Å; L541-V599 PolarHBondContact O-N 2.97Å
600	K	79.2	Confident	67.3	Low	87 Å²	87	91.5 Å²	91.5	38%	0.378	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	128.1	173.3	-168.7	175.6	-175.5	173.7	0	109.4	N602 P631	K600-N602 PolarHBondContact O-N 3.18Å; K600-P631 HydrophobicContact CB-CG 4.09Å
601	L	78.4	Confident	64.3	Low	83 Å²	83	93.6 Å²	93.6	44%	0.435	51%	0.513	S	S	.	.			trans	-87.6	105.1	174	-67.8	173	0	0	0	108.6	K539 L565 A603	K539-L601 HydrophobicContact CB-CB 4.28Å; K539-L601 PolarHBondContact O-N 3.02Å; L565-L601 HydrophobicContact CD1-CD1 3.52Å; L601-A603 PolarHBondContact O-N 2.97Å
602	N	63.5	Low	61.2	Low	124 Å²	124	100.6 Å²	100.6	66%	0.663	56%	0.555	S	S	*	*			trans	-69.6	128.4	174.6	-69.2	-12.9	0	0	0	109.5	K600 S604	K600-N602 PolarHBondContact O-N 3.18Å; N602-S604 PolarHBondContact O-N 3.35Å
603	A	47.8	Very low	58.1	Low	108 Å²	108	102.4 Å²	102.4	89%	0.893	58%	0.579	S	S	*	*	S	Bend	trans	-71	25.7	-179	0	0	0	0	0	114.6	L601	L601-A603 PolarHBondContact O-N 2.97Å
604	S	38.4	Very low	55	Low	104 Å²	104	111.1 Å²	111.1	73%	0.727	62%	0.62	S	S	*	*			trans	-152	70.4	179.5	-60.9	0	0	0	0	111.5	N602	N602-S604 PolarHBondContact O-N 3.35Å
605	A	36.5	Very low	51.9	Low	107 Å²	107	116.8 Å²	116.8	88%	0.884	66%	0.656	S	S	*	*			trans	-98.1	70.9	161.9	0	0	0	0	0	109.2
606	S	34	Very low	49.2	Very low	105 Å²	105	121.5 Å²	121.5	73%	0.734	69%	0.687	S	S	*	*			trans	-103.2	104.2	159.4	54.9	0	0	0	0	108.3
607	E	30.4	Very low	46.7	Very low	170 Å²	170	126 Å²	126	79%	0.794	71%	0.712	S	S	*	*			trans	65.9	79.4	161	-55.2	-169.8	177.5	0	0	118.4	K609	E607-K609 PolarHBondContact O-N 3.12Å; E607-K609 VanDerWaalsContact O-N 3.13Å
608	E	32	Very low	44.6	Very low	182 Å²	182	121.1 Å²	121.1	85%	0.85	70%	0.7	S	S	*	*			trans	-70.8	96.8	154.8	-74	-178.1	172.9	0	0	110.2
609	K	27.6	Very low	42.6	Very low	178 Å²	178	126 Å²	126	77%	0.774	73%	0.725	S	S	*	*			trans	-86.3	114.9	155.1	-87.4	178.4	-178.6	164.9	0	108.5	E607 T611	E607-K609 PolarHBondContact O-N 3.12Å; E607-K609 VanDerWaalsContact O-N 3.13Å; K609-T611 PolarHBondContact O-N 3.49Å; K609-T611 VanDerWaalsContact O-N 3.08Å
610	Y	29.4	Very low	40.8	Very low	212 Å²	212	129.3 Å²	129.3	83%	0.831	74%	0.739	S	S	*	*			trans	-53.4	107.4	168.1	-86.3	-104.9	0	0	0	110.8
611	T	28.4	Very low	39.3	Very low	135 Å²	135	132.3 Å²	132.3	83%	0.828	76%	0.756	S	S	*	*			trans	-110.1	113.9	157.4	39.4	0	0	0	0	109.3	K609	K609-T611 PolarHBondContact O-N 3.49Å; K609-T611 VanDerWaalsContact O-N 3.08Å
612	V	29.2	Very low	37.8	Very low	146 Å²	146	132.6 Å²	132.6	89%	0.885	76%	0.758	S	S	*	*			trans	-71.8	124.3	170.7	175.5	0	0	0	0	108.3
613	G	28.9	Very low	37.2	Very low	63 Å²	63	131.5 Å²	131.5	65%	0.649	75%	0.749	S	S	*	*			trans	132.4	99.1	164.9	0	0	0	0	0	113.1
614	E	28.8	Very low	37.2	Very low	183 Å²	183	134.8 Å²	134.8	86%	0.855	74%	0.739	S	S	*	*			trans	145	111.6	134.4	-80	178.3	-178.9	0	0	109.5	P616	E614-P616 WeakPolarHBondContact O-CD 3.29Å
615	T	29.4	Very low	37.6	Very low	145 Å²	145	135.5 Å²	135.5	89%	0.89	73%	0.733	S	S	*	*			trans	-53.9	110	166	20	0	0	0	0	109.7
616	P	38	Very low	38.2	Very low	107 Å²	107	136.7 Å²	136.7	70%	0.695	72%	0.72	S	S	*	*			trans	-86.2	122.7	170.9	3.5	17.3	0	0	0	107.6	E614 S618	E614-P616 WeakPolarHBondContact O-CD 3.29Å; P616-S618 PolarHBondContact O-N 3.27Å
617	T	38.1	Very low	39.3	Very low	145 Å²	145	137.9 Å²	137.9	89%	0.89	71%	0.714	S	S	*	*			trans	-65.9	82	158.6	46.6	0	0	0	0	107.9
618	S	45.1	Very low	40.4	Very low	69 Å²	69	136.5 Å²	136.5	48%	0.483	71%	0.709	S	S	.	*			trans	-80.7	135.4	170.9	52	0	0	0	0	109.4	P616	P616-S618 PolarHBondContact O-N 3.27Å
619	N	45.3	Very low	41.7	Very low	115 Å²	115	129.5 Å²	129.5	62%	0.615	69%	0.686	S	S	*	*			trans	-65.9	135.9	-180	-68	-46.7	0	0	0	109.7	M621 D622	N619-M621 PolarHBondContact O-N 3.48Å; N619-D622 PolarHBondContact O-N 2.84Å
620	L	48.6	Very low	43.9	Very low	147 Å²	147	126.4 Å²	126.4	77%	0.77	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.6	-11.5	177	-75.9	165	0	0	0	115	R624	L620-R624 WeakPolarHBondContact O-CB 3.31Å
621	M	47.1	Very low	46.3	Very low	150 Å²	150	116.8 Å²	116.8	74%	0.739	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-40.4	175.4	-74.9	-160.7	176.8	0	0	113.2	N619 E623 R624 I625	N619-M621 PolarHBondContact O-N 3.48Å; M621-E623 VanDerWaalsContact C-N 3.34Å; M621-R624 PolarHBondContact O-N 2.75Å; M621-I625 WeakPolarHBondContact O-CG1 3.41Å; M621-I625 PolarHBondContact O-N 3.37Å
622	D	48.2	Very low	48.9	Very low	89 Å²	89	113.4 Å²	113.4	48%	0.476	62%	0.615	S	S	.	*	H	α-helix	trans	-69.5	-37.3	179.4	-61.4	-36.7	0	0	0	110.3	N619 R624 I625 E626	N619-D622 PolarHBondContact O-N 2.84Å; D622-R624 VanDerWaalsContact C-N 3.28Å; D622-R624 PolarHBondContact O-N 3Å; D622-I625 PolarHBondContact O-N 3.12Å; D622-E626 WeakPolarHBondContact O-CB 3.38Å; D622-E626 WeakPolarHBondContact O-CG 3.48Å; D622-E626 PolarHBondContact O-N 2.8Å
623	E	49.4	Very low	51.7	Low	101 Å²	101	108.8 Å²	108.8	47%	0.472	59%	0.585	S	S	.	*	H	α-helix	trans	-63.3	-34	173.6	-138.3	175.4	-165.5	0	0	111.9	M621 E627	M621-E623 VanDerWaalsContact C-N 3.34Å; E623-E627 WeakPolarHBondContact O-CB 3.17Å; E623-E627 WeakPolarHBondContact O-CG 3.27Å; E623-E627 PolarHBondContact O-N 3.03Å
624	R	49.5	Very low	54.3	Low	178 Å²	178	106.3 Å²	106.3	67%	0.672	56%	0.56	S	S	*	*	H	α-helix	trans	-76.2	-36.2	179.4	-156.2	174.2	-160.5	165.2	3.3	112.4	L620 M621 D622 E627 M628	L620-R624 WeakPolarHBondContact O-CB 3.31Å; M621-R624 PolarHBondContact O-N 2.75Å; D622-R624 VanDerWaalsContact C-N 3.28Å; D622-R624 PolarHBondContact O-N 3Å; R624-E627 PolarHBondContact O-N 2.91Å; R624-M628 VanDerWaalsContact O-CG 3.27Å; R624-M628 WeakPolarHBondContact O-CG 3.3Å; R624-M628 PolarHBondContact O-N 3.13Å
625	I	45.6	Very low	56.9	Low	118 Å²	118	107.7 Å²	107.7	61%	0.605	56%	0.564	S	S	*	*	H	α-helix	trans	-70.5	-40.8	175	-64.6	166.1	0	0	0	110.1	M621 D622 E627 M628 G629	M621-I625 WeakPolarHBondContact O-CG1 3.41Å; M621-I625 PolarHBondContact O-N 3.37Å; D622-I625 PolarHBondContact O-N 3.12Å; I625-E627 VanDerWaalsContact C-N 3.34Å; I625-E627 PolarHBondContact O-N 3.21Å; I625-M628 PolarHBondContact O-N 3.26Å; I625-G629 PolarHBondContact O-N 2.96Å; I625-G629 VanDerWaalsContact O-N 3.12Å
626	E	49.6	Very low	59.6	Low	132 Å²	132	103.6 Å²	103.6	62%	0.617	54%	0.535	S	S	*	.	H	α-helix	trans	-67.5	-30.3	172.8	-73.9	-175.5	176.7	0	0	113.3	D622 K630	D622-E626 WeakPolarHBondContact O-CB 3.38Å; D622-E626 WeakPolarHBondContact O-CG 3.48Å; D622-E626 PolarHBondContact O-N 2.8Å; E626-K630 WeakPolarHBondContact O-CE 3.34Å; E626-K630 WeakPolarHBondContact O-CG 3.44Å
627	E	56.5	Low	62.1	Low	131 Å²	131	101.2 Å²	101.2	61%	0.612	52%	0.517	S	S	*	.	H	α-helix	trans	-70.7	-38.5	170.8	-83.6	-167.7	155.2	0	0	112.8	E623 R624 I625 G629	E623-E627 WeakPolarHBondContact O-CB 3.17Å; E623-E627 WeakPolarHBondContact O-CG 3.27Å; E623-E627 PolarHBondContact O-N 3.03Å; R624-E627 PolarHBondContact O-N 2.91Å; I625-E627 VanDerWaalsContact C-N 3.34Å; I625-E627 PolarHBondContact O-N 3.21Å; E627-G629 VanDerWaalsContact C-N 3.3Å; E627-G629 PolarHBondContact O-N 3.49Å
628	M	53	Low	64.6	Low	140 Å²	140	100.3 Å²	100.3	69%	0.69	50%	0.501	S	S	*	.	H	α-helix	trans	-69.6	-25	177.4	-72.9	-179.9	71.7	0	0	113	H506 R624 I625	H506-M628 PolarHBondContact CE1-O 3.24Å; H506-M628 VanDerWaalsContact CE1-O 3.26Å; R624-M628 VanDerWaalsContact O-CG 3.27Å; R624-M628 WeakPolarHBondContact O-CG 3.3Å; R624-M628 PolarHBondContact O-N 3.13Å; I625-M628 PolarHBondContact O-N 3.26Å
629	G	59.9	Low	66.8	Low	35 Å²	35	97 Å²	97	36%	0.361	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	9.3	179.3	0	0	0	0	0	116	I625 E627	I625-G629 PolarHBondContact O-N 2.96Å; I625-G629 VanDerWaalsContact O-N 3.12Å; E627-G629 VanDerWaalsContact C-N 3.3Å; E627-G629 PolarHBondContact O-N 3.49Å
630	K	74.4	Confident	69.1	Low	113 Å²	113	94.5 Å²	94.5	49%	0.491	46%	0.463	S	S	.	.	S	Bend	trans	-95.1	140.9	178.3	-73.8	166.8	-171.1	165.2	0	110.4	E626	E626-K630 WeakPolarHBondContact O-CE 3.34Å; E626-K630 WeakPolarHBondContact O-CG 3.44Å
631	P	80	Confident	71.2	Confident	11 Å²	11	87.5 Å²	87.5	7%	0.071	43%	0.427	C	S	.	.			trans	-60.1	145.4	172.7	27.9	-34.8	0	0	0	109.7	P507 G508 F510 V540 P598 K600	P507-P631 HydrophobicContact CB-CB 4.47Å; G508-P631 WeakPolarHBondContact O-CA 3.45Å; F510-P631 HydrophobicContact CD2-CB 4.36Å; F510-P631 HydrophobicContact CE2-CB 3.81Å; V540-P631 HydrophobicContact CG1-CB 3.88Å; V540-P631 HydrophobicContact CG1-CG 3.88Å; V540-P631 HydrophobicContact CG2-CB 4.17Å; V540-P631 HydrophobicContact CG2-CG 4.28Å; P598-P631 HydrophobicContact CB-CB 3.93Å; P598-P631 HydrophobicContact CB-CG 4.04Å; P598-P631 HydrophobicContact CG-CB 3.79Å; P598-P631 HydrophobicContact CG-CG 4.11Å; P598-P631 WeakPolarHBondContact CG-O 3.21Å; K600-P631 HydrophobicContact CB-CG 4.09Å
632	T	83.3	Confident	73.3	Confident	63 Å²	63	83.8 Å²	83.8	39%	0.387	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	160.8	-177.1	61.4	0	0	0	0	112.5	G508 V509 F510	G508-T632 PolarHBondContact O-N 3.32Å; V509-T632 WeakPolarHBondContact CA-O 3.42Å; V509-T632 WeakPolarHBondContact CG2-OG1 3.34Å; F510-T632 PolarHBondContact N-O 3.3Å
633	L	86.8	Confident	75.2	Confident	49 Å²	49	79.6 Å²	79.6	26%	0.257	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	131.5	171.3	-87.1	154.2	0	0	0	109.4	L595 K597 N637	L595-L633 HydrophobicContact CB-CD2 3.52Å; K597-L633 HydrophobicContact CG-CD1 4.15Å; L633-N637 HydrophobicContact CD2-CB 3.73Å
634	G	83	Confident	76.8	Confident	12 Å²	12	78.3 Å²	78.3	12%	0.124	38%	0.377	C	S	.	.			trans	-75.4	-178.2	173.4	0	0	0	0	0	113.4	F510 I636	F510-G634 PolarHBondContact O-N 3.36Å; G634-I636 VanDerWaalsContact C-N 3.33Å; G634-I636 PolarHBondContact O-N 3.14Å
635	K	83.5	Confident	78.1	Confident	212 Å²	212	71.8 Å²	71.8	92%	0.922	35%	0.354	S	S	*	.	S	Bend	trans	-62.5	-38	-175.8	-64.6	175.9	-176.3	167.5	0	112.6	N637	K635-N637 PolarHBondContact O-N 3.41Å
636	I	87.5	Confident	79.4	Confident	58 Å²	58	66.9 Å²	66.9	30%	0.297	33%	0.33	S	S	.	.			trans	-97.6	72.8	-178.9	-46.9	177.5	0	0	0	109.2	S511 F512 D515 G634	S511-I636 WeakPolarHBondContact CA-O 2.91Å; S511-I636 WeakPolarHBondContact CB-O 3.39Å; F512-I636 HydrophobicContact CB-CG2 3.96Å; F512-I636 HydrophobicContact CD2-CG2 4.5Å; F512-I636 WeakPolarHBondContact CD2-O 3.48Å; F512-I636 PolarHBondContact N-O 2.81Å; D515-I636 HydrophobicContact CB-CG2 3.96Å; G634-I636 VanDerWaalsContact C-N 3.33Å; G634-I636 PolarHBondContact O-N 3.14Å
637	N	89.4	Confident	80.3	Confident	57 Å²	57	68.7 Å²	68.7	31%	0.305	34%	0.336	S	S	.	.			trans	-91.3	1.2	174.1	62.7	-4	0	0	0	113.6	N594 L595 L633 K635	N594-N637 WeakPolarHBondContact CA-O 3.41Å; L595-N637 HydrophobicContact CB-CB 4.48Å; L595-N637 PolarHBondContact N-O 3.38Å; L633-N637 HydrophobicContact CD2-CB 3.73Å; K635-N637 PolarHBondContact O-N 3.41Å
638	K	91.1	Very high	80.6	Confident	127 Å²	127	69.3 Å²	69.3	55%	0.552	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.2	133	176.3	-59.8	-171.2	-179.9	-178.6	0	109.7	V592 V593 N594	V592-K638 HydrophobicContact CG1-CB 4.37Å; V593-K638 WeakPolarHBondContact O-CA 3.33Å; N594-K638 WeakPolarHBondContact OD1-CG 3.49Å
639	C	91.7	Very high	81	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	132.1	179.8	170.4	0	0	0	0	110.3	F512 D515 Y517 V592 V593	F512-C639 HydrophobicContact CB-CB 4.22Å; F512-C639 HydrophobicContact CD1-CB 4.04Å; F512-C639 HydrophobicContact CD2-CB 3.43Å; F512-C639 VanDerWaalsContact CD2-CB 3.43Å; F512-C639 HydrophobicContact CE1-CB 4.23Å; F512-C639 HydrophobicContact CE2-CB 3.63Å; F512-C639 HydrophobicContact CG-CB 3.64Å; F512-C639 HydrophobicContact CZ-CB 4.03Å; D515-C639 CarbonylContact O-C 3.48Å; D515-C639 WeakPolarHBondContact O-CA 3.23Å; Y517-C639 WeakPolarHBondContact CD2-SG 3.29Å; V592-C639 CarbonylContact C-O 3.58Å; V592-C639 VanDerWaalsContact CA-O 3.27Å; V592-C639 WeakPolarHBondContact CA-O 3.41Å; V593-C639 PolarHBondContact N-O 3.32Å; V593-C639 PolarHBondContact O-N 3.19Å
640	I	93.4	Very high	81	Confident	61 Å²	61	64.2 Å²	64.2	31%	0.313	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	120.1	179.1	-60.8	177.1	0	0	0	109.7	D515 T516 Y517 Y590 V592 K642	D515-I640 PolarHBondContact O-N 3.24Å; T516-I640 CarbonylContact C-O 3.56Å; T516-I640 VanDerWaalsContact CA-O 3.23Å; T516-I640 WeakPolarHBondContact CA-O 3Å; Y517-I640 PolarHBondContact N-O 3Å; Y590-I640 HydrophobicContact CD2-CG2 3.6Å; Y590-I640 HydrophobicContact CE2-CG2 4.43Å; Y590-I640 HydrophobicContact CG-CG2 3.88Å; V592-I640 HydrophobicContact CG2-CG1 4.4Å; I640-K642 HydrophobicContact CG2-CG 4.23Å
641	I	92.8	Very high	80.3	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	113.5	176.2	-61.1	143.2	0	0	0	108.5	Y517 V519 V526 I528 I577 Y590 F591 V593	Y517-I641 WeakPolarHBondContact O-CA 3.43Å; V519-I641 HydrophobicContact CG1-CG2 3.85Å; V526-I641 HydrophobicContact CB-CG2 4.47Å; V526-I641 HydrophobicContact CG1-CD1 4.29Å; V526-I641 HydrophobicContact CG1-CG2 4.22Å; V526-I641 HydrophobicContact CG2-CG2 4.17Å; I528-I641 HydrophobicContact CD1-CD1 3.38Å; I528-I641 HydrophobicContact CD1-CG1 4Å; I528-I641 HydrophobicContact CG1-CD1 4.38Å; I577-I641 HydrophobicContact CD1-CD1 4.36Å; Y590-I641 WeakPolarHBondContact CA-O 3.34Å; Y590-I641 VanDerWaalsContact CB-O 3.24Å; Y590-I641 WeakPolarHBondContact CB-O 3.37Å; F591-I641 HydrophobicContact CD1-CB 4.09Å; F591-I641 HydrophobicContact CD1-CG2 4.29Å; F591-I641 HydrophobicContact CD2-CD1 3.94Å; F591-I641 HydrophobicContact CE1-CB 3.71Å; F591-I641 HydrophobicContact CE1-CD1 4.04Å; F591-I641 HydrophobicContact CE1-CG2 3.55Å; F591-I641 HydrophobicContact CE2-CB 4.36Å; F591-I641 HydrophobicContact CE2-CD1 3.24Å; F591-I641 HydrophobicContact CE2-CG1 4.42Å; F591-I641 HydrophobicContact CZ-CB 3.87Å; F591-I641 HydrophobicContact CZ-CD1 3.31Å; F591-I641 HydrophobicContact CZ-CG1 4.2Å; F591-I641 HydrophobicContact CZ-CG2 3.87Å; F591-I641 PolarHBondContact N-O 3.05Å; F591-I641 VanDerWaalsContact N-O 3.11Å; F591-I641 PolarHBondContact O-N 3.11Å; V593-I641 HydrophobicContact CG2-CD1 3.4Å
642	K	90.5	Very high	79.2	Confident	73 Å²	73	64 Å²	64	32%	0.317	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	115.8	176.1	-64.8	178.1	-176.3	166.6	0	109.7	T516 Y517 E518 V519 E589 I640	T516-K642 HydrophobicContact CG2-CD 3.95Å; T516-K642 HydrophobicContact CG2-CG 4.25Å; Y517-K642 PolarHBondContact O-N 3.05Å; E518-K642 WeakPolarHBondContact CA-O 3.45Å; E518-K642 HydrophobicContact CG-CB 4.39Å; V519-K642 PolarHBondContact N-O 2.84Å; E589-K642 CarbonylContact O-C 3.57Å; E589-K642 WeakPolarHBondContact O-CA 3.35Å; I640-K642 HydrophobicContact CG2-CG 4.23Å
643	I	88.1	Confident	77.9	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	119.3	173.7	-50	170.7	0	0	0	108.2	V519 E521 D556 I579 R587 E589 F591	V519-I643 HydrophobicContact CG1-CG1 4.23Å; V519-I643 WeakPolarHBondContact O-CA 3.28Å; E521-I643 HydrophobicContact CB-CG2 3.98Å; D556-I643 HydrophobicContact CB-CD1 4.31Å; I579-I643 HydrophobicContact CD1-CD1 4.38Å; I579-I643 HydrophobicContact CD1-CG1 4.41Å; I579-I643 HydrophobicContact CG2-CD1 4.21Å; I579-I643 HydrophobicContact CG2-CG1 4.41Å; I579-I643 HydrophobicContact CG2-CG2 4.08Å; R587-I643 CarbonylContact C-O 3.52Å; R587-I643 HydrophobicContact CG-CG2 4.5Å; E589-I643 PolarHBondContact N-O 3.39Å; E589-I643 PolarHBondContact O-N 2.94Å; F591-I643 HydrophobicContact CD1-CD1 4.1Å; F591-I643 HydrophobicContact CD1-CG1 4.44Å; F591-I643 HydrophobicContact CE1-CD1 4.09Å; F591-I643 HydrophobicContact CE1-CG1 4.28Å
644	K	83.9	Confident	76.3	Confident	75 Å²	75	61 Å²	61	33%	0.326	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	156.2	178.4	-69.9	-169.3	175.3	176.9	0	112	E518 V519 E521 R587	E518-K644 VanDerWaalsContact OE1-CE 3.24Å; E518-K644 WeakPolarHBondContact OE1-CE 3.27Å; E518-K644 IonicContact OE1-NZ 2.93Å; E518-K644 PolarHBondContact OE1-NZ 2.8Å; E518-K644 WeakPolarHBondContact OE2-CE 3.34Å; E518-K644 IonicContact OE2-NZ 2.8Å; E518-K644 PolarHBondContact OE2-NZ 3.47Å; V519-K644 PolarHBondContact O-N 2.82Å; E521-K644 PolarHBondContact N-O 3.15Å; R587-K644 WeakPolarHBondContact O-CA 3.38Å
645	E	76.6	Confident	74.9	Confident	41 Å²	41	66 Å²	66	19%	0.192	31%	0.313	C	S	.	.			trans	-60.6	155.4	172.1	67.2	-115.4	-162	0	0	113	Y585 E586 R587 K647 K650	Y585-E645 WeakPolarHBondContact O-CB 3.26Å; E586-E645 VanDerWaalsContact CA-OE2 3.3Å; E586-E645 WeakPolarHBondContact CA-OE2 3.43Å; R587-E645 PolarHBondContact N-OE2 3.45Å; R587-E645 PolarHBondContact O-N 3.42Å; E645-K647 PolarHBondContact O-N 2.9Å; E645-K650 HydrophobicContact CG-CD 4.14Å; E645-K650 VanDerWaalsContact OE1-CD 3.27Å; E645-K650 WeakPolarHBondContact OE1-CD 3.27Å; E645-K650 IonicContact OE1-NZ 3.21Å; E645-K650 PolarHBondContact OE1-NZ 2.96Å
646	S	71.9	Confident	73.3	Confident	15 Å²	15	57.6 Å²	57.6	11%	0.105	28%	0.278	C	S	.	.			trans	-68.2	118.1	167.9	170.5	0	0	0	0	110.9	E648 F649 K650	S646-E648 PolarHBondContact O-N 3.3Å; S646-E648 PolarHBondContact OG-N 2.88Å; S646-F649 PolarHBondContact O-N 2.86Å; S646-F649 PolarHBondContact OG-N 2.79Å; S646-K650 PolarHBondContact O-N 3.42Å
647	K	68.6	Low	71.6	Confident	170 Å²	170	55.8 Å²	55.8	74%	0.739	27%	0.268	S	S	*	.	H	α-helix	trans	-58.9	-34.9	174.1	-69.7	179.9	-178.9	171.1	0	112.3	E645 N651	E645-K647 PolarHBondContact O-N 2.9Å; K647-N651 VanDerWaalsContact O-CB 3.25Å; K647-N651 WeakPolarHBondContact O-CB 3.41Å; K647-N651 PolarHBondContact O-N 3.15Å; K647-N651 PolarHBondContact O-ND2 2.83Å; K647-N651 VanDerWaalsContact O-ND2 3.17Å
648	E	62.4	Low	69.8	Low	144 Å²	144	61.7 Å²	61.7	67%	0.673	29%	0.291	S	S	*	.	H	α-helix	trans	-66.3	-45.4	177.9	-67.2	-171.8	161.4	0	0	111.5	S646 A652	S646-E648 PolarHBondContact O-N 3.3Å; S646-E648 PolarHBondContact OG-N 2.88Å; E648-A652 WeakPolarHBondContact O-CB 3.46Å; E648-A652 PolarHBondContact O-N 3.18Å
649	F	61.4	Low	67.8	Low	16 Å²	16	59.4 Å²	59.4	7%	0.07	28%	0.281	C	S	.	.	H	α-helix	trans	-61.8	-50	176	-177.3	-94.8	0	0	0	111.5	L298 L301 Y585 S646 N651 A652 V653	L298-F649 HydrophobicContact CD2-CE1 3.6Å; L298-F649 HydrophobicContact CD2-CZ 3.39Å; L301-F649 HydrophobicContact CD2-CD2 4.17Å; L301-F649 HydrophobicContact CD2-CE2 3.26Å; L301-F649 HydrophobicContact CD2-CZ 3.86Å; Y585-F649 HydrophobicContact CD2-CE1 4.47Å; S646-F649 PolarHBondContact O-N 2.86Å; S646-F649 PolarHBondContact OG-N 2.79Å; F649-N651 PolarHBondContact O-N 3.21Å; F649-A652 WeakPolarHBondContact O-CB 3.23Å; F649-A652 PolarHBondContact O-N 3.41Å; F649-V653 HydrophobicContact CD1-CG2 4.22Å; F649-V653 HydrophobicContact CE1-CG2 4.01Å; F649-V653 HydrophobicContact CZ-CG2 4.38Å; F649-V653 WeakPolarHBondContact O-CG2 3.25Å; F649-V653 PolarHBondContact O-N 3.48Å
650	K	61.3	Low	65.5	Low	52 Å²	52	60.7 Å²	60.7	23%	0.226	29%	0.289	C	S	.	.	H	α-helix	trans	-58.7	-47.5	178.8	-174.6	173.8	-169.1	165.8	0	112.2	Y585 E645 S646 A652 V653 D654	Y585-K650 HydrophobicContact CE2-CG 4.07Å; E645-K650 HydrophobicContact CG-CD 4.14Å; E645-K650 VanDerWaalsContact OE1-CD 3.27Å; E645-K650 WeakPolarHBondContact OE1-CD 3.27Å; E645-K650 IonicContact OE1-NZ 3.21Å; E645-K650 PolarHBondContact OE1-NZ 2.96Å; S646-K650 PolarHBondContact O-N 3.42Å; K650-A652 VanDerWaalsContact C-N 3.29Å; K650-A652 PolarHBondContact O-N 3.43Å; K650-V653 PolarHBondContact O-N 3.27Å; K650-D654 WeakPolarHBondContact O-CB 3.33Å; K650-D654 PolarHBondContact O-N 3.39Å
651	N	59.4	Low	63.4	Low	103 Å²	103	60.9 Å²	60.9	55%	0.551	29%	0.291	S	S	*	.	H	α-helix	trans	-62	-36.3	177.8	-75.5	-24.9	0	0	0	112.4	K647 F649 M655	K647-N651 VanDerWaalsContact O-CB 3.25Å; K647-N651 WeakPolarHBondContact O-CB 3.41Å; K647-N651 PolarHBondContact O-N 3.15Å; K647-N651 PolarHBondContact O-ND2 2.83Å; K647-N651 VanDerWaalsContact O-ND2 3.17Å; F649-N651 PolarHBondContact O-N 3.21Å; N651-M655 WeakPolarHBondContact O-CB 3.22Å; N651-M655 WeakPolarHBondContact O-CG 3.47Å; N651-M655 PolarHBondContact O-N 3.38Å
652	A	56.5	Low	61.2	Low	17 Å²	17	61.3 Å²	61.3	14%	0.14	29%	0.293	C	S	.	.	H	α-helix	trans	-65.7	-44.9	175.8	0	0	0	0	0	112	E648 F649 K650 L656	E648-A652 WeakPolarHBondContact O-CB 3.46Å; E648-A652 PolarHBondContact O-N 3.18Å; F649-A652 WeakPolarHBondContact O-CB 3.23Å; F649-A652 PolarHBondContact O-N 3.41Å; K650-A652 VanDerWaalsContact C-N 3.29Å; K650-A652 PolarHBondContact O-N 3.43Å; A652-L656 PolarHBondContact O-N 3.08Å
653	V	56.1	Low	59	Low	1 Å²	1	58.8 Å²	58.8	1%	0.006	29%	0.285	C	S	.	.	H	α-helix	trans	-63.3	-46.1	176	177.1	0	0	0	0	111.1	Y297 Y585 F649 K650 M655 L656 I657	Y297-V653 HydrophobicContact CD1-CG1 4.41Å; Y297-V653 HydrophobicContact CD1-CG2 3.86Å; Y297-V653 HydrophobicContact CE1-CG2 3.52Å; Y585-V653 HydrophobicContact CD2-CB 3.91Å; Y585-V653 HydrophobicContact CD2-CG1 3.72Å; Y585-V653 HydrophobicContact CD2-CG2 4.09Å; Y585-V653 HydrophobicContact CE2-CB 3.64Å; Y585-V653 HydrophobicContact CE2-CG1 3.39Å; Y585-V653 HydrophobicContact CE2-CG2 4.33Å; F649-V653 HydrophobicContact CD1-CG2 4.22Å; F649-V653 HydrophobicContact CE1-CG2 4.01Å; F649-V653 HydrophobicContact CZ-CG2 4.38Å; F649-V653 WeakPolarHBondContact O-CG2 3.25Å; F649-V653 PolarHBondContact O-N 3.48Å; K650-V653 PolarHBondContact O-N 3.27Å; V653-M655 VanDerWaalsContact C-N 3.34Å; V653-M655 PolarHBondContact O-N 3.13Å; V653-L656 WeakPolarHBondContact O-CB 3.32Å; V653-L656 PolarHBondContact O-N 2.76Å; V653-I657 HydrophobicContact CG1-CD1 3.65Å; V653-I657 HydrophobicContact CG1-CG1 4.19Å; V653-I657 WeakPolarHBondContact O-CG1 3.25Å; V653-I657 PolarHBondContact O-N 2.9Å
654	D	54.1	Low	56.9	Low	48 Å²	48	64.1 Å²	64.1	26%	0.257	31%	0.313	S	S	.	.	H	α-helix	trans	-63.7	-37	-179.1	-76.9	-6	0	0	0	113.2	Y585 K650 L656	Y585-D654 PolarHBondContact OH-OD1 3.18Å; K650-D654 WeakPolarHBondContact O-CB 3.33Å; K650-D654 PolarHBondContact O-N 3.39Å; D654-L656 VanDerWaalsContact C-N 3.26Å; D654-L656 PolarHBondContact O-N 3.5Å
655	M	52.3	Low	55.1	Low	117 Å²	117	62.4 Å²	62.4	58%	0.576	31%	0.307	S	S	*	.	H	α-helix	trans	-65.8	-30	173.5	-87.4	-80.4	-175.9	0	0	112.5	N651 V653 K659	N651-M655 WeakPolarHBondContact O-CB 3.22Å; N651-M655 WeakPolarHBondContact O-CG 3.47Å; N651-M655 PolarHBondContact O-N 3.38Å; V653-M655 VanDerWaalsContact C-N 3.34Å; V653-M655 PolarHBondContact O-N 3.13Å; M655-K659 WeakPolarHBondContact O-CG 3.5Å
656	L	50.3	Low	53.8	Low	35 Å²	35	61.9 Å²	61.9	18%	0.183	31%	0.305	C	S	.	.	H	α-helix	trans	-84.5	-43.9	-176.3	-98	156	0	0	0	113.3	Y297 T321 A652 V653 D654 K658 K659 T660	Y297-L656 HydrophobicContact CE2-CD1 3.84Å; T321-L656 HydrophobicContact CG2-CD1 3.48Å; T321-L656 VanDerWaalsContact CG2-CD1 3.48Å; T321-L656 HydrophobicContact CG2-CD2 3.29Å; T321-L656 HydrophobicContact CG2-CG 3.91Å; A652-L656 PolarHBondContact O-N 3.08Å; V653-L656 WeakPolarHBondContact O-CB 3.32Å; V653-L656 PolarHBondContact O-N 2.76Å; D654-L656 VanDerWaalsContact C-N 3.26Å; D654-L656 PolarHBondContact O-N 3.5Å; L656-K658 PolarHBondContact O-N 3.21Å; L656-K659 CarbonylContact O-C 3.55Å; L656-K659 WeakPolarHBondContact O-CA 3.36Å; L656-K659 PolarHBondContact O-N 3.1Å; L656-T660 PolarHBondContact O-N 3.47Å
657	I	52.2	Low	52.9	Low	19 Å²	19	62 Å²	62	10%	0.097	30%	0.303	C	S	.	.	H	α-helix	trans	-63.3	-31.8	178.5	-56.6	166.3	0	0	0	110.9	F290 R294 V653 K659 T660	F290-I657 HydrophobicContact CD2-CB 4.25Å; F290-I657 HydrophobicContact CD2-CD1 4.34Å; F290-I657 HydrophobicContact CD2-CG2 3.25Å; F290-I657 HydrophobicContact CE1-CD1 4.01Å; F290-I657 HydrophobicContact CE2-CB 3.67Å; F290-I657 HydrophobicContact CE2-CD1 3.64Å; F290-I657 HydrophobicContact CE2-CG1 4.24Å; F290-I657 HydrophobicContact CE2-CG2 3.17Å; F290-I657 HydrophobicContact CG-CG2 4.27Å; F290-I657 HydrophobicContact CZ-CB 4.32Å; F290-I657 HydrophobicContact CZ-CD1 3.42Å; F290-I657 VanDerWaalsContact CZ-CD1 3.42Å; F290-I657 HydrophobicContact CZ-CG1 4.47Å; F290-I657 HydrophobicContact CZ-CG2 4.14Å; R294-I657 HydrophobicContact CB-CD1 4.06Å; V653-I657 HydrophobicContact CG1-CD1 3.65Å; V653-I657 HydrophobicContact CG1-CG1 4.19Å; V653-I657 WeakPolarHBondContact O-CG1 3.25Å; V653-I657 PolarHBondContact O-N 2.9Å; I657-K659 PolarHBondContact O-N 2.98Å; I657-K659 VanDerWaalsContact O-N 3.16Å; I657-T660 PolarHBondContact O-OG1 3.45Å; I657-T660 VanDerWaalsContact O-OG1 3.11Å
658	K	51.5	Low	52.2	Low	181 Å²	181	56.2 Å²	56.2	79%	0.787	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-14.1	171.7	-75.6	178	-179.1	169.5	0	114.1	L656	L656-K658 PolarHBondContact O-N 3.21Å
659	K	48.4	Very low	52.4	Low	80 Å²	80	50.2 Å²	50.2	35%	0.348	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.8	1.2	-172.6	-70.3	-177.1	-179.8	177.7	0	115	M655 L656 I657 N661	M655-K659 WeakPolarHBondContact O-CG 3.5Å; L656-K659 CarbonylContact O-C 3.55Å; L656-K659 WeakPolarHBondContact O-CA 3.36Å; L656-K659 PolarHBondContact O-N 3.1Å; I657-K659 PolarHBondContact O-N 2.98Å; I657-K659 VanDerWaalsContact O-N 3.16Å; K659-N661 PolarHBondContact O-N 2.91Å
660	T	44	Very low	53.3	Low	27 Å²	27	52.5 Å²	52.5	17%	0.166	27%	0.272	C	S	.	.			trans	-68.3	-0.7	179.5	48.6	0	0	0	0	115	Q293 L324 L656 I657 V662	Q293-T660 PolarHBondContact OE1-OG1 3.5Å; Q293-T660 VanDerWaalsContact OE1-OG1 3.05Å; L324-T660 HydrophobicContact CD2-CG2 3.31Å; L656-T660 PolarHBondContact O-N 3.47Å; I657-T660 PolarHBondContact O-OG1 3.45Å; I657-T660 VanDerWaalsContact O-OG1 3.11Å; T660-V662 PolarHBondContact O-N 2.8Å
661	N	50	Low	54.5	Low	65 Å²	65	55.2 Å²	55.2	35%	0.348	28%	0.281	S	S	.	.			trans	-67.4	89.2	160.8	-81.9	3.5	0	0	0	108.6	E90 K659 S663 L664	E90-N661 PolarHBondContact OE1-ND2 3.43Å; E90-N661 PolarHBondContact OE2-ND2 2.86Å; K659-N661 PolarHBondContact O-N 2.91Å; N661-S663 PolarHBondContact O-N 3.12Å; N661-L664 HydrophobicContact CB-CB 4.49Å; N661-L664 WeakPolarHBondContact O-CB 3.31Å; N661-L664 PolarHBondContact O-N 3.23Å
662	V	46.5	Very low	55.7	Low	8 Å²	8	59.3 Å²	59.3	5%	0.048	29%	0.289	C	S	.	.	H	α-helix	trans	-47.6	-33.5	174	179.6	0	0	0	0	111.3	T325 A328 K330 T660 L664 L665 L666	T325-V662 HydrophobicContact CG2-CG1 4.24Å; T325-V662 HydrophobicContact CG2-CG2 4.2Å; A328-V662 HydrophobicContact CB-CG2 3.26Å; K330-V662 HydrophobicContact CG-CG1 4.13Å; T660-V662 PolarHBondContact O-N 2.8Å; V662-L664 PolarHBondContact O-N 3.27Å; V662-L665 PolarHBondContact O-N 3.14Å; V662-L665 VanDerWaalsContact O-N 3.12Å; V662-L666 HydrophobicContact CG1-CD1 3.79Å; V662-L666 WeakPolarHBondContact O-CD1 3.23Å; V662-L666 PolarHBondContact O-N 3.34Å
663	S	44.3	Very low	56.7	Low	21 Å²	21	60 Å²	60	15%	0.147	29%	0.289	C	S	.	.	H	α-helix	trans	-59.1	-24.4	174.5	57	0	0	0	0	114.3	N661 R667	N661-S663 PolarHBondContact O-N 3.12Å; S663-R667 WeakPolarHBondContact O-CD 3.36Å; S663-R667 PolarHBondContact O-NE 2.93Å; S663-R667 PolarHBondContact O-NH1 2.82Å
664	L	43.1	Very low	58.1	Low	112 Å²	112	60.1 Å²	60.1	59%	0.586	29%	0.289	S	S	*	.	H	α-helix	trans	-83.9	-34.8	175.7	-163	81.6	0	0	0	111.5	N661 V662 L666	N661-L664 HydrophobicContact CB-CB 4.49Å; N661-L664 WeakPolarHBondContact O-CB 3.31Å; N661-L664 PolarHBondContact O-N 3.23Å; V662-L664 PolarHBondContact O-N 3.27Å; L664-L666 VanDerWaalsContact C-N 3.34Å; L664-L666 PolarHBondContact O-N 3.43Å
665	L	46.1	Very low	59.8	Low	39 Å²	39	60.7 Å²	60.7	20%	0.204	29%	0.29	C	S	.	.	H	α-helix	trans	-73.8	-25.5	-175.1	-122.3	151.9	0	0	0	112.9	S353 V662 R667	S353-L665 WeakPolarHBondContact OG-CD2 3.39Å; V662-L665 PolarHBondContact O-N 3.14Å; V662-L665 VanDerWaalsContact O-N 3.12Å; L665-R667 PolarHBondContact O-N 3.46Å
666	L	50.1	Low	61.3	Low	29 Å²	29	58.4 Å²	58.4	15%	0.152	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-19.8	176.8	-105	105.5	0	0	0	115.6	F334 I349 V662 L664	F334-L666 HydrophobicContact CB-CD1 3.71Å; F334-L666 HydrophobicContact CB-CD2 3.47Å; F334-L666 VanDerWaalsContact CB-CD2 3.47Å; F334-L666 HydrophobicContact CB-CG 4.1Å; F334-L666 HydrophobicContact CD2-CD1 3.35Å; F334-L666 HydrophobicContact CD2-CD2 3.54Å; F334-L666 HydrophobicContact CD2-CG 3.55Å; F334-L666 HydrophobicContact CE2-CD1 4.31Å; F334-L666 HydrophobicContact CG-CD1 3.85Å; F334-L666 HydrophobicContact CG-CD2 3.96Å; F334-L666 HydrophobicContact CG-CG 4.27Å; I349-L666 HydrophobicContact CG2-CG 4.23Å; V662-L666 HydrophobicContact CG1-CD1 3.79Å; V662-L666 WeakPolarHBondContact O-CD1 3.23Å; V662-L666 PolarHBondContact O-N 3.34Å; L664-L666 VanDerWaalsContact C-N 3.34Å; L664-L666 PolarHBondContact O-N 3.43Å
667	R	52.6	Low	62.6	Low	17 Å²	17	57.2 Å²	57.2	6%	0.064	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.6	-10.3	-150.3	-78.7	129	156.8	-138.8	19.8	118	E84 V85 S88 S663 L665 S669 T721 D722	E84-R667 VanDerWaalsContact CB-NH2 3.3Å; E84-R667 PolarHBondContact O-NH2 3.19Å; E84-R667 IonicContact OE1-NH2 2.84Å; E84-R667 PolarHBondContact OE1-NH2 2.77Å; E84-R667 IonicContact OE2-NE 3.25Å; V85-R667 VanDerWaalsContact CA-CZ 3.4Å; V85-R667 HydrophobicContact CG2-CB 3.93Å; V85-R667 HydrophobicContact CG2-CG 3.41Å; V85-R667 VanDerWaalsContact CG2-CG 3.41Å; S88-R667 VanDerWaalsContact CB-NH2 3.29Å; S88-R667 VanDerWaalsContact OG-CZ 3.27Å; S88-R667 PolarHBondContact OG-NH1 2.8Å; S88-R667 PolarHBondContact OG-NH2 3.48Å; S663-R667 WeakPolarHBondContact O-CD 3.36Å; S663-R667 PolarHBondContact O-NE 2.93Å; S663-R667 PolarHBondContact O-NH1 2.82Å; L665-R667 PolarHBondContact O-N 3.46Å; R667-S669 PolarHBondContact O-N 3.25Å; R667-S669 VanDerWaalsContact O-N 3.1Å; R667-T721 PolarHBondContact O-OG1 3.01Å; R667-D722 VanDerWaalsContact O-OD1 3.08Å
668	T	54.2	Low	64.2	Low	50 Å²	50	56.5 Å²	56.5	31%	0.307	27%	0.273	S	S	.	.			trans	-94.6	63.4	-173.1	69.6	0	0	0	0	113.1	R360 D722	R360-T668 PolarHBondContact NH2-O 3.35Å; R360-T668 VanDerWaalsContact NH2-O 3.1Å; T668-D722 VanDerWaalsContact CA-CG 3.43Å; T668-D722 VanDerWaalsContact CA-OD1 3.24Å; T668-D722 WeakPolarHBondContact CA-OD1 3.38Å; T668-D722 WeakPolarHBondContact CA-OD2 3.24Å; T668-D722 WeakPolarHBondContact CB-OD1 3.48Å; T668-D722 WeakPolarHBondContact CB-OD2 3.07Å; T668-D722 VanDerWaalsContact CG2-CG 3.4Å; T668-D722 WeakPolarHBondContact CG2-OD1 3.24Å; T668-D722 WeakPolarHBondContact CG2-OD2 3.45Å
669	S	66	Low	65.8	Low	18 Å²	18	52.9 Å²	52.9	13%	0.126	26%	0.261	C	S	.	.			trans	-87	122	173.2	65.5	0	0	0	0	110.6	R667 E673 Q674 P720	R667-S669 PolarHBondContact O-N 3.25Å; R667-S669 VanDerWaalsContact O-N 3.1Å; S669-E673 VanDerWaalsContact CA-OE2 3.3Å; S669-E673 WeakPolarHBondContact CA-OE2 3.35Å; S669-Q674 WeakPolarHBondContact OG-CG 3.25Å; S669-Q674 PolarHBondContact OG-NE2 2.94Å; S669-P720 WeakPolarHBondContact O-CB 3.42Å; S669-P720 WeakPolarHBondContact O-CG 3.45Å
670	T	80.4	Confident	67.2	Low	64 Å²	64	51.6 Å²	51.6	39%	0.393	26%	0.26	S	S	.	.			trans	-69.4	156.7	166.8	60.9	0	0	0	0	109.8	R672 E673 Q674	T670-R672 PolarHBondContact O-N 3.35Å; T670-E673 PolarHBondContact N-OE2 2.84Å; T670-E673 WeakPolarHBondContact O-CA 3.33Å; T670-E673 WeakPolarHBondContact O-CB 3.32Å; T670-E673 PolarHBondContact O-N 2.9Å; T670-E673 VanDerWaalsContact OG1-CD 3.31Å; T670-E673 WeakPolarHBondContact OG1-CG 3.38Å; T670-E673 PolarHBondContact OG1-N 2.95Å; T670-E673 PolarHBondContact OG1-OE2 3.16Å; T670-Q674 PolarHBondContact O-N 2.72Å
671	W	86.1	Confident	68.4	Low	109 Å²	109	52 Å²	52	41%	0.413	26%	0.26	S	S	.	.	H	α-helix	trans	-48.7	-43.5	172.1	-81.6	95.3	0	0	0	113.1	E673 Q674 F675 A716 F717 P719 P720	W671-E673 VanDerWaalsContact C-N 3.31Å; W671-E673 PolarHBondContact O-N 2.87Å; W671-Q674 WeakPolarHBondContact O-CB 3.35Å; W671-Q674 PolarHBondContact O-N 3.41Å; W671-Q674 VanDerWaalsContact O-N 3.13Å; W671-F675 AromaticContact CE3-CE2 3.79Å; W671-F675 HydrophobicContact CE3-CE2 3.79Å; W671-F675 HydrophobicContact CZ3-CE2 4.18Å; W671-F675 VanDerWaalsContact O-CD2 3.31Å; W671-F675 WeakPolarHBondContact O-CD2 3.28Å; W671-F675 PolarHBondContact O-N 3.42Å; W671-F675 VanDerWaalsContact O-N 3.08Å; W671-A716 VanDerWaalsContact CE3-O 3.23Å; W671-A716 VanDerWaalsContact CZ3-O 3.28Å; W671-A716 WeakPolarHBondContact CZ3-O 3.33Å; W671-F717 WeakPolarHBondContact CH2-O 3.41Å; W671-F717 VanDerWaalsContact CZ3-CA 3.43Å; W671-F717 HydrophobicContact CZ3-CB 4.4Å; W671-F717 HydrophobicContact CZ3-CD1 4.35Å; W671-F717 WeakPolarHBondContact CZ3-O 3.49Å; W671-P719 HydrophobicContact CZ2-CB 4.35Å; W671-P720 HydrophobicContact CG-CG 4.18Å
672	R	83.8	Confident	68.9	Low	189 Å²	189	51.4 Å²	51.4	71%	0.713	26%	0.257	S	S	*	.	H	α-helix	trans	-56	-46.3	175	-179.5	-177	175.2	179.3	3	111.7	T670 Q674 F675 V676	T670-R672 PolarHBondContact O-N 3.35Å; R672-Q674 VanDerWaalsContact C-N 3.33Å; R672-F675 PolarHBondContact O-N 3.29Å; R672-V676 VanDerWaalsContact O-CG2 3.25Å; R672-V676 WeakPolarHBondContact O-CG2 3.44Å; R672-V676 PolarHBondContact O-N 3.45Å
673	E	78.9	Confident	69.2	Low	31 Å²	31	52.8 Å²	52.8	15%	0.145	27%	0.266	C	S	.	.	H	α-helix	trans	-65	-38	178.2	-72.2	159.2	175.8	0	0	111	R360 S669 T670 W671 F675 V676 D677	R360-E673 IonicContact CZ-OE1 3.57Å; R360-E673 IonicContact NE-OE1 3.03Å; R360-E673 VanDerWaalsContact NH2-CD 3.26Å; R360-E673 IonicContact NH2-OE1 3.49Å; R360-E673 PolarHBondContact NH2-OE1 2.91Å; R360-E673 IonicContact NH2-OE2 3.64Å; R360-E673 PolarHBondContact NH2-OE2 3.07Å; S669-E673 VanDerWaalsContact CA-OE2 3.3Å; S669-E673 WeakPolarHBondContact CA-OE2 3.35Å; T670-E673 PolarHBondContact N-OE2 2.84Å; T670-E673 WeakPolarHBondContact O-CA 3.33Å; T670-E673 WeakPolarHBondContact O-CB 3.32Å; T670-E673 PolarHBondContact O-N 2.9Å; T670-E673 VanDerWaalsContact OG1-CD 3.31Å; T670-E673 WeakPolarHBondContact OG1-CG 3.38Å; T670-E673 PolarHBondContact OG1-N 2.95Å; T670-E673 PolarHBondContact OG1-OE2 3.16Å; W671-E673 VanDerWaalsContact C-N 3.31Å; W671-E673 PolarHBondContact O-N 2.87Å; E673-F675 PolarHBondContact O-N 3.47Å; E673-V676 PolarHBondContact O-N 3.41Å; E673-D677 WeakPolarHBondContact O-CB 3.45Å; E673-D677 PolarHBondContact O-N 3.28Å
674	Q	85.5	Confident	69.5	Low	3 Å²	3	54.7 Å²	54.7	1%	0.014	28%	0.28	C	S	.	.	H	α-helix	trans	-62.5	-41.7	176.5	-62	-173.6	18.7	0	0	113.2	S669 T670 W671 R672 D677 A678 A716 M718 P720	S669-Q674 WeakPolarHBondContact OG-CG 3.25Å; S669-Q674 PolarHBondContact OG-NE2 2.94Å; T670-Q674 PolarHBondContact O-N 2.72Å; W671-Q674 WeakPolarHBondContact O-CB 3.35Å; W671-Q674 PolarHBondContact O-N 3.41Å; W671-Q674 VanDerWaalsContact O-N 3.13Å; R672-Q674 VanDerWaalsContact C-N 3.33Å; Q674-D677 PolarHBondContact O-N 2.95Å; Q674-A678 WeakPolarHBondContact O-CB 3.46Å; Q674-A678 PolarHBondContact O-N 3.22Å; Q674-A716 HydrophobicContact CB-CB 3.97Å; Q674-A716 PolarHBondContact OE1-O 3.41Å; Q674-M718 PolarHBondContact NE2-O 2.55Å; Q674-M718 PolarHBondContact OE1-O 3.03Å; Q674-P720 VanDerWaalsContact NE2-CA 3.28Å
675	F	89.3	Confident	69.6	Low	61 Å²	61	51.3 Å²	51.3	27%	0.268	26%	0.262	S	S	.	.	H	α-helix	trans	-70.1	-39.8	176.4	-80.9	-72.9	0	0	0	112.4	W671 R672 E673 D677 A678 I679 I713 A716 F717	W671-F675 AromaticContact CE3-CE2 3.79Å; W671-F675 HydrophobicContact CE3-CE2 3.79Å; W671-F675 HydrophobicContact CZ3-CE2 4.18Å; W671-F675 VanDerWaalsContact O-CD2 3.31Å; W671-F675 WeakPolarHBondContact O-CD2 3.28Å; W671-F675 PolarHBondContact O-N 3.42Å; W671-F675 VanDerWaalsContact O-N 3.08Å; R672-F675 PolarHBondContact O-N 3.29Å; E673-F675 PolarHBondContact O-N 3.47Å; F675-D677 VanDerWaalsContact C-N 3.31Å; F675-D677 PolarHBondContact O-N 3.29Å; F675-A678 PolarHBondContact O-N 3.12Å; F675-I679 WeakPolarHBondContact O-CG1 3.08Å; F675-I679 PolarHBondContact O-N 3.26Å; F675-I679 VanDerWaalsContact O-N 3.12Å; F675-I713 HydrophobicContact CE1-CG2 4.38Å; F675-A716 HydrophobicContact CD1-CB 3.98Å; F675-A716 HydrophobicContact CE1-CB 4.07Å; F675-A716 HydrophobicContact CG-CB 4.23Å; F675-A716 HydrophobicContact CZ-CB 4.41Å; F675-F717 HydrophobicContact CE1-CD2 4.35Å; F675-F717 HydrophobicContact CE1-CE1 4.47Å; F675-F717 HydrophobicContact CE1-CE2 4.01Å; F675-F717 HydrophobicContact CE1-CZ 4.08Å; F675-F717 AromaticContact CZ-CD1 3.96Å; F675-F717 HydrophobicContact CZ-CD1 3.96Å; F675-F717 HydrophobicContact CZ-CD2 4.21Å; F675-F717 AromaticContact CZ-CE1 3.81Å; F675-F717 HydrophobicContact CZ-CE1 3.81Å; F675-F717 HydrophobicContact CZ-CE2 4.08Å; F675-F717 HydrophobicContact CZ-CG 4.16Å; F675-F717 AromaticContact CZ-CZ 3.88Å; F675-F717 HydrophobicContact CZ-CZ 3.88Å
676	V	84.6	Confident	69.4	Low	69 Å²	69	54 Å²	54	42%	0.418	28%	0.277	S	S	.	.	H	α-helix	trans	-61.9	-44.3	174.2	172	0	0	0	0	109.9	R672 E673 A678 I679 T680	R672-V676 VanDerWaalsContact O-CG2 3.25Å; R672-V676 WeakPolarHBondContact O-CG2 3.44Å; R672-V676 PolarHBondContact O-N 3.45Å; E673-V676 PolarHBondContact O-N 3.41Å; V676-A678 VanDerWaalsContact C-N 3.29Å; V676-A678 PolarHBondContact O-N 3.33Å; V676-I679 PolarHBondContact O-N 2.97Å; V676-T680 HydrophobicContact CG1-CG2 4.06Å; V676-T680 WeakPolarHBondContact O-CB 3.45Å; V676-T680 WeakPolarHBondContact O-CG2 3.41Å; V676-T680 PolarHBondContact O-N 2.88Å; V676-T680 PolarHBondContact O-OG1 3.2Å
677	D	77.3	Confident	68.8	Low	10 Å²	10	60.3 Å²	60.3	5%	0.053	31%	0.311	C	S	.	.	H	α-helix	trans	-65.6	-33	177.3	-70.6	-5.4	0	0	0	112.5	K352 E673 Q674 F675 I679	K352-D677 WeakPolarHBondContact CE-OD1 3.47Å; K352-D677 WeakPolarHBondContact CE-OD2 3.13Å; K352-D677 IonicContact NZ-OD1 3.6Å; K352-D677 PolarHBondContact NZ-OD1 3.06Å; K352-D677 IonicContact NZ-OD2 2.67Å; K352-D677 PolarHBondContact NZ-OD2 3.5Å; E673-D677 WeakPolarHBondContact O-CB 3.45Å; E673-D677 PolarHBondContact O-N 3.28Å; Q674-D677 PolarHBondContact O-N 2.95Å; F675-D677 VanDerWaalsContact C-N 3.31Å; F675-D677 PolarHBondContact O-N 3.29Å; D677-I679 VanDerWaalsContact C-N 3.34Å
678	A	84.5	Confident	67.9	Low	3 Å²	3	62.3 Å²	62.3	3%	0.025	33%	0.327	C	S	.	.	H	α-helix	trans	-65.4	-40.3	175.1	0	0	0	0	0	111.3	Q674 F675 V676 M709 K712 I713 A716	Q674-A678 WeakPolarHBondContact O-CB 3.46Å; Q674-A678 PolarHBondContact O-N 3.22Å; F675-A678 PolarHBondContact O-N 3.12Å; V676-A678 VanDerWaalsContact C-N 3.29Å; V676-A678 PolarHBondContact O-N 3.33Å; A678-M709 VanDerWaalsContact O-CE 3.27Å; A678-M709 WeakPolarHBondContact O-CE 3.43Å; A678-K712 HydrophobicContact CB-CB 3.85Å; A678-K712 WeakPolarHBondContact O-CD 3.44Å; A678-I713 HydrophobicContact CB-CG1 4.24Å; A678-A716 HydrophobicContact CB-CB 4.14Å
679	I	85.9	Confident	67	Low	105 Å²	105	66 Å²	66	54%	0.538	35%	0.349	S	S	.	.	H	α-helix	trans	-92.7	-29.4	-171.8	-60.3	165.1	0	0	0	113.3	F675 V676 D677 H705 M709	F675-I679 WeakPolarHBondContact O-CG1 3.08Å; F675-I679 PolarHBondContact O-N 3.26Å; F675-I679 VanDerWaalsContact O-N 3.12Å; V676-I679 PolarHBondContact O-N 2.97Å; D677-I679 VanDerWaalsContact C-N 3.34Å; I679-H705 PolarHBondContact O-NE2 3.45Å; I679-M709 HydrophobicContact CB-CE 4.23Å; I679-M709 HydrophobicContact CG1-CE 3.99Å
680	T	78.6	Confident	65.7	Low	54 Å²	54	71.3 Å²	71.3	33%	0.331	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-96.8	140.6	-176	60.9	0	0	0	0	111	V676 H705	V676-T680 HydrophobicContact CG1-CG2 4.06Å; V676-T680 WeakPolarHBondContact O-CB 3.45Å; V676-T680 WeakPolarHBondContact O-CG2 3.41Å; V676-T680 PolarHBondContact O-N 2.88Å; V676-T680 PolarHBondContact O-OG1 3.2Å; T680-H705 PolarHBondContact O-CE1 2.99Å
681	M	69	Low	63.9	Low	35 Å²	35	72.5 Å²	72.5	17%	0.172	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-101.9	125.5	171.9	-165.1	178.6	-174.5	0	0	108.6	G345 P697 G701 Y702 H705	G345-M681 VanDerWaalsContact O-CG 3.25Å; G345-M681 WeakPolarHBondContact O-CG 3.3Å; M681-P697 HydrophobicContact CE-CB 3.49Å; M681-P697 VanDerWaalsContact CE-CB 3.49Å; M681-P697 HydrophobicContact CE-CG 4.16Å; M681-P697 HydrophobicContact CG-CB 4.41Å; M681-P697 HydrophobicContact CG-CG 4.07Å; M681-P697 HydrophobicContact SD-CB 3.41Å; M681-P697 WeakPolarHBondContact SD-CB 3.48Å; M681-P697 HydrophobicContact SD-CG 3.56Å; M681-P697 VanDerWaalsContact SD-CG 3.56Å; M681-G701 WeakPolarHBondContact CE-O 3.31Å; M681-Y702 HydrophobicContact SD-CD1 3.98Å; M681-Y702 HydrophobicContact SD-CE1 4.16Å; M681-Y702 HydrophobicContact SD-CG 4.26Å; M681-H705 HydrophobicContact SD-CB 4.15Å
682	N	60.3	Low	61.3	Low	53 Å²	53	75.1 Å²	75.1	28%	0.283	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-94.7	138.4	174.2	-76.3	-28.1	0	0	0	110.4	K352 S684	K352-N682 WeakPolarHBondContact CE-ND2 3.45Å; N682-S684 PolarHBondContact O-N 3.42Å
683	P	51.9	Low	58.9	Low	36 Å²	36	73.7 Å²	73.7	23%	0.234	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-58.7	136.4	174.1	26.7	-34.5	0	0	0	109.7	D685 P694 V695	P683-D685 PolarHBondContact O-N 2.66Å; P683-P694 HydrophobicContact CB-CB 4.11Å; P683-P694 HydrophobicContact CG-CB 3.73Å; P683-V695 VanDerWaalsContact CB-O 3.31Å; P683-V695 WeakPolarHBondContact CB-O 3.42Å
684	S	50.2	Low	57.3	Low	62 Å²	62	76.2 Å²	76.2	43%	0.434	43%	0.434	S	S	.	.			trans	-90.9	84.1	177.3	-62.8	0	0	0	0	108.7	N682 N686	N682-S684 PolarHBondContact O-N 3.42Å; S684-N686 PolarHBondContact O-N 3.3Å
685	D	46.3	Very low	55.7	Low	40 Å²	40	80.4 Å²	80.4	21%	0.214	46%	0.46	C	S	.	.			trans	-72.7	98.1	173.7	-88.2	-4.1	0	0	0	109.4	P683 S688	P683-D685 PolarHBondContact O-N 2.66Å; D685-S688 PolarHBondContact OD1-OG 3.21Å; D685-S688 PolarHBondContact OD2-OG 3.5Å
686	N	42.4	Very low	54.1	Low	97 Å²	97	85 Å²	85	52%	0.519	48%	0.48	S	S	.	.	S	Bend	trans	-106.4	3.4	165.5	-96.5	-5.1	0	0	0	112.7	R342 S684	R342-N686 PolarHBondContact NH2-OD1 2.9Å; R342-N686 VanDerWaalsContact NH2-OD1 3.15Å; S684-N686 PolarHBondContact O-N 3.3Å
687	N	37	Very low	53	Low	161 Å²	161	83 Å²	83	86%	0.861	47%	0.468	S	S	*	.	S	Bend	trans	-164	19.5	177.2	-95.3	-17.3	0	0	0	116.5	V689	N687-V689 PolarHBondContact O-N 3.39Å
688	S	34	Very low	52.7	Low	59 Å²	59	87.3 Å²	87.3	41%	0.413	50%	0.495	S	S	.	.			trans	-70.2	102.2	172.4	46	0	0	0	0	109.7	D685	D685-S688 PolarHBondContact OD1-OG 3.21Å; D685-S688 PolarHBondContact OD2-OG 3.5Å
689	V	35.3	Very low	52.4	Low	127 Å²	127	92.7 Å²	92.7	77%	0.77	53%	0.527	S	S	*	.			trans	-68	146.8	149.4	-178.4	0	0	0	0	106.6	N687	N687-V689 PolarHBondContact O-N 3.39Å
690	E	37.5	Very low	52	Low	130 Å²	130	92.3 Å²	92.3	61%	0.607	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	150.8	-160.7	-54.8	-175.5	125.8	0	0	117.2	K319	K319-E690 IonicContact NZ-OE1 2.9Å; K319-E690 PolarHBondContact NZ-OE1 3.09Å
691	G	42.3	Very low	51.8	Low	88 Å²	88	90.5 Å²	90.5	91%	0.907	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.3	-10.1	160.4	0	0	0	0	0	117.1
692	E	32.1	Very low	52.5	Low	164 Å²	164	94.1 Å²	94.1	77%	0.766	54%	0.535	S	S	*	.	S	Bend	trans	-94.5	145.8	176.3	-69.6	-170.8	164.4	0	0	112.6
693	E	34.3	Very low	53.6	Low	160 Å²	160	94.5 Å²	94.5	75%	0.748	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-50	143.9	172.3	-72.3	-171.4	167.3	0	0	110.6	V695	E693-V695 PolarHBondContact O-N 3.13Å; E693-V695 VanDerWaalsContact O-N 3.07Å
694	P	45.1	Very low	55.2	Low	84 Å²	84	95 Å²	95	55%	0.545	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-47.3	122.5	-179.3	17.4	-31	0	0	0	110.3	P683 K696	P683-P694 HydrophobicContact CB-CB 4.11Å; P683-P694 HydrophobicContact CG-CB 3.73Å; P694-K696 PolarHBondContact O-N 2.8Å
695	V	51.9	Low	56.8	Low	90 Å²	90	92.7 Å²	92.7	55%	0.545	53%	0.53	S	S	.	.			trans	-55.8	111.8	-179.4	179.5	0	0	0	0	107.4	P683 E693	P683-V695 VanDerWaalsContact CB-O 3.31Å; P683-V695 WeakPolarHBondContact CB-O 3.42Å; E693-V695 PolarHBondContact O-N 3.13Å; E693-V695 VanDerWaalsContact O-N 3.07Å
696	K	55.5	Low	58.8	Low	159 Å²	159	96.4 Å²	96.4	69%	0.691	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-54.3	141.4	-179.9	-71.3	175	-177.2	168.5	0	108.6	P694 T698	P694-K696 PolarHBondContact O-N 2.8Å; K696-T698 PolarHBondContact O-N 2.87Å
697	P	60.7	Low	61.1	Low	25 Å²	25	96.2 Å²	96.2	16%	0.162	55%	0.547	C	S	.	.	P	Polyproline II helix	trans	-54.4	142.9	179.1	-16.1	23.5	0	0	0	111.4	M681 Y702	M681-P697 HydrophobicContact CE-CB 3.49Å; M681-P697 VanDerWaalsContact CE-CB 3.49Å; M681-P697 HydrophobicContact CE-CG 4.16Å; M681-P697 HydrophobicContact CG-CB 4.41Å; M681-P697 HydrophobicContact CG-CG 4.07Å; M681-P697 HydrophobicContact SD-CB 3.41Å; M681-P697 WeakPolarHBondContact SD-CB 3.48Å; M681-P697 HydrophobicContact SD-CG 3.56Å; M681-P697 VanDerWaalsContact SD-CG 3.56Å; P697-Y702 HydrophobicContact CB-CD2 3.89Å; P697-Y702 HydrophobicContact CB-CE2 3.59Å; P697-Y702 WeakPolarHBondContact CD-OH 3.44Å; P697-Y702 HydrophobicContact CG-CD2 4.35Å; P697-Y702 HydrophobicContact CG-CE1 4.26Å; P697-Y702 HydrophobicContact CG-CE2 3.62Å; P697-Y702 WeakPolarHBondContact O-CE2 3.3Å
698	T	72.5	Confident	63.6	Low	101 Å²	101	88.6 Å²	88.6	62%	0.62	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-57.4	146.1	173.3	-41.4	0	0	0	0	109.5	K696 V700 G701 Y702	K696-T698 PolarHBondContact O-N 2.87Å; T698-V700 PolarHBondContact O-N 3.42Å; T698-V700 VanDerWaalsContact O-N 3.13Å; T698-G701 WeakPolarHBondContact O-CA 3.42Å; T698-G701 PolarHBondContact O-N 3.37Å; T698-Y702 PolarHBondContact O-N 2.94Å; T698-Y702 VanDerWaalsContact O-N 3.12Å
699	T	77.6	Confident	66.3	Low	116 Å²	116	87.3 Å²	87.3	71%	0.712	49%	0.494	S	S	*	.	H	α-helix	trans	-50.9	-38.3	176.8	49	0	0	0	0	112.7	G701 Y702 A703	T699-G701 VanDerWaalsContact C-N 3.34Å; T699-G701 PolarHBondContact O-N 3.39Å; T699-Y702 PolarHBondContact O-N 3.45Å; T699-A703 PolarHBondContact O-N 3.32Å
700	V	76.7	Confident	69.2	Low	97 Å²	97	84.3 Å²	84.3	59%	0.588	48%	0.477	S	S	*	.	H	α-helix	trans	-61.2	-41.7	173.3	-179.4	0	0	0	0	111.6	T698 Y702 A703 V704	T698-V700 PolarHBondContact O-N 3.42Å; T698-V700 VanDerWaalsContact O-N 3.13Å; V700-Y702 PolarHBondContact O-N 2.9Å; V700-A703 PolarHBondContact O-N 3.48Å; V700-V704 HydrophobicContact CG1-CG2 4.41Å; V700-V704 WeakPolarHBondContact O-CG2 3.3Å; V700-V704 PolarHBondContact O-N 2.93Å
701	G	76.3	Confident	71.8	Confident	17 Å²	17	79.3 Å²	79.3	18%	0.175	45%	0.453	C	S	.	.	H	α-helix	trans	-63.1	-40.9	177.2	0	0	0	0	0	112.4	M681 T698 T699 H705	M681-G701 WeakPolarHBondContact CE-O 3.31Å; T698-G701 WeakPolarHBondContact O-CA 3.42Å; T698-G701 PolarHBondContact O-N 3.37Å; T699-G701 VanDerWaalsContact C-N 3.34Å; T699-G701 PolarHBondContact O-N 3.39Å; G701-H705 VanDerWaalsContact O-CB 3.27Å; G701-H705 WeakPolarHBondContact O-CB 3.45Å; G701-H705 PolarHBondContact O-N 3.28Å
702	Y	81.8	Confident	74.1	Confident	110 Å²	110	76 Å²	76	43%	0.431	41%	0.413	S	S	.	.	H	α-helix	trans	-63.4	-44.4	173.3	-83	-70.4	0	0	0	112.3	M681 P697 T698 T699 V700 H705 I706	M681-Y702 HydrophobicContact SD-CD1 3.98Å; M681-Y702 HydrophobicContact SD-CE1 4.16Å; M681-Y702 HydrophobicContact SD-CG 4.26Å; P697-Y702 HydrophobicContact CB-CD2 3.89Å; P697-Y702 HydrophobicContact CB-CE2 3.59Å; P697-Y702 WeakPolarHBondContact CD-OH 3.44Å; P697-Y702 HydrophobicContact CG-CD2 4.35Å; P697-Y702 HydrophobicContact CG-CE1 4.26Å; P697-Y702 HydrophobicContact CG-CE2 3.62Å; P697-Y702 WeakPolarHBondContact O-CE2 3.3Å; T698-Y702 PolarHBondContact O-N 2.94Å; T698-Y702 VanDerWaalsContact O-N 3.12Å; T699-Y702 PolarHBondContact O-N 3.45Å; V700-Y702 PolarHBondContact O-N 2.9Å; Y702-H705 PolarHBondContact O-N 2.85Å; Y702-I706 WeakPolarHBondContact O-CG1 3.39Å; Y702-I706 PolarHBondContact O-N 2.99Å
703	A	84.6	Confident	77	Confident	61 Å²	61	70.9 Å²	70.9	50%	0.504	39%	0.391	S	S	.	.	H	α-helix	trans	-61.6	-45.2	178.4	0	0	0	0	0	111.8	T699 V700 I706 L707	T699-A703 PolarHBondContact O-N 3.32Å; V700-A703 PolarHBondContact O-N 3.48Å; A703-I706 PolarHBondContact O-N 3.4Å; A703-L707 WeakPolarHBondContact O-CB 3.28Å; A703-L707 PolarHBondContact O-N 3.25Å
704	V	84.2	Confident	79.8	Confident	48 Å²	48	66 Å²	66	29%	0.291	37%	0.372	S	S	.	.	H	α-helix	trans	-65.7	-39.4	176.2	175.4	0	0	0	0	111.2	L343 V700 L707 T708	L343-V704 WeakPolarHBondContact O-CG1 3.34Å; V700-V704 HydrophobicContact CG1-CG2 4.41Å; V700-V704 WeakPolarHBondContact O-CG2 3.3Å; V700-V704 PolarHBondContact O-N 2.93Å; V704-L707 PolarHBondContact O-N 3.45Å; V704-T708 HydrophobicContact CG1-CG2 4.1Å; V704-T708 WeakPolarHBondContact O-CB 3.43Å; V704-T708 WeakPolarHBondContact O-CG2 3.49Å; V704-T708 PolarHBondContact O-N 2.86Å; V704-T708 PolarHBondContact O-OG1 3.03Å
705	H	85.4	Confident	82	Confident	12 Å²	12	62.1 Å²	62.1	6%	0.056	35%	0.347	C	S	.	.	H	α-helix	trans	-59.2	-52.2	175	-172.9	96.3	0	0	0	110.6	I679 T680 M681 G701 Y702 L707 T708 M709 K712	I679-H705 PolarHBondContact O-NE2 3.45Å; T680-H705 PolarHBondContact O-CE1 2.99Å; M681-H705 HydrophobicContact SD-CB 4.15Å; G701-H705 VanDerWaalsContact O-CB 3.27Å; G701-H705 WeakPolarHBondContact O-CB 3.45Å; G701-H705 PolarHBondContact O-N 3.28Å; Y702-H705 PolarHBondContact O-N 2.85Å; H705-L707 VanDerWaalsContact C-N 3.31Å; H705-L707 PolarHBondContact O-N 3.01Å; H705-T708 WeakPolarHBondContact CA-OG1 3.42Å; H705-T708 CarbonylContact O-C 3.57Å; H705-T708 PolarHBondContact O-N 3.31Å; H705-T708 VanDerWaalsContact O-N 3.13Å; H705-T708 PolarHBondContact O-OG1 3.23Å; H705-M709 PolarHBondContact CD2-SD 3.36Å; H705-M709 PolarHBondContact NE2-SD 2.97Å; H705-M709 WeakPolarHBondContact O-CG 3.42Å; H705-M709 PolarHBondContact O-N 3.42Å; H705-K712 PolarHBondContact CE1-NZ 2.7Å; H705-K712 VanDerWaalsContact CE1-NZ 3.25Å; H705-K712 PolarHBondContact ND1-NZ 3.06Å
706	I	88.4	Confident	83.8	Confident	119 Å²	119	57.8 Å²	57.8	61%	0.61	32%	0.321	S	S	*	.	H	α-helix	trans	-58.8	-41.4	178	-67.7	167.4	0	0	0	111.7	Y702 A703 M709	Y702-I706 WeakPolarHBondContact O-CG1 3.39Å; Y702-I706 PolarHBondContact O-N 2.99Å; A703-I706 PolarHBondContact O-N 3.4Å; I706-M709 WeakPolarHBondContact O-CB 3.45Å; I706-M709 PolarHBondContact O-N 2.67Å
707	L	90	Very high	85.5	Confident	93 Å²	93	56.4 Å²	56.4	49%	0.487	32%	0.315	S	S	.	.	H	α-helix	trans	-64.8	-40	177.3	-177.2	64.8	0	0	0	112.1	Y67 L70 A703 V704 H705	Y67-L707 HydrophobicContact CD2-CD1 4.04Å; Y67-L707 HydrophobicContact CE2-CD1 3.94Å; Y67-L707 HydrophobicContact CE2-CG 4.37Å; Y67-L707 WeakPolarHBondContact CE2-O 3.22Å; L70-L707 HydrophobicContact CD2-CD2 4.02Å; L70-L707 HydrophobicContact CD2-CG 4.08Å; A703-L707 WeakPolarHBondContact O-CB 3.28Å; A703-L707 PolarHBondContact O-N 3.25Å; V704-L707 PolarHBondContact O-N 3.45Å; H705-L707 VanDerWaalsContact C-N 3.31Å; H705-L707 PolarHBondContact O-N 3.01Å
708	T	90	Very high	86.9	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-85.5	-11.8	-177.6	56.6	0	0	0	0	113.6	L70 I74 I344 V704 H705 W711 K712	L70-T708 HydrophobicContact CD1-CG2 3.75Å; L70-T708 HydrophobicContact CD2-CG2 3.6Å; L70-T708 HydrophobicContact CG-CG2 3.83Å; I74-T708 HydrophobicContact CD1-CG2 3.93Å; I344-T708 HydrophobicContact CG2-CG2 3.84Å; I344-T708 WeakPolarHBondContact CG2-OG1 3.04Å; V704-T708 HydrophobicContact CG1-CG2 4.1Å; V704-T708 WeakPolarHBondContact O-CB 3.43Å; V704-T708 WeakPolarHBondContact O-CG2 3.49Å; V704-T708 PolarHBondContact O-N 2.86Å; V704-T708 PolarHBondContact O-OG1 3.03Å; H705-T708 WeakPolarHBondContact CA-OG1 3.42Å; H705-T708 CarbonylContact O-C 3.57Å; H705-T708 PolarHBondContact O-N 3.31Å; H705-T708 VanDerWaalsContact O-N 3.13Å; H705-T708 PolarHBondContact O-OG1 3.23Å; T708-W711 PolarHBondContact O-N 3.13Å; T708-W711 VanDerWaalsContact O-N 3.12Å; T708-K712 PolarHBondContact O-N 3.1Å
709	M	91.3	Very high	87.9	Confident	32 Å²	32	51.5 Å²	51.5	16%	0.158	28%	0.284	C	S	.	.	H	α-helix	trans	-48.7	-50.4	-177	-88	-49.9	-67.6	0	0	113.9	A678 I679 H705 I706 W711 K712 I713	A678-M709 VanDerWaalsContact O-CE 3.27Å; A678-M709 WeakPolarHBondContact O-CE 3.43Å; I679-M709 HydrophobicContact CB-CE 4.23Å; I679-M709 HydrophobicContact CG1-CE 3.99Å; H705-M709 PolarHBondContact CD2-SD 3.36Å; H705-M709 PolarHBondContact NE2-SD 2.97Å; H705-M709 WeakPolarHBondContact O-CG 3.42Å; H705-M709 PolarHBondContact O-N 3.42Å; I706-M709 WeakPolarHBondContact O-CB 3.45Å; I706-M709 PolarHBondContact O-N 2.67Å; M709-W711 VanDerWaalsContact C-N 3.31Å; M709-W711 PolarHBondContact O-N 2.94Å; M709-K712 WeakPolarHBondContact O-CB 3.27Å; M709-K712 PolarHBondContact O-N 3.33Å; M709-K712 HydrophobicContact SD-CD 4.42Å; M709-I713 HydrophobicContact CE-CD1 3.86Å; M709-I713 HydrophobicContact CE-CG1 4.17Å; M709-I713 WeakPolarHBondContact O-CG1 3.25Å; M709-I713 PolarHBondContact O-N 3.28Å
710	P	94.3	Very high	88.4	Confident	64 Å²	64	46.5 Å²	46.5	42%	0.416	25%	0.254	S	S	.	.	H	α-helix	trans	-59.5	-43.3	-178.8	-25.1	36.9	0	0	0	112	Y67 I713 T714	Y67-P710 WeakPolarHBondContact OH-CG 3.39Å; P710-I713 PolarHBondContact O-N 2.64Å; P710-T714 PolarHBondContact O-N 3.39Å; P710-T714 PolarHBondContact O-OG1 3.09Å; P710-T714 VanDerWaalsContact O-OG1 3.08Å
711	W	93.6	Very high	88.7	Confident	26 Å²	26	42.5 Å²	42.5	10%	0.098	23%	0.23	C	C	.	.	H	α-helix	trans	-66	-38.2	177.1	-67	122.2	0	0	0	113	Y67 M68 G71 I74 T708 M709 I713 T714 C715 I740	Y67-W711 HydrophobicContact CD1-CZ2 4.07Å; Y67-W711 AromaticContact CD1-NE1 3.66Å; Y67-W711 AromaticContact CE1-CE2 3.7Å; Y67-W711 AromaticContact CE1-CZ2 3.82Å; Y67-W711 HydrophobicContact CE1-CZ2 3.82Å; Y67-W711 AromaticContact CE1-NE1 3.23Å; Y67-W711 AromaticContact CE2-NE1 3.66Å; Y67-W711 AromaticContact CZ-CD1 3.76Å; Y67-W711 AromaticContact CZ-NE1 3.23Å; Y67-W711 PolarHBondContact O-NE1 2.79Å; M68-W711 HydrophobicContact SD-CH2 3.72Å; M68-W711 HydrophobicContact SD-CZ2 3.58Å; M68-W711 VanDerWaalsContact SD-CZ2 3.58Å; G71-W711 VanDerWaalsContact CA-CD2 3.41Å; I74-W711 HydrophobicContact CD1-CB 3.55Å; I74-W711 HydrophobicContact CD1-CG 4.27Å; T708-W711 PolarHBondContact O-N 3.13Å; T708-W711 VanDerWaalsContact O-N 3.12Å; M709-W711 VanDerWaalsContact C-N 3.31Å; M709-W711 PolarHBondContact O-N 2.94Å; W711-I713 VanDerWaalsContact C-N 3.34Å; W711-T714 PolarHBondContact O-N 3.47Å; W711-C715 WeakPolarHBondContact O-CB 3.37Å; W711-C715 PolarHBondContact O-N 3.01Å; W711-C715 PolarHBondContact O-SG 2.9Å; W711-I740 HydrophobicContact CE3-CD1 4.03Å; W711-I740 HydrophobicContact CH2-CD1 4.05Å; W711-I740 HydrophobicContact CH2-CG1 4.03Å; W711-I740 HydrophobicContact CH2-CG2 4.32Å; W711-I740 HydrophobicContact CZ3-CD1 3.47Å; W711-I740 VanDerWaalsContact CZ3-CD1 3.47Å; W711-I740 HydrophobicContact CZ3-CG1 3.8Å
712	K	90.1	Very high	88.7	Confident	17 Å²	17	45.2 Å²	45.2	7%	0.074	24%	0.24	C	C	.	.	H	α-helix	trans	-61.3	-43.9	173.9	-71.5	-176.8	179.2	-177.6	0	112	I344 A678 H705 T708 M709 C715 A716	I344-K712 HydrophobicContact CG2-CD 4.28Å; I344-K712 HydrophobicContact CG2-CG 4.4Å; I344-K712 PolarHBondContact O-NZ 3.01Å; A678-K712 HydrophobicContact CB-CB 3.85Å; A678-K712 WeakPolarHBondContact O-CD 3.44Å; H705-K712 PolarHBondContact CE1-NZ 2.7Å; H705-K712 VanDerWaalsContact CE1-NZ 3.25Å; H705-K712 PolarHBondContact ND1-NZ 3.06Å; T708-K712 PolarHBondContact O-N 3.1Å; M709-K712 WeakPolarHBondContact O-CB 3.27Å; M709-K712 PolarHBondContact O-N 3.33Å; M709-K712 HydrophobicContact SD-CD 4.42Å; K712-C715 PolarHBondContact O-N 3.32Å; K712-A716 WeakPolarHBondContact O-CB 3.16Å; K712-A716 PolarHBondContact O-N 2.96Å
713	I	92.7	Very high	88.8	Confident	58 Å²	58	47.7 Å²	47.7	30%	0.297	25%	0.25	S	C	.	.	H	α-helix	trans	-64.3	-46.4	177.9	-68.5	169.9	0	0	0	109.6	F675 A678 M709 P710 W711 C715 A716 F717	F675-I713 HydrophobicContact CE1-CG2 4.38Å; A678-I713 HydrophobicContact CB-CG1 4.24Å; M709-I713 HydrophobicContact CE-CD1 3.86Å; M709-I713 HydrophobicContact CE-CG1 4.17Å; M709-I713 WeakPolarHBondContact O-CG1 3.25Å; M709-I713 PolarHBondContact O-N 3.28Å; P710-I713 PolarHBondContact O-N 2.64Å; W711-I713 VanDerWaalsContact C-N 3.34Å; I713-C715 VanDerWaalsContact C-N 3.3Å; I713-C715 PolarHBondContact O-N 2.81Å; I713-A716 WeakPolarHBondContact O-CB 3.42Å; I713-A716 PolarHBondContact O-N 3.07Å; I713-F717 HydrophobicContact CG2-CD2 4.5Å; I713-F717 HydrophobicContact CG2-CE2 3.93Å; I713-F717 WeakPolarHBondContact O-CD2 3.3Å; I713-F717 PolarHBondContact O-N 3.15Å
714	T	92.8	Very high	88.9	Confident	58 Å²	58	52.9 Å²	52.9	36%	0.356	26%	0.256	S	S	.	.	H	α-helix	trans	-58.1	-42.3	175.1	-58.3	0	0	0	0	111.6	P710 W711 A716 F717 L736	P710-T714 PolarHBondContact O-N 3.39Å; P710-T714 PolarHBondContact O-OG1 3.09Å; P710-T714 VanDerWaalsContact O-OG1 3.08Å; W711-T714 PolarHBondContact O-N 3.47Å; T714-A716 VanDerWaalsContact C-N 3.33Å; T714-A716 PolarHBondContact O-N 2.75Å; T714-F717 WeakPolarHBondContact O-CB 3.32Å; T714-F717 PolarHBondContact O-N 2.88Å; T714-L736 HydrophobicContact CG2-CD1 3.96Å; T714-L736 HydrophobicContact CG2-CD2 3.97Å
715	C	91.1	Very high	88.9	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.007	27%	0.268	C	S	.	.	H	α-helix	trans	-71.9	-23.9	176.3	-69.5	0	0	0	0	113.6	I74 R78 W711 K712 I713 F717 M718	I74-C715 HydrophobicContact CG2-CB 4.35Å; R78-C715 HydrophobicContact CG-CB 3.99Å; W711-C715 WeakPolarHBondContact O-CB 3.37Å; W711-C715 PolarHBondContact O-N 3.01Å; W711-C715 PolarHBondContact O-SG 2.9Å; K712-C715 PolarHBondContact O-N 3.32Å; I713-C715 VanDerWaalsContact C-N 3.3Å; I713-C715 PolarHBondContact O-N 2.81Å; C715-F717 PolarHBondContact O-N 3.03Å; C715-M718 VanDerWaalsContact O-CB 3.28Å; C715-M718 WeakPolarHBondContact O-CB 3.38Å; C715-M718 WeakPolarHBondContact O-CG 3.44Å; C715-M718 PolarHBondContact O-N 3.39Å; C715-M718 VanDerWaalsContact O-N 3.14Å
716	A	89.9	Confident	88.8	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-72.7	-13.4	172.2	0	0	0	0	0	112.7	W671 Q674 F675 A678 K712 I713 T714 M718	W671-A716 VanDerWaalsContact CE3-O 3.23Å; W671-A716 VanDerWaalsContact CZ3-O 3.28Å; W671-A716 WeakPolarHBondContact CZ3-O 3.33Å; Q674-A716 HydrophobicContact CB-CB 3.97Å; Q674-A716 PolarHBondContact OE1-O 3.41Å; F675-A716 HydrophobicContact CD1-CB 3.98Å; F675-A716 HydrophobicContact CE1-CB 4.07Å; F675-A716 HydrophobicContact CG-CB 4.23Å; F675-A716 HydrophobicContact CZ-CB 4.41Å; A678-A716 HydrophobicContact CB-CB 4.14Å; K712-A716 WeakPolarHBondContact O-CB 3.16Å; K712-A716 PolarHBondContact O-N 2.96Å; I713-A716 WeakPolarHBondContact O-CB 3.42Å; I713-A716 PolarHBondContact O-N 3.07Å; T714-A716 VanDerWaalsContact C-N 3.33Å; T714-A716 PolarHBondContact O-N 2.75Å; A716-M718 PolarHBondContact O-N 3.43Å
717	F	91.9	Very high	89	Confident	129 Å²	129	53.6 Å²	53.6	57%	0.566	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-1.8	166.7	-73.5	-82.6	0	0	0	113.9	W671 F675 I713 T714 C715	W671-F717 WeakPolarHBondContact CH2-O 3.41Å; W671-F717 VanDerWaalsContact CZ3-CA 3.43Å; W671-F717 HydrophobicContact CZ3-CB 4.4Å; W671-F717 HydrophobicContact CZ3-CD1 4.35Å; W671-F717 WeakPolarHBondContact CZ3-O 3.49Å; F675-F717 HydrophobicContact CE1-CD2 4.35Å; F675-F717 HydrophobicContact CE1-CE1 4.47Å; F675-F717 HydrophobicContact CE1-CE2 4.01Å; F675-F717 HydrophobicContact CE1-CZ 4.08Å; F675-F717 AromaticContact CZ-CD1 3.96Å; F675-F717 HydrophobicContact CZ-CD1 3.96Å; F675-F717 HydrophobicContact CZ-CD2 4.21Å; F675-F717 AromaticContact CZ-CE1 3.81Å; F675-F717 HydrophobicContact CZ-CE1 3.81Å; F675-F717 HydrophobicContact CZ-CE2 4.08Å; F675-F717 HydrophobicContact CZ-CG 4.16Å; F675-F717 AromaticContact CZ-CZ 3.88Å; F675-F717 HydrophobicContact CZ-CZ 3.88Å; I713-F717 HydrophobicContact CG2-CD2 4.5Å; I713-F717 HydrophobicContact CG2-CE2 3.93Å; I713-F717 WeakPolarHBondContact O-CD2 3.3Å; I713-F717 PolarHBondContact O-N 3.15Å; T714-F717 WeakPolarHBondContact O-CB 3.32Å; T714-F717 PolarHBondContact O-N 2.88Å; C715-F717 PolarHBondContact O-N 3.03Å
718	M	90.5	Very high	89.1	Confident	7 Å²	7	49.9 Å²	49.9	3%	0.034	24%	0.236	C	C	.	.	S	Bend	trans	-81.2	143.5	175.8	-63.1	-179.4	-178.7	0	0	110.7	R78 Q674 C715 A716 L736	R78-M718 HydrophobicContact CB-SD 3.64Å; R78-M718 HydrophobicContact CG-SD 3.99Å; Q674-M718 PolarHBondContact NE2-O 2.55Å; Q674-M718 PolarHBondContact OE1-O 3.03Å; C715-M718 VanDerWaalsContact O-CB 3.28Å; C715-M718 WeakPolarHBondContact O-CB 3.38Å; C715-M718 WeakPolarHBondContact O-CG 3.44Å; C715-M718 PolarHBondContact O-N 3.39Å; C715-M718 VanDerWaalsContact O-N 3.14Å; A716-M718 PolarHBondContact O-N 3.43Å; M718-L736 HydrophobicContact CE-CB 3.74Å; M718-L736 HydrophobicContact CE-CD2 3.17Å; M718-L736 HydrophobicContact CE-CG 4.05Å
719	P	91.8	Very high	89.1	Confident	16 Å²	16	50 Å²	50	10%	0.104	24%	0.237	C	C	.	.			trans	-59.8	139.7	174.9	24.4	-31.8	0	0	0	110.4	W671 A728 S729 C732	W671-P719 HydrophobicContact CZ2-CB 4.35Å; P719-A728 HydrophobicContact CB-CB 4.14Å; P719-A728 HydrophobicContact CG-CB 3.78Å; P719-S729 VanDerWaalsContact O-CB 3.27Å; P719-S729 WeakPolarHBondContact O-CB 3.32Å; P719-S729 PolarHBondContact O-OG 3.27Å; P719-C732 HydrophobicContact CG-CB 4.33Å
720	P	88.2	Confident	89.1	Confident	11 Å²	11	49.6 Å²	49.6	7%	0.071	23%	0.234	C	C	.	.			trans	-41.8	142.7	166.1	-36.7	40.1	0	0	0	113.5	S669 W671 Q674 D722 Y723	S669-P720 WeakPolarHBondContact O-CB 3.42Å; S669-P720 WeakPolarHBondContact O-CG 3.45Å; W671-P720 HydrophobicContact CG-CG 4.18Å; Q674-P720 VanDerWaalsContact NE2-CA 3.28Å; P720-D722 PolarHBondContact O-N 2.88Å; P720-D722 VanDerWaalsContact O-N 3.16Å; P720-Y723 VanDerWaalsContact O-CB 3.29Å; P720-Y723 WeakPolarHBondContact O-CB 3.42Å; P720-Y723 PolarHBondContact O-N 3.24Å
721	T	83.5	Confident	89.1	Confident	14 Å²	14	50.5 Å²	50.5	9%	0.086	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-13.8	178.4	48.9	0	0	0	0	113.1	A82 R667 Y723 G726	A82-T721 HydrophobicContact CB-CG2 4.37Å; R667-T721 PolarHBondContact O-OG1 3.01Å; T721-Y723 VanDerWaalsContact C-N 3.3Å; T721-G726 WeakPolarHBondContact O-CA 3.38Å; T721-G726 PolarHBondContact O-N 3.44Å
722	D	77.1	Confident	89.2	Confident	74 Å²	74	52 Å²	52	40%	0.396	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-25.4	169.1	-64.7	-14.8	0	0	0	113.1	R667 T668 P720 W724 D725	R667-D722 VanDerWaalsContact O-OD1 3.08Å; T668-D722 VanDerWaalsContact CA-CG 3.43Å; T668-D722 VanDerWaalsContact CA-OD1 3.24Å; T668-D722 WeakPolarHBondContact CA-OD1 3.38Å; T668-D722 WeakPolarHBondContact CA-OD2 3.24Å; T668-D722 WeakPolarHBondContact CB-OD1 3.48Å; T668-D722 WeakPolarHBondContact CB-OD2 3.07Å; T668-D722 VanDerWaalsContact CG2-CG 3.4Å; T668-D722 WeakPolarHBondContact CG2-OD1 3.24Å; T668-D722 WeakPolarHBondContact CG2-OD2 3.45Å; P720-D722 PolarHBondContact O-N 2.88Å; P720-D722 VanDerWaalsContact O-N 3.16Å; D722-W724 PolarHBondContact O-N 2.98Å; D722-D725 PolarHBondContact O-N 2.64Å
723	Y	83	Confident	89.3	Confident	162 Å²	162	51.2 Å²	51.2	64%	0.635	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-73.3	123.7	-174.1	-153.9	-100.6	0	0	0	109	P720 T721 D725 G726 A728	P720-Y723 VanDerWaalsContact O-CB 3.29Å; P720-Y723 WeakPolarHBondContact O-CB 3.42Å; P720-Y723 PolarHBondContact O-N 3.24Å; T721-Y723 VanDerWaalsContact C-N 3.3Å; Y723-D725 VanDerWaalsContact C-N 3.26Å; Y723-D725 PolarHBondContact O-N 3.35Å; Y723-G726 PolarHBondContact O-N 2.68Å; Y723-A728 HydrophobicContact CD1-CB 3.96Å
724	W	86.3	Confident	89.3	Confident	170 Å²	170	50.8 Å²	50.8	64%	0.644	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	52.8	42.7	-177.4	-160.3	20.3	0	0	0	113.4	D722 G726 W727 A728 I731	D722-W724 PolarHBondContact O-N 2.98Å; W724-G726 PolarHBondContact O-N 3.28Å; W724-G726 VanDerWaalsContact O-N 3.07Å; W724-W727 HydrophobicContact CD2-CB 4.01Å; W724-W727 HydrophobicContact CE3-CB 3.91Å; W724-W727 HydrophobicContact CG-CB 4.34Å; W724-W727 HydrophobicContact CZ3-CB 4.42Å; W724-W727 WeakPolarHBondContact O-CB 3.32Å; W724-W727 PolarHBondContact O-N 3.45Å; W724-A728 HydrophobicContact CB-CB 4.25Å; W724-A728 HydrophobicContact CE3-CB 4.32Å; W724-I731 HydrophobicContact CZ3-CD1 4.22Å
725	D	84.2	Confident	89.4	Confident	101 Å²	101	52.8 Å²	52.8	54%	0.54	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	50.3	35.6	-179.5	-58.6	-45.8	0	0	0	113.9	V85 D722 Y723	V85-D725 VanDerWaalsContact CG1-C 3.48Å; V85-D725 WeakPolarHBondContact CG1-O 2.94Å; D722-D725 PolarHBondContact O-N 2.64Å; Y723-D725 VanDerWaalsContact C-N 3.26Å; Y723-D725 PolarHBondContact O-N 3.35Å
726	G	84.8	Confident	89.6	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	92.2	-15.6	177.4	0	0	0	0	0	115	T721 Y723 W724 A728 S729 F730	T721-G726 WeakPolarHBondContact O-CA 3.38Å; T721-G726 PolarHBondContact O-N 3.44Å; Y723-G726 PolarHBondContact O-N 2.68Å; W724-G726 PolarHBondContact O-N 3.28Å; W724-G726 VanDerWaalsContact O-N 3.07Å; G726-A728 PolarHBondContact O-N 3.19Å; G726-S729 PolarHBondContact O-N 3.47Å; G726-F730 WeakPolarHBondContact O-CB 3.23Å; G726-F730 PolarHBondContact O-N 3.45Å
727	W	91	Very high	89.9	Confident	93 Å²	93	54.1 Å²	54.1	35%	0.352	26%	0.262	S	S	.	.	H	α-helix	trans	-65.5	-36.5	-175.6	-75.6	103.7	0	0	0	113.8	I86 W724 S729 F730 I731	I86-W727 HydrophobicContact CD1-CD2 3.78Å; I86-W727 HydrophobicContact CD1-CE3 3.88Å; I86-W727 HydrophobicContact CD1-CG 4.25Å; I86-W727 HydrophobicContact CD1-CH2 4.37Å; I86-W727 HydrophobicContact CD1-CZ2 4.27Å; I86-W727 HydrophobicContact CD1-CZ3 4.18Å; I86-W727 HydrophobicContact CG1-CD2 4.21Å; I86-W727 HydrophobicContact CG1-CG 4.41Å; I86-W727 HydrophobicContact CG1-CZ2 4.47Å; I86-W727 HydrophobicContact CG2-CH2 4.27Å; I86-W727 HydrophobicContact CG2-CZ2 3.66Å; W724-W727 HydrophobicContact CD2-CB 4.01Å; W724-W727 HydrophobicContact CE3-CB 3.91Å; W724-W727 HydrophobicContact CG-CB 4.34Å; W724-W727 HydrophobicContact CZ3-CB 4.42Å; W724-W727 WeakPolarHBondContact O-CB 3.32Å; W724-W727 PolarHBondContact O-N 3.45Å; W727-S729 VanDerWaalsContact C-N 3.33Å; W727-S729 PolarHBondContact O-N 3.11Å; W727-F730 HydrophobicContact CE3-CD1 4.06Å; W727-F730 HydrophobicContact CE3-CG 4.43Å; W727-F730 HydrophobicContact CZ3-CD1 4.11Å; W727-F730 HydrophobicContact CZ3-CE1 4.15Å; W727-F730 WeakPolarHBondContact O-CB 3.45Å; W727-F730 PolarHBondContact O-N 2.83Å; W727-I731 WeakPolarHBondContact O-CG1 2.85Å; W727-I731 PolarHBondContact O-N 3.46Å
728	A	92.5	Very high	90	Very high	15 Å²	15	48.4 Å²	48.4	12%	0.124	24%	0.24	C	C	.	.	H	α-helix	trans	-62.5	-43.6	175.7	0	0	0	0	0	111.2	P719 Y723 W724 G726 I731 C732	P719-A728 HydrophobicContact CB-CB 4.14Å; P719-A728 HydrophobicContact CG-CB 3.78Å; Y723-A728 HydrophobicContact CD1-CB 3.96Å; W724-A728 HydrophobicContact CB-CB 4.25Å; W724-A728 HydrophobicContact CE3-CB 4.32Å; G726-A728 PolarHBondContact O-N 3.19Å; A728-I731 PolarHBondContact O-N 3.33Å; A728-C732 PolarHBondContact O-N 2.9Å; A728-C732 VanDerWaalsContact O-N 3.11Å; A728-C732 PolarHBondContact O-SG 3.44Å; A728-C732 VanDerWaalsContact O-SG 3.4Å
729	S	91	Very high	90.3	Very high	3 Å²	3	53.5 Å²	53.5	2%	0.021	26%	0.262	C	S	.	.	H	α-helix	trans	-66.8	-39.6	178.1	-161.3	0	0	0	0	111.5	P719 G726 W727 S733	P719-S729 VanDerWaalsContact O-CB 3.27Å; P719-S729 WeakPolarHBondContact O-CB 3.32Å; P719-S729 PolarHBondContact O-OG 3.27Å; G726-S729 PolarHBondContact O-N 3.47Å; W727-S729 VanDerWaalsContact C-N 3.33Å; W727-S729 PolarHBondContact O-N 3.11Å; S729-S733 VanDerWaalsContact O-CB 3.29Å; S729-S733 WeakPolarHBondContact O-CB 3.04Å; S729-S733 PolarHBondContact O-N 3.49Å; S729-S733 PolarHBondContact O-OG 2.87Å
730	F	91.8	Very high	90.4	Very high	22 Å²	22	52.7 Å²	52.7	10%	0.096	26%	0.257	C	S	.	.	H	α-helix	trans	-58.2	-49.1	175.2	179.2	-88.9	0	0	0	112.2	F79 A82 I83 I86 L119 L122 G726 W727 S733 I734	F79-F730 AromaticContact CD2-CD2 3.99Å; F79-F730 HydrophobicContact CD2-CD2 3.99Å; F79-F730 HydrophobicContact CD2-CE2 4.28Å; F79-F730 AromaticContact CE2-CD2 3.33Å; F79-F730 HydrophobicContact CE2-CD2 3.33Å; F79-F730 HydrophobicContact CE2-CE1 4.48Å; F79-F730 AromaticContact CE2-CE2 3.24Å; F79-F730 HydrophobicContact CE2-CE2 3.24Å; F79-F730 HydrophobicContact CE2-CG 4.02Å; F79-F730 AromaticContact CE2-CZ 3.87Å; F79-F730 HydrophobicContact CE2-CZ 3.87Å; F79-F730 HydrophobicContact CZ-CD2 4.21Å; F79-F730 AromaticContact CZ-CE2 3.66Å; F79-F730 HydrophobicContact CZ-CE2 3.66Å; F79-F730 HydrophobicContact CZ-CZ 4.14Å; A82-F730 HydrophobicContact CB-CB 4.01Å; I83-F730 HydrophobicContact CD1-CE2 4.39Å; I83-F730 HydrophobicContact CG1-CD2 3.83Å; I83-F730 HydrophobicContact CG1-CE2 3.79Å; I86-F730 HydrophobicContact CD1-CB 3.88Å; I86-F730 HydrophobicContact CD1-CD2 3.87Å; I86-F730 HydrophobicContact CD1-CG 3.97Å; L119-F730 HydrophobicContact CD2-CE2 4.12Å; L119-F730 HydrophobicContact CD2-CZ 4.26Å; L122-F730 HydrophobicContact CD2-CZ 4.32Å; G726-F730 WeakPolarHBondContact O-CB 3.23Å; G726-F730 PolarHBondContact O-N 3.45Å; W727-F730 HydrophobicContact CE3-CD1 4.06Å; W727-F730 HydrophobicContact CE3-CG 4.43Å; W727-F730 HydrophobicContact CZ3-CD1 4.11Å; W727-F730 HydrophobicContact CZ3-CE1 4.15Å; W727-F730 WeakPolarHBondContact O-CB 3.45Å; W727-F730 PolarHBondContact O-N 2.83Å; F730-S733 PolarHBondContact O-OG 2.95Å; F730-I734 HydrophobicContact CD1-CD1 3.85Å; F730-I734 HydrophobicContact CE1-CD1 3.31Å; F730-I734 HydrophobicContact CE2-CD1 4.22Å; F730-I734 HydrophobicContact CG-CD1 4.5Å; F730-I734 HydrophobicContact CZ-CD1 3.53Å; F730-I734 WeakPolarHBondContact O-CG1 3.12Å; F730-I734 PolarHBondContact O-N 2.71Å; F730-I734 VanDerWaalsContact O-N 3.11Å
731	I	94	Very high	90.7	Very high	84 Å²	84	52.2 Å²	52.2	43%	0.431	25%	0.254	S	S	.	.	H	α-helix	trans	-67.8	-48.5	-179	-64.5	168	0	0	0	110.9	W724 W727 A728 S733 I734 V735	W724-I731 HydrophobicContact CZ3-CD1 4.22Å; W727-I731 WeakPolarHBondContact O-CG1 2.85Å; W727-I731 PolarHBondContact O-N 3.46Å; A728-I731 PolarHBondContact O-N 3.33Å; I731-S733 VanDerWaalsContact C-N 3.29Å; I731-S733 PolarHBondContact O-N 3Å; I731-I734 PolarHBondContact O-N 3.46Å; I731-V735 WeakPolarHBondContact O-CG2 3.28Å; I731-V735 PolarHBondContact O-N 3.02Å; I731-V735 VanDerWaalsContact O-N 3.1Å
732	C	94.5	Very high	91.3	Very high	58 Å²	58	52 Å²	52	39%	0.392	25%	0.253	S	S	.	.	H	α-helix	trans	-61.8	-36.6	-179.8	-70.2	0	0	0	0	112.6	P719 A728 L736	P719-C732 HydrophobicContact CG-CB 4.33Å; A728-C732 PolarHBondContact O-N 2.9Å; A728-C732 VanDerWaalsContact O-N 3.11Å; A728-C732 PolarHBondContact O-SG 3.44Å; A728-C732 VanDerWaalsContact O-SG 3.4Å; C732-L736 PolarHBondContact O-N 3.29Å; C732-L736 VanDerWaalsContact O-N 3.1Å
733	S	93.1	Very high	92.2	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-71.2	-40	177.5	52.9	0	0	0	0	112.7	F79 S729 F730 I731 V735 L736 I737	F79-S733 WeakPolarHBondContact CA-OG 3.5Å; F79-S733 VanDerWaalsContact CD2-OG 3.27Å; F79-S733 WeakPolarHBondContact CD2-OG 3.5Å; S729-S733 VanDerWaalsContact O-CB 3.29Å; S729-S733 WeakPolarHBondContact O-CB 3.04Å; S729-S733 PolarHBondContact O-N 3.49Å; S729-S733 PolarHBondContact O-OG 2.87Å; F730-S733 PolarHBondContact O-OG 2.95Å; I731-S733 VanDerWaalsContact C-N 3.29Å; I731-S733 PolarHBondContact O-N 3Å; S733-V735 VanDerWaalsContact C-N 3.31Å; S733-V735 PolarHBondContact O-N 2.88Å; S733-L736 PolarHBondContact O-N 2.99Å; S733-I737 WeakPolarHBondContact O-CB 3.33Å; S733-I737 VanDerWaalsContact O-CG1 3.24Å; S733-I737 WeakPolarHBondContact O-CG1 3.43Å; S733-I737 PolarHBondContact O-N 2.88Å
734	I	93.4	Very high	92.8	Very high	49 Å²	49	41.6 Å²	41.6	25%	0.251	21%	0.208	S	C	.	.	H	α-helix	trans	-58.8	-43.4	172.5	-71.8	175.3	0	0	0	111.2	F79 L130 F730 I731 I737 G738	F79-I734 HydrophobicContact CD2-CG1 3.96Å; F79-I734 HydrophobicContact CE2-CD1 3.58Å; F79-I734 HydrophobicContact CE2-CG1 3.3Å; F79-I734 HydrophobicContact CZ-CD1 3.83Å; F79-I734 HydrophobicContact CZ-CG1 3.66Å; L130-I734 HydrophobicContact CD1-CG2 4.41Å; L130-I734 HydrophobicContact CD2-CG2 4.34Å; F730-I734 HydrophobicContact CD1-CD1 3.85Å; F730-I734 HydrophobicContact CE1-CD1 3.31Å; F730-I734 HydrophobicContact CE2-CD1 4.22Å; F730-I734 HydrophobicContact CG-CD1 4.5Å; F730-I734 HydrophobicContact CZ-CD1 3.53Å; F730-I734 WeakPolarHBondContact O-CG1 3.12Å; F730-I734 PolarHBondContact O-N 2.71Å; F730-I734 VanDerWaalsContact O-N 3.11Å; I731-I734 PolarHBondContact O-N 3.46Å; I734-I737 PolarHBondContact O-N 3.34Å; I734-G738 PolarHBondContact O-N 2.96Å
735	V	95	Very high	93.2	Very high	100 Å²	100	33.8 Å²	33.8	61%	0.606	18%	0.181	S	C	*	.	H	α-helix	trans	-62.6	-44.2	178.4	173	0	0	0	0	111.1	I731 S733 G738 F739	I731-V735 WeakPolarHBondContact O-CG2 3.28Å; I731-V735 PolarHBondContact O-N 3.02Å; I731-V735 VanDerWaalsContact O-N 3.1Å; S733-V735 VanDerWaalsContact C-N 3.31Å; S733-V735 PolarHBondContact O-N 2.88Å; V735-G738 PolarHBondContact O-N 3.48Å; V735-F739 PolarHBondContact O-N 3.07Å
736	L	95.2	Very high	93.6	Very high	28 Å²	28	29.5 Å²	29.5	15%	0.147	16%	0.158	C	C	.	.	H	α-helix	trans	-65.5	-45.6	177	-177.9	65.2	0	0	0	111.7	A75 T714 M718 C732 S733 G738 F739 I740	A75-L736 HydrophobicContact CB-CD2 4.03Å; A75-L736 HydrophobicContact CB-CG 4.44Å; T714-L736 HydrophobicContact CG2-CD1 3.96Å; T714-L736 HydrophobicContact CG2-CD2 3.97Å; M718-L736 HydrophobicContact CE-CB 3.74Å; M718-L736 HydrophobicContact CE-CD2 3.17Å; M718-L736 HydrophobicContact CE-CG 4.05Å; C732-L736 PolarHBondContact O-N 3.29Å; C732-L736 VanDerWaalsContact O-N 3.1Å; S733-L736 PolarHBondContact O-N 2.99Å; L736-G738 VanDerWaalsContact C-N 3.27Å; L736-G738 PolarHBondContact O-N 3.15Å; L736-F739 PolarHBondContact O-N 3.33Å; L736-I740 HydrophobicContact CD1-CD1 4.1Å; L736-I740 HydrophobicContact CD1-CG1 4.23Å; L736-I740 HydrophobicContact CD2-CD1 4.31Å; L736-I740 HydrophobicContact CG-CD1 3.84Å; L736-I740 HydrophobicContact CG-CG1 4.36Å; L736-I740 WeakPolarHBondContact O-CG1 3.32Å; L736-I740 PolarHBondContact O-N 2.98Å
737	I	94.9	Very high	94.1	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-57.6	-47.4	176.7	-66.9	166.4	0	0	0	108.9	A75 F79 P127 L130 S733 I734 F739 I740 T741	A75-I737 HydrophobicContact CB-CG1 3.75Å; F79-I737 HydrophobicContact CB-CD1 3.79Å; F79-I737 HydrophobicContact CD1-CD1 3.96Å; F79-I737 HydrophobicContact CG-CD1 3.97Å; P127-I737 HydrophobicContact CG-CG2 4.24Å; L130-I737 HydrophobicContact CD1-CB 4.02Å; L130-I737 HydrophobicContact CD1-CG2 3.59Å; S733-I737 WeakPolarHBondContact O-CB 3.33Å; S733-I737 VanDerWaalsContact O-CG1 3.24Å; S733-I737 WeakPolarHBondContact O-CG1 3.43Å; S733-I737 PolarHBondContact O-N 2.88Å; I734-I737 PolarHBondContact O-N 3.34Å; I737-F739 VanDerWaalsContact C-N 3.35Å; I737-F739 PolarHBondContact O-N 3.43Å; I737-I740 PolarHBondContact O-N 3.11Å; I737-T741 HydrophobicContact CG2-CG2 4.11Å; I737-T741 WeakPolarHBondContact O-CB 3.48Å; I737-T741 WeakPolarHBondContact O-CG2 3.35Å; I737-T741 PolarHBondContact O-N 3.27Å; I737-T741 PolarHBondContact O-OG1 3.49Å
738	G	94.8	Very high	94.3	Very high	10 Å²	10	25.6 Å²	25.6	10%	0.103	14%	0.144	C	C	.	.	H	α-helix	trans	-54.1	-48.1	176.7	0	0	0	0	0	112.6	I134 I734 V735 L736 T741 A742	I134-G738 WeakPolarHBondContact CD1-O 3.41Å; I734-G738 PolarHBondContact O-N 2.96Å; V735-G738 PolarHBondContact O-N 3.48Å; L736-G738 VanDerWaalsContact C-N 3.27Å; L736-G738 PolarHBondContact O-N 3.15Å; G738-T741 VanDerWaalsContact C-OG1 3.27Å; G738-T741 WeakPolarHBondContact CA-OG1 3.34Å; G738-T741 PolarHBondContact O-N 3.31Å; G738-T741 PolarHBondContact O-OG1 3.4Å; G738-A742 PolarHBondContact O-N 3.04Å
739	F	95.5	Very high	94.2	Very high	113 Å²	113	25.5 Å²	25.5	50%	0.496	14%	0.141	S	C	.	.	H	α-helix	trans	-61.3	-46.3	176.5	178	-102.7	0	0	0	112.6	L39 V735 L736 I737 A742 L743	L39-F739 HydrophobicContact CD1-CD2 4.17Å; L39-F739 HydrophobicContact CD1-CE2 3.98Å; V735-F739 PolarHBondContact O-N 3.07Å; L736-F739 PolarHBondContact O-N 3.33Å; I737-F739 VanDerWaalsContact C-N 3.35Å; I737-F739 PolarHBondContact O-N 3.43Å; F739-A742 WeakPolarHBondContact O-CB 3.4Å; F739-A742 PolarHBondContact O-N 2.96Å; F739-L743 HydrophobicContact CD1-CD1 4.21Å; F739-L743 HydrophobicContact CE1-CD1 3.66Å; F739-L743 HydrophobicContact CZ-CD1 3.96Å; F739-L743 PolarHBondContact O-N 3.45Å
740	I	95.7	Very high	94.3	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-68.2	-37.9	179	-56	166.7	0	0	0	110.6	M68 V72 A75 W711 L736 I737 A742 L743 I744	M68-I740 HydrophobicContact CB-CG2 4.18Å; M68-I740 HydrophobicContact SD-CG2 4.12Å; V72-I740 HydrophobicContact CG2-CB 3.8Å; V72-I740 HydrophobicContact CG2-CG2 3.36Å; A75-I740 HydrophobicContact CB-CD1 4.37Å; W711-I740 HydrophobicContact CE3-CD1 4.03Å; W711-I740 HydrophobicContact CH2-CD1 4.05Å; W711-I740 HydrophobicContact CH2-CG1 4.03Å; W711-I740 HydrophobicContact CH2-CG2 4.32Å; W711-I740 HydrophobicContact CZ3-CD1 3.47Å; W711-I740 VanDerWaalsContact CZ3-CD1 3.47Å; W711-I740 HydrophobicContact CZ3-CG1 3.8Å; L736-I740 HydrophobicContact CD1-CD1 4.1Å; L736-I740 HydrophobicContact CD1-CG1 4.23Å; L736-I740 HydrophobicContact CD2-CD1 4.31Å; L736-I740 HydrophobicContact CG-CD1 3.84Å; L736-I740 HydrophobicContact CG-CG1 4.36Å; L736-I740 WeakPolarHBondContact O-CG1 3.32Å; L736-I740 PolarHBondContact O-N 2.98Å; I737-I740 PolarHBondContact O-N 3.11Å; I740-A742 VanDerWaalsContact C-N 3.32Å; I740-A742 PolarHBondContact O-N 2.68Å; I740-L743 WeakPolarHBondContact O-CB 3.42Å; I740-L743 PolarHBondContact O-N 2.96Å; I740-I744 HydrophobicContact CG2-CD1 4.2Å; I740-I744 WeakPolarHBondContact O-CG1 3.46Å; I740-I744 PolarHBondContact O-N 3.14Å
741	T	94.5	Very high	94.4	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.006	14%	0.137	C	C	.	.	H	α-helix	trans	-65.3	-34.2	176.2	45.7	0	0	0	0	113	V72 P127 I134 I737 G738 L743 I744 G745	V72-T741 HydrophobicContact CG2-CG2 4.47Å; P127-T741 HydrophobicContact CB-CG2 3.81Å; I134-T741 WeakPolarHBondContact CD1-OG1 3.43Å; I737-T741 HydrophobicContact CG2-CG2 4.11Å; I737-T741 WeakPolarHBondContact O-CB 3.48Å; I737-T741 WeakPolarHBondContact O-CG2 3.35Å; I737-T741 PolarHBondContact O-N 3.27Å; I737-T741 PolarHBondContact O-OG1 3.49Å; G738-T741 VanDerWaalsContact C-OG1 3.27Å; G738-T741 WeakPolarHBondContact CA-OG1 3.34Å; G738-T741 PolarHBondContact O-N 3.31Å; G738-T741 PolarHBondContact O-OG1 3.4Å; T741-L743 VanDerWaalsContact C-N 3.34Å; T741-I744 PolarHBondContact O-N 3.18Å; T741-G745 PolarHBondContact O-N 3.17Å
742	A	95	Very high	94.2	Very high	9 Å²	9	20.6 Å²	20.6	7%	0.074	12%	0.116	C	C	.	.	H	α-helix	trans	-61.2	-45.2	171.9	0	0	0	0	0	110.9	L39 I134 G738 F739 I740 I744 G745 D746	L39-A742 HydrophobicContact CD1-CB 3.6Å; L39-A742 HydrophobicContact CG-CB 4.42Å; I134-A742 HydrophobicContact CD1-CB 4.31Å; I134-A742 HydrophobicContact CG2-CB 3.94Å; G738-A742 PolarHBondContact O-N 3.04Å; F739-A742 WeakPolarHBondContact O-CB 3.4Å; F739-A742 PolarHBondContact O-N 2.96Å; I740-A742 VanDerWaalsContact C-N 3.32Å; I740-A742 PolarHBondContact O-N 2.68Å; A742-I744 VanDerWaalsContact C-N 3.33Å; A742-I744 PolarHBondContact O-N 3.18Å; A742-G745 PolarHBondContact O-N 2.97Å; A742-D746 PolarHBondContact O-N 3.25Å; A742-D746 VanDerWaalsContact O-N 3.11Å
743	L	95.9	Very high	93.9	Very high	17 Å²	17	19 Å²	19	9%	0.089	11%	0.106	C	C	.	.	H	α-helix	trans	-63.2	-38	174.8	-64.7	171.8	0	0	0	112.4	L39 L40 M68 F739 I740 T741 D746 L747	L39-L743 HydrophobicContact CB-CD2 3.97Å; L39-L743 HydrophobicContact CD1-CD2 3.8Å; L39-L743 HydrophobicContact CD1-CG 4.03Å; L40-L743 HydrophobicContact CD1-CD2 3.93Å; L40-L743 HydrophobicContact CD2-CD2 4.06Å; L40-L743 HydrophobicContact CG-CD2 3.76Å; M68-L743 HydrophobicContact CE-CB 4.15Å; M68-L743 HydrophobicContact CE-CD1 3.76Å; M68-L743 HydrophobicContact SD-CD1 4.34Å; F739-L743 HydrophobicContact CD1-CD1 4.21Å; F739-L743 HydrophobicContact CE1-CD1 3.66Å; F739-L743 HydrophobicContact CZ-CD1 3.96Å; F739-L743 PolarHBondContact O-N 3.45Å; I740-L743 WeakPolarHBondContact O-CB 3.42Å; I740-L743 PolarHBondContact O-N 2.96Å; T741-L743 VanDerWaalsContact C-N 3.34Å; L743-D746 PolarHBondContact O-N 2.83Å; L743-L747 WeakPolarHBondContact O-CB 3.49Å; L743-L747 WeakPolarHBondContact O-CG 3.34Å; L743-L747 PolarHBondContact O-N 3.36Å
744	I	95.8	Very high	93.6	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.005	11%	0.11	C	C	.	.	H	α-helix	trans	-62.1	-44.6	174.5	-72.3	167.1	0	0	0	110.6	L65 M68 F69 V72 I740 T741 A742 D746 L747 A748 V767	L65-I744 HydrophobicContact CD2-CG2 4.31Å; M68-I744 HydrophobicContact CB-CD1 4.1Å; M68-I744 HydrophobicContact CB-CG1 3.57Å; M68-I744 HydrophobicContact CG-CG1 4.42Å; F69-I744 HydrophobicContact CD1-CD1 3.75Å; F69-I744 HydrophobicContact CD1-CG1 4.43Å; F69-I744 HydrophobicContact CE1-CD1 3.88Å; F69-I744 HydrophobicContact CE1-CG1 4.27Å; F69-I744 HydrophobicContact CE1-CG2 3.6Å; F69-I744 HydrophobicContact CZ-CG2 3.97Å; V72-I744 HydrophobicContact CB-CD1 4.43Å; V72-I744 HydrophobicContact CG2-CD1 3.4Å; I740-I744 HydrophobicContact CG2-CD1 4.2Å; I740-I744 WeakPolarHBondContact O-CG1 3.46Å; I740-I744 PolarHBondContact O-N 3.14Å; T741-I744 PolarHBondContact O-N 3.18Å; A742-I744 VanDerWaalsContact C-N 3.33Å; A742-I744 PolarHBondContact O-N 3.18Å; I744-D746 VanDerWaalsContact C-N 3.35Å; I744-D746 PolarHBondContact O-N 3.18Å; I744-L747 PolarHBondContact O-N 3.4Å; I744-A748 WeakPolarHBondContact O-CB 3.37Å; I744-A748 PolarHBondContact O-N 2.93Å; I744-V767 HydrophobicContact CG2-CG1 4.14Å
745	G	93.8	Very high	93.3	Very high	6 Å²	6	20.8 Å²	20.8	6%	0.062	12%	0.116	C	C	.	.	H	α-helix	trans	-57.4	-47.9	177.4	0	0	0	0	0	112.1	T741 A742 A748 N749	T741-G745 PolarHBondContact O-N 3.17Å; A742-G745 PolarHBondContact O-N 2.97Å; G745-A748 PolarHBondContact O-N 3.04Å; G745-N749 VanDerWaalsContact O-CG 3.27Å; G745-N749 PolarHBondContact O-N 3.1Å; G745-N749 PolarHBondContact O-ND2 3.26Å
746	D	94.4	Very high	92.8	Very high	10 Å²	10	16.7 Å²	16.7	5%	0.053	9%	0.094	C	C	.	.	H	α-helix	trans	-62.8	-49.7	177.6	-68.8	-8.7	0	0	0	112.3	G37 L38 L39 L40 A742 L743 I744 A748 N749 H750	G37-D746 WeakPolarHBondContact CA-OD1 3.49Å; L38-D746 VanDerWaalsContact N-CG 3.27Å; L38-D746 PolarHBondContact N-OD1 2.91Å; L38-D746 PolarHBondContact N-OD2 3.2Å; L38-D746 VanDerWaalsContact N-OD2 3.16Å; L39-D746 WeakPolarHBondContact CA-OD2 3.48Å; L39-D746 WeakPolarHBondContact CB-OD2 3.42Å; L39-D746 PolarHBondContact N-OD2 2.97Å; L40-D746 HydrophobicContact CB-CB 4.13Å; L40-D746 HydrophobicContact CD1-CB 4.38Å; L40-D746 HydrophobicContact CG-CB 4.48Å; L40-D746 PolarHBondContact N-OD2 3.43Å; A742-D746 PolarHBondContact O-N 3.25Å; A742-D746 VanDerWaalsContact O-N 3.11Å; L743-D746 PolarHBondContact O-N 2.83Å; I744-D746 VanDerWaalsContact C-N 3.35Å; I744-D746 PolarHBondContact O-N 3.18Å; D746-A748 VanDerWaalsContact C-N 3.27Å; D746-A748 PolarHBondContact O-N 3.43Å; D746-N749 PolarHBondContact O-N 2.89Å; D746-H750 WeakPolarHBondContact O-CB 3.23Å; D746-H750 PolarHBondContact O-CD2 3.46Å; D746-H750 VanDerWaalsContact O-CD2 3.23Å; D746-H750 PolarHBondContact O-N 3.36Å
747	L	95.4	Very high	92.5	Very high	12 Å²	12	17 Å²	17	6%	0.063	10%	0.095	C	C	.	.	H	α-helix	trans	-62.6	-35.1	179.6	-72.1	170.4	0	0	0	112	L40 Y61 A64 L65 M68 L743 I744 F751	L40-L747 HydrophobicContact CD1-CD2 3.79Å; L40-L747 HydrophobicContact CD1-CG 3.83Å; Y61-L747 HydrophobicContact CD1-CD2 3.86Å; Y61-L747 HydrophobicContact CE1-CD2 4.19Å; A64-L747 HydrophobicContact CB-CD1 4.03Å; A64-L747 HydrophobicContact CB-CD2 4.07Å; L65-L747 HydrophobicContact CD2-CB 3.51Å; L65-L747 HydrophobicContact CD2-CD1 4.48Å; L65-L747 HydrophobicContact CG-CB 3.88Å; M68-L747 HydrophobicContact CE-CD1 4.2Å; M68-L747 HydrophobicContact CG-CD1 3.64Å; L743-L747 WeakPolarHBondContact O-CB 3.49Å; L743-L747 WeakPolarHBondContact O-CG 3.34Å; L743-L747 PolarHBondContact O-N 3.36Å; I744-L747 PolarHBondContact O-N 3.4Å; L747-F751 WeakPolarHBondContact O-CB 3.27Å; L747-F751 PolarHBondContact O-N 2.96Å
748	A	94.5	Very high	92.2	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-67.7	-46.7	177.4	0	0	0	0	0	111.1	L65 L146 I744 G745 D746 H750 F751 G752 T762 V767	L65-A748 HydrophobicContact CD2-CB 4.32Å; L146-A748 HydrophobicContact CD1-CB 4.24Å; L146-A748 HydrophobicContact CD2-CB 4.26Å; I744-A748 WeakPolarHBondContact O-CB 3.37Å; I744-A748 PolarHBondContact O-N 2.93Å; G745-A748 PolarHBondContact O-N 3.04Å; D746-A748 VanDerWaalsContact C-N 3.27Å; D746-A748 PolarHBondContact O-N 3.43Å; A748-H750 VanDerWaalsContact C-N 3.32Å; A748-H750 PolarHBondContact O-N 3.08Å; A748-F751 PolarHBondContact O-N 3.07Å; A748-G752 PolarHBondContact O-N 3.37Å; A748-T762 HydrophobicContact CB-CG2 4.3Å; A748-V767 HydrophobicContact CB-CG2 3.46Å; A748-V767 VanDerWaalsContact CB-CG2 3.46Å
749	N	91.1	Very high	92	Very high	13 Å²	13	17.4 Å²	17.4	7%	0.07	10%	0.095	C	C	.	.	H	α-helix	trans	-60.6	-43.6	175.5	-67.4	-15.5	0	0	0	110.9	G745 D746 G752 C753	G745-N749 VanDerWaalsContact O-CG 3.27Å; G745-N749 PolarHBondContact O-N 3.1Å; G745-N749 PolarHBondContact O-ND2 3.26Å; D746-N749 PolarHBondContact O-N 2.89Å; N749-G752 PolarHBondContact O-N 3.39Å; N749-C753 VanDerWaalsContact O-CB 3.25Å; N749-C753 WeakPolarHBondContact O-CB 3.48Å; N749-C753 PolarHBondContact O-N 2.94Å
750	H	92.3	Very high	91.7	Very high	3 Å²	3	12.2 Å²	12.2	1%	0.014	7%	0.073	C	C	.	.	H	α-helix	trans	-67.4	-38.8	178.5	-64.8	-178.2	0	0	0	112.7	G37 L40 P41 L42 Y61 D746 A748 T754	G37-H750 PolarHBondContact N-NE2 2.72Å; L40-H750 PolarHBondContact O-CE1 2.97Å; L40-H750 VanDerWaalsContact O-CE1 3.23Å; P41-H750 PolarHBondContact O-CE1 3.48Å; L42-H750 HydrophobicContact CD1-CB 3.99Å; L42-H750 WeakPolarHBondContact CD1-CD2 3.39Å; Y61-H750 HydrophobicContact CD1-CB 4.11Å; Y61-H750 HydrophobicContact CE1-CB 3.57Å; Y61-H750 AromaticContact CE1-ND1 3.91Å; Y61-H750 HydrophobicContact CE2-CB 4.17Å; D746-H750 WeakPolarHBondContact O-CB 3.23Å; D746-H750 PolarHBondContact O-CD2 3.46Å; D746-H750 VanDerWaalsContact O-CD2 3.23Å; D746-H750 PolarHBondContact O-N 3.36Å; A748-H750 VanDerWaalsContact C-N 3.32Å; A748-H750 PolarHBondContact O-N 3.08Å; H750-T754 WeakPolarHBondContact O-CB 3.39Å; H750-T754 PolarHBondContact O-N 3.4Å; H750-T754 PolarHBondContact O-OG1 3.1Å
751	F	92.8	Very high	91.6	Very high	2 Å²	2	12.7 Å²	12.7	1%	0.009	8%	0.075	C	C	.	.	H	α-helix	trans	-62.3	-49.5	174.2	172.2	-101.1	0	0	0	111.3	M62 L65 L747 A748 T754 I755 L757 T762 F766	M62-F751 HydrophobicContact CB-CD2 4.43Å; M62-F751 HydrophobicContact CB-CE2 4.03Å; M62-F751 HydrophobicContact CE-CD2 4.44Å; M62-F751 HydrophobicContact CE-CE1 3.92Å; M62-F751 HydrophobicContact CE-CE2 3.43Å; M62-F751 VanDerWaalsContact CE-CE2 3.43Å; M62-F751 HydrophobicContact CE-CZ 3.1Å; M62-F751 HydrophobicContact SD-CE2 4.42Å; M62-F751 HydrophobicContact SD-CZ 4.44Å; L65-F751 HydrophobicContact CD1-CB 3.87Å; L65-F751 HydrophobicContact CD1-CD1 4.31Å; L65-F751 HydrophobicContact CD1-CG 3.98Å; L747-F751 WeakPolarHBondContact O-CB 3.27Å; L747-F751 PolarHBondContact O-N 2.96Å; A748-F751 PolarHBondContact O-N 3.07Å; F751-T754 PolarHBondContact O-N 2.95Å; F751-I755 HydrophobicContact CD2-CD1 4.06Å; F751-I755 HydrophobicContact CD2-CG1 4.42Å; F751-I755 HydrophobicContact CE1-CD1 4.3Å; F751-I755 HydrophobicContact CE2-CD1 3.21Å; F751-I755 HydrophobicContact CE2-CG1 4.01Å; F751-I755 HydrophobicContact CZ-CD1 3.35Å; F751-I755 HydrophobicContact CZ-CG1 4.26Å; F751-I755 PolarHBondContact O-N 3.43Å; F751-L757 HydrophobicContact CE1-CD1 4.04Å; F751-T762 HydrophobicContact CD1-CG2 4.02Å; F751-F766 AromaticContact CE1-CD2 3.65Å; F751-F766 HydrophobicContact CE1-CD2 3.65Å; F751-F766 AromaticContact CE1-CE2 3.74Å; F751-F766 HydrophobicContact CE1-CE2 3.74Å; F751-F766 HydrophobicContact CE1-CG 4.14Å; F751-F766 HydrophobicContact CE1-CZ 4.3Å; F751-F766 HydrophobicContact CZ-CD2 4.4Å; F751-F766 HydrophobicContact CZ-CE2 4.19Å; F751-F766 HydrophobicContact CZ-CZ 4.31Å
752	G	90.5	Very high	91.5	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-58.3	-51.4	177.6	0	0	0	0	0	111.3	A748 N749 T754 I755 G756 L757	A748-G752 PolarHBondContact O-N 3.37Å; N749-G752 PolarHBondContact O-N 3.39Å; G752-T754 VanDerWaalsContact C-N 3.34Å; G752-T754 PolarHBondContact O-N 2.91Å; G752-I755 PolarHBondContact O-N 3.27Å; G752-G756 CarbonylContact O-C 3.49Å; G752-G756 WeakPolarHBondContact O-CA 3.48Å; G752-G756 PolarHBondContact O-N 3.39Å; G752-L757 CarbonylContact C-O 3.45Å; G752-L757 VanDerWaalsContact C-O 3.28Å; G752-L757 PolarHBondContact O-N 3.45Å
753	C	87.5	Confident	91.5	Very high	26 Å²	26	12.2 Å²	12.2	18%	0.176	7%	0.072	C	C	.	.	H	α-helix	trans	-53.7	-47.3	173.6	168.5	0	0	0	0	112.3	C34 N749 I755 G756	C34-C753 HydrophobicContact CB-CB 4.08Å; C34-C753 WeakPolarHBondContact CB-SG 3.1Å; C34-C753 WeakPolarHBondContact SG-CB 3.3Å; C34-C753 CovalentContact SG-SG 2.03Å; C34-C753 PolarHBondContact SG-SG 3.22Å; N749-C753 VanDerWaalsContact O-CB 3.25Å; N749-C753 WeakPolarHBondContact O-CB 3.48Å; N749-C753 PolarHBondContact O-N 2.94Å; C753-I755 PolarHBondContact O-N 3.46Å; C753-G756 PolarHBondContact O-N 3.19Å
754	T	88	Confident	91.5	Very high	13 Å²	13	11.6 Å²	11.6	8%	0.08	7%	0.068	C	C	.	.	H	α-helix	trans	-64.8	-43.7	-178.3	-59.7	0	0	0	0	112	R54 R57 Y61 H750 F751 G752	R54-T754 WeakPolarHBondContact CD-O 3.44Å; R54-T754 HydrophobicContact CG-CG2 4.31Å; R54-T754 WeakPolarHBondContact CG-O 3.43Å; R54-T754 PolarHBondContact NE-O 3.19Å; R54-T754 PolarHBondContact NH2-O 3.47Å; R57-T754 HydrophobicContact CB-CG2 3.66Å; Y61-T754 VanDerWaalsContact CE2-OG1 3.31Å; Y61-T754 WeakPolarHBondContact CE2-OG1 3.41Å; H750-T754 WeakPolarHBondContact O-CB 3.39Å; H750-T754 PolarHBondContact O-N 3.4Å; H750-T754 PolarHBondContact O-OG1 3.1Å; F751-T754 PolarHBondContact O-N 2.95Å; G752-T754 VanDerWaalsContact C-N 3.34Å; G752-T754 PolarHBondContact O-N 2.91Å
755	I	87.3	Confident	91.4	Very high	73 Å²	73	12.5 Å²	12.5	37%	0.374	7%	0.074	S	C	.	.	H	α-helix	trans	-83.8	-17.8	-178.5	-62.4	-163.7	0	0	0	112.4	R54 F751 G752 C753 L757	R54-I755 PolarHBondContact NH2-O 3.42Å; F751-I755 HydrophobicContact CD2-CD1 4.06Å; F751-I755 HydrophobicContact CD2-CG1 4.42Å; F751-I755 HydrophobicContact CE1-CD1 4.3Å; F751-I755 HydrophobicContact CE2-CD1 3.21Å; F751-I755 HydrophobicContact CE2-CG1 4.01Å; F751-I755 HydrophobicContact CZ-CD1 3.35Å; F751-I755 HydrophobicContact CZ-CG1 4.26Å; F751-I755 PolarHBondContact O-N 3.43Å; G752-I755 PolarHBondContact O-N 3.27Å; C753-I755 PolarHBondContact O-N 3.46Å; I755-L757 HydrophobicContact CB-CG 4.42Å; I755-L757 HydrophobicContact CG2-CD1 4.34Å; I755-L757 HydrophobicContact CG2-CG 4.06Å
756	G	84.5	Confident	91.4	Very high	14 Å²	14	15.7 Å²	15.7	14%	0.144	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.3	30.3	-173.5	0	0	0	0	0	112.8	R54 G752 C753	R54-G756 VanDerWaalsContact NH2-CA 3.34Å; R54-G756 VanDerWaalsContact NH2-N 3.18Å; G752-G756 CarbonylContact O-C 3.49Å; G752-G756 WeakPolarHBondContact O-CA 3.48Å; G752-G756 PolarHBondContact O-N 3.39Å; C753-G756 PolarHBondContact O-N 3.19Å
757	L	88.8	Confident	91.5	Very high	34 Å²	34	15.2 Å²	15.2	18%	0.178	8%	0.084	C	C	.	.			trans	-92	141.3	169	-61.2	175.7	0	0	0	108.9	F751 G752 I755 V761 T762 F766 Y893	F751-L757 HydrophobicContact CE1-CD1 4.04Å; G752-L757 CarbonylContact C-O 3.45Å; G752-L757 VanDerWaalsContact C-O 3.28Å; G752-L757 PolarHBondContact O-N 3.45Å; I755-L757 HydrophobicContact CB-CG 4.42Å; I755-L757 HydrophobicContact CG2-CD1 4.34Å; I755-L757 HydrophobicContact CG2-CG 4.06Å; L757-V761 HydrophobicContact CD2-CG1 4.41Å; L757-T762 WeakPolarHBondContact CB-OG1 3.36Å; L757-F766 HydrophobicContact CD1-CD2 4.35Å; L757-F766 HydrophobicContact CD1-CE2 3.69Å; L757-Y893 WeakPolarHBondContact CD2-OH 3.21Å
758	I	88.7	Confident	91.4	Very high	11 Å²	11	14.7 Å²	14.7	6%	0.056	8%	0.081	C	C	.	.			trans	-75.1	156.5	172.4	70.3	169.4	0	0	0	110.5	I29 A760 V761 T762 S892 Y893	I29-I758 HydrophobicContact CG2-CG2 3.85Å; I758-A760 VanDerWaalsContact C-N 3.28Å; I758-A760 HydrophobicContact CD1-CB 4.14Å; I758-A760 HydrophobicContact CG1-CB 4.37Å; I758-A760 PolarHBondContact O-N 3.43Å; I758-V761 HydrophobicContact CD1-CG2 4.04Å; I758-V761 HydrophobicContact CG1-CB 3.94Å; I758-V761 HydrophobicContact CG1-CG2 3.6Å; I758-V761 PolarHBondContact O-N 2.66Å; I758-V761 VanDerWaalsContact O-N 3.17Å; I758-T762 PolarHBondContact O-N 3.41Å; I758-T762 PolarHBondContact O-OG1 3.29Å; I758-S892 VanDerWaalsContact CD1-CB 3.45Å; I758-Y893 HydrophobicContact CG2-CE1 4.22Å
759	D	89.8	Confident	91.4	Very high	8 Å²	8	17.6 Å²	17.6	4%	0.043	10%	0.096	C	C	.	.	H	α-helix	trans	-57.9	-40.8	-176.5	-71	3.1	0	0	0	111.7	R35 D145 V761 T762 A763	R35-D759 IonicContact NH2-OD2 3.84Å; D145-D759 HydrophobicContact CB-CB 4.3Å; D759-V761 PolarHBondContact O-N 2.65Å; D759-T762 PolarHBondContact O-N 3.26Å; D759-A763 VanDerWaalsContact O-CB 3.22Å; D759-A763 WeakPolarHBondContact O-CB 3.11Å; D759-A763 PolarHBondContact O-N 2.92Å
760	A	90.2	Very high	91.5	Very high	4 Å²	4	17.2 Å²	17.2	3%	0.033	10%	0.095	C	C	.	.	H	α-helix	trans	-59.8	-45.4	177.2	0	0	0	0	0	113	N149 I758 A763 I764	N149-A760 HydrophobicContact CB-CB 4.48Å; I758-A760 VanDerWaalsContact C-N 3.28Å; I758-A760 HydrophobicContact CD1-CB 4.14Å; I758-A760 HydrophobicContact CG1-CB 4.37Å; I758-A760 PolarHBondContact O-N 3.43Å; A760-A763 PolarHBondContact O-N 3.4Å; A760-I764 WeakPolarHBondContact O-CG1 3.12Å; A760-I764 WeakPolarHBondContact O-CG2 3.44Å; A760-I764 PolarHBondContact O-N 2.84Å
761	V	92.8	Very high	91.5	Very high	9 Å²	9	17.1 Å²	17.1	6%	0.055	9%	0.094	C	C	.	.	H	α-helix	trans	-69.5	-40.7	178.8	175.3	0	0	0	0	110.6	L757 I758 D759 A763 T765 Y893	L757-V761 HydrophobicContact CD2-CG1 4.41Å; I758-V761 HydrophobicContact CD1-CG2 4.04Å; I758-V761 HydrophobicContact CG1-CB 3.94Å; I758-V761 HydrophobicContact CG1-CG2 3.6Å; I758-V761 PolarHBondContact O-N 2.66Å; I758-V761 VanDerWaalsContact O-N 3.17Å; D759-V761 PolarHBondContact O-N 2.65Å; V761-A763 VanDerWaalsContact C-N 3.3Å; V761-A763 PolarHBondContact O-N 2.99Å; V761-T765 WeakPolarHBondContact O-CB 3.01Å; V761-T765 WeakPolarHBondContact O-CG2 2.97Å; V761-T765 PolarHBondContact O-N 3.04Å; V761-T765 PolarHBondContact O-OG1 3.31Å; V761-Y893 HydrophobicContact CG2-CE2 3.99Å
762	T	93.2	Very high	91.5	Very high	1 Å²	1	17 Å²	17	1%	0.006	9%	0.094	C	C	.	.	H	α-helix	trans	-61.6	-41.1	176.1	-55.1	0	0	0	0	111.3	A748 F751 L757 I758 D759 F766 V767	A748-T762 HydrophobicContact CB-CG2 4.3Å; F751-T762 HydrophobicContact CD1-CG2 4.02Å; L757-T762 WeakPolarHBondContact CB-OG1 3.36Å; I758-T762 PolarHBondContact O-N 3.41Å; I758-T762 PolarHBondContact O-OG1 3.29Å; D759-T762 PolarHBondContact O-N 3.26Å; T762-F766 PolarHBondContact O-N 3.24Å; T762-V767 HydrophobicContact CG2-CG2 4.5Å; T762-V767 PolarHBondContact O-N 2.8Å
763	A	94.4	Very high	91.5	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.104	C	C	.	.	I	π-helix	trans	-63.6	-56	177.1	0	0	0	0	0	112.6	L146 N149 T150 D759 A760 V761 T765 A768	L146-A763 HydrophobicContact CD1-CB 3.94Å; L146-A763 HydrophobicContact CG-CB 4.46Å; L146-A763 WeakPolarHBondContact O-CB 3.01Å; N149-A763 HydrophobicContact CB-CB 3.74Å; T150-A763 WeakPolarHBondContact OG1-CB 3.35Å; D759-A763 VanDerWaalsContact O-CB 3.22Å; D759-A763 WeakPolarHBondContact O-CB 3.11Å; D759-A763 PolarHBondContact O-N 2.92Å; A760-A763 PolarHBondContact O-N 3.4Å; V761-A763 VanDerWaalsContact C-N 3.3Å; V761-A763 PolarHBondContact O-N 2.99Å; A763-T765 PolarHBondContact O-N 2.91Å; A763-A768 WeakPolarHBondContact O-CB 3.41Å; A763-A768 PolarHBondContact O-N 2.94Å
764	I	94.8	Very high	91.4	Very high	3 Å²	3	18.1 Å²	18.1	2%	0.015	10%	0.1	C	C	.	.	I	π-helix	trans	-68.6	-19.3	-174.6	66.7	-179.3	0	0	0	113.7	N149 A760 Y884	N149-I764 HydrophobicContact CB-CG2 4.1Å; N149-I764 WeakPolarHBondContact O-CG2 3.45Å; A760-I764 WeakPolarHBondContact O-CG1 3.12Å; A760-I764 WeakPolarHBondContact O-CG2 3.44Å; A760-I764 PolarHBondContact O-N 2.84Å; I764-Y884 HydrophobicContact CB-CE1 4.46Å
765	T	94.1	Very high	91.4	Very high	20 Å²	20	17.5 Å²	17.5	12%	0.123	10%	0.097	C	C	.	.	I	π-helix	trans	-102	-72.7	-178.7	58.8	0	0	0	0	111.6	V761 A763 I769 I885	V761-T765 WeakPolarHBondContact O-CB 3.01Å; V761-T765 WeakPolarHBondContact O-CG2 2.97Å; V761-T765 PolarHBondContact O-N 3.04Å; V761-T765 PolarHBondContact O-OG1 3.31Å; A763-T765 PolarHBondContact O-N 2.91Å; T765-I769 WeakPolarHBondContact O-CB 3.4Å; T765-I769 WeakPolarHBondContact O-CD1 3.37Å; T765-I769 WeakPolarHBondContact O-CG1 3.34Å; T765-I769 PolarHBondContact O-N 3.36Å; T765-I885 HydrophobicContact CG2-CD1 4.18Å; T765-I885 HydrophobicContact CG2-CG1 4.36Å; T765-I885 HydrophobicContact CG2-CG2 3.72Å
766	F	94.4	Very high	91.5	Very high	74 Å²	74	14.8 Å²	14.8	33%	0.325	8%	0.083	S	C	.	.	I	π-helix	trans	-80.8	-45	-168.7	-62.6	-74.2	0	0	0	112.6	M62 F751 L757 T762 G770	M62-F766 HydrophobicContact CE-CD1 3.56Å; M62-F766 HydrophobicContact CE-CE1 3.38Å; M62-F766 HydrophobicContact CE-CG 4.3Å; M62-F766 HydrophobicContact CE-CZ 3.99Å; M62-F766 HydrophobicContact SD-CD1 4.17Å; M62-F766 HydrophobicContact SD-CE1 4.46Å; F751-F766 AromaticContact CE1-CD2 3.65Å; F751-F766 HydrophobicContact CE1-CD2 3.65Å; F751-F766 AromaticContact CE1-CE2 3.74Å; F751-F766 HydrophobicContact CE1-CE2 3.74Å; F751-F766 HydrophobicContact CE1-CG 4.14Å; F751-F766 HydrophobicContact CE1-CZ 4.3Å; F751-F766 HydrophobicContact CZ-CD2 4.4Å; F751-F766 HydrophobicContact CZ-CE2 4.19Å; F751-F766 HydrophobicContact CZ-CZ 4.31Å; L757-F766 HydrophobicContact CD1-CD2 4.35Å; L757-F766 HydrophobicContact CD1-CE2 3.69Å; T762-F766 PolarHBondContact O-N 3.24Å; F766-G770 PolarHBondContact O-N 3Å
767	V	95.8	Very high	91.4	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.09	C	C	.	.	I	π-helix	trans	-70.8	-48	-177.6	-171.5	0	0	0	0	110.7	L131 L146 T150 I744 A748 T762 I769 G770 T771	L131-V767 HydrophobicContact CD2-CG1 3.84Å; L146-V767 HydrophobicContact CD1-CG2 4.33Å; T150-V767 HydrophobicContact CG2-CB 4.34Å; T150-V767 HydrophobicContact CG2-CG1 3.78Å; I744-V767 HydrophobicContact CG2-CG1 4.14Å; A748-V767 HydrophobicContact CB-CG2 3.46Å; A748-V767 VanDerWaalsContact CB-CG2 3.46Å; T762-V767 HydrophobicContact CG2-CG2 4.5Å; T762-V767 PolarHBondContact O-N 2.8Å; V767-I769 VanDerWaalsContact C-N 3.34Å; V767-I769 PolarHBondContact O-N 3.41Å; V767-G770 PolarHBondContact O-N 2.77Å; V767-T771 HydrophobicContact CG1-CG2 3.98Å; V767-T771 WeakPolarHBondContact O-CG2 3.45Å; V767-T771 PolarHBondContact O-N 3.35Å; V767-T771 PolarHBondContact O-OG1 2.83Å
768	A	95.1	Very high	91.1	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-55.9	-44.8	178.6	0	0	0	0	0	113	G153 S154 A763 T771 S772	G153-A768 VanDerWaalsContact C-CB 3.47Å; S154-A768 VanDerWaalsContact OG-CA 3.32Å; S154-A768 WeakPolarHBondContact OG-CA 3.14Å; S154-A768 PolarHBondContact OG-O 2.88Å; A763-A768 WeakPolarHBondContact O-CB 3.41Å; A763-A768 PolarHBondContact O-N 2.94Å; A768-T771 PolarHBondContact O-OG1 3.04Å; A768-S772 WeakPolarHBondContact O-CB 3.46Å; A768-S772 PolarHBondContact O-N 2.83Å; A768-S772 VanDerWaalsContact O-N 3.09Å; A768-S772 PolarHBondContact O-OG 2.76Å
769	I	94.1	Very high	91	Very high	62 Å²	62	15.3 Å²	15.3	32%	0.318	8%	0.081	S	C	.	.	H	α-helix	trans	-61.4	-47.1	175.9	-69	168.8	0	0	0	110.3	F157 T765 V767 S772 V773 W881	F157-I769 HydrophobicContact CD2-CG1 3.9Å; F157-I769 HydrophobicContact CE2-CG1 3.85Å; F157-I769 HydrophobicContact CE2-CG2 4.39Å; F157-I769 HydrophobicContact CZ-CG1 4.47Å; F157-I769 HydrophobicContact CZ-CG2 4.28Å; T765-I769 WeakPolarHBondContact O-CB 3.4Å; T765-I769 WeakPolarHBondContact O-CD1 3.37Å; T765-I769 WeakPolarHBondContact O-CG1 3.34Å; T765-I769 PolarHBondContact O-N 3.36Å; V767-I769 VanDerWaalsContact C-N 3.34Å; V767-I769 PolarHBondContact O-N 3.41Å; I769-S772 PolarHBondContact O-N 2.88Å; I769-V773 WeakPolarHBondContact O-CG2 3.28Å; I769-V773 PolarHBondContact O-N 3.4Å; I769-W881 HydrophobicContact CD1-CH2 3.81Å; I769-W881 HydrophobicContact CD1-CZ2 3.72Å; I769-W881 HydrophobicContact CG1-CH2 4.47Å; I769-W881 HydrophobicContact CG1-CZ2 3.92Å
770	G	93.2	Very high	90.9	Very high	4 Å²	4	17.6 Å²	17.6	4%	0.041	9%	0.091	C	C	.	.	H	α-helix	trans	-66.7	-42.8	-175.4	0	0	0	0	0	113.7	F69 F766 V767 S772 V773	F69-G770 VanDerWaalsContact CD1-CA 3.43Å; F766-G770 PolarHBondContact O-N 3Å; V767-G770 PolarHBondContact O-N 2.77Å; G770-S772 VanDerWaalsContact C-N 3.34Å; G770-V773 WeakPolarHBondContact O-CB 3.36Å; G770-V773 WeakPolarHBondContact O-CG2 3.32Å; G770-V773 PolarHBondContact O-N 2.92Å
771	T	91.8	Very high	90.3	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.006	9%	0.094	C	C	.	.	H	α-helix	trans	-72.4	-29.1	177.5	64.5	0	0	0	0	112.2	F69 P127 E128 T150 S154 V767 A768 V773 P774	F69-T771 HydrophobicContact CE1-CG2 4.2Å; P127-T771 HydrophobicContact CB-CG2 4.07Å; E128-T771 WeakPolarHBondContact CG-OG1 3.44Å; E128-T771 WeakPolarHBondContact OE1-CB 3.34Å; E128-T771 PolarHBondContact OE1-OG1 3.11Å; T150-T771 HydrophobicContact CG2-CG2 4.45Å; S154-T771 PolarHBondContact OG-OG1 3.47Å; V767-T771 HydrophobicContact CG1-CG2 3.98Å; V767-T771 WeakPolarHBondContact O-CG2 3.45Å; V767-T771 PolarHBondContact O-N 3.35Å; V767-T771 PolarHBondContact O-OG1 2.83Å; A768-T771 PolarHBondContact O-OG1 3.04Å; T771-V773 VanDerWaalsContact C-N 3.27Å; T771-V773 PolarHBondContact O-N 2.61Å; T771-P774 WeakPolarHBondContact O-CD 3.42Å
772	S	92.3	Very high	89.8	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-2.7	178	-57.4	0	0	0	0	114	E128 S154 F157 A768 I769 G770 D775 T776	E128-S772 PolarHBondContact OE1-N 3.15Å; S154-S772 VanDerWaalsContact CB-OG 3.28Å; S154-S772 WeakPolarHBondContact CB-OG 3.37Å; S154-S772 PolarHBondContact OG-OG 3.4Å; F157-S772 VanDerWaalsContact CD1-CB 3.42Å; A768-S772 WeakPolarHBondContact O-CB 3.46Å; A768-S772 PolarHBondContact O-N 2.83Å; A768-S772 VanDerWaalsContact O-N 3.09Å; A768-S772 PolarHBondContact O-OG 2.76Å; I769-S772 PolarHBondContact O-N 2.88Å; G770-S772 VanDerWaalsContact C-N 3.34Å; S772-D775 WeakPolarHBondContact O-CB 3.24Å; S772-D775 PolarHBondContact O-N 3.14Å; S772-D775 VanDerWaalsContact O-N 3.11Å; S772-T776 VanDerWaalsContact O-CG2 3.27Å; S772-T776 WeakPolarHBondContact O-CG2 3.24Å; S772-T776 PolarHBondContact O-N 3.03Å
773	V	89.8	Confident	89.5	Confident	34 Å²	34	18.1 Å²	18.1	21%	0.206	10%	0.095	C	C	.	.	H	α-helix	trans	-55	-46.9	178.1	173.8	0	0	0	0	112.6	S73 I769 G770 T771 D775 T776 F777	S73-V773 WeakPolarHBondContact OG-CG1 3.27Å; I769-V773 WeakPolarHBondContact O-CG2 3.28Å; I769-V773 PolarHBondContact O-N 3.4Å; G770-V773 WeakPolarHBondContact O-CB 3.36Å; G770-V773 WeakPolarHBondContact O-CG2 3.32Å; G770-V773 PolarHBondContact O-N 2.92Å; T771-V773 VanDerWaalsContact C-N 3.27Å; T771-V773 PolarHBondContact O-N 2.61Å; V773-D775 VanDerWaalsContact C-N 3.31Å; V773-D775 PolarHBondContact O-N 3.2Å; V773-T776 PolarHBondContact O-N 2.6Å; V773-T776 VanDerWaalsContact O-N 3.15Å; V773-T776 PolarHBondContact O-OG1 3.45Å; V773-F777 HydrophobicContact CG1-CD2 3.72Å; V773-F777 HydrophobicContact CG1-CE2 3.27Å; V773-F777 HydrophobicContact CG1-CZ 4.26Å; V773-F777 VanDerWaalsContact O-CD2 3.27Å; V773-F777 WeakPolarHBondContact O-CD2 3.34Å; V773-F777 PolarHBondContact O-N 3.49Å
774	P	86	Confident	89	Confident	16 Å²	16	21.2 Å²	21.2	10%	0.104	11%	0.11	C	C	.	.	H	α-helix	trans	-58.8	-39.8	174.6	-22.7	36	0	0	0	113	A76 T771 T776 F777 A778	A76-P774 HydrophobicContact CB-CB 4.16Å; A76-P774 HydrophobicContact CB-CG 3.97Å; T771-P774 WeakPolarHBondContact O-CD 3.42Å; P774-T776 VanDerWaalsContact C-N 3.35Å; P774-F777 PolarHBondContact O-N 3.16Å; P774-A778 VanDerWaalsContact O-CB 3.25Å; P774-A778 WeakPolarHBondContact O-CB 3.44Å; P774-A778 PolarHBondContact O-N 2.84Å
775	D	89	Confident	88	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-63.4	-39.1	175.6	-97.2	-32.4	0	0	0	111.9	S124 N158 I162 S772 V773 S779 N795 S799	S124-D775 WeakPolarHBondContact CB-OD1 3.03Å; S124-D775 PolarHBondContact OG-OD1 3.22Å; N158-D775 PolarHBondContact ND2-OD2 2.79Å; I162-D775 HydrophobicContact CD1-CB 3.73Å; S772-D775 WeakPolarHBondContact O-CB 3.24Å; S772-D775 PolarHBondContact O-N 3.14Å; S772-D775 VanDerWaalsContact O-N 3.11Å; V773-D775 VanDerWaalsContact C-N 3.31Å; V773-D775 PolarHBondContact O-N 3.2Å; D775-S779 WeakPolarHBondContact O-CB 3.45Å; D775-S779 PolarHBondContact O-N 2.87Å; D775-S779 PolarHBondContact O-OG 3.15Å; D775-N795 PolarHBondContact OD1-ND2 2.96Å; D775-S799 PolarHBondContact OD1-OG 3.38Å; D775-S799 VanDerWaalsContact OD1-OG 3.09Å
776	T	89.3	Confident	87.2	Confident	16 Å²	16	24 Å²	24	10%	0.098	12%	0.123	C	C	.	.	H	α-helix	trans	-61.2	-48.4	179	69.2	0	0	0	0	111	F157 I162 S772 V773 P774 S779 H780	F157-T776 HydrophobicContact CD1-CG2 4.41Å; F157-T776 HydrophobicContact CE1-CG2 3.41Å; F157-T776 VanDerWaalsContact CE1-CG2 3.41Å; F157-T776 HydrophobicContact CZ-CG2 4.06Å; I162-T776 HydrophobicContact CD1-CG2 3.66Å; I162-T776 HydrophobicContact CG1-CG2 3.59Å; S772-T776 VanDerWaalsContact O-CG2 3.27Å; S772-T776 WeakPolarHBondContact O-CG2 3.24Å; S772-T776 PolarHBondContact O-N 3.03Å; V773-T776 PolarHBondContact O-N 2.6Å; V773-T776 VanDerWaalsContact O-N 3.15Å; V773-T776 PolarHBondContact O-OG1 3.45Å; P774-T776 VanDerWaalsContact C-N 3.35Å; T776-S779 PolarHBondContact O-N 3.11Å; T776-H780 WeakPolarHBondContact O-CB 3.47Å; T776-H780 PolarHBondContact O-N 2.95Å
777	F	83	Confident	86.5	Confident	64 Å²	64	27.6 Å²	27.6	28%	0.281	14%	0.138	S	C	.	.	H	α-helix	trans	-71.7	-41	-177.1	-68.4	-52.3	0	0	0	111.7	A339 L343 V773 P774 S779 V781	A339-F777 HydrophobicContact CB-CB 4.45Å; L343-F777 HydrophobicContact CD1-CD1 3.64Å; L343-F777 HydrophobicContact CD1-CD2 3.99Å; L343-F777 HydrophobicContact CD1-CE1 3.24Å; L343-F777 HydrophobicContact CD1-CE2 3.55Å; L343-F777 HydrophobicContact CD1-CG 4.03Å; L343-F777 HydrophobicContact CD1-CZ 3.19Å; L343-F777 HydrophobicContact CG-CE1 4.44Å; V773-F777 HydrophobicContact CG1-CD2 3.72Å; V773-F777 HydrophobicContact CG1-CE2 3.27Å; V773-F777 HydrophobicContact CG1-CZ 4.26Å; V773-F777 VanDerWaalsContact O-CD2 3.27Å; V773-F777 WeakPolarHBondContact O-CD2 3.34Å; V773-F777 PolarHBondContact O-N 3.49Å; P774-F777 PolarHBondContact O-N 3.16Å; F777-S779 VanDerWaalsContact C-N 3.3Å; F777-S779 PolarHBondContact O-N 2.9Å; F777-V781 WeakPolarHBondContact O-CB 3.08Å; F777-V781 WeakPolarHBondContact O-CG2 3.27Å; F777-V781 PolarHBondContact O-N 2.95Å
778	A	80.5	Confident	86	Confident	5 Å²	5	32.3 Å²	32.3	4%	0.041	16%	0.157	C	C	.	.	H	α-helix	trans	-59.2	-42.8	176.8	0	0	0	0	0	111.9	R336 P774 A782	R336-A778 HydrophobicContact CG-CB 3.91Å; P774-A778 VanDerWaalsContact O-CB 3.25Å; P774-A778 WeakPolarHBondContact O-CB 3.44Å; P774-A778 PolarHBondContact O-N 2.84Å; A778-A782 VanDerWaalsContact O-CB 3.26Å; A778-A782 WeakPolarHBondContact O-CB 3.22Å; A778-A782 PolarHBondContact O-N 3.15Å
779	S	88.3	Confident	85.6	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-77.7	-42.6	-178.7	-52.5	0	0	0	0	112.2	C166 D775 T776 F777 V781 A782 A783 S792 N795	C166-S779 VanDerWaalsContact SG-C 3.55Å; D775-S779 WeakPolarHBondContact O-CB 3.45Å; D775-S779 PolarHBondContact O-N 2.87Å; D775-S779 PolarHBondContact O-OG 3.15Å; T776-S779 PolarHBondContact O-N 3.11Å; F777-S779 VanDerWaalsContact C-N 3.3Å; F777-S779 PolarHBondContact O-N 2.9Å; S779-V781 PolarHBondContact O-N 3Å; S779-A782 PolarHBondContact O-N 3.41Å; S779-A783 WeakPolarHBondContact O-CB 3.34Å; S779-A783 PolarHBondContact O-N 3.37Å; S779-S792 VanDerWaalsContact O-CB 3.25Å; S779-S792 WeakPolarHBondContact O-CB 3.34Å; S779-N795 PolarHBondContact OG-ND2 3.25Å
780	H	86.8	Confident	85.1	Confident	56 Å²	56	30.1 Å²	30.1	26%	0.259	15%	0.146	S	C	.	.	H	α-helix	trans	-59	-47.3	177.5	169.8	-93.6	0	0	0	111.7	I165 A169 T776 A783 I784	I165-H780 HydrophobicContact CG2-CB 4.27Å; A169-H780 VanDerWaalsContact CB-CD2 3.46Å; A169-H780 WeakPolarHBondContact CB-CD2 3.35Å; T776-H780 WeakPolarHBondContact O-CB 3.47Å; T776-H780 PolarHBondContact O-N 2.95Å; H780-A783 WeakPolarHBondContact O-CB 3.26Å; H780-A783 PolarHBondContact O-N 3.37Å; H780-I784 WeakPolarHBondContact CE1-CD1 3.37Å; H780-I784 WeakPolarHBondContact NE2-CD1 3.46Å; H780-I784 PolarHBondContact O-N 2.82Å; H780-I784 VanDerWaalsContact O-N 3.17Å
781	V	78.1	Confident	84.5	Confident	17 Å²	17	30.5 Å²	30.5	10%	0.103	15%	0.148	C	C	.	.	H	α-helix	trans	-73.4	-36.7	-177.2	173.5	0	0	0	0	112.1	Y335 A339 F777 S779 A783 I784 Q785	Y335-V781 VanDerWaalsContact O-CG1 3.31Å; Y335-V781 WeakPolarHBondContact O-CG1 3.37Å; A339-V781 HydrophobicContact CB-CB 3.83Å; A339-V781 HydrophobicContact CB-CG1 4.11Å; A339-V781 HydrophobicContact CB-CG2 3.23Å; F777-V781 WeakPolarHBondContact O-CB 3.08Å; F777-V781 WeakPolarHBondContact O-CG2 3.27Å; F777-V781 PolarHBondContact O-N 2.95Å; S779-V781 PolarHBondContact O-N 3Å; V781-A783 VanDerWaalsContact C-N 3.28Å; V781-A783 PolarHBondContact O-N 3.11Å; V781-I784 PolarHBondContact O-N 2.86Å; V781-Q785 HydrophobicContact CG1-CG 4.26Å; V781-Q785 WeakPolarHBondContact O-CB 3.29Å; V781-Q785 PolarHBondContact O-N 2.82Å
782	A	81.3	Confident	84.2	Confident	8 Å²	8	30.4 Å²	30.4	7%	0.066	15%	0.148	C	C	.	.	H	α-helix	trans	-57.4	-41.4	168.7	0	0	0	0	0	111.8	A778 S779 I784 D786	A778-A782 VanDerWaalsContact O-CB 3.26Å; A778-A782 WeakPolarHBondContact O-CB 3.22Å; A778-A782 PolarHBondContact O-N 3.15Å; S779-A782 PolarHBondContact O-N 3.41Å; A782-I784 PolarHBondContact O-N 3.12Å; A782-D786 VanDerWaalsContact O-CB 3.26Å; A782-D786 WeakPolarHBondContact O-CB 3.26Å; A782-D786 PolarHBondContact O-N 3.09Å
783	A	87.5	Confident	84.1	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.8	-40.7	179.1	0	0	0	0	0	113.1	C166 I170 S779 H780 V781 L863	C166-A783 HydrophobicContact CB-CB 4Å; I170-A783 HydrophobicContact CD1-CB 4.05Å; I170-A783 WeakPolarHBondContact CD1-O 3.39Å; S779-A783 WeakPolarHBondContact O-CB 3.34Å; S779-A783 PolarHBondContact O-N 3.37Å; H780-A783 WeakPolarHBondContact O-CB 3.26Å; H780-A783 PolarHBondContact O-N 3.37Å; V781-A783 VanDerWaalsContact C-N 3.28Å; V781-A783 PolarHBondContact O-N 3.11Å; A783-L863 HydrophobicContact CB-CD1 3.99Å
784	I	84.5	Confident	83.8	Confident	65 Å²	65	29.4 Å²	29.4	33%	0.333	14%	0.142	S	C	.	.	H	α-helix	trans	-71.5	-47.2	-179.5	-67.7	176.2	0	0	0	111.3	A169 R176 H780 V781 A782	A169-I784 HydrophobicContact CB-CD1 4.16Å; A169-I784 HydrophobicContact CB-CG1 3.94Å; R176-I784 PolarHBondContact NH2-O 2.78Å; H780-I784 WeakPolarHBondContact CE1-CD1 3.37Å; H780-I784 WeakPolarHBondContact NE2-CD1 3.46Å; H780-I784 PolarHBondContact O-N 2.82Å; H780-I784 VanDerWaalsContact O-N 3.17Å; V781-I784 PolarHBondContact O-N 2.86Å; A782-I784 PolarHBondContact O-N 3.12Å
785	Q	74.2	Confident	83.7	Confident	55 Å²	55	28.9 Å²	28.9	26%	0.257	14%	0.138	S	C	.	.	H	α-helix	trans	-89.2	-29	-165.9	-67.3	178	-35.1	0	0	113.5	Y335 V781	Y335-Q785 HydrophobicContact CD1-CB 4.07Å; Y335-Q785 HydrophobicContact CD1-CG 4.3Å; Y335-Q785 HydrophobicContact CE1-CB 3.96Å; Y335-Q785 HydrophobicContact CE1-CG 4.4Å; Y335-Q785 HydrophobicContact CG-CB 4.39Å; V781-Q785 HydrophobicContact CG1-CG 4.26Å; V781-Q785 WeakPolarHBondContact O-CB 3.29Å; V781-Q785 PolarHBondContact O-N 2.82Å
786	D	77.3	Confident	83.8	Confident	26 Å²	26	28.9 Å²	28.9	14%	0.139	14%	0.138	C	C	.	.	S	Bend	trans	-83.4	143.3	177.5	-70.7	-20.8	0	0	0	111.7	R176 A782 Y788 S791	R176-D786 VanDerWaalsContact CD-O 3.23Å; R176-D786 WeakPolarHBondContact CD-O 3.5Å; R176-D786 PolarHBondContact NE-O 3.3Å; A782-D786 VanDerWaalsContact O-CB 3.26Å; A782-D786 WeakPolarHBondContact O-CB 3.26Å; A782-D786 PolarHBondContact O-N 3.09Å; D786-Y788 PolarHBondContact O-N 3.44Å; D786-S791 WeakPolarHBondContact OD2-CB 3.37Å; D786-S791 PolarHBondContact OD2-OG 2.85Å
787	K	78.9	Confident	83.8	Confident	150 Å²	150	28.2 Å²	28.2	65%	0.652	13%	0.133	S	C	*	.	S	Bend	trans	-67.7	-23.8	176.3	-171.3	176.1	-179.1	178.2	0	112.8	R176	R176-K787 VanDerWaalsContact CD-O 3.25Å; R176-K787 WeakPolarHBondContact CD-O 3.44Å
788	Y	85.9	Confident	84	Confident	99 Å²	99	25.2 Å²	25.2	39%	0.388	12%	0.121	S	C	.	.	B	Isolated β-bridge	trans	-120.7	158.2	-175.7	-56.3	-72.9	0	0	0	111.1	K177 L179 D786 D790	K177-Y788 WeakPolarHBondContact O-CA 3.28Å; K177-Y788 WeakPolarHBondContact O-CB 3.49Å; L179-Y788 HydrophobicContact CB-CD1 4.1Å; L179-Y788 HydrophobicContact CB-CE1 4.42Å; L179-Y788 HydrophobicContact CB-CG 4.3Å; L179-Y788 HydrophobicContact CD1-CE1 4.23Å; L179-Y788 HydrophobicContact CD2-CE1 4.42Å; L179-Y788 HydrophobicContact CD2-CE2 4.26Å; D786-Y788 PolarHBondContact O-N 3.44Å; Y788-D790 VanDerWaalsContact C-N 3.3Å; Y788-D790 VanDerWaalsContact CB-OD2 3.3Å; Y788-D790 WeakPolarHBondContact CB-OD2 3.32Å; Y788-D790 PolarHBondContact O-N 2.67Å
789	A	86.7	Confident	84.5	Confident	0 Å²	0	25 Å²	25	0%	0	12%	0.119	C	C	.	.	S	Bend	trans	-83.3	-4.1	-179	0	0	0	0	0	113.7	R176 K177 S791 S792 I793 L863	R176-A789 HydrophobicContact CB-CB 4.03Å; K177-A789 PolarHBondContact O-N 3.49Å; A789-S791 VanDerWaalsContact C-N 3.26Å; A789-S791 PolarHBondContact O-N 2.82Å; A789-S792 PolarHBondContact O-N 2.89Å; A789-S792 PolarHBondContact O-OG 2.78Å; A789-I793 HydrophobicContact CB-CD1 3.81Å; A789-I793 HydrophobicContact CB-CG1 4.37Å; A789-I793 PolarHBondContact O-N 2.76Å; A789-L863 HydrophobicContact CB-CD1 3.77Å; A789-L863 HydrophobicContact CB-CG 3.95Å
790	D	83.8	Confident	84.6	Confident	16 Å²	16	25 Å²	25	9%	0.086	12%	0.119	C	C	.	.	H	α-helix	trans	-54.4	-42.6	-174.7	-63.8	-84.6	0	0	0	112.2	Q178 L179 H180 Y788 T794	Q178-D790 HydrophobicContact CG-CB 4.32Å; Q178-D790 WeakPolarHBondContact CG-OD1 3.49Å; L179-D790 WeakPolarHBondContact CB-OD2 3.42Å; L179-D790 PolarHBondContact N-OD1 2.91Å; L179-D790 PolarHBondContact N-OD2 2.89Å; H180-D790 WeakPolarHBondContact CB-OD1 3.45Å; H180-D790 IonicContact CD2-OD1 3.53Å; H180-D790 IonicContact CG-OD1 3.97Å; H180-D790 PolarHBondContact N-OD1 2.98Å; Y788-D790 VanDerWaalsContact C-N 3.3Å; Y788-D790 VanDerWaalsContact CB-OD2 3.3Å; Y788-D790 WeakPolarHBondContact CB-OD2 3.32Å; Y788-D790 PolarHBondContact O-N 2.67Å; D790-T794 WeakPolarHBondContact O-CB 3.4Å; D790-T794 PolarHBondContact O-N 2.9Å; D790-T794 PolarHBondContact O-OG1 3.31Å
791	S	79.5	Confident	84.9	Confident	12 Å²	12	22.5 Å²	22.5	8%	0.084	11%	0.108	C	C	.	.	H	α-helix	trans	-71.3	-42.7	-172.6	-63	0	0	0	0	114	R332 D786 A789 N795	R332-S791 VanDerWaalsContact CZ-CA 3.44Å; R332-S791 VanDerWaalsContact CZ-OG 3.24Å; R332-S791 PolarHBondContact NE-OG 2.86Å; R332-S791 PolarHBondContact NH1-OG 3.5Å; R332-S791 PolarHBondContact NH2-O 2.9Å; D786-S791 WeakPolarHBondContact OD2-CB 3.37Å; D786-S791 PolarHBondContact OD2-OG 2.85Å; A789-S791 VanDerWaalsContact C-N 3.26Å; A789-S791 PolarHBondContact O-N 2.82Å; S791-N795 VanDerWaalsContact O-CB 3.25Å; S791-N795 WeakPolarHBondContact O-CB 3.32Å; S791-N795 PolarHBondContact O-N 3.06Å
792	S	86.4	Confident	85.6	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-74.5	-46.2	-178.1	50.4	0	0	0	0	111.5	S779 A789 N795 V796 L863	S779-S792 VanDerWaalsContact O-CB 3.25Å; S779-S792 WeakPolarHBondContact O-CB 3.34Å; A789-S792 PolarHBondContact O-N 2.89Å; A789-S792 PolarHBondContact O-OG 2.78Å; S792-N795 PolarHBondContact O-N 3.41Å; S792-V796 PolarHBondContact O-N 2.85Å; S792-L863 VanDerWaalsContact OG-CD1 3.31Å; S792-L863 WeakPolarHBondContact OG-CD1 3.34Å
793	I	89.4	Confident	86.1	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-72.3	-40.9	-178.1	-60.3	178.1	0	0	0	111.5	L163 F184 A789 N795 V796 T797 L851 E862 L863	L163-I793 HydrophobicContact CD2-CG1 4.13Å; F184-I793 HydrophobicContact CD2-CG2 3.85Å; F184-I793 HydrophobicContact CE2-CG2 3.31Å; F184-I793 HydrophobicContact CZ-CG2 4.14Å; A789-I793 HydrophobicContact CB-CD1 3.81Å; A789-I793 HydrophobicContact CB-CG1 4.37Å; A789-I793 PolarHBondContact O-N 2.76Å; I793-N795 VanDerWaalsContact C-N 3.26Å; I793-N795 PolarHBondContact O-N 2.64Å; I793-V796 PolarHBondContact O-N 3.24Å; I793-T797 PolarHBondContact O-N 2.96Å; I793-T797 PolarHBondContact O-OG1 3.49Å; I793-L851 HydrophobicContact CG2-CD1 4.44Å; I793-E862 HydrophobicContact CD1-CB 3.81Å; I793-E862 HydrophobicContact CD1-CG 4.35Å; I793-L863 HydrophobicContact CD1-CD2 4.28Å; I793-L863 HydrophobicContact CD1-CG 4.32Å; I793-L863 HydrophobicContact CG1-CD2 4.44Å
794	T	84.6	Confident	86.5	Confident	13 Å²	13	21.5 Å²	21.5	8%	0.08	10%	0.101	C	C	.	.	H	α-helix	trans	-69.9	-26.9	177.3	-48.7	0	0	0	0	111.4	L117 Q178 T187 D790 T797 G798	L117-T794 HydrophobicContact CD2-CG2 4.28Å; Q178-T794 PolarHBondContact NE2-OG1 3.3Å; T187-T794 HydrophobicContact CG2-CG2 4.29Å; D790-T794 WeakPolarHBondContact O-CB 3.4Å; D790-T794 PolarHBondContact O-N 2.9Å; D790-T794 PolarHBondContact O-OG1 3.31Å; T794-T797 WeakPolarHBondContact CA-OG1 3.29Å; T794-G798 WeakPolarHBondContact O-CA 3.35Å; T794-G798 PolarHBondContact O-N 3.48Å
795	N	83.8	Confident	87	Confident	5 Å²	5	18.4 Å²	18.4	3%	0.027	9%	0.086	C	C	.	.	H	α-helix	trans	-62.7	-55.1	170.8	-172.3	68.2	0	0	0	110.4	R336 D775 S779 S791 S792 I793 T797 G798 S799	R336-N795 VanDerWaalsContact NH2-CG 3.26Å; R336-N795 PolarHBondContact NH2-OD1 2.81Å; D775-N795 PolarHBondContact OD1-ND2 2.96Å; S779-N795 PolarHBondContact OG-ND2 3.25Å; S791-N795 VanDerWaalsContact O-CB 3.25Å; S791-N795 WeakPolarHBondContact O-CB 3.32Å; S791-N795 PolarHBondContact O-N 3.06Å; S792-N795 PolarHBondContact O-N 3.41Å; I793-N795 VanDerWaalsContact C-N 3.26Å; I793-N795 PolarHBondContact O-N 2.64Å; N795-T797 PolarHBondContact O-N 3.31Å; N795-G798 PolarHBondContact O-N 2.84Å; N795-S799 WeakPolarHBondContact O-CB 3.36Å; N795-S799 PolarHBondContact O-N 3.22Å; N795-S799 PolarHBondContact O-OG 3.39Å
796	V	89.7	Confident	88	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-56.1	-52.1	179.6	168.3	0	0	0	0	111.9	N158 M159 I162 L163 S792 I793 N800	N158-V796 HydrophobicContact CB-CG1 4.2Å; N158-V796 WeakPolarHBondContact O-CG1 3.3Å; M159-V796 HydrophobicContact SD-CG1 4.13Å; I162-V796 HydrophobicContact CB-CG2 4.29Å; I162-V796 HydrophobicContact CG2-CG2 3.83Å; L163-V796 HydrophobicContact CD1-CG1 4.46Å; L163-V796 HydrophobicContact CD2-CB 4.38Å; L163-V796 HydrophobicContact CD2-CG1 4.44Å; L163-V796 HydrophobicContact CD2-CG2 4.13Å; L163-V796 HydrophobicContact CG-CG1 4.2Å; L163-V796 HydrophobicContact CG-CG2 4.49Å; S792-V796 PolarHBondContact O-N 2.85Å; I793-V796 PolarHBondContact O-N 3.24Å; V796-N800 VanDerWaalsContact O-CG 3.27Å; V796-N800 PolarHBondContact O-N 2.89Å; V796-N800 VanDerWaalsContact O-N 3.14Å; V796-N800 PolarHBondContact O-OD1 2.86Å
797	T	89.2	Confident	88.7	Confident	1 Å²	1	15.5 Å²	15.5	1%	0.006	7%	0.072	C	C	.	.	H	α-helix	trans	-69.1	-36	-178.4	51.6	0	0	0	0	112.7	F184 S191 I793 T794 N795 A801	F184-T797 HydrophobicContact CE2-CG2 4.3Å; S191-T797 VanDerWaalsContact CB-O 3.26Å; S191-T797 WeakPolarHBondContact CB-O 3.06Å; I793-T797 PolarHBondContact O-N 2.96Å; I793-T797 PolarHBondContact O-OG1 3.49Å; T794-T797 WeakPolarHBondContact CA-OG1 3.29Å; N795-T797 PolarHBondContact O-N 3.31Å; T797-A801 PolarHBondContact O-N 2.96Å
798	G	88.1	Confident	89.4	Confident	2 Å²	2	8.4 Å²	8.4	2%	0.021	4%	0.041	C	C	.	.	H	α-helix	trans	-63.5	-52.4	174.4	0	0	0	0	0	112.1	T794 N795 N800 A801 V802	T794-G798 WeakPolarHBondContact O-CA 3.35Å; T794-G798 PolarHBondContact O-N 3.48Å; N795-G798 PolarHBondContact O-N 2.84Å; G798-N800 VanDerWaalsContact C-N 3.27Å; G798-N800 PolarHBondContact O-N 3.03Å; G798-A801 PolarHBondContact O-N 2.83Å; G798-A801 VanDerWaalsContact O-N 3.16Å; G798-V802 WeakPolarHBondContact O-CG2 3.46Å; G798-V802 PolarHBondContact O-N 3.41Å
799	S	89.7	Confident	89.9	Confident	0 Å²	0	3.7 Å²	3.7	0%	0	2%	0.022	C	C	.	.	H	α-helix	trans	-52.9	-44.7	176.3	-62.3	0	0	0	0	111.4	S124 S125 D775 N795 A801 V802 N803	S124-S799 PolarHBondContact OG-OG 2.99Å; S125-S799 WeakPolarHBondContact OG-CB 3.19Å; D775-S799 PolarHBondContact OD1-OG 3.38Å; D775-S799 VanDerWaalsContact OD1-OG 3.09Å; N795-S799 WeakPolarHBondContact O-CB 3.36Å; N795-S799 PolarHBondContact O-N 3.22Å; N795-S799 PolarHBondContact O-OG 3.39Å; S799-A801 PolarHBondContact O-N 2.74Å; S799-V802 PolarHBondContact O-N 2.85Å; S799-N803 VanDerWaalsContact O-CG 3.24Å; S799-N803 PolarHBondContact O-N 3.02Å; S799-N803 PolarHBondContact O-OD1 2.97Å
800	N	91.9	Very high	90.3	Very high	0 Å²	0	6 Å²	6	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-62.1	-39.8	-179.5	-72.9	5.3	0	0	0	113.4	A155 N158 Y195 V796 G798	A155-N800 WeakPolarHBondContact CA-OD1 3.15Å; A155-N800 PolarHBondContact O-ND2 2.83Å; N158-N800 WeakPolarHBondContact CB-OD1 3.38Å; Y195-N800 HydrophobicContact CE2-CB 4.18Å; Y195-N800 WeakPolarHBondContact CE2-O 3.23Å; Y195-N800 PolarHBondContact OH-O 3.39Å; V796-N800 VanDerWaalsContact O-CG 3.27Å; V796-N800 PolarHBondContact O-N 2.89Å; V796-N800 VanDerWaalsContact O-N 3.14Å; V796-N800 PolarHBondContact O-OD1 2.86Å; G798-N800 VanDerWaalsContact C-N 3.27Å; G798-N800 PolarHBondContact O-N 3.03Å
801	A	92.3	Very high	90.9	Very high	4 Å²	4	5.3 Å²	5.3	3%	0.033	3%	0.031	C	C	.	.	H	α-helix	trans	-69.3	-41	175.8	0	0	0	0	0	111.5	T797 G798 S799 V804 F805	T797-A801 PolarHBondContact O-N 2.96Å; G798-A801 PolarHBondContact O-N 2.83Å; G798-A801 VanDerWaalsContact O-N 3.16Å; S799-A801 PolarHBondContact O-N 2.74Å; A801-V804 PolarHBondContact O-N 3.03Å; A801-F805 HydrophobicContact CB-CD2 4.27Å; A801-F805 HydrophobicContact CB-CE2 4.24Å; A801-F805 VanDerWaalsContact O-CD2 3.27Å; A801-F805 WeakPolarHBondContact O-CD2 3.45Å; A801-F805 PolarHBondContact O-N 3.32Å
802	V	92.8	Very high	91.6	Very high	4 Å²	4	4.9 Å²	4.9	2%	0.024	3%	0.027	C	C	.	.	H	α-helix	trans	-65.5	-40.1	178.9	177.9	0	0	0	0	111.4	L117 A121 I129 F222 G798 S799 V804 L806 G807	L117-V802 WeakPolarHBondContact O-CG2 3.14Å; A121-V802 HydrophobicContact CB-CB 4.46Å; A121-V802 HydrophobicContact CB-CG2 3.83Å; I129-V802 HydrophobicContact CD1-CG1 3.95Å; F222-V802 HydrophobicContact CD2-CG2 4.1Å; F222-V802 HydrophobicContact CE2-CG1 4.4Å; F222-V802 HydrophobicContact CE2-CG2 3.65Å; G798-V802 WeakPolarHBondContact O-CG2 3.46Å; G798-V802 PolarHBondContact O-N 3.41Å; S799-V802 PolarHBondContact O-N 2.85Å; V802-V804 VanDerWaalsContact C-N 3.29Å; V802-V804 PolarHBondContact O-N 2.88Å; V802-L806 HydrophobicContact CG1-CB 3.95Å; V802-L806 HydrophobicContact CG1-CD2 3.99Å; V802-L806 WeakPolarHBondContact O-CA 3.35Å; V802-L806 VanDerWaalsContact O-CB 3.23Å; V802-L806 WeakPolarHBondContact O-CB 3.46Å; V802-L806 PolarHBondContact O-N 2.67Å; V802-G807 PolarHBondContact O-N 3.33Å
803	N	92.9	Very high	92.1	Very high	0 Å²	0	5.8 Å²	5.8	0%	0	3%	0.033	C	C	.	.	I	π-helix	trans	-53.9	-45.4	177.6	-73.9	-5.9	0	0	0	112.2	S125 I151 S799 G807 I808	S125-N803 WeakPolarHBondContact CB-OD1 3.42Å; S125-N803 PolarHBondContact OG-OD1 2.85Å; I151-N803 HydrophobicContact CG1-CB 4.49Å; I151-N803 HydrophobicContact CG2-CB 3.84Å; S799-N803 VanDerWaalsContact O-CG 3.24Å; S799-N803 PolarHBondContact O-N 3.02Å; S799-N803 PolarHBondContact O-OD1 2.97Å; N803-G807 CarbonylContact O-C 3.29Å; N803-G807 WeakPolarHBondContact O-CA 3.4Å; N803-G807 PolarHBondContact O-N 3.39Å; N803-I808 PolarHBondContact O-N 2.68Å; N803-I808 VanDerWaalsContact O-N 3.14Å
804	V	95	Very high	92.4	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.048	C	C	.	.	I	π-helix	trans	-79.1	-55	-179.7	177.3	0	0	0	0	111.3	I151 A194 Y195 L198 T218 A801 V802 L806 I808 G809	I151-V804 HydrophobicContact CG2-CG2 4.23Å; A194-V804 HydrophobicContact CB-CB 3.86Å; A194-V804 HydrophobicContact CB-CG1 4.07Å; A194-V804 HydrophobicContact CB-CG2 4.26Å; A194-V804 WeakPolarHBondContact O-CG1 3.5Å; Y195-V804 HydrophobicContact CD1-CG2 3.95Å; Y195-V804 HydrophobicContact CD2-CG2 4.11Å; Y195-V804 HydrophobicContact CE1-CG2 3.52Å; Y195-V804 HydrophobicContact CE2-CG2 3.7Å; Y195-V804 HydrophobicContact CG-CG2 4.21Å; L198-V804 HydrophobicContact CB-CG1 4.37Å; T218-V804 HydrophobicContact CG2-CG1 4.4Å; A801-V804 PolarHBondContact O-N 3.03Å; V802-V804 VanDerWaalsContact C-N 3.29Å; V802-V804 PolarHBondContact O-N 2.88Å; V804-L806 PolarHBondContact O-N 2.96Å; V804-I808 WeakPolarHBondContact O-CB 3.47Å; V804-I808 PolarHBondContact O-N 3.25Å; V804-G809 PolarHBondContact O-N 3.11Å
805	F	95.2	Very high	92.9	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.044	C	C	.	.	I	π-helix	trans	-67.2	-39.3	-173	-63.1	-42.6	0	0	0	112.6	W190 F193 A194 T218 F219 M221 F222 T225 A801 G809	W190-F805 AromaticContact CE3-CE2 3.69Å; W190-F805 HydrophobicContact CE3-CE2 3.69Å; W190-F805 AromaticContact CE3-CZ 3.63Å; W190-F805 HydrophobicContact CE3-CZ 3.63Å; W190-F805 HydrophobicContact CZ3-CE2 4.31Å; W190-F805 AromaticContact CZ3-CZ 3.99Å; W190-F805 HydrophobicContact CZ3-CZ 3.99Å; F193-F805 HydrophobicContact CD1-CZ 4.12Å; A194-F805 HydrophobicContact CB-CD1 4.27Å; A194-F805 HydrophobicContact CB-CD2 4.35Å; A194-F805 HydrophobicContact CB-CE1 3.67Å; A194-F805 HydrophobicContact CB-CE2 3.76Å; A194-F805 HydrophobicContact CB-CZ 3.37Å; T218-F805 HydrophobicContact CG2-CD1 4.24Å; T218-F805 WeakPolarHBondContact O-CA 3.47Å; T218-F805 WeakPolarHBondContact O-CB 3.23Å; T218-F805 WeakPolarHBondContact O-CD1 3.25Å; F219-F805 WeakPolarHBondContact CA-O 3.41Å; M221-F805 HydrophobicContact CB-CD1 3.56Å; M221-F805 HydrophobicContact CB-CD2 4.4Å; M221-F805 HydrophobicContact CB-CE1 3.6Å; M221-F805 HydrophobicContact CB-CE2 4.42Å; M221-F805 HydrophobicContact CB-CG 4Å; M221-F805 HydrophobicContact CB-CZ 4.05Å; M221-F805 HydrophobicContact CG-CE1 4.27Å; F222-F805 HydrophobicContact CB-CB 3.66Å; T225-F805 VanDerWaalsContact OG1-CE2 3.31Å; T225-F805 WeakPolarHBondContact OG1-CE2 3.31Å; A801-F805 HydrophobicContact CB-CD2 4.27Å; A801-F805 HydrophobicContact CB-CE2 4.24Å; A801-F805 VanDerWaalsContact O-CD2 3.27Å; A801-F805 WeakPolarHBondContact O-CD2 3.45Å; A801-F805 PolarHBondContact O-N 3.32Å; F805-G809 WeakPolarHBondContact O-CA 3.48Å
806	L	94.4	Very high	93.5	Very high	20 Å²	20	8 Å²	8	11%	0.105	4%	0.044	C	C	.	.	I	π-helix	trans	-92.1	-47.7	178.1	-175.3	59.2	0	0	0	112	L122 I129 F219 F222 V802 V804 L810	L122-L806 HydrophobicContact CD1-CD2 3.7Å; I129-L806 HydrophobicContact CD1-CD2 4.16Å; I129-L806 HydrophobicContact CD1-CG 4.4Å; F219-L806 HydrophobicContact CD2-CD1 4.11Å; F219-L806 HydrophobicContact CE2-CD1 3.57Å; F222-L806 HydrophobicContact CE1-CD2 4.36Å; V802-L806 HydrophobicContact CG1-CB 3.95Å; V802-L806 HydrophobicContact CG1-CD2 3.99Å; V802-L806 WeakPolarHBondContact O-CA 3.35Å; V802-L806 VanDerWaalsContact O-CB 3.23Å; V802-L806 WeakPolarHBondContact O-CB 3.46Å; V802-L806 PolarHBondContact O-N 2.67Å; V804-L806 PolarHBondContact O-N 2.96Å; L806-L810 HydrophobicContact CD1-CB 4.49Å; L806-L810 HydrophobicContact CD1-CD2 4.36Å; L806-L810 WeakPolarHBondContact O-CB 3.13Å; L806-L810 PolarHBondContact O-N 3.27Å
807	G	93	Very high	93.8	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	7%	0.065	C	C	.	.	I	π-helix	trans	-66.3	-67.3	-177.2	0	0	0	0	0	112.7	V802 N803 A811	V802-G807 PolarHBondContact O-N 3.33Å; N803-G807 CarbonylContact O-C 3.29Å; N803-G807 WeakPolarHBondContact O-CA 3.4Å; N803-G807 PolarHBondContact O-N 3.39Å; G807-A811 VanDerWaalsContact O-CB 3.26Å; G807-A811 WeakPolarHBondContact O-CB 3.37Å; G807-A811 PolarHBondContact O-N 2.84Å
808	I	94.1	Very high	94.2	Very high	1 Å²	1	16 Å²	16	1%	0.005	8%	0.083	C	C	.	.	I	π-helix	trans	-65	-47.7	178	-63.8	-177	0	0	0	110.6	I151 L198 N803 V804 L810 A811 W812	I151-I808 HydrophobicContact CB-CD1 4.37Å; I151-I808 HydrophobicContact CB-CG1 4.47Å; I151-I808 HydrophobicContact CD1-CD1 4.35Å; I151-I808 HydrophobicContact CD1-CG1 3.54Å; I151-I808 HydrophobicContact CG2-CD1 3.8Å; I151-I808 HydrophobicContact CG2-CG1 4.1Å; L198-I808 HydrophobicContact CD1-CD1 3.96Å; L198-I808 HydrophobicContact CD1-CG2 4.06Å; L198-I808 HydrophobicContact CD2-CD1 3.63Å; L198-I808 HydrophobicContact CG-CD1 4.47Å; N803-I808 PolarHBondContact O-N 2.68Å; N803-I808 VanDerWaalsContact O-N 3.14Å; V804-I808 WeakPolarHBondContact O-CB 3.47Å; V804-I808 PolarHBondContact O-N 3.25Å; I808-L810 PolarHBondContact O-N 3.17Å; I808-A811 PolarHBondContact O-N 2.97Å; I808-W812 HydrophobicContact CG2-CD2 3.21Å; I808-W812 VanDerWaalsContact CG2-CE2 3.44Å; I808-W812 HydrophobicContact CG2-CE3 3.18Å; I808-W812 HydrophobicContact CG2-CG 3.91Å; I808-W812 HydrophobicContact CG2-CH2 3.69Å; I808-W812 HydrophobicContact CG2-CZ2 3.67Å; I808-W812 HydrophobicContact CG2-CZ3 3.44Å; I808-W812 VanDerWaalsContact CG2-CZ3 3.44Å; I808-W812 VanDerWaalsContact O-CB 3.29Å; I808-W812 WeakPolarHBondContact O-CB 3.18Å; I808-W812 PolarHBondContact O-N 3.47Å
809	G	95.5	Very high	94.5	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-57.6	-45.7	-176.9	0	0	0	0	0	113.4	V804 F805 T813	V804-G809 PolarHBondContact O-N 3.11Å; F805-G809 WeakPolarHBondContact O-CA 3.48Å; G809-T813 VanDerWaalsContact O-CB 3.28Å; G809-T813 WeakPolarHBondContact O-CB 3.4Å; G809-T813 PolarHBondContact O-N 3.09Å; G809-T813 PolarHBondContact O-OG1 3.28Å
810	L	95.4	Very high	94.7	Very high	48 Å²	48	19 Å²	19	25%	0.251	11%	0.106	S	C	.	.	H	α-helix	trans	-68.9	-47.4	177.6	-177.8	58.2	0	0	0	111.7	I133 F219 L806 I808 W812 T813 I814	I133-L810 HydrophobicContact CD1-CD2 3.84Å; I133-L810 HydrophobicContact CD1-CG 4.4Å; F219-L810 HydrophobicContact CD2-CB 4.28Å; F219-L810 HydrophobicContact CE1-CD1 4.48Å; F219-L810 HydrophobicContact CE2-CB 4.44Å; F219-L810 HydrophobicContact CE2-CD1 4.3Å; F219-L810 HydrophobicContact CZ-CD1 4.24Å; L806-L810 HydrophobicContact CD1-CB 4.49Å; L806-L810 HydrophobicContact CD1-CD2 4.36Å; L806-L810 WeakPolarHBondContact O-CB 3.13Å; L806-L810 PolarHBondContact O-N 3.27Å; I808-L810 PolarHBondContact O-N 3.17Å; L810-W812 PolarHBondContact O-N 2.99Å; L810-T813 PolarHBondContact O-N 2.81Å; L810-I814 HydrophobicContact CD1-CD1 4.04Å; L810-I814 HydrophobicContact CD1-CG1 4.36Å; L810-I814 HydrophobicContact CG-CD1 4Å; L810-I814 VanDerWaalsContact O-CG1 3.3Å; L810-I814 WeakPolarHBondContact O-CG1 3.36Å; L810-I814 PolarHBondContact O-N 2.88Å
811	A	95.5	Very high	94.9	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.008	14%	0.143	C	C	.	.	H	α-helix	trans	-62.7	-43.7	-176.4	0	0	0	0	0	111.4	I133 I136 G807 I808 I814 A815	I133-A811 HydrophobicContact CG1-CB 3.95Å; I136-A811 HydrophobicContact CD1-CB 3.71Å; G807-A811 VanDerWaalsContact O-CB 3.26Å; G807-A811 WeakPolarHBondContact O-CB 3.37Å; G807-A811 PolarHBondContact O-N 2.84Å; I808-A811 PolarHBondContact O-N 2.97Å; A811-I814 PolarHBondContact O-N 3.45Å; A811-A815 PolarHBondContact O-N 3.29Å; A811-A815 VanDerWaalsContact O-N 3.1Å
812	W	95.7	Very high	95	Very high	3 Å²	3	32.5 Å²	32.5	1%	0.011	16%	0.164	C	C	.	.	H	α-helix	trans	-73	-32.9	177	-68.4	-2.4	0	0	0	113.2	I136 P148 L198 I201 L202 I210 I808 L810 I814 A815 A816 F826 V828 L833	I136-W812 VanDerWaalsContact CD1-CD1 3.48Å; P148-W812 HydrophobicContact CG-CZ2 4.39Å; L198-W812 HydrophobicContact CD1-CE3 4.48Å; L198-W812 HydrophobicContact CD1-CH2 3.37Å; L198-W812 HydrophobicContact CD1-CZ2 4.47Å; L198-W812 HydrophobicContact CD1-CZ3 3.38Å; I201-W812 HydrophobicContact CD1-CE3 4.03Å; I201-W812 HydrophobicContact CD1-CZ3 3.63Å; I201-W812 HydrophobicContact CG1-CZ3 4.26Å; L202-W812 HydrophobicContact CD1-CH2 4.24Å; L202-W812 HydrophobicContact CD2-CH2 3.79Å; L202-W812 HydrophobicContact CD2-CZ3 4.31Å; L202-W812 HydrophobicContact CG-CH2 4.16Å; I210-W812 HydrophobicContact CD1-CD2 3.46Å; I210-W812 VanDerWaalsContact CD1-CD2 3.46Å; I210-W812 HydrophobicContact CD1-CE3 3.08Å; I210-W812 HydrophobicContact CD1-CG 4.23Å; I210-W812 HydrophobicContact CD1-CH2 3.68Å; I210-W812 HydrophobicContact CD1-CZ2 4.04Å; I210-W812 HydrophobicContact CD1-CZ3 3.19Å; I210-W812 HydrophobicContact CG1-CE3 4.47Å; I210-W812 HydrophobicContact CG2-CE3 4.45Å; I808-W812 HydrophobicContact CG2-CD2 3.21Å; I808-W812 VanDerWaalsContact CG2-CE2 3.44Å; I808-W812 HydrophobicContact CG2-CE3 3.18Å; I808-W812 HydrophobicContact CG2-CG 3.91Å; I808-W812 HydrophobicContact CG2-CH2 3.69Å; I808-W812 HydrophobicContact CG2-CZ2 3.67Å; I808-W812 HydrophobicContact CG2-CZ3 3.44Å; I808-W812 VanDerWaalsContact CG2-CZ3 3.44Å; I808-W812 VanDerWaalsContact O-CB 3.29Å; I808-W812 WeakPolarHBondContact O-CB 3.18Å; I808-W812 PolarHBondContact O-N 3.47Å; L810-W812 PolarHBondContact O-N 2.99Å; W812-I814 VanDerWaalsContact C-N 3.33Å; W812-I814 PolarHBondContact O-N 2.87Å; W812-A815 PolarHBondContact O-N 3.04Å; W812-A816 WeakPolarHBondContact O-CB 3.25Å; W812-A816 PolarHBondContact O-N 3.36Å; W812-F826 HydrophobicContact CB-CE1 3.98Å; W812-F826 AromaticContact CD1-CE1 3.69Å; W812-F826 AromaticContact CD1-CZ 3.83Å; W812-F826 HydrophobicContact CD2-CE1 4.41Å; W812-F826 AromaticContact CG-CE1 3.79Å; W812-F826 HydrophobicContact CG-CE1 3.79Å; W812-F826 HydrophobicContact CG-CZ 4.38Å; W812-V828 HydrophobicContact CH2-CG1 4.34Å; W812-V828 HydrophobicContact CZ2-CG1 3.95Å; W812-L833 HydrophobicContact CH2-CD2 4.35Å; W812-L833 HydrophobicContact CZ2-CD2 4.36Å
813	T	96.4	Very high	95	Very high	19 Å²	19	35.8 Å²	35.8	12%	0.117	20%	0.199	C	C	.	.	H	α-helix	trans	-60.2	-45.9	171.1	-60.4	0	0	0	0	110.7	G215 L216 G809 L810 V817	G215-T813 PolarHBondContact O-OG1 2.83Å; L216-T813 HydrophobicContact CD1-CG2 4.33Å; L216-T813 PolarHBondContact N-OG1 2.64Å; G809-T813 VanDerWaalsContact O-CB 3.28Å; G809-T813 WeakPolarHBondContact O-CB 3.4Å; G809-T813 PolarHBondContact O-N 3.09Å; G809-T813 PolarHBondContact O-OG1 3.28Å; L810-T813 PolarHBondContact O-N 2.81Å; T813-V817 HydrophobicContact CG2-CG2 4.35Å; T813-V817 WeakPolarHBondContact O-CB 3.48Å; T813-V817 VanDerWaalsContact O-CG2 3.22Å; T813-V817 WeakPolarHBondContact O-CG2 3.34Å; T813-V817 PolarHBondContact O-N 3.39Å
814	I	95.6	Very high	94.9	Very high	61 Å²	61	40 Å²	40	31%	0.313	22%	0.222	S	C	.	.	H	α-helix	trans	-61.2	-47.5	179.3	-67.5	165.4	0	0	0	110.4	F141 L810 A811 W812 Y818	F141-I814 HydrophobicContact CD1-CG2 4.13Å; F141-I814 HydrophobicContact CE1-CG2 3.72Å; L810-I814 HydrophobicContact CD1-CD1 4.04Å; L810-I814 HydrophobicContact CD1-CG1 4.36Å; L810-I814 HydrophobicContact CG-CD1 4Å; L810-I814 VanDerWaalsContact O-CG1 3.3Å; L810-I814 WeakPolarHBondContact O-CG1 3.36Å; L810-I814 PolarHBondContact O-N 2.88Å; A811-I814 PolarHBondContact O-N 3.45Å; W812-I814 VanDerWaalsContact C-N 3.33Å; W812-I814 PolarHBondContact O-N 2.87Å; I814-Y818 WeakPolarHBondContact O-CB 3.45Å; I814-Y818 PolarHBondContact O-N 2.81Å; I814-Y818 VanDerWaalsContact O-N 3.08Å
815	A	95.7	Very high	94.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.9	-48.3	179.2	0	0	0	0	0	112.6	I136 A811 W812 V817 Y818 H819 F826	I136-A815 HydrophobicContact CD1-CB 4.5Å; I136-A815 HydrophobicContact CG2-CB 3.7Å; A811-A815 PolarHBondContact O-N 3.29Å; A811-A815 VanDerWaalsContact O-N 3.1Å; W812-A815 PolarHBondContact O-N 3.04Å; A815-V817 VanDerWaalsContact C-N 3.33Å; A815-V817 PolarHBondContact O-N 3.03Å; A815-Y818 WeakPolarHBondContact O-CB 3.43Å; A815-Y818 PolarHBondContact O-N 2.94Å; A815-H819 PolarHBondContact O-CD2 2.8Å; A815-H819 VanDerWaalsContact O-CD2 3.24Å; A815-H819 PolarHBondContact O-N 2.76Å; A815-F826 HydrophobicContact CB-CD1 4.01Å; A815-F826 HydrophobicContact CB-CD2 3.7Å; A815-F826 HydrophobicContact CB-CE1 3.88Å; A815-F826 HydrophobicContact CB-CE2 3.51Å; A815-F826 HydrophobicContact CB-CG 3.96Å; A815-F826 HydrophobicContact CB-CZ 3.63Å
816	A	95.7	Very high	94.8	Very high	3 Å²	3	45.4 Å²	45.4	3%	0.025	25%	0.247	C	C	.	.	H	α-helix	trans	-62.3	-40.6	-179.1	0	0	0	0	0	111.6	V212 W812 A820 F826	V212-A816 HydrophobicContact CG2-CB 4.08Å; W812-A816 WeakPolarHBondContact O-CB 3.25Å; W812-A816 PolarHBondContact O-N 3.36Å; A816-A820 WeakPolarHBondContact O-CB 3.04Å; A816-A820 PolarHBondContact O-N 2.77Å; A816-F826 HydrophobicContact CB-CB 4.34Å; A816-F826 HydrophobicContact CB-CD1 4.33Å
817	V	96.1	Very high	94.6	Very high	74 Å²	74	52 Å²	52	45%	0.448	27%	0.27	S	S	.	.	H	α-helix	trans	-64.6	-41.7	175.3	170.6	0	0	0	0	111.4	V212 T813 A815 Y821	V212-V817 HydrophobicContact CG1-CG2 3.81Å; T813-V817 HydrophobicContact CG2-CG2 4.35Å; T813-V817 WeakPolarHBondContact O-CB 3.48Å; T813-V817 VanDerWaalsContact O-CG2 3.22Å; T813-V817 WeakPolarHBondContact O-CG2 3.34Å; T813-V817 PolarHBondContact O-N 3.39Å; A815-V817 VanDerWaalsContact C-N 3.33Å; A815-V817 PolarHBondContact O-N 3.03Å; V817-Y821 WeakPolarHBondContact O-CB 3.29Å; V817-Y821 PolarHBondContact O-N 2.8Å
818	Y	96.3	Very high	94.4	Very high	95 Å²	95	52.3 Å²	52.3	37%	0.373	27%	0.272	S	S	.	.	H	α-helix	trans	-62.3	-48.7	177.4	174.3	-94.3	0	0	0	112.1	F141 I814 A815 Y821 N822	F141-Y818 HydrophobicContact CB-CD1 3.5Å; F141-Y818 HydrophobicContact CB-CE1 3.96Å; F141-Y818 HydrophobicContact CB-CG 4.08Å; F141-Y818 HydrophobicContact CD1-CD1 4.41Å; F141-Y818 HydrophobicContact CD1-CG 4.14Å; F141-Y818 AromaticContact CD2-CD1 3.46Å; F141-Y818 HydrophobicContact CD2-CD1 3.46Å; F141-Y818 VanDerWaalsContact CD2-CD1 3.46Å; F141-Y818 AromaticContact CD2-CD2 3.71Å; F141-Y818 HydrophobicContact CD2-CD2 3.71Å; F141-Y818 AromaticContact CD2-CE1 3.46Å; F141-Y818 HydrophobicContact CD2-CE1 3.46Å; F141-Y818 VanDerWaalsContact CD2-CE1 3.46Å; F141-Y818 AromaticContact CD2-CE2 3.71Å; F141-Y818 HydrophobicContact CD2-CE2 3.71Å; F141-Y818 AromaticContact CD2-CG 3.57Å; F141-Y818 HydrophobicContact CD2-CG 3.57Å; F141-Y818 AromaticContact CD2-CZ 3.57Å; F141-Y818 HydrophobicContact CE2-CD1 4.29Å; F141-Y818 AromaticContact CE2-CD2 3.67Å; F141-Y818 HydrophobicContact CE2-CD2 3.67Å; F141-Y818 HydrophobicContact CE2-CE1 4.27Å; F141-Y818 AromaticContact CE2-CE2 3.65Å; F141-Y818 HydrophobicContact CE2-CE2 3.65Å; F141-Y818 AromaticContact CE2-CG 3.99Å; F141-Y818 HydrophobicContact CE2-CG 3.99Å; F141-Y818 AromaticContact CE2-CZ 3.95Å; F141-Y818 AromaticContact CG-CD1 3.54Å; F141-Y818 HydrophobicContact CG-CD1 3.54Å; F141-Y818 HydrophobicContact CG-CD2 4.22Å; F141-Y818 AromaticContact CG-CE1 3.97Å; F141-Y818 HydrophobicContact CG-CE1 3.97Å; F141-Y818 AromaticContact CG-CG 3.66Å; F141-Y818 HydrophobicContact CG-CG 3.66Å; F141-Y818 HydrophobicContact CZ-CD2 4.15Å; F141-Y818 HydrophobicContact CZ-CG 4.44Å; I814-Y818 WeakPolarHBondContact O-CB 3.45Å; I814-Y818 PolarHBondContact O-N 2.81Å; I814-Y818 VanDerWaalsContact O-N 3.08Å; A815-Y818 WeakPolarHBondContact O-CB 3.43Å; A815-Y818 PolarHBondContact O-N 2.94Å; Y818-Y821 PolarHBondContact O-N 3Å; Y818-N822 WeakPolarHBondContact CE1-ND2 3.38Å; Y818-N822 WeakPolarHBondContact CE2-ND2 3.37Å; Y818-N822 PolarHBondContact O-N 3.16Å; Y818-N822 VanDerWaalsContact O-N 3.14Å; Y818-N822 PolarHBondContact O-ND2 2.85Å
819	H	95.8	Very high	93.9	Very high	11 Å²	11	59.6 Å²	59.6	5%	0.051	31%	0.306	C	S	.	.	H	α-helix	trans	-64.3	-44.9	177.7	-79	-67.7	0	0	0	111.7	F141 A815 Y821 N822 G823 D824 F826	F141-H819 PolarHBondContact O-CD2 2.9Å; F141-H819 PolarHBondContact O-NE2 2.79Å; A815-H819 PolarHBondContact O-CD2 2.8Å; A815-H819 VanDerWaalsContact O-CD2 3.24Å; A815-H819 PolarHBondContact O-N 2.76Å; H819-Y821 VanDerWaalsContact C-N 3.3Å; H819-Y821 PolarHBondContact O-N 2.97Å; H819-N822 CarbonylContact O-C 3.45Å; H819-N822 WeakPolarHBondContact O-CA 3.4Å; H819-N822 PolarHBondContact O-N 3.19Å; H819-G823 PolarHBondContact O-N 2.84Å; H819-D824 CarbonylContact C-O 3.53Å; H819-D824 HydrophobicContact CB-CB 4.4Å; H819-D824 WeakPolarHBondContact CB-O 3.49Å; H819-D824 IonicContact ND1-OD2 2.78Å; H819-D824 PolarHBondContact O-N 3.46Å; H819-D824 VanDerWaalsContact O-O 3.1Å; H819-F826 HydrophobicContact CB-CB 4.22Å; H819-F826 AromaticContact CD2-CD2 3.64Å; H819-F826 AromaticContact NE2-CD2 3.95Å
820	A	94	Very high	93	Very high	56 Å²	56	60.7 Å²	60.7	46%	0.463	32%	0.315	S	S	.	.	H	α-helix	trans	-60.8	-37.6	176.3	0	0	0	0	0	112.8	V212 A816 N822 G823	V212-A820 HydrophobicContact CG2-CB 3.58Å; A816-A820 WeakPolarHBondContact O-CB 3.04Å; A816-A820 PolarHBondContact O-N 2.77Å; A820-N822 VanDerWaalsContact C-N 3.3Å; A820-N822 PolarHBondContact O-N 2.81Å; A820-G823 PolarHBondContact O-N 2.83Å
821	Y	95	Very high	92.2	Very high	199 Å²	199	60.7 Å²	60.7	78%	0.78	33%	0.326	S	S	*	.	H	α-helix	trans	-65.4	-34.4	174.8	-178.6	-96.7	0	0	0	112.3	V817 Y818 H819 G823	V817-Y821 WeakPolarHBondContact O-CB 3.29Å; V817-Y821 PolarHBondContact O-N 2.8Å; Y818-Y821 PolarHBondContact O-N 3Å; H819-Y821 VanDerWaalsContact C-N 3.3Å; H819-Y821 PolarHBondContact O-N 2.97Å; Y821-G823 VanDerWaalsContact C-N 3.34Å
822	N	94.6	Very high	91.8	Very high	87 Å²	87	62.4 Å²	62.4	47%	0.465	34%	0.337	S	S	.	.	H	α-helix	trans	-86.2	-3.5	177.3	-66.8	-30.6	0	0	0	113.8	Y818 H819 A820	Y818-N822 WeakPolarHBondContact CE1-ND2 3.38Å; Y818-N822 WeakPolarHBondContact CE2-ND2 3.37Å; Y818-N822 PolarHBondContact O-N 3.16Å; Y818-N822 VanDerWaalsContact O-N 3.14Å; Y818-N822 PolarHBondContact O-ND2 2.85Å; H819-N822 CarbonylContact O-C 3.45Å; H819-N822 WeakPolarHBondContact O-CA 3.4Å; H819-N822 PolarHBondContact O-N 3.19Å; A820-N822 VanDerWaalsContact C-N 3.3Å; A820-N822 PolarHBondContact O-N 2.81Å
823	G	92.2	Very high	91.4	Very high	74 Å²	74	62.5 Å²	62.5	76%	0.763	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.8	22.5	-176.9	0	0	0	0	0	114.3	H819 A820 Y821	H819-G823 PolarHBondContact O-N 2.84Å; A820-G823 PolarHBondContact O-N 2.83Å; Y821-G823 VanDerWaalsContact C-N 3.34Å
824	D	92.4	Very high	91.1	Very high	89 Å²	89	62 Å²	62	48%	0.476	34%	0.336	S	S	.	.			trans	-109.6	166.5	174.7	-158.3	2.8	0	0	0	110.8	H819	H819-D824 CarbonylContact C-O 3.53Å; H819-D824 HydrophobicContact CB-CB 4.4Å; H819-D824 WeakPolarHBondContact CB-O 3.49Å; H819-D824 IonicContact ND1-OD2 2.78Å; H819-D824 PolarHBondContact O-N 3.46Å; H819-D824 VanDerWaalsContact O-O 3.1Å
825	E	92.5	Very high	90.9	Very high	108 Å²	108	59.7 Å²	59.7	51%	0.505	32%	0.323	S	S	.	.			trans	-103.6	132.8	179.1	-70.9	174.9	171.1	0	0	110.7	V209 R827	V209-E825 HydrophobicContact CG1-CB 3.94Å; V209-E825 HydrophobicContact CG1-CG 4.36Å; E825-R827 PolarHBondContact O-N 3.14Å; E825-R827 VanDerWaalsContact O-N 3.11Å; E825-R827 IonicContact OE2-NH2 3.94Å
826	F	94.5	Very high	90.7	Very high	5 Å²	5	59.8 Å²	59.8	2%	0.022	32%	0.324	C	S	.	.			trans	-77.8	101.6	175.3	179.6	-129	0	0	0	110.5	I136 A143 V209 I210 W812 A815 A816 H819 V828	I136-F826 HydrophobicContact CD1-CZ 4.26Å; A143-F826 HydrophobicContact CB-CE2 3.83Å; A143-F826 HydrophobicContact CB-CZ 3.87Å; V209-F826 WeakPolarHBondContact CA-O 3.47Å; I210-F826 HydrophobicContact CB-CD1 3.83Å; I210-F826 HydrophobicContact CB-CE1 4.32Å; I210-F826 HydrophobicContact CD1-CE1 4.2Å; I210-F826 HydrophobicContact CG1-CD1 4.5Å; I210-F826 HydrophobicContact CG2-CD1 4.39Å; I210-F826 PolarHBondContact N-O 2.8Å; W812-F826 HydrophobicContact CB-CE1 3.98Å; W812-F826 AromaticContact CD1-CE1 3.69Å; W812-F826 AromaticContact CD1-CZ 3.83Å; W812-F826 HydrophobicContact CD2-CE1 4.41Å; W812-F826 AromaticContact CG-CE1 3.79Å; W812-F826 HydrophobicContact CG-CE1 3.79Å; W812-F826 HydrophobicContact CG-CZ 4.38Å; A815-F826 HydrophobicContact CB-CD1 4.01Å; A815-F826 HydrophobicContact CB-CD2 3.7Å; A815-F826 HydrophobicContact CB-CE1 3.88Å; A815-F826 HydrophobicContact CB-CE2 3.51Å; A815-F826 HydrophobicContact CB-CG 3.96Å; A815-F826 HydrophobicContact CB-CZ 3.63Å; A816-F826 HydrophobicContact CB-CB 4.34Å; A816-F826 HydrophobicContact CB-CD1 4.33Å; H819-F826 HydrophobicContact CB-CB 4.22Å; H819-F826 AromaticContact CD2-CD2 3.64Å; H819-F826 AromaticContact NE2-CD2 3.95Å; F826-V828 HydrophobicContact CD1-CG2 4.03Å; F826-V828 HydrophobicContact CE1-CG2 3.47Å; F826-V828 VanDerWaalsContact CE1-CG2 3.47Å; F826-V828 HydrophobicContact CE2-CG2 4.21Å; F826-V828 HydrophobicContact CZ-CG2 3.57Å
827	R	90.9	Very high	90.6	Very high	158 Å²	158	59.7 Å²	59.7	60%	0.596	32%	0.323	S	S	*	.	B	Isolated β-bridge	trans	-89.9	128.7	-176.6	-64.3	178.9	-179.6	-179.8	1.7	111.8	G208 V209 E825	G208-R827 WeakPolarHBondContact O-CA 3.39Å; V209-R827 HydrophobicContact CG2-CG 4.3Å; E825-R827 PolarHBondContact O-N 3.14Å; E825-R827 VanDerWaalsContact O-N 3.11Å; E825-R827 IonicContact OE2-NH2 3.94Å
828	V	89.5	Confident	90.4	Very high	6 Å²	6	57.8 Å²	57.8	4%	0.036	31%	0.311	C	S	.	.			trans	-131.8	117.8	176.8	-173.3	0	0	0	0	108.9	A143 L202 G208 I210 W812 F826 A830	A143-V828 HydrophobicContact CB-CB 4.37Å; A143-V828 HydrophobicContact CB-CG1 4.31Å; A143-V828 HydrophobicContact CB-CG2 3.81Å; L202-V828 HydrophobicContact CD2-CB 4.13Å; L202-V828 HydrophobicContact CD2-CG1 3.73Å; G208-V828 CarbonylContact C-O 3.58Å; G208-V828 VanDerWaalsContact CA-O 3.3Å; G208-V828 WeakPolarHBondContact CA-O 3.3Å; G208-V828 PolarHBondContact O-N 3.23Å; I210-V828 HydrophobicContact CD1-CB 3.85Å; I210-V828 HydrophobicContact CD1-CG1 4.36Å; I210-V828 HydrophobicContact CD1-CG2 3.39Å; I210-V828 HydrophobicContact CG1-CB 4.12Å; I210-V828 HydrophobicContact CG1-CG2 3.74Å; W812-V828 HydrophobicContact CH2-CG1 4.34Å; W812-V828 HydrophobicContact CZ2-CG1 3.95Å; F826-V828 HydrophobicContact CD1-CG2 4.03Å; F826-V828 HydrophobicContact CE1-CG2 3.47Å; F826-V828 VanDerWaalsContact CE1-CG2 3.47Å; F826-V828 HydrophobicContact CE2-CG2 4.21Å; F826-V828 HydrophobicContact CZ-CG2 3.57Å; V828-A830 PolarHBondContact O-N 2.83Å
829	H	82.2	Confident	90.3	Very high	155 Å²	155	54.3 Å²	54.3	72%	0.718	30%	0.299	S	S	*	.			trans	-72	121.3	179.8	-66.7	-63	0	0	0	110.9
830	A	77.1	Confident	90.3	Very high	23 Å²	23	54 Å²	54	19%	0.19	30%	0.297	C	S	.	.			trans	-70.3	-39.9	-178	0	0	0	0	0	113.1	L202 V828 T832 L833 A834	L202-A830 HydrophobicContact CB-CB 4.04Å; V828-A830 PolarHBondContact O-N 2.83Å; A830-T832 PolarHBondContact O-N 2.78Å; A830-L833 PolarHBondContact O-N 3.34Å; A830-A834 HydrophobicContact CB-CB 4.18Å; A830-A834 WeakPolarHBondContact O-CB 3.22Å; A830-A834 PolarHBondContact O-N 3.41Å
831	G	79.6	Confident	90.3	Very high	48 Å²	48	52 Å²	52	50%	0.495	28%	0.28	S	S	.	.	H	α-helix	trans	-29.3	-85	-163.1	0	0	0	0	0	117	L833 A834 F835	G831-L833 VanDerWaalsContact C-N 3.34Å; G831-L833 PolarHBondContact O-N 2.87Å; G831-A834 PolarHBondContact O-N 2.83Å; G831-F835 PolarHBondContact O-N 2.95Å; G831-F835 VanDerWaalsContact O-N 3.15Å
832	T	85.3	Confident	90.3	Very high	37 Å²	37	47 Å²	47	23%	0.227	27%	0.27	C	S	.	.	H	α-helix	trans	-65.3	-37.4	-174.1	56.5	0	0	0	0	112.7	A830 S836 E891	A830-T832 PolarHBondContact O-N 2.78Å; T832-S836 WeakPolarHBondContact O-CB 3.35Å; T832-S836 PolarHBondContact O-N 3.18Å; T832-E891 WeakPolarHBondContact CA-OE2 3.49Å; T832-E891 WeakPolarHBondContact CG2-OE2 3.39Å
833	L	88.2	Confident	90.3	Very high	5 Å²	5	43.6 Å²	43.6	3%	0.026	25%	0.251	C	S	.	.	H	α-helix	trans	-66.8	-47.3	-179.4	-178	60.9	0	0	0	111.7	P148 V152 L202 W812 A830 G831 F835 S836 V837	P148-L833 HydrophobicContact CB-CD1 4.02Å; P148-L833 HydrophobicContact CB-CD2 3.74Å; V152-L833 HydrophobicContact CG2-CD1 3.75Å; L202-L833 HydrophobicContact CD1-CD2 3.59Å; L202-L833 HydrophobicContact CD1-CG 3.89Å; W812-L833 HydrophobicContact CH2-CD2 4.35Å; W812-L833 HydrophobicContact CZ2-CD2 4.36Å; A830-L833 PolarHBondContact O-N 3.34Å; G831-L833 VanDerWaalsContact C-N 3.34Å; G831-L833 PolarHBondContact O-N 2.87Å; L833-F835 VanDerWaalsContact C-N 3.35Å; L833-F835 PolarHBondContact O-N 2.79Å; L833-S836 PolarHBondContact O-N 2.88Å; L833-V837 HydrophobicContact CD1-CG2 4.42Å; L833-V837 WeakPolarHBondContact O-CB 3.32Å; L833-V837 WeakPolarHBondContact O-CG2 3.38Å; L833-V837 PolarHBondContact O-N 2.85Å
834	A	90	Very high	90.4	Very high	9 Å²	9	40.1 Å²	40.1	7%	0.074	22%	0.216	C	C	.	.	H	α-helix	trans	-65.8	-38.2	179.6	0	0	0	0	0	111.6	Y199 A830 G831 T838	Y199-A834 HydrophobicContact CD2-CB 4.04Å; Y199-A834 HydrophobicContact CE2-CB 4.26Å; A830-A834 HydrophobicContact CB-CB 4.18Å; A830-A834 WeakPolarHBondContact O-CB 3.22Å; A830-A834 PolarHBondContact O-N 3.41Å; G831-A834 PolarHBondContact O-N 2.83Å; A834-T838 WeakPolarHBondContact O-CB 3.35Å; A834-T838 PolarHBondContact O-N 3.49Å; A834-T838 PolarHBondContact O-OG1 2.9Å
835	F	91.1	Very high	90.4	Very high	12 Å²	12	39 Å²	39	5%	0.053	21%	0.212	C	C	.	.	H	α-helix	trans	-61.8	-51.6	172.8	-176.5	-94.8	0	0	0	111.2	G831 L833 V837 T838 I839 L887 E891 I896 F899	G831-F835 PolarHBondContact O-N 2.95Å; G831-F835 VanDerWaalsContact O-N 3.15Å; L833-F835 VanDerWaalsContact C-N 3.35Å; L833-F835 PolarHBondContact O-N 2.79Å; F835-V837 VanDerWaalsContact C-N 3.34Å; F835-V837 PolarHBondContact O-N 2.79Å; F835-T838 WeakPolarHBondContact O-CB 3.39Å; F835-T838 PolarHBondContact O-N 2.62Å; F835-T838 VanDerWaalsContact O-N 3.07Å; F835-I839 HydrophobicContact CD1-CG1 4.21Å; F835-I839 HydrophobicContact CE1-CD1 4.33Å; F835-I839 HydrophobicContact CE1-CG1 3.77Å; F835-I839 HydrophobicContact CE2-CD1 4.48Å; F835-I839 HydrophobicContact CZ-CD1 4.04Å; F835-I839 HydrophobicContact CZ-CG1 3.99Å; F835-I839 PolarHBondContact O-N 2.84Å; F835-I839 VanDerWaalsContact O-N 3.07Å; F835-L887 HydrophobicContact CE1-CB 4.24Å; F835-L887 WeakPolarHBondContact CE1-O 3.36Å; F835-E891 HydrophobicContact CB-CG 4.13Å; F835-E891 HydrophobicContact CD1-CB 3.59Å; F835-E891 HydrophobicContact CD1-CG 3.72Å; F835-E891 HydrophobicContact CD2-CB 4.47Å; F835-E891 HydrophobicContact CD2-CG 3.92Å; F835-E891 HydrophobicContact CE1-CB 3.58Å; F835-E891 HydrophobicContact CE1-CG 4.08Å; F835-E891 HydrophobicContact CE2-CB 4.47Å; F835-E891 HydrophobicContact CE2-CG 4.25Å; F835-E891 HydrophobicContact CG-CB 4.06Å; F835-E891 HydrophobicContact CG-CG 3.63Å; F835-E891 HydrophobicContact CZ-CB 4.05Å; F835-E891 HydrophobicContact CZ-CG 4.33Å; F835-I896 HydrophobicContact CE1-CD1 4.32Å; F835-I896 HydrophobicContact CZ-CD1 3.78Å; F835-F899 AromaticContact CD2-CD2 3.63Å; F835-F899 HydrophobicContact CD2-CD2 3.63Å; F835-F899 AromaticContact CD2-CE2 3.45Å; F835-F899 HydrophobicContact CD2-CE2 3.45Å; F835-F899 VanDerWaalsContact CD2-CE2 3.45Å; F835-F899 HydrophobicContact CD2-CZ 4.28Å; F835-F899 HydrophobicContact CE2-CD2 4.07Å; F835-F899 AromaticContact CE2-CE2 3.52Å; F835-F899 HydrophobicContact CE2-CE2 3.52Å; F835-F899 AromaticContact CE2-CZ 3.9Å; F835-F899 HydrophobicContact CE2-CZ 3.9Å
836	S	92.1	Very high	90.5	Very high	2 Å²	2	37 Å²	37	1%	0.014	21%	0.207	C	C	.	.	H	α-helix	trans	-58.3	-44.4	179.2	-171.9	0	0	0	0	112.4	T832 L833 T838 I839 F840 Y884 S888	T832-S836 WeakPolarHBondContact O-CB 3.35Å; T832-S836 PolarHBondContact O-N 3.18Å; L833-S836 PolarHBondContact O-N 2.88Å; S836-T838 VanDerWaalsContact C-N 3.3Å; S836-T838 PolarHBondContact O-N 2.98Å; S836-I839 PolarHBondContact O-N 2.9Å; S836-F840 WeakPolarHBondContact O-CB 3.46Å; S836-F840 PolarHBondContact O-N 2.92Å; S836-Y884 WeakPolarHBondContact OG-CE2 3.46Å; S836-Y884 PolarHBondContact OG-OH 3.29Å; S836-S888 PolarHBondContact OG-OG 3.2Å
837	V	93.6	Very high	90.5	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-58.9	-40.6	174.6	165.5	0	0	0	0	112	V152 Y195 L198 L833 F835 F840 C841	V152-V837 HydrophobicContact CG1-CG2 4.05Å; V152-V837 HydrophobicContact CG2-CG2 3.68Å; Y195-V837 WeakPolarHBondContact O-CG1 3.43Å; L198-V837 HydrophobicContact CD2-CG2 3.73Å; L198-V837 HydrophobicContact CG-CG2 4.32Å; L833-V837 HydrophobicContact CD1-CG2 4.42Å; L833-V837 WeakPolarHBondContact O-CB 3.32Å; L833-V837 WeakPolarHBondContact O-CG2 3.38Å; L833-V837 PolarHBondContact O-N 2.85Å; F835-V837 VanDerWaalsContact C-N 3.34Å; F835-V837 PolarHBondContact O-N 2.79Å; V837-F840 PolarHBondContact O-N 2.85Å; V837-C841 WeakPolarHBondContact O-CB 3.42Å; V837-C841 PolarHBondContact O-N 2.85Å; V837-C841 PolarHBondContact O-SG 3.49Å
838	T	92.7	Very high	90.5	Very high	34 Å²	34	30.3 Å²	30.3	21%	0.209	18%	0.183	C	C	.	.	H	α-helix	trans	-65.8	-48.4	-179.9	-59	0	0	0	0	111.1	A834 F835 S836 F840 C841 V842 F899	A834-T838 WeakPolarHBondContact O-CB 3.35Å; A834-T838 PolarHBondContact O-N 3.49Å; A834-T838 PolarHBondContact O-OG1 2.9Å; F835-T838 WeakPolarHBondContact O-CB 3.39Å; F835-T838 PolarHBondContact O-N 2.62Å; F835-T838 VanDerWaalsContact O-N 3.07Å; S836-T838 VanDerWaalsContact C-N 3.3Å; S836-T838 PolarHBondContact O-N 2.98Å; T838-F840 VanDerWaalsContact C-N 3.34Å; T838-F840 PolarHBondContact O-N 2.88Å; T838-C841 PolarHBondContact O-N 2.96Å; T838-V842 WeakPolarHBondContact O-CG2 3.25Å; T838-V842 PolarHBondContact O-N 3.22Å; T838-V842 VanDerWaalsContact O-N 3.15Å; T838-F899 HydrophobicContact CG2-CD2 4.49Å; T838-F899 HydrophobicContact CG2-CE2 3.9Å
839	I	94.1	Very high	90.6	Very high	23 Å²	23	34 Å²	34	12%	0.118	21%	0.205	C	C	.	.	H	α-helix	trans	-60.2	-46.6	176.9	-59.6	-55.9	0	0	0	110.2	F835 S836 C841 V842 E843 Y884 L887	F835-I839 HydrophobicContact CD1-CG1 4.21Å; F835-I839 HydrophobicContact CE1-CD1 4.33Å; F835-I839 HydrophobicContact CE1-CG1 3.77Å; F835-I839 HydrophobicContact CE2-CD1 4.48Å; F835-I839 HydrophobicContact CZ-CD1 4.04Å; F835-I839 HydrophobicContact CZ-CG1 3.99Å; F835-I839 PolarHBondContact O-N 2.84Å; F835-I839 VanDerWaalsContact O-N 3.07Å; S836-I839 PolarHBondContact O-N 2.9Å; I839-C841 PolarHBondContact O-N 2.88Å; I839-V842 PolarHBondContact O-N 2.99Å; I839-E843 HydrophobicContact CG2-CG 4.38Å; I839-E843 WeakPolarHBondContact O-CG 3.27Å; I839-E843 PolarHBondContact O-N 2.91Å; I839-Y884 HydrophobicContact CB-CD2 4.38Å; I839-Y884 HydrophobicContact CG2-CD2 4.03Å; I839-L887 HydrophobicContact CD1-CD1 4.13Å; I839-L887 HydrophobicContact CG2-CD1 4.3Å
840	F	95	Very high	91.2	Very high	3 Å²	3	28.5 Å²	28.5	1%	0.013	18%	0.181	C	C	.	.	H	α-helix	trans	-55.8	-48	176	169.6	-102.8	0	0	0	112.1	V152 A155 A156 M159 F160 Y195 S836 V837 T838 V842 E843 A844 Y884	V152-F840 HydrophobicContact CG1-CB 4.4Å; A155-F840 HydrophobicContact CB-CE1 4.44Å; A155-F840 HydrophobicContact CB-CE2 4.03Å; A155-F840 HydrophobicContact CB-CZ 3.91Å; A155-F840 WeakPolarHBondContact O-CE2 3.4Å; A156-F840 HydrophobicContact CB-CD2 3.86Å; A156-F840 HydrophobicContact CB-CE2 4.39Å; M159-F840 HydrophobicContact CB-CE2 3.99Å; M159-F840 HydrophobicContact CG-CE2 4.49Å; F160-F840 HydrophobicContact CE2-CD2 4.31Å; F160-F840 HydrophobicContact CZ-CD2 4.15Å; F160-F840 HydrophobicContact CZ-CE2 4.43Å; Y195-F840 AromaticContact CD1-CD1 3.72Å; Y195-F840 HydrophobicContact CD1-CD1 3.72Å; Y195-F840 AromaticContact CD1-CE1 3.76Å; Y195-F840 HydrophobicContact CD1-CE1 3.76Å; Y195-F840 HydrophobicContact CD2-CD1 4.17Å; Y195-F840 AromaticContact CD2-CE1 3.46Å; Y195-F840 HydrophobicContact CD2-CE1 3.46Å; Y195-F840 VanDerWaalsContact CD2-CE1 3.46Å; Y195-F840 HydrophobicContact CD2-CZ 4.36Å; Y195-F840 HydrophobicContact CE1-CD1 4.24Å; Y195-F840 HydrophobicContact CE1-CE1 4.02Å; Y195-F840 AromaticContact CE2-CE1 3.76Å; Y195-F840 HydrophobicContact CE2-CE1 3.76Å; Y195-F840 HydrophobicContact CE2-CZ 4.27Å; Y195-F840 AromaticContact CG-CD1 3.7Å; Y195-F840 HydrophobicContact CG-CD1 3.7Å; Y195-F840 AromaticContact CG-CE1 3.48Å; Y195-F840 HydrophobicContact CG-CE1 3.48Å; Y195-F840 VanDerWaalsContact CG-CE1 3.48Å; S836-F840 WeakPolarHBondContact O-CB 3.46Å; S836-F840 PolarHBondContact O-N 2.92Å; V837-F840 PolarHBondContact O-N 2.85Å; T838-F840 VanDerWaalsContact C-N 3.34Å; T838-F840 PolarHBondContact O-N 2.88Å; F840-V842 VanDerWaalsContact C-N 3.34Å; F840-V842 PolarHBondContact O-N 2.9Å; F840-E843 PolarHBondContact O-N 3.38Å; F840-A844 HydrophobicContact CD2-CB 4.42Å; F840-A844 HydrophobicContact CE1-CB 4.3Å; F840-A844 HydrophobicContact CE2-CB 4.04Å; F840-A844 HydrophobicContact CZ-CB 3.99Å; F840-A844 WeakPolarHBondContact O-CB 3.35Å; F840-A844 PolarHBondContact O-N 3.16Å; F840-Y884 HydrophobicContact CB-CD2 4.41Å; F840-Y884 HydrophobicContact CB-CE2 4.07Å
841	C	93.9	Very high	91.8	Very high	15 Å²	15	27.6 Å²	27.6	10%	0.101	17%	0.173	C	C	.	.	H	α-helix	trans	-61.2	-41.6	-178.7	-72	0	0	0	0	112.7	Y195 V837 T838 I839 T845	Y195-C841 VanDerWaalsContact CB-SG 3.52Å; V837-C841 WeakPolarHBondContact O-CB 3.42Å; V837-C841 PolarHBondContact O-N 2.85Å; V837-C841 PolarHBondContact O-SG 3.49Å; T838-C841 PolarHBondContact O-N 2.96Å; I839-C841 PolarHBondContact O-N 2.88Å; C841-T845 WeakPolarHBondContact O-CB 3.26Å; C841-T845 PolarHBondContact O-N 2.68Å; C841-T845 VanDerWaalsContact O-N 3.1Å; C841-T845 PolarHBondContact O-OG1 3.47Å
842	V	94	Very high	92.3	Very high	93 Å²	93	29.3 Å²	29.3	56%	0.564	17%	0.174	S	C	*	.	H	α-helix	trans	-63.8	-51.7	178	172.8	0	0	0	0	110.3	T838 I839 F840 T845 V846	T838-V842 WeakPolarHBondContact O-CG2 3.25Å; T838-V842 PolarHBondContact O-N 3.22Å; T838-V842 VanDerWaalsContact O-N 3.15Å; I839-V842 PolarHBondContact O-N 2.99Å; F840-V842 VanDerWaalsContact C-N 3.34Å; F840-V842 PolarHBondContact O-N 2.9Å; V842-T845 PolarHBondContact O-N 2.99Å; V842-V846 WeakPolarHBondContact O-CG2 3.41Å; V842-V846 PolarHBondContact O-N 3.02Å
843	E	95.7	Very high	92.5	Very high	16 Å²	16	31.8 Å²	31.8	8%	0.075	19%	0.188	C	C	.	.	H	α-helix	trans	-70.1	-35.9	-177.9	-67.2	-173.1	175.6	0	0	113	F160 I839 F840 T845 V846 C847 L880 V883 Y884	F160-E843 HydrophobicContact CE1-CB 4.04Å; F160-E843 HydrophobicContact CE2-CB 4.19Å; F160-E843 HydrophobicContact CZ-CB 3.47Å; F160-E843 VanDerWaalsContact CZ-CB 3.47Å; I839-E843 HydrophobicContact CG2-CG 4.38Å; I839-E843 WeakPolarHBondContact O-CG 3.27Å; I839-E843 PolarHBondContact O-N 2.91Å; F840-E843 PolarHBondContact O-N 3.38Å; E843-T845 VanDerWaalsContact C-N 3.31Å; E843-T845 PolarHBondContact O-N 3.13Å; E843-V846 WeakPolarHBondContact O-CB 3.25Å; E843-V846 PolarHBondContact O-N 2.81Å; E843-C847 PolarHBondContact O-N 2.84Å; E843-L880 HydrophobicContact CB-CD2 4.33Å; E843-L880 HydrophobicContact CG-CD2 4.04Å; E843-V883 WeakPolarHBondContact OE1-CG1 3.44Å; E843-Y884 WeakPolarHBondContact OE2-CB 3.27Å
844	A	94.3	Very high	92.7	Very high	2 Å²	2	31.8 Å²	31.8	2%	0.017	19%	0.188	C	C	.	.	H	α-helix	trans	-62.4	-39.6	174.4	0	0	0	0	0	111.4	M159 F840 C847 I848	M159-A844 HydrophobicContact CG-CB 4.2Å; F840-A844 HydrophobicContact CD2-CB 4.42Å; F840-A844 HydrophobicContact CE1-CB 4.3Å; F840-A844 HydrophobicContact CE2-CB 4.04Å; F840-A844 HydrophobicContact CZ-CB 3.99Å; F840-A844 WeakPolarHBondContact O-CB 3.35Å; F840-A844 PolarHBondContact O-N 3.16Å; A844-C847 WeakPolarHBondContact O-CB 3.26Å; A844-C847 PolarHBondContact O-N 2.77Å; A844-I848 WeakPolarHBondContact O-CG1 3.44Å; A844-I848 PolarHBondContact O-N 3.17Å
845	T	92.8	Very high	92.6	Very high	65 Å²	65	36.2 Å²	36.2	40%	0.399	20%	0.203	S	C	.	.	H	α-helix	trans	-62.5	-44.5	174.2	-58.4	0	0	0	0	110.9	C841 V842 E843 C847 I848 V849	C841-T845 WeakPolarHBondContact O-CB 3.26Å; C841-T845 PolarHBondContact O-N 2.68Å; C841-T845 VanDerWaalsContact O-N 3.1Å; C841-T845 PolarHBondContact O-OG1 3.47Å; V842-T845 PolarHBondContact O-N 2.99Å; E843-T845 VanDerWaalsContact C-N 3.31Å; E843-T845 PolarHBondContact O-N 3.13Å; T845-C847 VanDerWaalsContact C-N 3.34Å; T845-C847 PolarHBondContact O-N 2.84Å; T845-I848 PolarHBondContact O-N 3.32Å; T845-V849 VanDerWaalsContact O-CG2 3.31Å; T845-V849 WeakPolarHBondContact O-CG2 3.23Å; T845-V849 PolarHBondContact O-N 2.77Å
846	V	94.3	Very high	92.4	Very high	66 Å²	66	38.2 Å²	38.2	40%	0.4	22%	0.218	S	C	.	.	H	α-helix	trans	-59.7	-44.5	174.5	173.8	0	0	0	0	111.1	V842 E843 I848 V849 I850 L880	V842-V846 WeakPolarHBondContact O-CG2 3.41Å; V842-V846 PolarHBondContact O-N 3.02Å; E843-V846 WeakPolarHBondContact O-CB 3.25Å; E843-V846 PolarHBondContact O-N 2.81Å; V846-I848 PolarHBondContact O-N 2.79Å; V846-V849 PolarHBondContact O-N 2.63Å; V846-I850 HydrophobicContact CG1-CD1 3.85Å; V846-I850 HydrophobicContact CG1-CG1 4.49Å; V846-I850 VanDerWaalsContact O-CG1 3.31Å; V846-I850 WeakPolarHBondContact O-CG1 3.39Å; V846-I850 PolarHBondContact O-N 2.74Å; V846-L880 HydrophobicContact CG1-CD1 4.41Å
847	C	94.3	Very high	91.9	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-58.6	-46.8	177.1	-176.8	0	0	0	0	112	M159 F160 E843 A844 T845 V849 I850 L851 F877	M159-C847 HydrophobicContact CE-CB 4.27Å; M159-C847 HydrophobicContact CG-CB 4.45Å; M159-C847 PolarHBondContact O-SG 2.95Å; F160-C847 HydrophobicContact CD1-CB 4.2Å; F160-C847 HydrophobicContact CE1-CB 4.04Å; E843-C847 PolarHBondContact O-N 2.84Å; A844-C847 WeakPolarHBondContact O-CB 3.26Å; A844-C847 PolarHBondContact O-N 2.77Å; T845-C847 VanDerWaalsContact C-N 3.34Å; T845-C847 PolarHBondContact O-N 2.84Å; C847-V849 PolarHBondContact O-N 2.76Å; C847-I850 PolarHBondContact O-N 2.78Å; C847-L851 PolarHBondContact O-N 2.91Å; C847-F877 HydrophobicContact CB-CE1 4.2Å; C847-F877 VanDerWaalsContact SG-CE1 3.56Å; C847-F877 WeakPolarHBondContact SG-CZ 3.45Å
848	I	91.4	Very high	91.3	Very high	23 Å²	23	53.2 Å²	53.2	12%	0.118	30%	0.295	C	S	.	.	H	α-helix	trans	-63.8	-43.2	177.9	-69.3	165.4	0	0	0	111.1	M159 A188 I192 A844 T845 V846 I850 L851 V852	M159-I848 HydrophobicContact CE-CD1 3.65Å; M159-I848 HydrophobicContact CE-CG1 3.24Å; A188-I848 HydrophobicContact CB-CD1 4.27Å; I192-I848 HydrophobicContact CD1-CD1 3.36Å; I192-I848 HydrophobicContact CG1-CD1 3.86Å; A844-I848 WeakPolarHBondContact O-CG1 3.44Å; A844-I848 PolarHBondContact O-N 3.17Å; T845-I848 PolarHBondContact O-N 3.32Å; V846-I848 PolarHBondContact O-N 2.79Å; I848-I850 VanDerWaalsContact C-N 3.3Å; I848-I850 PolarHBondContact O-N 3.46Å; I848-L851 PolarHBondContact O-N 2.82Å; I848-V852 HydrophobicContact CG2-CG2 4.42Å; I848-V852 WeakPolarHBondContact O-CG2 3.33Å; I848-V852 PolarHBondContact O-N 3.34Å
849	V	91.9	Very high	90.9	Very high	83 Å²	83	52.9 Å²	52.9	50%	0.503	29%	0.292	S	S	.	.	H	α-helix	trans	-59.8	-43.1	176	171	0	0	0	0	110.6	T845 V846 C847 L851 V852 V853	T845-V849 VanDerWaalsContact O-CG2 3.31Å; T845-V849 WeakPolarHBondContact O-CG2 3.23Å; T845-V849 PolarHBondContact O-N 2.77Å; V846-V849 PolarHBondContact O-N 2.63Å; C847-V849 PolarHBondContact O-N 2.76Å; V849-L851 PolarHBondContact O-N 3.12Å; V849-V852 PolarHBondContact O-N 2.96Å; V849-V853 HydrophobicContact CG1-CG2 4.24Å; V849-V853 WeakPolarHBondContact O-CB 3.46Å; V849-V853 VanDerWaalsContact O-CG2 3.26Å; V849-V853 WeakPolarHBondContact O-CG2 3.44Å; V849-V853 PolarHBondContact O-N 2.88Å
850	I	93.5	Very high	90.5	Very high	40 Å²	40	52.4 Å²	52.4	21%	0.205	29%	0.293	C	S	.	.	H	α-helix	trans	-60.8	-46.1	176	-69.9	165.7	0	0	0	110.8	V846 C847 I848 V852 V853 R854 T873 T876 F877	V846-I850 HydrophobicContact CG1-CD1 3.85Å; V846-I850 HydrophobicContact CG1-CG1 4.49Å; V846-I850 VanDerWaalsContact O-CG1 3.31Å; V846-I850 WeakPolarHBondContact O-CG1 3.39Å; V846-I850 PolarHBondContact O-N 2.74Å; C847-I850 PolarHBondContact O-N 2.78Å; I848-I850 VanDerWaalsContact C-N 3.3Å; I848-I850 PolarHBondContact O-N 3.46Å; I850-V852 VanDerWaalsContact C-N 3.32Å; I850-V852 PolarHBondContact O-N 2.81Å; I850-V853 PolarHBondContact O-N 3.02Å; I850-R854 HydrophobicContact CG2-CG 4.32Å; I850-R854 WeakPolarHBondContact O-CB 3.09Å; I850-R854 WeakPolarHBondContact O-CG 3.5Å; I850-R854 PolarHBondContact O-N 3.33Å; I850-T873 HydrophobicContact CG2-CG2 4.14Å; I850-T876 HydrophobicContact CD1-CG2 3.89Å; I850-F877 HydrophobicContact CB-CE1 3.94Å; I850-F877 HydrophobicContact CB-CZ 4.23Å; I850-F877 HydrophobicContact CD1-CE1 3.89Å; I850-F877 HydrophobicContact CG2-CE1 3.72Å; I850-F877 HydrophobicContact CG2-CZ 3.86Å
851	L	90.7	Very high	90.1	Very high	3 Å²	3	52.3 Å²	52.3	2%	0.016	29%	0.292	C	S	.	.	H	α-helix	trans	-57.8	-45.5	176.1	-71.4	178.9	0	0	0	111.7	L163 I793 C847 I848 V849 R854 E862 F877	L163-L851 HydrophobicContact CD1-CD1 3.8Å; I793-L851 HydrophobicContact CG2-CD1 4.44Å; C847-L851 PolarHBondContact O-N 2.91Å; I848-L851 PolarHBondContact O-N 2.82Å; V849-L851 PolarHBondContact O-N 3.12Å; L851-R854 PolarHBondContact O-N 2.96Å; L851-E862 HydrophobicContact CD2-CB 4.45Å; L851-F877 HydrophobicContact CD2-CE2 4.18Å; L851-F877 HydrophobicContact CD2-CZ 4.16Å; L851-F877 HydrophobicContact CG-CZ 4.27Å
852	V	88.7	Confident	90	Very high	85 Å²	85	51.8 Å²	51.8	52%	0.515	29%	0.289	S	S	.	.	H	α-helix	trans	-63.9	-43	178.5	173.3	0	0	0	0	111.3	I848 V849 I850 R854 R855	I848-V852 HydrophobicContact CG2-CG2 4.42Å; I848-V852 WeakPolarHBondContact O-CG2 3.33Å; I848-V852 PolarHBondContact O-N 3.34Å; V849-V852 PolarHBondContact O-N 2.96Å; I850-V852 VanDerWaalsContact C-N 3.32Å; I850-V852 PolarHBondContact O-N 2.81Å; V852-R854 VanDerWaalsContact C-N 3.33Å; V852-R854 PolarHBondContact O-N 2.83Å; V852-R855 WeakPolarHBondContact O-CB 3.33Å; V852-R855 PolarHBondContact O-N 3.3Å
853	V	90.7	Very high	89.9	Confident	89 Å²	89	47.4 Å²	47.4	54%	0.539	26%	0.262	S	S	.	.	H	α-helix	trans	-65.4	-35.5	177.9	169.5	0	0	0	0	111.9	V849 I850 R855 S856	V849-V853 HydrophobicContact CG1-CG2 4.24Å; V849-V853 WeakPolarHBondContact O-CB 3.46Å; V849-V853 VanDerWaalsContact O-CG2 3.26Å; V849-V853 WeakPolarHBondContact O-CG2 3.44Å; V849-V853 PolarHBondContact O-N 2.88Å; I850-V853 PolarHBondContact O-N 3.02Å; V853-R855 PolarHBondContact O-N 2.79Å; V853-R855 VanDerWaalsContact O-N 3.13Å; V853-S856 WeakPolarHBondContact O-CB 3.42Å; V853-S856 PolarHBondContact O-N 2.63Å; V853-S856 PolarHBondContact O-OG 3.13Å
854	R	92.5	Very high	89.7	Confident	4 Å²	4	46.6 Å²	46.6	2%	0.015	26%	0.258	C	S	.	.	H	α-helix	trans	-62.8	-17.6	176.3	-75.3	173.5	59.7	70.7	15.3	113.6	I850 L851 V852 S856 I859 G861 E862 G864 C869 T873	I850-R854 HydrophobicContact CG2-CG 4.32Å; I850-R854 WeakPolarHBondContact O-CB 3.09Å; I850-R854 WeakPolarHBondContact O-CG 3.5Å; I850-R854 PolarHBondContact O-N 3.33Å; L851-R854 PolarHBondContact O-N 2.96Å; V852-R854 VanDerWaalsContact C-N 3.33Å; V852-R854 PolarHBondContact O-N 2.83Å; R854-S856 PolarHBondContact O-N 2.78Å; R854-I859 HydrophobicContact CB-CD1 4.38Å; R854-I859 HydrophobicContact CB-CG2 4.27Å; R854-I859 HydrophobicContact CG-CD1 3.96Å; R854-I859 VanDerWaalsContact O-CB 3.3Å; R854-I859 WeakPolarHBondContact O-CB 3.06Å; R854-I859 WeakPolarHBondContact O-CG2 3.47Å; R854-G861 PolarHBondContact O-N 3.02Å; R854-E862 PolarHBondContact NE-O 3.44Å; R854-E862 PolarHBondContact NH2-O 3.19Å; R854-E862 VanDerWaalsContact NH2-O 3.13Å; R854-G864 PolarHBondContact NH2-O 3.46Å; R854-C869 PolarHBondContact NH1-O 2.57Å; R854-T873 WeakPolarHBondContact CD-OG1 3.01Å; R854-T873 PolarHBondContact NH1-OG1 2.84Å
855	R	87.6	Confident	89.5	Confident	103 Å²	103	46.7 Å²	46.7	39%	0.389	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-13.1	171.4	-157.9	-177.6	178.4	-177.5	9	114.1	L181 V852 V853 E862	L181-R855 VanDerWaalsContact CD2-CZ 3.49Å; V852-R855 WeakPolarHBondContact O-CB 3.33Å; V852-R855 PolarHBondContact O-N 3.3Å; V853-R855 PolarHBondContact O-N 2.79Å; V853-R855 VanDerWaalsContact O-N 3.13Å; R855-E862 WeakPolarHBondContact CD-OE1 3.18Å; R855-E862 IonicContact NE-OE1 3.91Å
856	S	86.5	Confident	89.4	Confident	54 Å²	54	46.4 Å²	46.4	38%	0.378	26%	0.258	S	S	.	.	S	Bend	trans	-52.4	154.2	175.8	63.5	0	0	0	0	112.3	V853 R854 S858 I859 G860	V853-S856 WeakPolarHBondContact O-CB 3.42Å; V853-S856 PolarHBondContact O-N 2.63Å; V853-S856 PolarHBondContact O-OG 3.13Å; R854-S856 PolarHBondContact O-N 2.78Å; S856-S858 PolarHBondContact O-N 2.91Å; S856-I859 PolarHBondContact O-N 2.95Å; S856-I859 VanDerWaalsContact O-N 3.12Å; S856-G860 PolarHBondContact O-N 3.43Å
857	K	80.7	Confident	89.2	Confident	219 Å²	219	48 Å²	48	95%	0.952	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-25.2	-178	-69	-176.4	178.7	-180	0	113.5
858	S	81.3	Confident	89	Confident	97 Å²	97	58.8 Å²	58.8	68%	0.678	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-29.1	-178.6	-171.5	0	0	0	0	114.4	S856	S856-S858 PolarHBondContact O-N 2.91Å
859	I	85.9	Confident	88.9	Confident	28 Å²	28	59.6 Å²	59.6	14%	0.144	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	-34.1	-177.5	-65.2	171.8	0	0	0	109.9	V175 R854 S856 G861 C869	V175-I859 WeakPolarHBondContact CG1-O 3.19Å; R854-I859 HydrophobicContact CB-CD1 4.38Å; R854-I859 HydrophobicContact CB-CG2 4.27Å; R854-I859 HydrophobicContact CG-CD1 3.96Å; R854-I859 VanDerWaalsContact O-CB 3.3Å; R854-I859 WeakPolarHBondContact O-CB 3.06Å; R854-I859 WeakPolarHBondContact O-CG2 3.47Å; S856-I859 PolarHBondContact O-N 2.95Å; S856-I859 VanDerWaalsContact O-N 3.12Å; I859-G861 PolarHBondContact O-N 3.07Å; I859-C869 HydrophobicContact CD1-CB 4.03Å; I859-C869 HydrophobicContact CG1-CB 4.01Å
860	G	84.5	Confident	88.9	Confident	13 Å²	13	56.6 Å²	56.6	13%	0.134	29%	0.293	C	S	.	.			trans	93.7	-34.5	172.1	0	0	0	0	0	113.6	K177 S856	K177-G860 WeakPolarHBondContact CD-O 3.31Å; K177-G860 WeakPolarHBondContact CE-O 3.36Å; K177-G860 WeakPolarHBondContact CG-O 3.26Å; K177-G860 PolarHBondContact NZ-O 3.27Å; S856-G860 PolarHBondContact O-N 3.43Å
861	G	88	Confident	88.9	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.304	C	S	.	.	S	Bend	trans	-160.6	166	-177.2	0	0	0	0	0	114.3	R854 I859	R854-G861 PolarHBondContact O-N 3.02Å; I859-G861 PolarHBondContact O-N 3.07Å
862	E	90.3	Very high	89.1	Confident	5 Å²	5	60.6 Å²	60.6	2%	0.023	32%	0.324	C	S	.	.	S	Bend	trans	-62.6	-43.9	-178.4	-65	79.8	-177.4	0	0	111	R176 K177 Q178 I793 L851 R854 R855	R176-E862 PolarHBondContact O-N 3.44Å; K177-E862 WeakPolarHBondContact CA-OE2 3.42Å; Q178-E862 PolarHBondContact N-OE2 3.46Å; I793-E862 HydrophobicContact CD1-CB 3.81Å; I793-E862 HydrophobicContact CD1-CG 4.35Å; L851-E862 HydrophobicContact CD2-CB 4.45Å; R854-E862 PolarHBondContact NE-O 3.44Å; R854-E862 PolarHBondContact NH2-O 3.19Å; R854-E862 VanDerWaalsContact NH2-O 3.13Å; R855-E862 WeakPolarHBondContact CD-OE1 3.18Å; R855-E862 IonicContact NE-OE1 3.91Å
863	L	92.2	Very high	89.4	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	147.1	177.7	-49.5	177.1	0	0	0	112.1	C166 V167 I170 V175 R176 A783 A789 S792 I793	C166-L863 HydrophobicContact CB-CD1 4.32Å; C166-L863 HydrophobicContact CB-CD2 4.08Å; V167-L863 HydrophobicContact CG2-CD2 3.67Å; I170-L863 HydrophobicContact CD1-CB 4.46Å; I170-L863 HydrophobicContact CG1-CB 3.87Å; V175-L863 WeakPolarHBondContact CA-O 2.85Å; R176-L863 HydrophobicContact CB-CB 4.15Å; R176-L863 HydrophobicContact CB-CD1 4.47Å; R176-L863 PolarHBondContact N-O 3.5Å; R176-L863 VanDerWaalsContact N-O 3.09Å; R176-L863 PolarHBondContact O-N 3.42Å; A783-L863 HydrophobicContact CB-CD1 3.99Å; A789-L863 HydrophobicContact CB-CD1 3.77Å; A789-L863 HydrophobicContact CB-CG 3.95Å; S792-L863 VanDerWaalsContact OG-CD1 3.31Å; S792-L863 WeakPolarHBondContact OG-CD1 3.34Å; I793-L863 HydrophobicContact CD1-CD2 4.28Å; I793-L863 HydrophobicContact CD1-CG 4.32Å; I793-L863 HydrophobicContact CG1-CD2 4.44Å
864	G	92.5	Very high	89.7	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	76.9	-137.9	179.7	0	0	0	0	0	113.7	R854	R854-G864 PolarHBondContact NH2-O 3.46Å
865	G	89.5	Confident	89.9	Confident	4 Å²	4	57.5 Å²	57.5	4%	0.041	31%	0.307	C	S	.	.			trans	87.2	-167.5	-179	0	0	0	0	0	114.3	E174 L867	E174-G865 PolarHBondContact O-N 3.06Å; G865-L867 PolarHBondContact O-N 3.26Å
866	P	90.4	Very high	90.3	Very high	58 Å²	58	55.2 Å²	55.2	38%	0.377	31%	0.305	S	S	.	.	S	Bend	trans	-56.3	138.2	-176.2	-24.8	33.5	0	0	0	112	R868 C869 K870	P866-R868 VanDerWaalsContact C-N 3.27Å; P866-R868 PolarHBondContact O-N 3.22Å; P866-R868 VanDerWaalsContact O-N 3.11Å; P866-C869 HydrophobicContact CB-CB 4.5Å; P866-C869 PolarHBondContact O-N 3.34Å; P866-K870 WeakPolarHBondContact O-CB 3.09Å; P866-K870 PolarHBondContact O-N 3.2Å
867	L	89.4	Confident	90.9	Very high	101 Å²	101	52.6 Å²	52.6	53%	0.529	29%	0.287	S	S	.	.	H	α-helix	trans	-51.1	-43.7	-172.9	-177.4	65	0	0	0	113.1	G865 K870 V871	G865-L867 PolarHBondContact O-N 3.26Å; L867-K870 PolarHBondContact O-N 2.77Å; L867-V871 HydrophobicContact CD1-CG2 3.99Å; L867-V871 HydrophobicContact CG-CG2 4.37Å; L867-V871 WeakPolarHBondContact O-CB 3.31Å; L867-V871 VanDerWaalsContact O-CG2 3.28Å; L867-V871 WeakPolarHBondContact O-CG2 3.39Å; L867-V871 PolarHBondContact O-N 2.89Å
868	R	90.5	Very high	91.7	Very high	225 Å²	225	44.5 Å²	44.5	85%	0.849	26%	0.256	S	S	*	.	H	α-helix	trans	-62.1	-45.8	178.8	-66.5	-175.9	-178.3	174.4	0.7	112.2	P866 A872	P866-R868 VanDerWaalsContact C-N 3.27Å; P866-R868 PolarHBondContact O-N 3.22Å; P866-R868 VanDerWaalsContact O-N 3.11Å; R868-A872 WeakPolarHBondContact O-CB 3.33Å; R868-A872 PolarHBondContact O-N 2.98Å
869	C	90.5	Very high	92.4	Very high	41 Å²	41	42.4 Å²	42.4	28%	0.277	24%	0.241	S	C	.	.	H	α-helix	trans	-69.4	-39.2	179.1	-64.7	0	0	0	0	111.5	R854 I859 P866 T873	R854-C869 PolarHBondContact NH1-O 2.57Å; I859-C869 HydrophobicContact CD1-CB 4.03Å; I859-C869 HydrophobicContact CG1-CB 4.01Å; P866-C869 HydrophobicContact CB-CB 4.5Å; P866-C869 PolarHBondContact O-N 3.34Å; C869-T873 WeakPolarHBondContact O-CB 3.43Å; C869-T873 PolarHBondContact O-N 3.01Å; C869-T873 PolarHBondContact O-OG1 2.64Å; C869-T873 VanDerWaalsContact O-OG1 3.05Å
870	K	91.6	Very high	93	Very high	19 Å²	19	42.3 Å²	42.3	8%	0.083	24%	0.24	C	C	.	.	H	α-helix	trans	-60.1	-51.3	175.9	178.4	-176.6	171.4	-179.7	0	111.5	V167 V168 I170 P866 L867 A874	V167-K870 HydrophobicContact CG1-CB 4.48Å; V167-K870 HydrophobicContact CG1-CG 3.92Å; V167-K870 WeakPolarHBondContact O-CE 3.27Å; V168-K870 VanDerWaalsContact C-CE 3.42Å; V168-K870 WeakPolarHBondContact O-CE 3.41Å; V168-K870 PolarHBondContact O-NZ 3Å; I170-K870 PolarHBondContact O-NZ 3.03Å; P866-K870 WeakPolarHBondContact O-CB 3.09Å; P866-K870 PolarHBondContact O-N 3.2Å; L867-K870 PolarHBondContact O-N 2.77Å; K870-A874 WeakPolarHBondContact O-CB 3.36Å; K870-A874 PolarHBondContact O-N 3.03Å; K870-A874 VanDerWaalsContact O-N 3.09Å
871	V	93.2	Very high	93.6	Very high	73 Å²	73	43.1 Å²	43.1	44%	0.442	24%	0.24	S	C	.	.	H	α-helix	trans	-66.4	-43.6	177.8	173.8	0	0	0	0	110.9	L867 T873 A874 V875	L867-V871 HydrophobicContact CD1-CG2 3.99Å; L867-V871 HydrophobicContact CG-CG2 4.37Å; L867-V871 WeakPolarHBondContact O-CB 3.31Å; L867-V871 VanDerWaalsContact O-CG2 3.28Å; L867-V871 WeakPolarHBondContact O-CG2 3.39Å; L867-V871 PolarHBondContact O-N 2.89Å; V871-T873 PolarHBondContact O-N 3.16Å; V871-A874 PolarHBondContact O-N 3.38Å; V871-V875 HydrophobicContact CG1-CG2 4.15Å; V871-V875 VanDerWaalsContact O-CG2 3.32Å; V871-V875 WeakPolarHBondContact O-CG2 3.48Å; V871-V875 PolarHBondContact O-N 3.21Å
872	A	94.7	Very high	94.1	Very high	54 Å²	54	47.8 Å²	47.8	45%	0.446	26%	0.264	S	S	.	.	H	α-helix	trans	-57.4	-48.3	177.5	0	0	0	0	0	111.8	R868 A874 V875 T876	R868-A872 WeakPolarHBondContact O-CB 3.33Å; R868-A872 PolarHBondContact O-N 2.98Å; A872-A874 PolarHBondContact O-N 3.45Å; A872-V875 PolarHBondContact O-N 3.34Å; A872-T876 PolarHBondContact O-N 3.12Å; A872-T876 PolarHBondContact O-OG1 2.83Å
873	T	95.2	Very high	94.4	Very high	12 Å²	12	50.5 Å²	50.5	7%	0.074	28%	0.281	C	S	.	.	H	α-helix	trans	-61.6	-43.8	176.8	-62.6	0	0	0	0	112.4	V167 I850 R854 C869 V871 T876 F877	V167-T873 HydrophobicContact CG1-CG2 4.41Å; V167-T873 HydrophobicContact CG2-CG2 4.31Å; I850-T873 HydrophobicContact CG2-CG2 4.14Å; R854-T873 WeakPolarHBondContact CD-OG1 3.01Å; R854-T873 PolarHBondContact NH1-OG1 2.84Å; C869-T873 WeakPolarHBondContact O-CB 3.43Å; C869-T873 PolarHBondContact O-N 3.01Å; C869-T873 PolarHBondContact O-OG1 2.64Å; C869-T873 VanDerWaalsContact O-OG1 3.05Å; V871-T873 PolarHBondContact O-N 3.16Å; T873-T876 PolarHBondContact O-N 3.31Å; T873-F877 HydrophobicContact CG2-CD1 4.45Å; T873-F877 HydrophobicContact CG2-CD2 4.11Å; T873-F877 HydrophobicContact CG2-CE1 4.12Å; T873-F877 HydrophobicContact CG2-CE2 3.74Å; T873-F877 HydrophobicContact CG2-CG 4.45Å; T873-F877 HydrophobicContact CG2-CZ 3.75Å; T873-F877 WeakPolarHBondContact O-CG 3.31Å; T873-F877 PolarHBondContact O-N 2.94Å
874	A	95.7	Very high	94.6	Very high	10 Å²	10	50.5 Å²	50.5	8%	0.083	28%	0.281	C	S	.	.	H	α-helix	trans	-62.3	-45.5	178.8	0	0	0	0	0	111.8	A164 V168 K870 V871 A872 T876 F877 V878	A164-A874 HydrophobicContact CB-CB 4.36Å; V168-A874 HydrophobicContact CG2-CB 3.37Å; K870-A874 WeakPolarHBondContact O-CB 3.36Å; K870-A874 PolarHBondContact O-N 3.03Å; K870-A874 VanDerWaalsContact O-N 3.09Å; V871-A874 PolarHBondContact O-N 3.38Å; A872-A874 PolarHBondContact O-N 3.45Å; A874-T876 VanDerWaalsContact C-N 3.34Å; A874-T876 PolarHBondContact O-N 2.99Å; A874-F877 PolarHBondContact O-N 2.77Å; A874-V878 WeakPolarHBondContact O-CB 3.33Å; A874-V878 WeakPolarHBondContact O-CG2 3.48Å; A874-V878 PolarHBondContact O-N 3.46Å
875	V	97.2	Very high	94.7	Very high	91 Å²	91	51.8 Å²	51.8	55%	0.552	29%	0.287	S	S	*	.	H	α-helix	trans	-61.7	-42.6	175.9	172.1	0	0	0	0	110.9	V871 A872 V878 S879	V871-V875 HydrophobicContact CG1-CG2 4.15Å; V871-V875 VanDerWaalsContact O-CG2 3.32Å; V871-V875 WeakPolarHBondContact O-CG2 3.48Å; V871-V875 PolarHBondContact O-N 3.21Å; A872-V875 PolarHBondContact O-N 3.34Å; V875-V878 PolarHBondContact O-N 3.38Å; V875-S879 VanDerWaalsContact O-CB 3.31Å; V875-S879 WeakPolarHBondContact O-CB 3.4Å; V875-S879 PolarHBondContact O-N 3.11Å; V875-S879 PolarHBondContact O-OG 2.81Å
876	T	97.5	Very high	95	Very high	55 Å²	55	56.3 Å²	56.3	34%	0.337	31%	0.31	S	S	.	.	H	α-helix	trans	-60.1	-48.8	176.2	-58.3	0	0	0	0	111.5	I850 A872 T873 A874 S879 L880	I850-T876 HydrophobicContact CD1-CG2 3.89Å; A872-T876 PolarHBondContact O-N 3.12Å; A872-T876 PolarHBondContact O-OG1 2.83Å; T873-T876 PolarHBondContact O-N 3.31Å; A874-T876 VanDerWaalsContact C-N 3.34Å; A874-T876 PolarHBondContact O-N 2.99Å; T876-S879 WeakPolarHBondContact CA-OG 3.46Å; T876-S879 PolarHBondContact O-N 3.19Å; T876-S879 PolarHBondContact O-OG 2.95Å; T876-L880 HydrophobicContact CG2-CD1 4.4Å; T876-L880 WeakPolarHBondContact O-CG 3.31Å; T876-L880 PolarHBondContact O-N 2.8Å
877	F	97.7	Very high	95.2	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-65.6	-42.6	-179.4	-71.3	-2.3	0	0	0	112.4	F160 L163 A164 C847 I850 L851 T873 A874 S879 L880 W881	F160-F877 WeakPolarHBondContact O-CB 3.4Å; L163-F877 HydrophobicContact CB-CD2 4.01Å; L163-F877 HydrophobicContact CB-CE2 4Å; A164-F877 HydrophobicContact CB-CB 3.87Å; A164-F877 HydrophobicContact CB-CD2 4.42Å; C847-F877 HydrophobicContact CB-CE1 4.2Å; C847-F877 VanDerWaalsContact SG-CE1 3.56Å; C847-F877 WeakPolarHBondContact SG-CZ 3.45Å; I850-F877 HydrophobicContact CB-CE1 3.94Å; I850-F877 HydrophobicContact CB-CZ 4.23Å; I850-F877 HydrophobicContact CD1-CE1 3.89Å; I850-F877 HydrophobicContact CG2-CE1 3.72Å; I850-F877 HydrophobicContact CG2-CZ 3.86Å; L851-F877 HydrophobicContact CD2-CE2 4.18Å; L851-F877 HydrophobicContact CD2-CZ 4.16Å; L851-F877 HydrophobicContact CG-CZ 4.27Å; T873-F877 HydrophobicContact CG2-CD1 4.45Å; T873-F877 HydrophobicContact CG2-CD2 4.11Å; T873-F877 HydrophobicContact CG2-CE1 4.12Å; T873-F877 HydrophobicContact CG2-CE2 3.74Å; T873-F877 HydrophobicContact CG2-CG 4.45Å; T873-F877 HydrophobicContact CG2-CZ 3.75Å; T873-F877 WeakPolarHBondContact O-CG 3.31Å; T873-F877 PolarHBondContact O-N 2.94Å; A874-F877 PolarHBondContact O-N 2.77Å; F877-S879 VanDerWaalsContact C-N 3.28Å; F877-S879 PolarHBondContact O-N 3.37Å; F877-L880 HydrophobicContact CD1-CD1 4.32Å; F877-L880 PolarHBondContact O-N 2.95Å; F877-W881 PolarHBondContact O-N 3.46Å; F877-W881 VanDerWaalsContact O-N 3.12Å
878	V	97.5	Very high	95.4	Very high	49 Å²	49	51.5 Å²	51.5	30%	0.297	28%	0.281	S	S	.	.	H	α-helix	trans	-61	-39.8	173.6	174.8	0	0	0	0	110.9	M161 A164 A874 V875 W881 L882	M161-V878 HydrophobicContact CE-CG1 4.46Å; M161-V878 HydrophobicContact CE-CG2 4.05Å; M161-V878 HydrophobicContact SD-CB 4.07Å; M161-V878 HydrophobicContact SD-CG1 4.03Å; M161-V878 HydrophobicContact SD-CG2 3.73Å; A164-V878 HydrophobicContact CB-CG2 4.02Å; A874-V878 WeakPolarHBondContact O-CB 3.33Å; A874-V878 WeakPolarHBondContact O-CG2 3.48Å; A874-V878 PolarHBondContact O-N 3.46Å; V875-V878 PolarHBondContact O-N 3.38Å; V878-W881 PolarHBondContact O-N 2.97Å; V878-L882 HydrophobicContact CG1-CD1 4.35Å; V878-L882 WeakPolarHBondContact O-CG 3.41Å; V878-L882 PolarHBondContact O-N 2.87Å; V878-L882 VanDerWaalsContact O-N 3.07Å
879	S	97.6	Very high	95.4	Very high	53 Å²	53	41.6 Å²	41.6	37%	0.371	25%	0.247	S	C	.	.	H	α-helix	trans	-66.3	-37.8	177.7	70.3	0	0	0	0	113	V875 T876 F877 L882 V883	V875-S879 VanDerWaalsContact O-CB 3.31Å; V875-S879 WeakPolarHBondContact O-CB 3.4Å; V875-S879 PolarHBondContact O-N 3.11Å; V875-S879 PolarHBondContact O-OG 2.81Å; T876-S879 WeakPolarHBondContact CA-OG 3.46Å; T876-S879 PolarHBondContact O-N 3.19Å; T876-S879 PolarHBondContact O-OG 2.95Å; F877-S879 VanDerWaalsContact C-N 3.28Å; F877-S879 PolarHBondContact O-N 3.37Å; S879-L882 PolarHBondContact O-N 3.23Å; S879-V883 VanDerWaalsContact O-CG2 3.29Å; S879-V883 WeakPolarHBondContact O-CG2 3.4Å; S879-V883 PolarHBondContact O-N 3.25Å
880	L	97.7	Very high	95.5	Very high	26 Å²	26	41.9 Å²	41.9	14%	0.136	25%	0.245	C	C	.	.	H	α-helix	trans	-60.4	-48	174.1	-70.4	170.6	0	0	0	110.1	F160 E843 V846 T876 F877 L882 V883 Y884	F160-L880 HydrophobicContact CD1-CB 4.44Å; F160-L880 HydrophobicContact CG-CB 4.42Å; E843-L880 HydrophobicContact CB-CD2 4.33Å; E843-L880 HydrophobicContact CG-CD2 4.04Å; V846-L880 HydrophobicContact CG1-CD1 4.41Å; T876-L880 HydrophobicContact CG2-CD1 4.4Å; T876-L880 WeakPolarHBondContact O-CG 3.31Å; T876-L880 PolarHBondContact O-N 2.8Å; F877-L880 HydrophobicContact CD1-CD1 4.32Å; F877-L880 PolarHBondContact O-N 2.95Å; L880-L882 VanDerWaalsContact C-N 3.32Å; L880-L882 PolarHBondContact O-N 3.4Å; L880-V883 PolarHBondContact O-N 2.94Å; L880-V883 VanDerWaalsContact O-N 3.07Å; L880-Y884 PolarHBondContact O-N 2.92Å
881	W	97.4	Very high	95.4	Very high	30 Å²	30	42 Å²	42	11%	0.114	25%	0.246	C	C	.	.	H	α-helix	trans	-58	-41	176.4	-177	71.7	0	0	0	113.9	F157 F160 M161 I769 F877 V878 Y884 I885	F157-W881 AromaticContact CD2-CE2 3.75Å; F157-W881 AromaticContact CD2-CZ2 3.82Å; F157-W881 HydrophobicContact CD2-CZ2 3.82Å; F157-W881 AromaticContact CD2-NE1 3.67Å; F157-W881 HydrophobicContact CE2-CZ2 4.27Å; F160-W881 HydrophobicContact CB-CB 3.77Å; F160-W881 HydrophobicContact CD2-CB 4.02Å; F160-W881 HydrophobicContact CG-CB 4.35Å; M161-W881 HydrophobicContact CG-CB 3.97Å; M161-W881 HydrophobicContact CG-CD2 3.54Å; M161-W881 HydrophobicContact CG-CE3 3.97Å; M161-W881 HydrophobicContact CG-CG 3.54Å; M161-W881 HydrophobicContact SD-CB 4.06Å; M161-W881 HydrophobicContact SD-CD2 3.91Å; M161-W881 HydrophobicContact SD-CE3 3.75Å; M161-W881 HydrophobicContact SD-CG 4.07Å; M161-W881 HydrophobicContact SD-CZ3 4.48Å; I769-W881 HydrophobicContact CD1-CH2 3.81Å; I769-W881 HydrophobicContact CD1-CZ2 3.72Å; I769-W881 HydrophobicContact CG1-CH2 4.47Å; I769-W881 HydrophobicContact CG1-CZ2 3.92Å; F877-W881 PolarHBondContact O-N 3.46Å; F877-W881 VanDerWaalsContact O-N 3.12Å; V878-W881 PolarHBondContact O-N 2.97Å; W881-Y884 PolarHBondContact O-N 3Å; W881-I885 HydrophobicContact CD2-CD1 3.81Å; W881-I885 HydrophobicContact CE3-CD1 4.07Å; W881-I885 HydrophobicContact CH2-CD1 3.49Å; W881-I885 VanDerWaalsContact CH2-CD1 3.49Å; W881-I885 HydrophobicContact CZ2-CD1 3.18Å; W881-I885 HydrophobicContact CZ2-CG1 4.47Å; W881-I885 HydrophobicContact CZ3-CD1 3.92Å; W881-I885 PolarHBondContact O-N 3.36Å
882	L	97.2	Very high	95.1	Very high	97 Å²	97	38.9 Å²	38.9	51%	0.508	23%	0.228	S	C	.	.	H	α-helix	trans	-66.5	-38.7	175.6	-69.1	173.8	0	0	0	112.3	V878 S879 L880 I885 L886	V878-L882 HydrophobicContact CG1-CD1 4.35Å; V878-L882 WeakPolarHBondContact O-CG 3.41Å; V878-L882 PolarHBondContact O-N 2.87Å; V878-L882 VanDerWaalsContact O-N 3.07Å; S879-L882 PolarHBondContact O-N 3.23Å; L880-L882 VanDerWaalsContact C-N 3.32Å; L880-L882 PolarHBondContact O-N 3.4Å; L882-I885 PolarHBondContact O-N 2.99Å; L882-L886 VanDerWaalsContact O-CB 3.27Å; L882-L886 WeakPolarHBondContact O-CB 3.32Å; L882-L886 PolarHBondContact O-N 3.13Å
883	V	96.6	Very high	94.8	Very high	63 Å²	63	40.4 Å²	40.4	38%	0.382	22%	0.222	S	C	.	.	H	α-helix	trans	-65.3	-44.9	175.2	171.4	0	0	0	0	110.5	E843 S879 L880 I885 L886 L887	E843-V883 WeakPolarHBondContact OE1-CG1 3.44Å; S879-V883 VanDerWaalsContact O-CG2 3.29Å; S879-V883 WeakPolarHBondContact O-CG2 3.4Å; S879-V883 PolarHBondContact O-N 3.25Å; L880-V883 PolarHBondContact O-N 2.94Å; L880-V883 VanDerWaalsContact O-N 3.07Å; V883-I885 PolarHBondContact O-N 3.08Å; V883-L886 PolarHBondContact O-N 3.14Å; V883-L887 HydrophobicContact CG1-CD1 3.68Å; V883-L887 HydrophobicContact CG1-CG 4.09Å; V883-L887 WeakPolarHBondContact O-CB 3.39Å; V883-L887 WeakPolarHBondContact O-CG 2.95Å; V883-L887 PolarHBondContact O-N 2.73Å
884	Y	97	Very high	94.2	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-54.8	-49.9	173.9	164.9	-97.6	0	0	0	112.3	G153 A156 I764 S836 I839 F840 E843 L880 W881 S888	G153-Y884 WeakPolarHBondContact CA-OH 3.26Å; G153-Y884 PolarHBondContact N-OH 2.84Å; A156-Y884 HydrophobicContact CB-CD1 3.62Å; A156-Y884 HydrophobicContact CB-CD2 4.26Å; A156-Y884 HydrophobicContact CB-CE1 3.44Å; A156-Y884 VanDerWaalsContact CB-CE1 3.44Å; A156-Y884 HydrophobicContact CB-CE2 4.09Å; A156-Y884 HydrophobicContact CB-CG 4.04Å; I764-Y884 HydrophobicContact CB-CE1 4.46Å; S836-Y884 WeakPolarHBondContact OG-CE2 3.46Å; S836-Y884 PolarHBondContact OG-OH 3.29Å; I839-Y884 HydrophobicContact CB-CD2 4.38Å; I839-Y884 HydrophobicContact CG2-CD2 4.03Å; F840-Y884 HydrophobicContact CB-CD2 4.41Å; F840-Y884 HydrophobicContact CB-CE2 4.07Å; E843-Y884 WeakPolarHBondContact OE2-CB 3.27Å; L880-Y884 PolarHBondContact O-N 2.92Å; W881-Y884 PolarHBondContact O-N 3Å; Y884-S888 VanDerWaalsContact O-CB 3.23Å; Y884-S888 WeakPolarHBondContact O-CB 3.28Å; Y884-S888 PolarHBondContact O-N 2.84Å; Y884-S888 PolarHBondContact O-OG 2.96Å
885	I	95.6	Very high	93.7	Very high	26 Å²	26	45.7 Å²	45.7	13%	0.133	25%	0.251	C	S	.	.	H	α-helix	trans	-62.1	-46.8	177.6	-72.8	175	0	0	0	110.4	T765 W881 L882 V883 S889	T765-I885 HydrophobicContact CG2-CD1 4.18Å; T765-I885 HydrophobicContact CG2-CG1 4.36Å; T765-I885 HydrophobicContact CG2-CG2 3.72Å; W881-I885 HydrophobicContact CD2-CD1 3.81Å; W881-I885 HydrophobicContact CE3-CD1 4.07Å; W881-I885 HydrophobicContact CH2-CD1 3.49Å; W881-I885 VanDerWaalsContact CH2-CD1 3.49Å; W881-I885 HydrophobicContact CZ2-CD1 3.18Å; W881-I885 HydrophobicContact CZ2-CG1 4.47Å; W881-I885 HydrophobicContact CZ3-CD1 3.92Å; W881-I885 PolarHBondContact O-N 3.36Å; L882-I885 PolarHBondContact O-N 2.99Å; V883-I885 PolarHBondContact O-N 3.08Å; I885-S889 WeakPolarHBondContact O-CB 3.44Å; I885-S889 PolarHBondContact O-N 3.5Å; I885-S889 PolarHBondContact O-OG 2.97Å
886	L	95.1	Very high	93.1	Very high	100 Å²	100	43.6 Å²	43.6	52%	0.524	24%	0.236	S	C	.	.	H	α-helix	trans	-60.2	-53.6	-178	178.8	64.9	0	0	0	111	L882 V883 S889 L890	L882-L886 VanDerWaalsContact O-CB 3.27Å; L882-L886 WeakPolarHBondContact O-CB 3.32Å; L882-L886 PolarHBondContact O-N 3.13Å; V883-L886 PolarHBondContact O-N 3.14Å; L886-S889 PolarHBondContact O-N 2.68Å; L886-L890 HydrophobicContact CD1-CD1 4.01Å; L886-L890 HydrophobicContact CD1-CG 4.14Å; L886-L890 HydrophobicContact CG-CD1 3.96Å; L886-L890 HydrophobicContact CG-CG 4.44Å; L886-L890 WeakPolarHBondContact O-CB 3.47Å; L886-L890 WeakPolarHBondContact O-CG 3.4Å; L886-L890 PolarHBondContact O-N 2.87Å
887	L	94.6	Very high	92.1	Very high	55 Å²	55	46.1 Å²	46.1	29%	0.288	26%	0.256	S	S	.	.	H	α-helix	trans	-63.4	-46.6	-178.2	-67.4	178.7	0	0	0	111.5	F835 I839 V883 S889 L890 E891 I896	F835-L887 HydrophobicContact CE1-CB 4.24Å; F835-L887 WeakPolarHBondContact CE1-O 3.36Å; I839-L887 HydrophobicContact CD1-CD1 4.13Å; I839-L887 HydrophobicContact CG2-CD1 4.3Å; V883-L887 HydrophobicContact CG1-CD1 3.68Å; V883-L887 HydrophobicContact CG1-CG 4.09Å; V883-L887 WeakPolarHBondContact O-CB 3.39Å; V883-L887 WeakPolarHBondContact O-CG 2.95Å; V883-L887 PolarHBondContact O-N 2.73Å; L887-S889 VanDerWaalsContact C-N 3.28Å; L887-S889 PolarHBondContact O-N 3.21Å; L887-L890 PolarHBondContact O-N 3.44Å; L887-E891 PolarHBondContact O-N 2.9Å; L887-I896 HydrophobicContact CD2-CD1 4.43Å
888	S	92.9	Very high	90.6	Very high	2 Å²	2	47.5 Å²	47.5	1%	0.014	27%	0.27	C	S	.	.	H	α-helix	trans	-61.9	-38.3	178.6	-55.9	0	0	0	0	111.6	S836 Y884 S892	S836-S888 PolarHBondContact OG-OG 3.2Å; Y884-S888 VanDerWaalsContact O-CB 3.23Å; Y884-S888 WeakPolarHBondContact O-CB 3.28Å; Y884-S888 PolarHBondContact O-N 2.84Å; Y884-S888 PolarHBondContact O-OG 2.96Å; S888-S892 WeakPolarHBondContact O-CB 3.49Å; S888-S892 PolarHBondContact O-N 2.83Å; S888-S892 PolarHBondContact O-OG 3.45Å
889	S	91.9	Very high	89	Confident	18 Å²	18	55 Å²	55	13%	0.126	30%	0.299	C	S	.	.	H	α-helix	trans	-70.5	-41.8	177.1	-56.6	0	0	0	0	112.2	I885 L886 L887 E891 S892 Y893	I885-S889 WeakPolarHBondContact O-CB 3.44Å; I885-S889 PolarHBondContact O-N 3.5Å; I885-S889 PolarHBondContact O-OG 2.97Å; L886-S889 PolarHBondContact O-N 2.68Å; L887-S889 VanDerWaalsContact C-N 3.28Å; L887-S889 PolarHBondContact O-N 3.21Å; S889-E891 VanDerWaalsContact C-N 3.31Å; S889-E891 PolarHBondContact O-N 2.64Å; S889-S892 WeakPolarHBondContact O-CB 3.44Å; S889-S892 PolarHBondContact O-N 3.04Å; S889-Y893 WeakPolarHBondContact O-CD2 3.23Å; S889-Y893 PolarHBondContact O-N 2.91Å
890	L	91.7	Very high	88.6	Confident	47 Å²	47	55.2 Å²	55.2	25%	0.246	30%	0.295	C	S	.	.	H	α-helix	trans	-63	-38.8	178.4	-71.8	174.8	0	0	0	111.8	L886 L887 Y893 C894 I895 I896	L886-L890 HydrophobicContact CD1-CD1 4.01Å; L886-L890 HydrophobicContact CD1-CG 4.14Å; L886-L890 HydrophobicContact CG-CD1 3.96Å; L886-L890 HydrophobicContact CG-CG 4.44Å; L886-L890 WeakPolarHBondContact O-CB 3.47Å; L886-L890 WeakPolarHBondContact O-CG 3.4Å; L886-L890 PolarHBondContact O-N 2.87Å; L887-L890 PolarHBondContact O-N 3.44Å; L890-Y893 PolarHBondContact O-N 3.14Å; L890-C894 PolarHBondContact O-N 3.27Å; L890-I895 HydrophobicContact CB-CB 4.42Å; L890-I895 HydrophobicContact CD2-CB 4.13Å; L890-I895 HydrophobicContact CD2-CD1 3.6Å; L890-I895 HydrophobicContact CD2-CG1 4.46Å; L890-I895 HydrophobicContact CD2-CG2 4.03Å; L890-I895 WeakPolarHBondContact O-CB 3.1Å; L890-I895 PolarHBondContact O-N 2.85Å; L890-I896 HydrophobicContact CB-CD1 4.04Å; L890-I896 HydrophobicContact CB-CG1 4Å; L890-I896 HydrophobicContact CB-CG2 4.43Å; L890-I896 PolarHBondContact O-N 3.49Å
891	E	89.4	Confident	88.1	Confident	21 Å²	21	56.7 Å²	56.7	10%	0.098	30%	0.304	C	S	.	.	H	α-helix	trans	-69.7	-43.5	175.9	-173.5	-83.8	165.7	0	0	111.1	T832 F835 L887 S889 Y893 C894 I896	T832-E891 WeakPolarHBondContact CA-OE2 3.49Å; T832-E891 WeakPolarHBondContact CG2-OE2 3.39Å; F835-E891 HydrophobicContact CB-CG 4.13Å; F835-E891 HydrophobicContact CD1-CB 3.59Å; F835-E891 HydrophobicContact CD1-CG 3.72Å; F835-E891 HydrophobicContact CD2-CB 4.47Å; F835-E891 HydrophobicContact CD2-CG 3.92Å; F835-E891 HydrophobicContact CE1-CB 3.58Å; F835-E891 HydrophobicContact CE1-CG 4.08Å; F835-E891 HydrophobicContact CE2-CB 4.47Å; F835-E891 HydrophobicContact CE2-CG 4.25Å; F835-E891 HydrophobicContact CG-CB 4.06Å; F835-E891 HydrophobicContact CG-CG 3.63Å; F835-E891 HydrophobicContact CZ-CB 4.05Å; F835-E891 HydrophobicContact CZ-CG 4.33Å; L887-E891 PolarHBondContact O-N 2.9Å; S889-E891 VanDerWaalsContact C-N 3.31Å; S889-E891 PolarHBondContact O-N 2.64Å; E891-Y893 PolarHBondContact O-N 2.83Å; E891-C894 WeakPolarHBondContact O-CA 3.32Å; E891-C894 PolarHBondContact O-N 2.85Å; E891-I896 HydrophobicContact CB-CD1 4.02Å; E891-I896 HydrophobicContact CB-CG1 3.74Å; E891-I896 HydrophobicContact CG-CG1 4.46Å
892	S	87.7	Confident	87.6	Confident	8 Å²	8	58.2 Å²	58.2	6%	0.056	31%	0.314	C	S	.	.	H	α-helix	trans	-55	-33.4	173.5	-84.7	0	0	0	0	114	I758 S888 S889	I758-S892 VanDerWaalsContact CD1-CB 3.45Å; S888-S892 WeakPolarHBondContact O-CB 3.49Å; S888-S892 PolarHBondContact O-N 2.83Å; S888-S892 PolarHBondContact O-OG 3.45Å; S889-S892 WeakPolarHBondContact O-CB 3.44Å; S889-S892 PolarHBondContact O-N 3.04Å
893	Y	87.4	Confident	87	Confident	85 Å²	85	55.9 Å²	55.9	33%	0.333	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	9.8	174.6	-74.4	-66.8	0	0	0	113.8	L757 I758 V761 S889 L890 E891 I895	L757-Y893 WeakPolarHBondContact CD2-OH 3.21Å; I758-Y893 HydrophobicContact CG2-CE1 4.22Å; V761-Y893 HydrophobicContact CG2-CE2 3.99Å; S889-Y893 WeakPolarHBondContact O-CD2 3.23Å; S889-Y893 PolarHBondContact O-N 2.91Å; L890-Y893 PolarHBondContact O-N 3.14Å; E891-Y893 PolarHBondContact O-N 2.83Å; Y893-I895 PolarHBondContact O-N 3.13Å; Y893-I895 VanDerWaalsContact O-N 3.12Å
894	C	84	Confident	86.4	Confident	38 Å²	38	55.4 Å²	55.4	26%	0.257	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	23	-179.7	-43.8	0	0	0	0	113.8	C26 L890 E891	C26-C894 HydrophobicContact CB-CB 3.82Å; C26-C894 WeakPolarHBondContact CB-SG 3.49Å; C26-C894 WeakPolarHBondContact SG-CB 3.35Å; C26-C894 CovalentContact SG-SG 2.04Å; C26-C894 PolarHBondContact SG-SG 3.33Å; L890-C894 PolarHBondContact O-N 3.27Å; E891-C894 WeakPolarHBondContact O-CA 3.32Å; E891-C894 PolarHBondContact O-N 2.85Å
895	I	84.5	Confident	85.7	Confident	96 Å²	96	59.1 Å²	59.1	49%	0.492	32%	0.318	S	S	.	.	S	Bend	trans	-75.7	-36.8	177	-63.3	166.9	0	0	0	109.7	A21 L890 Y893	A21-I895 WeakPolarHBondContact CB-O 3.26Å; L890-I895 HydrophobicContact CB-CB 4.42Å; L890-I895 HydrophobicContact CD2-CB 4.13Å; L890-I895 HydrophobicContact CD2-CD1 3.6Å; L890-I895 HydrophobicContact CD2-CG1 4.46Å; L890-I895 HydrophobicContact CD2-CG2 4.03Å; L890-I895 WeakPolarHBondContact O-CB 3.1Å; L890-I895 PolarHBondContact O-N 2.85Å; Y893-I895 PolarHBondContact O-N 3.13Å; Y893-I895 VanDerWaalsContact O-N 3.12Å
896	I	85	Confident	85	Confident	46 Å²	46	61.5 Å²	61.5	24%	0.236	33%	0.331	C	S	.	.	S	Bend	trans	-112.2	144.8	167.5	62.4	177.7	0	0	0	108.5	F835 L887 L890 E891 G898	F835-I896 HydrophobicContact CE1-CD1 4.32Å; F835-I896 HydrophobicContact CZ-CD1 3.78Å; L887-I896 HydrophobicContact CD2-CD1 4.43Å; L890-I896 HydrophobicContact CB-CD1 4.04Å; L890-I896 HydrophobicContact CB-CG1 4Å; L890-I896 HydrophobicContact CB-CG2 4.43Å; L890-I896 PolarHBondContact O-N 3.49Å; E891-I896 HydrophobicContact CB-CD1 4.02Å; E891-I896 HydrophobicContact CB-CG1 3.74Å; E891-I896 HydrophobicContact CG-CG1 4.46Å; I896-G898 PolarHBondContact O-N 3.08Å
897	S	75.6	Confident	84.2	Confident	109 Å²	109	58.5 Å²	58.5	76%	0.762	32%	0.316	S	S	*	.			trans	-71.6	127	170.4	54.1	0	0	0	0	109.4
898	G	67.1	Low	83.4	Confident	28 Å²	28	58.8 Å²	58.8	29%	0.289	32%	0.318	S	S	.	.			trans	-58.9	162.6	160.3	0	0	0	0	0	111.4	I896	I896-G898 PolarHBondContact O-N 3.08Å
899	F	63.4	Low	82.5	Confident	208 Å²	208	64 Å²	64	91%	0.912	35%	0.346	S	S	*	.			trans	-65.9	0	-179.8	-53.5	-71.4	0	0	0	112.8	F835 T838	F835-F899 AromaticContact CD2-CD2 3.63Å; F835-F899 HydrophobicContact CD2-CD2 3.63Å; F835-F899 AromaticContact CD2-CE2 3.45Å; F835-F899 HydrophobicContact CD2-CE2 3.45Å; F835-F899 VanDerWaalsContact CD2-CE2 3.45Å; F835-F899 HydrophobicContact CD2-CZ 4.28Å; F835-F899 HydrophobicContact CE2-CD2 4.07Å; F835-F899 AromaticContact CE2-CE2 3.52Å; F835-F899 HydrophobicContact CE2-CE2 3.52Å; F835-F899 AromaticContact CE2-CZ 3.9Å; F835-F899 HydrophobicContact CE2-CZ 3.9Å; T838-F899 HydrophobicContact CG2-CD2 4.49Å; T838-F899 HydrophobicContact CG2-CE2 3.9Å

Retrieved 899 of 899 residues in 602.6 ms (Link to these results)

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