A0A087XKS8_POEFO Loading...

THUMP domain containing 2

AlphaFold DB , UniProt , Accession A0A087XKS8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 504 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.5	Very low	33	Very low	236 Å²	236	159.5 Å²	159.5	100%	1.163	82%	0.821	S	S	*	*				0	89.7	0	-82.1	178.5	-178.7	0	0	108.6
2	F	26.5	Very low	33.8	Very low	207 Å²	207	161.3 Å²	161.3	91%	0.908	82%	0.823	S	S	*	*			trans	-133.5	100.8	163.3	-78.8	-76.8	0	0	0	105.2	N4	F2-N4 PolarHBondContact O-N 3.25Å
3	S	29	Very low	35.5	Very low	112 Å²	112	158.7 Å²	158.7	78%	0.783	81%	0.812	S	S	*	*			trans	-73.1	107.6	176.9	47	0	0	0	0	108.5	I5	S3-I5 PolarHBondContact O-N 3.19Å
4	N	28.1	Very low	38.6	Very low	143 Å²	143	151.5 Å²	151.5	77%	0.765	78%	0.783	S	S	*	*			trans	-54.9	106.2	166.5	-89.2	-21.6	0	0	0	109.6	F2 M6	F2-N4 PolarHBondContact O-N 3.25Å; N4-M6 VanDerWaalsContact C-N 3.35Å; N4-M6 PolarHBondContact O-N 3.05Å
5	I	36.4	Very low	42.2	Very low	157 Å²	157	146.9 Å²	146.9	81%	0.805	76%	0.764	S	S	*	*			trans	-78.1	95.2	160.2	-61.3	174.1	0	0	0	105.3	S3	S3-I5 PolarHBondContact O-N 3.19Å
6	M	29.2	Very low	45.6	Very low	149 Å²	149	138.3 Å²	138.3	73%	0.734	72%	0.72	S	S	*	*			trans	-58.8	125.9	165.9	-77.6	-84.5	146.2	0	0	107.8	N4 E8	N4-M6 VanDerWaalsContact C-N 3.35Å; N4-M6 PolarHBondContact O-N 3.05Å; M6-E8 PolarHBondContact O-N 3.23Å
7	P	32.7	Very low	48.7	Very low	108 Å²	108	136 Å²	136	70%	0.701	70%	0.7	S	S	*	*			trans	-65.4	123.4	172.7	26.3	-29.3	0	0	0	107.9	V9	P7-V9 PolarHBondContact O-N 2.9Å
8	E	32.5	Very low	51.4	Low	186 Å²	186	128.6 Å²	128.6	87%	0.869	66%	0.661	S	S	*	*			trans	-50.1	113.5	170.4	-159.8	170.9	-158.5	0	0	108.2	M6 R10	M6-E8 PolarHBondContact O-N 3.23Å; E8-R10 PolarHBondContact O-N 3.04Å
9	V	33.5	Very low	53.9	Low	133 Å²	133	121.8 Å²	121.8	81%	0.806	63%	0.627	S	S	*	*			trans	-58.5	105.6	179.1	176.8	0	0	0	0	106.9	P7 S11	P7-V9 PolarHBondContact O-N 2.9Å; V9-S11 PolarHBondContact O-N 2.97Å
10	R	37.1	Very low	56	Low	238 Å²	238	115.8 Å²	115.8	90%	0.898	60%	0.595	S	S	*	*			trans	-55.2	110.6	167.7	-73.2	-177.8	174.5	-175.9	-1	106.4	E8 E12	E8-R10 PolarHBondContact O-N 3.04Å; R10-E12 PolarHBondContact O-N 2.83Å
11	S	42.8	Very low	57.7	Low	86 Å²	86	111 Å²	111	60%	0.601	57%	0.572	S	S	*	*			trans	-50.9	129.2	177.7	59.9	0	0	0	0	108.7	V9 D13	V9-S11 PolarHBondContact O-N 2.97Å; S11-D13 PolarHBondContact O-N 3.26Å
12	E	43	Very low	60.3	Low	180 Å²	180	100 Å²	100	84%	0.841	52%	0.518	S	S	*	.			trans	-41.5	131	163.5	-72.7	175.2	148.2	0	0	108.6	R10 S14	R10-E12 PolarHBondContact O-N 2.83Å; E12-S14 PolarHBondContact O-N 2.79Å
13	D	54.8	Low	62.9	Low	128 Å²	128	90.5 Å²	90.5	68%	0.684	48%	0.479	S	S	*	.			trans	-59.9	80.8	-178.5	-91.3	-22.5	0	0	0	109.8	S11 V15	S11-D13 PolarHBondContact O-N 3.26Å; D13-V15 PolarHBondContact O-N 2.76Å
14	S	79.5	Confident	65.4	Low	58 Å²	58	89.9 Å²	89.9	41%	0.406	47%	0.466	S	S	.	.			trans	-61.2	113.1	-175.8	50.2	0	0	0	0	108.7	E12 V16 R115	E12-S14 PolarHBondContact O-N 2.79Å; S14-V16 WeakPolarHBondContact O-CG2 3.4Å; S14-V16 PolarHBondContact O-N 3Å; S14-V16 VanDerWaalsContact O-N 3.14Å; S14-R115 PolarHBondContact OG-NH2 3.24Å
15	V	93.1	Very high	67.9	Low	82 Å²	82	84.3 Å²	84.3	50%	0.497	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-61.4	118.5	177	176.6	0	0	0	0	108.1	D13	D13-V15 PolarHBondContact O-N 2.76Å
16	V	96.6	Very high	70.1	Confident	9 Å²	9	77.7 Å²	77.7	6%	0.055	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	139.5	177.4	-179.4	0	0	0	0	109	S14 Y18 S53 S54 L72 T112 L116	S14-V16 WeakPolarHBondContact O-CG2 3.4Å; S14-V16 PolarHBondContact O-N 3Å; S14-V16 VanDerWaalsContact O-N 3.14Å; V16-Y18 HydrophobicContact CB-CD2 4.46Å; V16-Y18 HydrophobicContact CB-CE1 4.29Å; V16-Y18 HydrophobicContact CB-CE2 3.61Å; V16-Y18 WeakPolarHBondContact CB-OH 3.32Å; V16-Y18 HydrophobicContact CG1-CD1 4.2Å; V16-Y18 HydrophobicContact CG1-CD2 4.33Å; V16-Y18 HydrophobicContact CG1-CE1 3.57Å; V16-Y18 HydrophobicContact CG1-CE2 3.74Å; V16-Y18 WeakPolarHBondContact CG1-OH 3.37Å; V16-Y18 WeakPolarHBondContact O-CD2 3.27Å; V16-Y18 WeakPolarHBondContact O-CE2 3.29Å; V16-S53 WeakPolarHBondContact O-CA 3.42Å; V16-S54 PolarHBondContact N-O 2.69Å; V16-S54 PolarHBondContact O-N 2.99Å; V16-L72 HydrophobicContact CG1-CD1 3.34Å; V16-T112 HydrophobicContact CG1-CG2 4.26Å; V16-T112 HydrophobicContact CG2-CG2 4.21Å; V16-L116 HydrophobicContact CG1-CD1 4.23Å
17	R	97.5	Very high	73	Confident	100 Å²	100	71.3 Å²	71.3	38%	0.377	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	127.8	176.7	-157	163.1	179.1	169.7	3.8	110.9	Y44 L73	R17-Y44 PolarHBondContact NH2-OH 3.14Å; R17-L73 HydrophobicContact CB-CB 4.22Å; R17-L73 HydrophobicContact CB-CD2 4.41Å; R17-L73 HydrophobicContact CG-CB 4.14Å; R17-L73 HydrophobicContact CG-CD2 3.59Å; R17-L73 HydrophobicContact CG-CG 4.45Å; R17-L73 WeakPolarHBondContact O-CB 3.44Å; R17-L73 PolarHBondContact O-N 2.65Å
18	Y	98	Very high	75.7	Confident	3 Å²	3	69.7 Å²	69.7	1%	0.012	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	161	-176.4	-57.9	-79.6	0	0	0	110.6	V16 L51 F52 I58 V61 L70 F71 L116 L273	V16-Y18 HydrophobicContact CB-CD2 4.46Å; V16-Y18 HydrophobicContact CB-CE1 4.29Å; V16-Y18 HydrophobicContact CB-CE2 3.61Å; V16-Y18 WeakPolarHBondContact CB-OH 3.32Å; V16-Y18 HydrophobicContact CG1-CD1 4.2Å; V16-Y18 HydrophobicContact CG1-CD2 4.33Å; V16-Y18 HydrophobicContact CG1-CE1 3.57Å; V16-Y18 HydrophobicContact CG1-CE2 3.74Å; V16-Y18 WeakPolarHBondContact CG1-OH 3.37Å; V16-Y18 WeakPolarHBondContact O-CD2 3.27Å; V16-Y18 WeakPolarHBondContact O-CE2 3.29Å; Y18-L51 WeakPolarHBondContact O-CA 3.17Å; Y18-F52 HydrophobicContact CD2-CD2 4.19Å; Y18-F52 AromaticContact CD2-CE2 3.64Å; Y18-F52 HydrophobicContact CD2-CE2 3.64Å; Y18-F52 HydrophobicContact CD2-CZ 4.12Å; Y18-F52 HydrophobicContact CG-CE2 4.11Å; Y18-F52 HydrophobicContact CG-CZ 4.11Å; Y18-F52 PolarHBondContact N-O 3.02Å; Y18-F52 PolarHBondContact O-N 2.9Å; Y18-F52 VanDerWaalsContact O-N 3.08Å; Y18-I58 HydrophobicContact CE1-CD1 4.27Å; Y18-V61 HydrophobicContact CE2-CG2 4.28Å; Y18-L70 HydrophobicContact CD1-CD1 4Å; Y18-L70 HydrophobicContact CG-CD1 4.33Å; Y18-F71 WeakPolarHBondContact CA-O 3.42Å; Y18-L116 HydrophobicContact CE1-CD1 4.24Å; Y18-L273 HydrophobicContact CD1-CD1 3.74Å; Y18-L273 HydrophobicContact CE1-CD1 3.6Å
19	Y	97.5	Very high	78.2	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	151.8	151.3	73.3	-89.7	0	0	0	110.9	K49 V50 F71 L73 Y261 L268	Y19-K49 HydrophobicContact CD2-CD 4.28Å; Y19-K49 HydrophobicContact CE2-CD 4.42Å; Y19-V50 CarbonylContact C-O 3.56Å; Y19-V50 WeakPolarHBondContact CA-O 3.21Å; Y19-V50 WeakPolarHBondContact CB-O 3.47Å; Y19-F71 HydrophobicContact CD1-CB 3.74Å; Y19-F71 HydrophobicContact CD2-CB 4.14Å; Y19-F71 AromaticContact CD2-CD2 3.78Å; Y19-F71 HydrophobicContact CD2-CD2 3.78Å; Y19-F71 HydrophobicContact CD2-CG 4.2Å; Y19-F71 HydrophobicContact CE1-CB 3.37Å; Y19-F71 HydrophobicContact CE1-CD2 4.45Å; Y19-F71 AromaticContact CE1-CG 3.92Å; Y19-F71 HydrophobicContact CE1-CG 3.92Å; Y19-F71 HydrophobicContact CE2-CB 3.77Å; Y19-F71 HydrophobicContact CE2-CD1 4.24Å; Y19-F71 AromaticContact CE2-CD2 3.23Å; Y19-F71 HydrophobicContact CE2-CD2 3.23Å; Y19-F71 AromaticContact CE2-CE2 3.79Å; Y19-F71 HydrophobicContact CE2-CE2 3.79Å; Y19-F71 AromaticContact CE2-CG 3.49Å; Y19-F71 HydrophobicContact CE2-CG 3.49Å; Y19-F71 VanDerWaalsContact CE2-CG 3.49Å; Y19-F71 HydrophobicContact CE2-CZ 4.49Å; Y19-F71 HydrophobicContact CG-CB 4.11Å; Y19-F71 AromaticContact CZ-CD1 3.8Å; Y19-F71 AromaticContact CZ-CD2 3.63Å; Y19-F71 AromaticContact CZ-CG 3.32Å; Y19-F71 PolarHBondContact N-O 3.21Å; Y19-F71 PolarHBondContact O-N 2.64Å; Y19-F71 WeakPolarHBondContact OH-CD1 3.47Å; Y19-F71 WeakPolarHBondContact OH-CG 3.38Å; Y19-L73 HydrophobicContact CD1-CB 4.21Å; Y19-L73 HydrophobicContact CD1-CD1 3.67Å; Y19-L73 HydrophobicContact CE1-CD1 4.17Å; Y19-Y261 HydrophobicContact CE2-CE2 4.27Å; Y19-Y261 WeakPolarHBondContact OH-CE2 3.47Å; Y19-L268 HydrophobicContact CD1-CD2 4.25Å; Y19-L268 HydrophobicContact CD1-CG 4.46Å; Y19-L268 HydrophobicContact CD2-CD2 4.01Å; Y19-L268 HydrophobicContact CE1-CD2 4.17Å; Y19-L268 HydrophobicContact CE1-CG 4.24Å; Y19-L268 HydrophobicContact CE2-CD2 3.97Å; Y19-L268 HydrophobicContact CG-CD2 4.16Å
20	C	96	Very high	81	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	143.5	173.9	-74.1	0	0	0	0	110.1	L30 K49 V50 A67 R69 L70	C20-L30 HydrophobicContact CB-CD2 3.68Å; C20-K49 CarbonylContact O-C 3.58Å; C20-K49 WeakPolarHBondContact O-CA 3.4Å; C20-K49 WeakPolarHBondContact O-CB 3.24Å; C20-V50 PolarHBondContact N-O 2.89Å; C20-V50 PolarHBondContact O-N 3.41Å; C20-A67 HydrophobicContact CB-CB 3.74Å; C20-R69 CarbonylContact C-O 3.53Å; C20-R69 WeakPolarHBondContact CA-O 3.48Å; C20-L70 WeakPolarHBondContact SG-CD1 3.49Å
21	T	93.1	Very high	83.7	Confident	17 Å²	17	46 Å²	46	10%	0.104	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	147.2	161.1	61.8	0	0	0	0	109.3	G48 K49 E68 R69 F71	T21-G48 WeakPolarHBondContact CA-O 3.37Å; T21-K49 HydrophobicContact CG2-CG 4.39Å; T21-E68 PolarHBondContact O-N 3.43Å; T21-R69 PolarHBondContact N-O 2.7Å; T21-R69 WeakPolarHBondContact OG1-CB 3.29Å; T21-R69 PolarHBondContact OG1-N 2.99Å; T21-F71 HydrophobicContact CG2-CE2 3.93Å
22	A	89.2	Confident	86	Confident	5 Å²	5	45.4 Å²	45.4	4%	0.041	25%	0.249	C	C	.	.			trans	-140.9	146.5	176.9	0	0	0	0	0	108.5	M26 E27 L30 G48	A22-M26 HydrophobicContact CB-CB 3.82Å; A22-E27 HydrophobicContact CB-CG 4.37Å; A22-L30 HydrophobicContact CB-CD2 3.89Å; A22-G48 PolarHBondContact N-O 3.34Å; A22-G48 CarbonylContact O-C 3.57Å; A22-G48 WeakPolarHBondContact O-CA 3.41Å
23	G	82.4	Confident	88.3	Confident	7 Å²	7	36.9 Å²	36.9	7%	0.072	21%	0.209	C	C	.	.			trans	-61.4	155.5	172.9	0	0	0	0	0	111.2	G25 M26 E68	G23-G25 PolarHBondContact O-N 3.48Å; G23-M26 WeakPolarHBondContact O-CB 3.25Å; G23-M26 WeakPolarHBondContact O-CG 3.46Å; G23-M26 PolarHBondContact O-N 3.33Å; G23-E68 PolarHBondContact N-OE1 2.94Å
24	N	80.8	Confident	90.2	Very high	98 Å²	98	30.8 Å²	30.8	52%	0.524	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	130.4	177.7	-66.6	-15.3	0	0	0	110.5	M26 V487 S488	N24-M26 VanDerWaalsContact C-N 3.31Å; N24-V487 CarbonylContact O-C 3.57Å; N24-V487 WeakPolarHBondContact O-CA 3.41Å; N24-S488 PolarHBondContact O-N 2.92Å
25	G	80.2	Confident	91	Very high	27 Å²	27	33.4 Å²	33.4	28%	0.278	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.9	-6.9	-176.5	0	0	0	0	0	114	G23 E27 F29	G23-G25 PolarHBondContact O-N 3.48Å; G25-E27 WeakPolarHBondContact CA-OE2 3.35Å; G25-E27 PolarHBondContact N-OE2 3.04Å; G25-F29 WeakPolarHBondContact O-CD2 3.28Å
26	M	83.6	Confident	90.9	Very high	17 Å²	17	34.9 Å²	34.9	8%	0.084	18%	0.177	C	C	.	.			trans	-87.1	-19.6	177.7	-65.5	-59.7	-68.1	0	0	113.9	A22 G23 N24 F29 L30 A66 I294	A22-M26 HydrophobicContact CB-CB 3.82Å; G23-M26 WeakPolarHBondContact O-CB 3.25Å; G23-M26 WeakPolarHBondContact O-CG 3.46Å; G23-M26 PolarHBondContact O-N 3.33Å; N24-M26 VanDerWaalsContact C-N 3.31Å; M26-F29 WeakPolarHBondContact O-CB 3.45Å; M26-F29 PolarHBondContact O-N 3.29Å; M26-F29 VanDerWaalsContact O-N 3.12Å; M26-L30 PolarHBondContact O-N 3.21Å; M26-A66 HydrophobicContact CE-CB 3.78Å; M26-I294 HydrophobicContact CE-CD1 3.91Å; M26-I294 HydrophobicContact CE-CG1 3.4Å; M26-I294 HydrophobicContact CG-CD1 4.43Å; M26-I294 HydrophobicContact SD-CD1 2.97Å; M26-I294 WeakPolarHBondContact SD-CD1 3.16Å; M26-I294 HydrophobicContact SD-CG1 3.14Å; M26-I294 WeakPolarHBondContact SD-CG1 3.37Å
27	E	89.8	Confident	90.6	Very high	16 Å²	16	36.9 Å²	36.9	8%	0.075	19%	0.185	C	C	.	.	H	α-helix	trans	-56.5	-44.8	-173.1	-54	90.4	148.6	0	0	112	A22 G25 F29 L30 V31 H45 G48 V50	A22-E27 HydrophobicContact CB-CG 4.37Å; G25-E27 WeakPolarHBondContact CA-OE2 3.35Å; G25-E27 PolarHBondContact N-OE2 3.04Å; E27-F29 VanDerWaalsContact C-N 3.35Å; E27-F29 PolarHBondContact O-N 3.15Å; E27-L30 PolarHBondContact O-N 2.99Å; E27-V31 VanDerWaalsContact O-CG2 3.29Å; E27-V31 WeakPolarHBondContact O-CG2 3.29Å; E27-V31 PolarHBondContact O-N 3.03Å; E27-H45 HydrophobicContact CB-CB 3.95Å; E27-G48 WeakPolarHBondContact OE1-CA 3.06Å; E27-G48 PolarHBondContact OE1-N 2.89Å; E27-V50 HydrophobicContact CB-CG2 4.07Å
28	P	88.2	Confident	90.6	Very high	74 Å²	74	32.2 Å²	32.2	48%	0.481	17%	0.168	S	C	.	.	H	α-helix	trans	-62.7	-38.8	177.5	-23	35.5	0	0	0	113.3	V31 D32	P28-V31 PolarHBondContact O-N 3.35Å; P28-D32 PolarHBondContact O-N 3.04Å
29	F	86.6	Confident	90.4	Very high	35 Å²	35	35.7 Å²	35.7	15%	0.154	20%	0.197	C	C	.	.	H	α-helix	trans	-66.7	-39.8	177.4	-64.9	-82	0	0	0	111.7	G25 M26 E27 D32 E33 A66 I294 L485	G25-F29 WeakPolarHBondContact O-CD2 3.28Å; M26-F29 WeakPolarHBondContact O-CB 3.45Å; M26-F29 PolarHBondContact O-N 3.29Å; M26-F29 VanDerWaalsContact O-N 3.12Å; E27-F29 VanDerWaalsContact C-N 3.35Å; E27-F29 PolarHBondContact O-N 3.15Å; F29-D32 PolarHBondContact O-N 2.96Å; F29-E33 VanDerWaalsContact O-CB 3.29Å; F29-E33 WeakPolarHBondContact O-CB 3.46Å; F29-E33 PolarHBondContact O-N 3.21Å; F29-A66 HydrophobicContact CB-CB 4.2Å; F29-I294 HydrophobicContact CD2-CG2 4.35Å; F29-I294 HydrophobicContact CE1-CG2 4.11Å; F29-I294 HydrophobicContact CE2-CG2 3.94Å; F29-I294 HydrophobicContact CZ-CG2 3.82Å; F29-L485 HydrophobicContact CE2-CD2 4.08Å; F29-L485 HydrophobicContact CZ-CD1 3.75Å; F29-L485 HydrophobicContact CZ-CD2 3.84Å; F29-L485 HydrophobicContact CZ-CG 4.33Å
30	L	90.9	Very high	90.4	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-69.4	-38.1	176.7	-179.8	55.6	0	0	0	111.6	C20 A22 M26 E27 E33 V34 V50 L64 A66 A67	C20-L30 HydrophobicContact CB-CD2 3.68Å; A22-L30 HydrophobicContact CB-CD2 3.89Å; M26-L30 PolarHBondContact O-N 3.21Å; E27-L30 PolarHBondContact O-N 2.99Å; L30-E33 PolarHBondContact O-N 3.04Å; L30-V34 HydrophobicContact CD1-CG1 3.85Å; L30-V34 HydrophobicContact CG-CG1 4.42Å; L30-V34 WeakPolarHBondContact O-CG1 3.42Å; L30-V34 WeakPolarHBondContact O-CG2 3.36Å; L30-V34 PolarHBondContact O-N 3Å; L30-V50 HydrophobicContact CB-CG2 3.89Å; L30-V50 HydrophobicContact CD2-CB 3.77Å; L30-V50 HydrophobicContact CD2-CG2 3.68Å; L30-V50 HydrophobicContact CG-CB 3.94Å; L30-V50 HydrophobicContact CG-CG1 4.3Å; L30-V50 HydrophobicContact CG-CG2 3.8Å; L30-L64 HydrophobicContact CD1-CD1 4.24Å; L30-L64 HydrophobicContact CD1-CD2 4.35Å; L30-A66 HydrophobicContact CB-CB 3.73Å; L30-A66 HydrophobicContact CD1-CB 4.15Å; L30-A66 HydrophobicContact CG-CB 4.49Å; L30-A67 HydrophobicContact CD1-CB 3.76Å; L30-A67 HydrophobicContact CD2-CB 3.83Å; L30-A67 HydrophobicContact CG-CB 4.49Å
31	V	93.9	Very high	90.4	Very high	23 Å²	23	41.7 Å²	41.7	14%	0.139	23%	0.227	C	C	.	.	H	α-helix	trans	-58.1	-48.7	172.5	165.6	0	0	0	0	111.2	E27 P28 E33 V34 K35 V43 H45 V50	E27-V31 VanDerWaalsContact O-CG2 3.29Å; E27-V31 WeakPolarHBondContact O-CG2 3.29Å; E27-V31 PolarHBondContact O-N 3.03Å; P28-V31 PolarHBondContact O-N 3.35Å; V31-E33 VanDerWaalsContact C-N 3.32Å; V31-E33 PolarHBondContact O-N 3.4Å; V31-V34 WeakPolarHBondContact O-CG2 3.31Å; V31-K35 HydrophobicContact CG1-CD 4.32Å; V31-K35 WeakPolarHBondContact O-CG 3.37Å; V31-K35 PolarHBondContact O-N 3.45Å; V31-V43 HydrophobicContact CB-CG1 4.25Å; V31-V43 HydrophobicContact CG1-CG1 3.85Å; V31-V43 HydrophobicContact CG2-CG1 4.08Å; V31-H45 HydrophobicContact CG2-CB 4.07Å; V31-V50 HydrophobicContact CG2-CG1 3.79Å; V31-V50 HydrophobicContact CG2-CG2 4.01Å
32	D	90.8	Very high	90.5	Very high	75 Å²	75	45.5 Å²	45.5	40%	0.401	25%	0.246	S	C	.	.	H	α-helix	trans	-61.6	-42.3	174.4	174.8	72.7	0	0	0	111.5	P28 F29 K35 R36 R297	P28-D32 PolarHBondContact O-N 3.04Å; F29-D32 PolarHBondContact O-N 2.96Å; D32-K35 PolarHBondContact O-N 3.29Å; D32-R36 WeakPolarHBondContact O-CB 3.32Å; D32-R36 PolarHBondContact O-N 3.38Å; D32-R36 IonicContact OD2-NE 3.4Å; D32-R36 IonicContact OD2-NH2 2.65Å; D32-R297 IonicContact OD2-CZ 3.49Å; D32-R297 IonicContact OD2-NE 3.41Å; D32-R297 IonicContact OD2-NH2 3.43Å; D32-R297 PolarHBondContact OD2-NH2 3.44Å
33	E	90.9	Very high	90.9	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.3	-47.3	-178.4	-169.6	178.6	-156.1	0	0	113	F29 L30 V31 K37 L64 K65 A66	F29-E33 VanDerWaalsContact O-CB 3.29Å; F29-E33 WeakPolarHBondContact O-CB 3.46Å; F29-E33 PolarHBondContact O-N 3.21Å; L30-E33 PolarHBondContact O-N 3.04Å; V31-E33 VanDerWaalsContact C-N 3.32Å; V31-E33 PolarHBondContact O-N 3.4Å; E33-K37 HydrophobicContact CG-CD 3.7Å; E33-K37 HydrophobicContact CG-CG 4.06Å; E33-K37 WeakPolarHBondContact O-CA 3.29Å; E33-K37 VanDerWaalsContact O-CB 3.24Å; E33-K37 WeakPolarHBondContact O-CB 3.31Å; E33-K37 PolarHBondContact O-N 2.79Å; E33-K37 WeakPolarHBondContact OE1-CE 3.32Å; E33-K37 IonicContact OE1-NZ 3.51Å; E33-K37 PolarHBondContact OE1-NZ 2.81Å; E33-L64 HydrophobicContact CB-CD2 4.41Å; E33-L64 HydrophobicContact CG-CD2 3.68Å; E33-K65 VanDerWaalsContact CD-N 3.26Å; E33-K65 WeakPolarHBondContact OE1-CB 2.81Å; E33-K65 PolarHBondContact OE1-N 3.01Å; E33-K65 PolarHBondContact OE2-N 3.32Å; E33-A66 WeakPolarHBondContact OE2-CB 3.5Å; E33-A66 PolarHBondContact OE2-N 3.36Å
34	V	95.6	Very high	91.6	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-67.7	-38.6	179.8	-60.5	0	0	0	0	111.4	L30 V31 L38 A39 A40 V43 V50 F52 L64	L30-V34 HydrophobicContact CD1-CG1 3.85Å; L30-V34 HydrophobicContact CG-CG1 4.42Å; L30-V34 WeakPolarHBondContact O-CG1 3.42Å; L30-V34 WeakPolarHBondContact O-CG2 3.36Å; L30-V34 PolarHBondContact O-N 3Å; V31-V34 WeakPolarHBondContact O-CG2 3.31Å; V34-L38 HydrophobicContact CB-CD1 4.31Å; V34-L38 HydrophobicContact CG1-CD1 4.2Å; V34-L38 CarbonylContact O-C 3.58Å; V34-L38 WeakPolarHBondContact O-CA 3.24Å; V34-L38 VanDerWaalsContact O-CB 3.26Å; V34-L38 WeakPolarHBondContact O-CB 3.47Å; V34-L38 PolarHBondContact O-N 3.36Å; V34-A39 PolarHBondContact O-N 3.36Å; V34-A40 HydrophobicContact CB-CB 3.89Å; V34-A40 HydrophobicContact CG2-CB 4.03Å; V34-A40 VanDerWaalsContact O-CB 3.3Å; V34-A40 WeakPolarHBondContact O-CB 3.19Å; V34-A40 PolarHBondContact O-N 3.45Å; V34-V43 HydrophobicContact CG2-CG1 3.62Å; V34-V43 HydrophobicContact CG2-CG2 4.11Å; V34-V50 HydrophobicContact CG2-CG1 4.47Å; V34-F52 HydrophobicContact CB-CD1 4.41Å; V34-F52 HydrophobicContact CB-CD2 4.25Å; V34-F52 HydrophobicContact CB-CE2 4.48Å; V34-F52 HydrophobicContact CB-CG 4.21Å; V34-F52 HydrophobicContact CG1-CD1 3.95Å; V34-F52 HydrophobicContact CG1-CD2 4.35Å; V34-F52 HydrophobicContact CG1-CE1 3.81Å; V34-F52 HydrophobicContact CG1-CE2 4.21Å; V34-F52 HydrophobicContact CG1-CG 4.23Å; V34-F52 HydrophobicContact CG1-CZ 3.94Å; V34-F52 HydrophobicContact CG2-CB 4.26Å; V34-F52 HydrophobicContact CG2-CD1 4.43Å; V34-F52 HydrophobicContact CG2-CG 4.23Å; V34-L64 HydrophobicContact CG1-CD1 3.9Å; V34-L64 HydrophobicContact CG1-CD2 3.88Å
35	K	95.4	Very high	92.2	Very high	114 Å²	114	49.6 Å²	49.6	50%	0.496	26%	0.259	S	S	.	.	H	α-helix	trans	-60.9	-50.3	176.9	-76.1	-179.2	176.6	-174.7	0	111.1	V31 D32 A39 V43	V31-K35 HydrophobicContact CG1-CD 4.32Å; V31-K35 WeakPolarHBondContact O-CG 3.37Å; V31-K35 PolarHBondContact O-N 3.45Å; D32-K35 PolarHBondContact O-N 3.29Å; K35-A39 VanDerWaalsContact O-CA 3.24Å; K35-A39 WeakPolarHBondContact O-CA 3.24Å; K35-A39 PolarHBondContact O-N 2.91Å; K35-A39 VanDerWaalsContact O-N 3.16Å; K35-V43 HydrophobicContact CG-CB 4.28Å; K35-V43 HydrophobicContact CG-CG1 4.38Å; K35-V43 HydrophobicContact CG-CG2 3.89Å
36	R	91.8	Very high	92.8	Very high	113 Å²	113	49.6 Å²	49.6	43%	0.426	25%	0.252	S	S	.	.	H	α-helix	trans	-79.6	-42.9	-174.4	-179.6	-174.8	43.8	60.1	18.8	113.4	D32	D32-R36 WeakPolarHBondContact O-CB 3.32Å; D32-R36 PolarHBondContact O-N 3.38Å; D32-R36 IonicContact OD2-NE 3.4Å; D32-R36 IonicContact OD2-NH2 2.65Å
37	K	91.4	Very high	93.1	Very high	50 Å²	50	53.5 Å²	53.5	22%	0.217	28%	0.279	C	S	.	.	H	α-helix	trans	-83.8	-25.7	-177	-67.3	-168.1	178.7	168.6	0	113.3	E33 R60	E33-K37 HydrophobicContact CG-CD 3.7Å; E33-K37 HydrophobicContact CG-CG 4.06Å; E33-K37 WeakPolarHBondContact O-CA 3.29Å; E33-K37 VanDerWaalsContact O-CB 3.24Å; E33-K37 WeakPolarHBondContact O-CB 3.31Å; E33-K37 PolarHBondContact O-N 2.79Å; E33-K37 WeakPolarHBondContact OE1-CE 3.32Å; E33-K37 IonicContact OE1-NZ 3.51Å; E33-K37 PolarHBondContact OE1-NZ 2.81Å; K37-R60 PolarHBondContact O-NH2 3.19Å
38	L	95.8	Very high	93.1	Very high	3 Å²	3	53.3 Å²	53.3	2%	0.016	28%	0.281	C	S	.	.	H	α-helix	trans	-122.2	4.5	-172	-49.6	178.4	0	0	0	113.3	V34 A40 F52 S54 A56 R60 V61 L64	V34-L38 HydrophobicContact CB-CD1 4.31Å; V34-L38 HydrophobicContact CG1-CD1 4.2Å; V34-L38 CarbonylContact O-C 3.58Å; V34-L38 WeakPolarHBondContact O-CA 3.24Å; V34-L38 VanDerWaalsContact O-CB 3.26Å; V34-L38 WeakPolarHBondContact O-CB 3.47Å; V34-L38 PolarHBondContact O-N 3.36Å; L38-A40 HydrophobicContact CB-CB 4.45Å; L38-A40 PolarHBondContact O-N 3.38Å; L38-A40 VanDerWaalsContact O-N 3.12Å; L38-F52 HydrophobicContact CD1-CE2 3.8Å; L38-F52 HydrophobicContact CD1-CZ 4.22Å; L38-S54 PolarHBondContact O-OG 2.92Å; L38-A56 HydrophobicContact CB-CB 4.03Å; L38-A56 HydrophobicContact CD2-CB 3.85Å; L38-A56 HydrophobicContact CG-CB 4.5Å; L38-R60 HydrophobicContact CD2-CB 3.7Å; L38-V61 HydrophobicContact CD1-CB 4.41Å; L38-V61 HydrophobicContact CD1-CG1 4.29Å; L38-V61 HydrophobicContact CD1-CG2 4.15Å; L38-V61 HydrophobicContact CD2-CG2 4.46Å; L38-L64 HydrophobicContact CD1-CD1 3.94Å; L38-L64 HydrophobicContact CD1-CD2 3.86Å; L38-L64 HydrophobicContact CD1-CG 4.08Å; L38-L64 HydrophobicContact CG-CD2 4.29Å
39	A	95	Very high	93.3	Very high	75 Å²	75	50.8 Å²	50.8	62%	0.62	26%	0.263	S	S	*	.			trans	48.1	38.7	-172.9	0	0	0	0	0	111.6	V34 K35	V34-A39 PolarHBondContact O-N 3.36Å; K35-A39 VanDerWaalsContact O-CA 3.24Å; K35-A39 WeakPolarHBondContact O-CA 3.24Å; K35-A39 PolarHBondContact O-N 2.91Å; K35-A39 VanDerWaalsContact O-N 3.16Å
40	A	96.7	Very high	93.8	Very high	12 Å²	12	49.1 Å²	49.1	10%	0.099	26%	0.255	C	S	.	.			trans	-69.6	142.1	-169.1	0	0	0	0	0	112.1	V34 L38 V43 F52 S53	V34-A40 HydrophobicContact CB-CB 3.89Å; V34-A40 HydrophobicContact CG2-CB 4.03Å; V34-A40 VanDerWaalsContact O-CB 3.3Å; V34-A40 WeakPolarHBondContact O-CB 3.19Å; V34-A40 PolarHBondContact O-N 3.45Å; L38-A40 HydrophobicContact CB-CB 4.45Å; L38-A40 PolarHBondContact O-N 3.38Å; L38-A40 VanDerWaalsContact O-N 3.12Å; A40-V43 HydrophobicContact CB-CG2 3.7Å; A40-V43 WeakPolarHBondContact O-CG2 3.36Å; A40-F52 HydrophobicContact CB-CB 4.06Å; A40-F52 HydrophobicContact CB-CD2 3.87Å; A40-F52 HydrophobicContact CB-CG 4.32Å; A40-S53 CarbonylContact C-O 3.58Å; A40-S53 VanDerWaalsContact CA-O 3.24Å; A40-S53 WeakPolarHBondContact CA-O 3.26Å
41	Q	96.5	Very high	94.2	Very high	115 Å²	115	49.1 Å²	49.1	54%	0.537	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	169.4	177	-57.5	177.4	31.8	0	0	109.8	V43 S53	Q41-V43 WeakPolarHBondContact O-CG2 3.32Å; Q41-V43 PolarHBondContact O-N 3.27Å; Q41-V43 VanDerWaalsContact O-N 3.09Å; Q41-S53 PolarHBondContact N-O 3.29Å; Q41-S53 PolarHBondContact O-N 3.04Å
42	D	95.9	Very high	94.4	Very high	96 Å²	96	48 Å²	48	51%	0.513	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	48.9	38.4	-179.8	-50.4	-46.2	0	0	0	113.8	Y44 S53	D42-Y44 WeakPolarHBondContact O-CD1 3.38Å; D42-Y44 VanDerWaalsContact O-CE1 3.3Å; D42-Y44 WeakPolarHBondContact O-CE1 3.38Å; D42-Y44 PolarHBondContact O-N 3Å; D42-S53 PolarHBondContact OD2-OG 3.5Å
43	V	97.6	Very high	94.7	Very high	27 Å²	27	44.8 Å²	44.8	16%	0.164	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	116.2	-172.1	-171	0	0	0	0	110.3	V31 V34 K35 A40 Q41 V50 L51 F52	V31-V43 HydrophobicContact CB-CG1 4.25Å; V31-V43 HydrophobicContact CG1-CG1 3.85Å; V31-V43 HydrophobicContact CG2-CG1 4.08Å; V34-V43 HydrophobicContact CG2-CG1 3.62Å; V34-V43 HydrophobicContact CG2-CG2 4.11Å; K35-V43 HydrophobicContact CG-CB 4.28Å; K35-V43 HydrophobicContact CG-CG1 4.38Å; K35-V43 HydrophobicContact CG-CG2 3.89Å; A40-V43 HydrophobicContact CB-CG2 3.7Å; A40-V43 WeakPolarHBondContact O-CG2 3.36Å; Q41-V43 WeakPolarHBondContact O-CG2 3.32Å; Q41-V43 PolarHBondContact O-N 3.27Å; Q41-V43 VanDerWaalsContact O-N 3.09Å; V43-V50 HydrophobicContact CG1-CG1 4.25Å; V43-L51 WeakPolarHBondContact CA-O 3.18Å; V43-F52 HydrophobicContact CB-CB 4.5Å; V43-F52 HydrophobicContact CG1-CB 4.44Å; V43-F52 HydrophobicContact CG2-CB 3.93Å
44	Y	95.9	Very high	95	Very high	73 Å²	73	44.9 Å²	44.9	29%	0.286	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	164.8	169.6	56.4	-81.8	0	0	0	109.8	R17 D42 L51 Q76	R17-Y44 PolarHBondContact NH2-OH 3.14Å; D42-Y44 WeakPolarHBondContact O-CD1 3.38Å; D42-Y44 VanDerWaalsContact O-CE1 3.3Å; D42-Y44 WeakPolarHBondContact O-CE1 3.38Å; D42-Y44 PolarHBondContact O-N 3Å; Y44-L51 HydrophobicContact CD2-CB 4.43Å; Y44-L51 HydrophobicContact CD2-CD1 4.27Å; Y44-L51 HydrophobicContact CE1-CB 4.24Å; Y44-L51 HydrophobicContact CE2-CB 3.92Å; Y44-L51 HydrophobicContact CE2-CD1 3.86Å; Y44-L51 HydrophobicContact CE2-CD2 4.05Å; Y44-L51 HydrophobicContact CE2-CG 4.15Å; Y44-L51 PolarHBondContact N-O 3.05Å; Y44-L51 PolarHBondContact O-N 3.46Å; Y44-L51 VanDerWaalsContact O-O 3.14Å; Y44-Q76 PolarHBondContact OH-OE1 2.94Å
45	H	94.6	Very high	95	Very high	97 Å²	97	47.4 Å²	47.4	45%	0.449	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	153.4	177.4	73.2	-82.9	0	0	0	110.8	E27 V31 K49 V50	E27-H45 HydrophobicContact CB-CB 3.95Å; V31-H45 HydrophobicContact CG2-CB 4.07Å; H45-K49 VanDerWaalsContact CA-O 3.29Å; H45-K49 WeakPolarHBondContact CA-O 3.43Å; H45-K49 WeakPolarHBondContact CB-O 3.43Å; H45-V50 HydrophobicContact CB-CG2 3.88Å
46	I	92.4	Very high	95.1	Very high	26 Å²	26	42.5 Å²	42.5	13%	0.133	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	163.8	168.6	52.3	174.9	0	0	0	106.3	G48 K49 L51 Y266	I46-G48 PolarHBondContact O-N 3.38Å; I46-K49 HydrophobicContact CD1-CB 4.12Å; I46-K49 HydrophobicContact CD1-CD 4.08Å; I46-K49 HydrophobicContact CG1-CB 3.8Å; I46-K49 HydrophobicContact CG1-CG 4.5Å; I46-K49 PolarHBondContact N-O 3.42Å; I46-K49 PolarHBondContact O-N 2.9Å; I46-L51 HydrophobicContact CD1-CD1 3.9Å; I46-L51 HydrophobicContact CG1-CD1 3.83Å; I46-Y266 HydrophobicContact CB-CE1 4.29Å; I46-Y266 HydrophobicContact CD1-CD1 3.99Å; I46-Y266 HydrophobicContact CD1-CD2 4.27Å; I46-Y266 HydrophobicContact CD1-CE1 3.57Å; I46-Y266 HydrophobicContact CD1-CE2 3.87Å; I46-Y266 HydrophobicContact CD1-CG 4.32Å; I46-Y266 HydrophobicContact CG1-CE1 4.37Å
47	P	89.4	Confident	95.2	Very high	99 Å²	99	41 Å²	41	64%	0.643	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.8	119.3	-179.1	-29.9	36.6	0	0	0	112.9	K49	P47-K49 VanDerWaalsContact C-N 3.33Å; P47-K49 PolarHBondContact O-N 3.09Å
48	G	89.1	Confident	95.3	Very high	12 Å²	12	38.9 Å²	38.9	12%	0.124	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.6	8.3	-179.1	0	0	0	0	0	116.5	T21 A22 E27 I46	T21-G48 WeakPolarHBondContact CA-O 3.37Å; A22-G48 PolarHBondContact N-O 3.34Å; A22-G48 CarbonylContact O-C 3.57Å; A22-G48 WeakPolarHBondContact O-CA 3.41Å; E27-G48 WeakPolarHBondContact OE1-CA 3.06Å; E27-G48 PolarHBondContact OE1-N 2.89Å; I46-G48 PolarHBondContact O-N 3.38Å
49	K	94.1	Very high	95.1	Very high	22 Å²	22	45 Å²	45	10%	0.096	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	144.4	179.2	-50.1	176.4	-172.6	61.4	0	113.3	Y19 C20 T21 H45 I46 P47 Y266 L268	Y19-K49 HydrophobicContact CD2-CD 4.28Å; Y19-K49 HydrophobicContact CE2-CD 4.42Å; C20-K49 CarbonylContact O-C 3.58Å; C20-K49 WeakPolarHBondContact O-CA 3.4Å; C20-K49 WeakPolarHBondContact O-CB 3.24Å; T21-K49 HydrophobicContact CG2-CG 4.39Å; H45-K49 VanDerWaalsContact CA-O 3.29Å; H45-K49 WeakPolarHBondContact CA-O 3.43Å; H45-K49 WeakPolarHBondContact CB-O 3.43Å; I46-K49 HydrophobicContact CD1-CB 4.12Å; I46-K49 HydrophobicContact CD1-CD 4.08Å; I46-K49 HydrophobicContact CG1-CB 3.8Å; I46-K49 HydrophobicContact CG1-CG 4.5Å; I46-K49 PolarHBondContact N-O 3.42Å; I46-K49 PolarHBondContact O-N 2.9Å; P47-K49 VanDerWaalsContact C-N 3.33Å; P47-K49 PolarHBondContact O-N 3.09Å; K49-Y266 PolarHBondContact NZ-OH 2.92Å; K49-L268 HydrophobicContact CD-CD2 3.53Å
50	V	97	Very high	95.1	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	129.9	171.5	179.7	0	0	0	0	108.9	Y19 C20 E27 L30 V31 V34 V43 H45 F52	Y19-V50 CarbonylContact C-O 3.56Å; Y19-V50 WeakPolarHBondContact CA-O 3.21Å; Y19-V50 WeakPolarHBondContact CB-O 3.47Å; C20-V50 PolarHBondContact N-O 2.89Å; C20-V50 PolarHBondContact O-N 3.41Å; E27-V50 HydrophobicContact CB-CG2 4.07Å; L30-V50 HydrophobicContact CB-CG2 3.89Å; L30-V50 HydrophobicContact CD2-CB 3.77Å; L30-V50 HydrophobicContact CD2-CG2 3.68Å; L30-V50 HydrophobicContact CG-CB 3.94Å; L30-V50 HydrophobicContact CG-CG1 4.3Å; L30-V50 HydrophobicContact CG-CG2 3.8Å; V31-V50 HydrophobicContact CG2-CG1 3.79Å; V31-V50 HydrophobicContact CG2-CG2 4.01Å; V34-V50 HydrophobicContact CG2-CG1 4.47Å; V43-V50 HydrophobicContact CG1-CG1 4.25Å; H45-V50 HydrophobicContact CB-CG2 3.88Å; V50-F52 HydrophobicContact CG1-CD1 4.41Å
51	L	98.2	Very high	95	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	140.3	177.5	-62.8	89.4	0	0	0	108.7	Y18 V43 Y44 I46 L73 Q76 L268	Y18-L51 WeakPolarHBondContact O-CA 3.17Å; V43-L51 WeakPolarHBondContact CA-O 3.18Å; Y44-L51 HydrophobicContact CD2-CB 4.43Å; Y44-L51 HydrophobicContact CD2-CD1 4.27Å; Y44-L51 HydrophobicContact CE1-CB 4.24Å; Y44-L51 HydrophobicContact CE2-CB 3.92Å; Y44-L51 HydrophobicContact CE2-CD1 3.86Å; Y44-L51 HydrophobicContact CE2-CD2 4.05Å; Y44-L51 HydrophobicContact CE2-CG 4.15Å; Y44-L51 PolarHBondContact N-O 3.05Å; Y44-L51 PolarHBondContact O-N 3.46Å; Y44-L51 VanDerWaalsContact O-O 3.14Å; I46-L51 HydrophobicContact CD1-CD1 3.9Å; I46-L51 HydrophobicContact CG1-CD1 3.83Å; L51-L73 HydrophobicContact CD2-CD1 4.25Å; L51-L73 HydrophobicContact CD2-CD2 4.15Å; L51-Q76 VanDerWaalsContact CD2-OE1 3.23Å; L51-L268 HydrophobicContact CD2-CD1 3.84Å
52	F	98.2	Very high	94.8	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	157.9	-177.7	63.4	-82.5	0	0	0	112.2	Y18 V34 L38 A40 V43 V50 V61 L64	Y18-F52 HydrophobicContact CD2-CD2 4.19Å; Y18-F52 AromaticContact CD2-CE2 3.64Å; Y18-F52 HydrophobicContact CD2-CE2 3.64Å; Y18-F52 HydrophobicContact CD2-CZ 4.12Å; Y18-F52 HydrophobicContact CG-CE2 4.11Å; Y18-F52 HydrophobicContact CG-CZ 4.11Å; Y18-F52 PolarHBondContact N-O 3.02Å; Y18-F52 PolarHBondContact O-N 2.9Å; Y18-F52 VanDerWaalsContact O-N 3.08Å; V34-F52 HydrophobicContact CB-CD1 4.41Å; V34-F52 HydrophobicContact CB-CD2 4.25Å; V34-F52 HydrophobicContact CB-CE2 4.48Å; V34-F52 HydrophobicContact CB-CG 4.21Å; V34-F52 HydrophobicContact CG1-CD1 3.95Å; V34-F52 HydrophobicContact CG1-CD2 4.35Å; V34-F52 HydrophobicContact CG1-CE1 3.81Å; V34-F52 HydrophobicContact CG1-CE2 4.21Å; V34-F52 HydrophobicContact CG1-CG 4.23Å; V34-F52 HydrophobicContact CG1-CZ 3.94Å; V34-F52 HydrophobicContact CG2-CB 4.26Å; V34-F52 HydrophobicContact CG2-CD1 4.43Å; V34-F52 HydrophobicContact CG2-CG 4.23Å; L38-F52 HydrophobicContact CD1-CE2 3.8Å; L38-F52 HydrophobicContact CD1-CZ 4.22Å; A40-F52 HydrophobicContact CB-CB 4.06Å; A40-F52 HydrophobicContact CB-CD2 3.87Å; A40-F52 HydrophobicContact CB-CG 4.32Å; V43-F52 HydrophobicContact CB-CB 4.5Å; V43-F52 HydrophobicContact CG1-CB 4.44Å; V43-F52 HydrophobicContact CG2-CB 3.93Å; V50-F52 HydrophobicContact CG1-CD1 4.41Å; F52-V61 HydrophobicContact CE2-CG1 4.36Å; F52-V61 HydrophobicContact CZ-CG1 4.01Å; F52-L64 HydrophobicContact CZ-CD1 4.06Å
53	S	97.9	Very high	94.4	Very high	6 Å²	6	42.2 Å²	42.2	4%	0.042	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	136.1	172.6	-59	0	0	0	0	109	V16 A40 Q41 D42	V16-S53 WeakPolarHBondContact O-CA 3.42Å; A40-S53 CarbonylContact C-O 3.58Å; A40-S53 VanDerWaalsContact CA-O 3.24Å; A40-S53 WeakPolarHBondContact CA-O 3.26Å; Q41-S53 PolarHBondContact N-O 3.29Å; Q41-S53 PolarHBondContact O-N 3.04Å; D42-S53 PolarHBondContact OD2-OG 3.5Å
54	S	97.1	Very high	94.1	Very high	3 Å²	3	41 Å²	41	2%	0.021	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	145.2	176.3	-177	0	0	0	0	111.7	V16 L38 A56	V16-S54 PolarHBondContact N-O 2.69Å; V16-S54 PolarHBondContact O-N 2.99Å; L38-S54 PolarHBondContact O-OG 2.92Å; S54-A56 VanDerWaalsContact OG-CB 3.24Å; S54-A56 WeakPolarHBondContact OG-CB 3.33Å; S54-A56 PolarHBondContact OG-N 3.48Å
55	S	96.1	Very high	93.6	Very high	52 Å²	52	38.5 Å²	38.5	36%	0.364	20%	0.2	S	C	.	.			trans	-89.7	-0.8	167.2	50.8	0	0	0	0	113.1	T57	S55-T57 PolarHBondContact O-N 2.91Å
56	A	95.8	Very high	93.2	Very high	11 Å²	11	34.2 Å²	34.2	9%	0.091	18%	0.181	C	C	.	.	S	Bend	trans	-62.2	140.9	-179.7	0	0	0	0	0	111	L38 S54 R60	L38-A56 HydrophobicContact CB-CB 4.03Å; L38-A56 HydrophobicContact CD2-CB 3.85Å; L38-A56 HydrophobicContact CG-CB 4.5Å; S54-A56 VanDerWaalsContact OG-CB 3.24Å; S54-A56 WeakPolarHBondContact OG-CB 3.33Å; S54-A56 PolarHBondContact OG-N 3.48Å; A56-R60 HydrophobicContact CB-CB 4.39Å
57	T	94.7	Very high	93	Very high	82 Å²	82	33.1 Å²	33.1	50%	0.503	18%	0.176	S	C	.	.			trans	-49.7	143	174.4	62.9	0	0	0	0	111.3	S55 R59 R60 V61	S55-T57 PolarHBondContact O-N 2.91Å; T57-R59 PolarHBondContact O-N 3.35Å; T57-R60 PolarHBondContact O-N 3.05Å; T57-R60 WeakPolarHBondContact OG1-CG 3.3Å; T57-V61 PolarHBondContact O-N 3.1Å
58	I	94.1	Very high	93	Very high	5 Å²	5	32.3 Å²	32.3	3%	0.026	16%	0.163	C	C	.	.	H	α-helix	trans	-54.6	-31	-179	-171.2	57.2	0	0	0	113.4	Y18 V61 C62 L70 L116 E119 L120 L273	Y18-I58 HydrophobicContact CE1-CD1 4.27Å; I58-V61 HydrophobicContact CD1-CB 4.35Å; I58-V61 PolarHBondContact O-N 3.38Å; I58-C62 PolarHBondContact O-N 3.25Å; I58-C62 PolarHBondContact O-SG 3.38Å; I58-L70 HydrophobicContact CD1-CD2 3.98Å; I58-L116 HydrophobicContact CB-CD2 3.97Å; I58-L116 HydrophobicContact CD1-CD2 4.42Å; I58-L116 HydrophobicContact CG1-CB 4.43Å; I58-L116 HydrophobicContact CG1-CD2 4.35Å; I58-E119 HydrophobicContact CG2-CB 3.67Å; I58-E119 WeakPolarHBondContact CG2-OE2 3.37Å; I58-L120 HydrophobicContact CG1-CD1 3.85Å; I58-L120 HydrophobicContact CG1-CD2 3.92Å; I58-L120 HydrophobicContact CG1-CG 3.74Å; I58-L120 HydrophobicContact CG2-CD2 4.11Å; I58-L120 HydrophobicContact CG2-CG 3.92Å; I58-L273 HydrophobicContact CD1-CD1 4Å
59	R	91.9	Very high	93.2	Very high	132 Å²	132	35.3 Å²	35.3	50%	0.498	17%	0.171	S	C	.	.	H	α-helix	trans	-57.1	-51.2	174.9	-177.3	176.4	176.7	134.7	-5.8	111.9	T57 V61 C62 D63 S123	T57-R59 PolarHBondContact O-N 3.35Å; R59-V61 VanDerWaalsContact C-N 3.25Å; R59-V61 PolarHBondContact O-N 2.93Å; R59-C62 PolarHBondContact O-N 3.48Å; R59-C62 VanDerWaalsContact O-N 3.09Å; R59-D63 VanDerWaalsContact O-CG 3.27Å; R59-D63 PolarHBondContact O-N 3.2Å; R59-S123 PolarHBondContact NH1-OG 3.11Å
60	R	93.4	Very high	93.3	Very high	129 Å²	129	34.3 Å²	34.3	49%	0.487	17%	0.167	S	C	.	.	H	α-helix	trans	-61.3	-36	177.4	-69.4	176.1	67.4	-178.6	6.9	111.8	K37 L38 A56 T57 D63	K37-R60 PolarHBondContact O-NH2 3.19Å; L38-R60 HydrophobicContact CD2-CB 3.7Å; A56-R60 HydrophobicContact CB-CB 4.39Å; T57-R60 PolarHBondContact O-N 3.05Å; T57-R60 WeakPolarHBondContact OG1-CG 3.3Å; R60-D63 PolarHBondContact O-N 3.02Å
61	V	94.7	Very high	93.3	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-67.7	-37.9	175.9	-169	0	0	0	0	111.1	Y18 L38 F52 T57 I58 R59 D63 L64 L70	Y18-V61 HydrophobicContact CE2-CG2 4.28Å; L38-V61 HydrophobicContact CD1-CB 4.41Å; L38-V61 HydrophobicContact CD1-CG1 4.29Å; L38-V61 HydrophobicContact CD1-CG2 4.15Å; L38-V61 HydrophobicContact CD2-CG2 4.46Å; F52-V61 HydrophobicContact CE2-CG1 4.36Å; F52-V61 HydrophobicContact CZ-CG1 4.01Å; T57-V61 PolarHBondContact O-N 3.1Å; I58-V61 HydrophobicContact CD1-CB 4.35Å; I58-V61 PolarHBondContact O-N 3.38Å; R59-V61 VanDerWaalsContact C-N 3.25Å; R59-V61 PolarHBondContact O-N 2.93Å; V61-D63 VanDerWaalsContact C-N 3.26Å; V61-D63 PolarHBondContact O-N 3.48Å; V61-L64 HydrophobicContact CG1-CD1 4.11Å; V61-L64 WeakPolarHBondContact O-CB 3.15Å; V61-L64 WeakPolarHBondContact O-CD1 3.11Å; V61-L64 WeakPolarHBondContact O-CG 3.33Å; V61-L64 PolarHBondContact O-N 2.95Å; V61-L70 HydrophobicContact CB-CD2 4.28Å; V61-L70 HydrophobicContact CG1-CD1 3.61Å; V61-L70 HydrophobicContact CG1-CD2 3.67Å; V61-L70 HydrophobicContact CG1-CG 4.3Å
62	C	91.9	Very high	93.3	Very high	22 Å²	22	34.7 Å²	34.7	15%	0.149	17%	0.168	C	C	.	.	H	α-helix	trans	-70.3	-20.8	173.7	-71.3	0	0	0	0	113.7	I58 R59 L64 L278	I58-C62 PolarHBondContact O-N 3.25Å; I58-C62 PolarHBondContact O-SG 3.38Å; R59-C62 PolarHBondContact O-N 3.48Å; R59-C62 VanDerWaalsContact O-N 3.09Å; C62-L64 PolarHBondContact O-N 3.43Å; C62-L278 HydrophobicContact CB-CD2 4.31Å
63	D	89.2	Confident	93.3	Very high	89 Å²	89	35.6 Å²	35.6	48%	0.476	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	2	175.8	-65.8	-26.4	0	0	0	113.3	R59 R60 V61 K65	R59-D63 VanDerWaalsContact O-CG 3.27Å; R59-D63 PolarHBondContact O-N 3.2Å; R60-D63 PolarHBondContact O-N 3.02Å; V61-D63 VanDerWaalsContact C-N 3.26Å; V61-D63 PolarHBondContact O-N 3.48Å; D63-K65 PolarHBondContact O-N 2.95Å
64	L	89.8	Confident	93.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.178	C	C	.	.			trans	-58.4	134.8	172.9	-71	172.4	0	0	0	110.9	L30 E33 V34 L38 F52 V61 C62 A67 L278 R281	L30-L64 HydrophobicContact CD1-CD1 4.24Å; L30-L64 HydrophobicContact CD1-CD2 4.35Å; E33-L64 HydrophobicContact CB-CD2 4.41Å; E33-L64 HydrophobicContact CG-CD2 3.68Å; V34-L64 HydrophobicContact CG1-CD1 3.9Å; V34-L64 HydrophobicContact CG1-CD2 3.88Å; L38-L64 HydrophobicContact CD1-CD1 3.94Å; L38-L64 HydrophobicContact CD1-CD2 3.86Å; L38-L64 HydrophobicContact CD1-CG 4.08Å; L38-L64 HydrophobicContact CG-CD2 4.29Å; F52-L64 HydrophobicContact CZ-CD1 4.06Å; V61-L64 HydrophobicContact CG1-CD1 4.11Å; V61-L64 WeakPolarHBondContact O-CB 3.15Å; V61-L64 WeakPolarHBondContact O-CD1 3.11Å; V61-L64 WeakPolarHBondContact O-CG 3.33Å; V61-L64 PolarHBondContact O-N 2.95Å; C62-L64 PolarHBondContact O-N 3.43Å; L64-A67 HydrophobicContact CB-CB 3.97Å; L64-A67 HydrophobicContact CD1-CB 4.36Å; L64-L278 HydrophobicContact CB-CD1 4.26Å; L64-R281 PolarHBondContact O-NH1 3.31Å; L64-R281 PolarHBondContact O-NH2 3.39Å; L64-R281 VanDerWaalsContact O-NH2 3.09Å
65	K	85.3	Confident	92.9	Very high	22 Å²	22	38 Å²	38	10%	0.096	18%	0.184	C	C	.	.	S	Bend	trans	-95.7	-45.4	-176.3	-68.6	-171.8	172.3	-161.4	0	112.1	E33 D63 A67 R281 L293 E322 E326	E33-K65 VanDerWaalsContact CD-N 3.26Å; E33-K65 WeakPolarHBondContact OE1-CB 2.81Å; E33-K65 PolarHBondContact OE1-N 3.01Å; E33-K65 PolarHBondContact OE2-N 3.32Å; D63-K65 PolarHBondContact O-N 2.95Å; K65-A67 VanDerWaalsContact C-N 3.25Å; K65-A67 PolarHBondContact O-N 2.88Å; K65-R281 VanDerWaalsContact CA-NH2 3.33Å; K65-R281 PolarHBondContact O-NH2 2.94Å; K65-L293 HydrophobicContact CB-CB 4.44Å; K65-L293 HydrophobicContact CB-CD1 4.14Å; K65-L293 HydrophobicContact CB-CD2 4.22Å; K65-L293 HydrophobicContact CD-CD2 4.2Å; K65-L293 HydrophobicContact CG-CD2 4.39Å; K65-L293 WeakPolarHBondContact O-CD1 3.33Å; K65-E322 WeakPolarHBondContact CE-OE2 3.15Å; K65-E322 PolarHBondContact NZ-O 3.36Å; K65-E322 VanDerWaalsContact NZ-O 3.09Å; K65-E322 IonicContact NZ-OE2 2.79Å; K65-E322 PolarHBondContact NZ-OE2 3.1Å; K65-E326 WeakPolarHBondContact CD-OE2 3.37Å; K65-E326 IonicContact NZ-OE2 3.34Å; K65-E326 PolarHBondContact NZ-OE2 2.75Å
66	A	86.3	Confident	92.8	Very high	7 Å²	7	38.7 Å²	38.7	6%	0.058	18%	0.181	C	C	.	.	S	Bend	trans	-76.5	-11	-178	0	0	0	0	0	113.9	M26 F29 L30 E33	M26-A66 HydrophobicContact CE-CB 3.78Å; F29-A66 HydrophobicContact CB-CB 4.2Å; L30-A66 HydrophobicContact CB-CB 3.73Å; L30-A66 HydrophobicContact CD1-CB 4.15Å; L30-A66 HydrophobicContact CG-CB 4.49Å; E33-A66 WeakPolarHBondContact OE2-CB 3.5Å; E33-A66 PolarHBondContact OE2-N 3.36Å
67	A	89.8	Confident	92.7	Very high	2 Å²	2	40.7 Å²	40.7	2%	0.017	19%	0.191	C	C	.	.			trans	-87.6	142.5	178.6	0	0	0	0	0	112.5	C20 L30 L64 K65 L278	C20-A67 HydrophobicContact CB-CB 3.74Å; L30-A67 HydrophobicContact CD1-CB 3.76Å; L30-A67 HydrophobicContact CD2-CB 3.83Å; L30-A67 HydrophobicContact CG-CB 4.49Å; L64-A67 HydrophobicContact CB-CB 3.97Å; L64-A67 HydrophobicContact CD1-CB 4.36Å; K65-A67 VanDerWaalsContact C-N 3.25Å; K65-A67 PolarHBondContact O-N 2.88Å; A67-L278 HydrophobicContact CB-CD1 3.74Å
68	E	88.5	Confident	92.6	Very high	82 Å²	82	40.5 Å²	40.5	38%	0.383	19%	0.192	S	C	.	.	S	Bend	trans	-95.4	-49.6	176.7	-65.4	-176.3	161.7	0	0	112.5	T21 G23 P277 L278	T21-E68 PolarHBondContact O-N 3.43Å; G23-E68 PolarHBondContact N-OE1 2.94Å; E68-P277 CarbonylContact O-C 3.59Å; E68-P277 WeakPolarHBondContact O-CA 3.4Å; E68-P277 WeakPolarHBondContact O-CB 3.41Å; E68-L278 PolarHBondContact O-N 3.24Å
69	R	93	Very high	92.6	Very high	76 Å²	76	41.6 Å²	41.6	29%	0.287	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	143.9	179.7	-58.6	-175.9	64.5	90.2	7.1	109.6	C20 T21 F71	C20-R69 CarbonylContact C-O 3.53Å; C20-R69 WeakPolarHBondContact CA-O 3.48Å; T21-R69 PolarHBondContact N-O 2.7Å; T21-R69 WeakPolarHBondContact OG1-CB 3.29Å; T21-R69 PolarHBondContact OG1-N 2.99Å; R69-F71 HydrophobicContact CB-CD2 4.38Å; R69-F71 HydrophobicContact CB-CE2 3.52Å; R69-F71 HydrophobicContact CB-CZ 4.04Å
70	L	96.3	Very high	92.5	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	134.2	-178.5	177.1	64.4	0	0	0	111	Y18 C20 I58 V61 L273 L278	Y18-L70 HydrophobicContact CD1-CD1 4Å; Y18-L70 HydrophobicContact CG-CD1 4.33Å; C20-L70 WeakPolarHBondContact SG-CD1 3.49Å; I58-L70 HydrophobicContact CD1-CD2 3.98Å; V61-L70 HydrophobicContact CB-CD2 4.28Å; V61-L70 HydrophobicContact CG1-CD1 3.61Å; V61-L70 HydrophobicContact CG1-CD2 3.67Å; V61-L70 HydrophobicContact CG1-CG 4.3Å; L70-L273 HydrophobicContact CD2-CB 4.18Å; L70-L273 HydrophobicContact CD2-CD1 4.08Å; L70-L273 HydrophobicContact CG-CB 4.14Å; L70-L273 HydrophobicContact CG-CD1 3.94Å; L70-L273 PolarHBondContact O-N 2.82Å; L70-L278 HydrophobicContact CB-CD1 4.15Å; L70-L278 HydrophobicContact CB-CD2 4.47Å; L70-L278 HydrophobicContact CB-CG 4.49Å
71	F	97.8	Very high	92.2	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	142.9	179.6	-58.7	-97.2	0	0	0	110.5	Y18 Y19 T21 R69 N259 I271 P272	Y18-F71 WeakPolarHBondContact CA-O 3.42Å; Y19-F71 HydrophobicContact CD1-CB 3.74Å; Y19-F71 HydrophobicContact CD2-CB 4.14Å; Y19-F71 AromaticContact CD2-CD2 3.78Å; Y19-F71 HydrophobicContact CD2-CD2 3.78Å; Y19-F71 HydrophobicContact CD2-CG 4.2Å; Y19-F71 HydrophobicContact CE1-CB 3.37Å; Y19-F71 HydrophobicContact CE1-CD2 4.45Å; Y19-F71 AromaticContact CE1-CG 3.92Å; Y19-F71 HydrophobicContact CE1-CG 3.92Å; Y19-F71 HydrophobicContact CE2-CB 3.77Å; Y19-F71 HydrophobicContact CE2-CD1 4.24Å; Y19-F71 AromaticContact CE2-CD2 3.23Å; Y19-F71 HydrophobicContact CE2-CD2 3.23Å; Y19-F71 AromaticContact CE2-CE2 3.79Å; Y19-F71 HydrophobicContact CE2-CE2 3.79Å; Y19-F71 AromaticContact CE2-CG 3.49Å; Y19-F71 HydrophobicContact CE2-CG 3.49Å; Y19-F71 VanDerWaalsContact CE2-CG 3.49Å; Y19-F71 HydrophobicContact CE2-CZ 4.49Å; Y19-F71 HydrophobicContact CG-CB 4.11Å; Y19-F71 AromaticContact CZ-CD1 3.8Å; Y19-F71 AromaticContact CZ-CD2 3.63Å; Y19-F71 AromaticContact CZ-CG 3.32Å; Y19-F71 PolarHBondContact N-O 3.21Å; Y19-F71 PolarHBondContact O-N 2.64Å; Y19-F71 WeakPolarHBondContact OH-CD1 3.47Å; Y19-F71 WeakPolarHBondContact OH-CG 3.38Å; T21-F71 HydrophobicContact CG2-CE2 3.93Å; R69-F71 HydrophobicContact CB-CD2 4.38Å; R69-F71 HydrophobicContact CB-CE2 3.52Å; R69-F71 HydrophobicContact CB-CZ 4.04Å; F71-N259 HydrophobicContact CD1-CB 4.4Å; F71-N259 HydrophobicContact CE1-CB 4Å; F71-N259 WeakPolarHBondContact CE1-ND2 3.49Å; F71-I271 CarbonylContact C-O 3.59Å; F71-I271 WeakPolarHBondContact CA-O 3.37Å; F71-P272 HydrophobicContact CD1-CB 3.83Å; F71-P272 HydrophobicContact CE1-CB 3.75Å; F71-P272 HydrophobicContact CE1-CG 4.47Å
72	L	97.8	Very high	91.9	Very high	7 Å²	7	41.4 Å²	41.4	4%	0.037	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	123.8	159.1	178.7	67.6	0	0	0	107.6	V16 L74 A109 T112 W113 L116 G270 I271 L273	V16-L72 HydrophobicContact CG1-CD1 3.34Å; L72-L74 PolarHBondContact O-N 3.49Å; L72-A109 HydrophobicContact CD2-CB 4.48Å; L72-A109 VanDerWaalsContact CD2-O 3.25Å; L72-A109 WeakPolarHBondContact CD2-O 3.34Å; L72-T112 HydrophobicContact CD1-CG2 4.02Å; L72-T112 HydrophobicContact CD2-CG2 4.21Å; L72-W113 HydrophobicContact CD2-CB 3.81Å; L72-L116 HydrophobicContact CD1-CD1 4.4Å; L72-G270 CarbonylContact O-C 3.54Å; L72-G270 WeakPolarHBondContact O-CA 3.4Å; L72-I271 HydrophobicContact CB-CB 4.41Å; L72-I271 HydrophobicContact CD2-CD1 4.45Å; L72-I271 PolarHBondContact N-O 3.31Å; L72-I271 PolarHBondContact O-N 2.95Å; L72-L273 HydrophobicContact CB-CD1 4.15Å; L72-L273 HydrophobicContact CB-CD2 4.44Å; L72-L273 HydrophobicContact CB-CG 4.26Å
73	L	97.1	Very high	91.5	Very high	20 Å²	20	43.3 Å²	43.3	11%	0.105	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	120.6	175.9	-177.3	68.6	0	0	0	108.9	R17 Y19 L51 L268	R17-L73 HydrophobicContact CB-CB 4.22Å; R17-L73 HydrophobicContact CB-CD2 4.41Å; R17-L73 HydrophobicContact CG-CB 4.14Å; R17-L73 HydrophobicContact CG-CD2 3.59Å; R17-L73 HydrophobicContact CG-CG 4.45Å; R17-L73 WeakPolarHBondContact O-CB 3.44Å; R17-L73 PolarHBondContact O-N 2.65Å; Y19-L73 HydrophobicContact CD1-CB 4.21Å; Y19-L73 HydrophobicContact CD1-CD1 3.67Å; Y19-L73 HydrophobicContact CE1-CD1 4.17Å; L51-L73 HydrophobicContact CD2-CD1 4.25Å; L51-L73 HydrophobicContact CD2-CD2 4.15Å; L73-L268 HydrophobicContact CD1-CD1 3.35Å; L73-L268 HydrophobicContact CD1-CG 4.29Å
74	L	95	Very high	91	Very high	27 Å²	27	43.7 Å²	43.7	14%	0.141	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	-47.5	174	-174.2	125	0	0	0	110.4	L72 W106 A109 L269 I271	L72-L74 PolarHBondContact O-N 3.49Å; L74-W106 HydrophobicContact CD1-CD2 4.01Å; L74-W106 HydrophobicContact CD1-CE3 3.39Å; L74-W106 HydrophobicContact CD1-CH2 4.2Å; L74-W106 HydrophobicContact CD1-CZ3 3.5Å; L74-W106 HydrophobicContact CD2-CD2 4.22Å; L74-W106 HydrophobicContact CD2-CE3 4.08Å; L74-W106 HydrophobicContact CD2-CH2 3.51Å; L74-W106 HydrophobicContact CD2-CZ2 3.64Å; L74-W106 HydrophobicContact CD2-CZ3 3.72Å; L74-W106 HydrophobicContact CG-CE3 4.39Å; L74-W106 HydrophobicContact CG-CZ3 4.28Å; L74-A109 HydrophobicContact CD1-CB 3.55Å; L74-A109 HydrophobicContact CG-CB 4.34Å; L74-L269 HydrophobicContact CB-CB 4.18Å; L74-L269 HydrophobicContact CD2-CB 3.89Å; L74-L269 HydrophobicContact CD2-CD2 3.82Å; L74-L269 PolarHBondContact N-O 3.03Å; L74-I271 HydrophobicContact CD1-CD1 4.2Å
75	K	93.1	Very high	90.6	Very high	33 Å²	33	51.8 Å²	51.8	14%	0.143	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	142.5	-175	-175.1	170.5	176.7	-177.8	0	111.5	D77 R98 L269	K75-D77 WeakPolarHBondContact CE-OD1 3.33Å; K75-D77 WeakPolarHBondContact CE-OD2 3.49Å; K75-D77 IonicContact NZ-OD1 2.97Å; K75-D77 IonicContact NZ-OD2 2.9Å; K75-D77 PolarHBondContact NZ-OD2 3.46Å; K75-R98 PolarHBondContact NZ-O 2.81Å; K75-L269 HydrophobicContact CB-CB 4.19Å; K75-L269 PolarHBondContact N-O 3.11Å; K75-L269 PolarHBondContact O-N 3.4Å
76	Q	93.8	Very high	90.6	Very high	65 Å²	65	52.4 Å²	52.4	30%	0.304	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	125.9	165.4	-177.2	-170.4	-6.3	0	0	109.1	Y44 L51 C267 L268	Y44-Q76 PolarHBondContact OH-OE1 2.94Å; L51-Q76 VanDerWaalsContact CD2-OE1 3.23Å; Q76-C267 CarbonylContact C-O 3.58Å; Q76-C267 WeakPolarHBondContact CA-O 3.33Å; Q76-L268 HydrophobicContact CB-CD1 3.91Å; Q76-L268 HydrophobicContact CG-CD1 4.06Å
77	D	93.3	Very high	90.8	Very high	54 Å²	54	55.1 Å²	55.1	29%	0.289	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	168.8	-177.8	-94.3	16.1	0	0	0	111.3	K75 C267	K75-D77 WeakPolarHBondContact CE-OD1 3.33Å; K75-D77 WeakPolarHBondContact CE-OD2 3.49Å; K75-D77 IonicContact NZ-OD1 2.97Å; K75-D77 IonicContact NZ-OD2 2.9Å; K75-D77 PolarHBondContact NZ-OD2 3.46Å; D77-C267 HydrophobicContact CB-CB 4.06Å; D77-C267 PolarHBondContact N-O 3.48Å; D77-C267 PolarHBondContact O-N 3.33Å
78	S	92.9	Very high	90.7	Very high	77 Å²	77	59.9 Å²	59.9	54%	0.538	31%	0.314	S	S	.	.	S	Bend	trans	-60.1	161.4	166.5	65.3	0	0	0	0	112	R98	S78-R98 PolarHBondContact O-NH2 2.94Å; S78-R98 PolarHBondContact OG-NH2 3Å; S78-R98 VanDerWaalsContact OG-NH2 3.09Å
79	P	92.8	Very high	90.7	Very high	28 Å²	28	59.7 Å²	59.7	18%	0.182	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-52.8	148.2	178.8	-25	31.1	0	0	0	113.7	R81 R98 D264 D265	P79-R81 PolarHBondContact O-N 3.16Å; P79-R98 PolarHBondContact O-NH1 3.01Å; P79-R98 VanDerWaalsContact O-NH1 3.08Å; P79-R98 PolarHBondContact O-NH2 3.01Å; P79-D264 VanDerWaalsContact CG-C 3.49Å; P79-D264 WeakPolarHBondContact CG-O 3.32Å; P79-D265 WeakPolarHBondContact CD-O 3.3Å; P79-D265 WeakPolarHBondContact CG-O 3.48Å
80	V	90.9	Very high	90.7	Very high	9 Å²	9	62.4 Å²	62.4	6%	0.055	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-78.9	118.4	167.1	-176.7	0	0	0	0	108	L82 V94 L95 R98 L99 L224 L262	V80-L82 HydrophobicContact CG1-CD1 4.41Å; V80-L82 HydrophobicContact CG1-CG 4.16Å; V80-V94 HydrophobicContact CG1-CG1 3.89Å; V80-L95 HydrophobicContact CG1-CD2 4.14Å; V80-R98 HydrophobicContact CG2-CB 4.25Å; V80-L99 HydrophobicContact CG2-CD2 4.4Å; V80-L224 HydrophobicContact CB-CD1 4.36Å; V80-L224 HydrophobicContact CB-CD2 4.25Å; V80-L224 HydrophobicContact CG1-CD1 4.34Å; V80-L262 HydrophobicContact CG2-CD2 4.45Å
81	R	88.1	Confident	90.4	Very high	220 Å²	220	62.8 Å²	62.8	83%	0.83	34%	0.344	S	S	*	.			trans	-93.7	111.4	-179.9	-63.6	-173.6	-179	-166.3	0.7	109.7	P79	P79-R81 PolarHBondContact O-N 3.16Å
82	L	87.8	Confident	90.1	Very high	28 Å²	28	63.6 Å²	63.6	15%	0.147	35%	0.35	C	S	.	.			trans	-129.4	142.8	172.1	-66.3	178.2	0	0	0	109.5	V80 T86 A91 V94 L224 C227 V228	V80-L82 HydrophobicContact CG1-CD1 4.41Å; V80-L82 HydrophobicContact CG1-CG 4.16Å; L82-T86 HydrophobicContact CD2-CG2 4.17Å; L82-A91 HydrophobicContact CD1-CB 4.07Å; L82-A91 HydrophobicContact CD2-CB 4.35Å; L82-V94 HydrophobicContact CD2-CB 3.92Å; L82-V94 HydrophobicContact CD2-CG1 3.83Å; L82-V94 HydrophobicContact CD2-CG2 4.21Å; L82-L224 HydrophobicContact CB-CD1 3.96Å; L82-L224 HydrophobicContact CD1-CD1 3.66Å; L82-L224 HydrophobicContact CG-CD1 3.92Å; L82-C227 HydrophobicContact CB-CB 4.13Å; L82-V228 HydrophobicContact CD1-CG2 3.49Å; L82-V228 VanDerWaalsContact CD1-CG2 3.49Å
83	S	82	Confident	89.9	Confident	62 Å²	62	66.7 Å²	66.7	43%	0.434	37%	0.372	S	S	.	.			trans	-96.3	157	170.3	71.7	0	0	0	0	110.6	H85 T86	S83-H85 PolarHBondContact O-N 3.12Å; S83-T86 PolarHBondContact N-OG1 2.92Å; S83-T86 VanDerWaalsContact O-CB 3.26Å; S83-T86 WeakPolarHBondContact O-CB 3.48Å; S83-T86 PolarHBondContact O-N 2.81Å; S83-T86 PolarHBondContact O-OG1 2.81Å; S83-T86 PolarHBondContact OG-N 2.98Å; S83-T86 PolarHBondContact OG-OG1 2.89Å
84	T	78.8	Confident	89.7	Confident	97 Å²	97	67.6 Å²	67.6	60%	0.595	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-22.1	175.4	47	0	0	0	0	113.1
85	H	82.3	Confident	89.6	Confident	170 Å²	170	66.3 Å²	66.3	79%	0.787	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	2.9	177.4	-56.1	-72	0	0	0	113.1	S83 S87	S83-H85 PolarHBondContact O-N 3.12Å; H85-S87 PolarHBondContact O-N 3.37Å
86	T	86.4	Confident	89.6	Confident	36 Å²	36	67.4 Å²	67.4	22%	0.221	38%	0.377	C	S	.	.			trans	-72.2	126.7	179.4	-58.6	0	0	0	0	109.9	L82 S83 K90 A91	L82-T86 HydrophobicContact CD2-CG2 4.17Å; S83-T86 PolarHBondContact N-OG1 2.92Å; S83-T86 VanDerWaalsContact O-CB 3.26Å; S83-T86 WeakPolarHBondContact O-CB 3.48Å; S83-T86 PolarHBondContact O-N 2.81Å; S83-T86 PolarHBondContact O-OG1 2.81Å; S83-T86 PolarHBondContact OG-N 2.98Å; S83-T86 PolarHBondContact OG-OG1 2.89Å; T86-K90 HydrophobicContact CG2-CB 3.8Å; T86-K90 HydrophobicContact CG2-CD 4.15Å; T86-K90 HydrophobicContact CG2-CG 3.86Å; T86-A91 HydrophobicContact CG2-CB 4.13Å
87	S	89.8	Confident	89.5	Confident	63 Å²	63	68.1 Å²	68.1	44%	0.441	39%	0.39	S	S	.	.			trans	-61.9	149.1	176.7	69.3	0	0	0	0	111.5	H85 A89 K90 A91	H85-S87 PolarHBondContact O-N 3.37Å; S87-A89 VanDerWaalsContact C-N 3.26Å; S87-A89 PolarHBondContact O-N 2.94Å; S87-K90 PolarHBondContact O-N 2.87Å; S87-K90 WeakPolarHBondContact OG-CB 3.49Å; S87-K90 PolarHBondContact OG-N 3.19Å; S87-A91 PolarHBondContact O-N 3.05Å
88	P	87.9	Confident	89.4	Confident	103 Å²	103	68.3 Å²	68.3	67%	0.669	39%	0.387	S	S	*	.	H	α-helix	trans	-55	-39	-179.7	-28.6	35.5	0	0	0	113.9	A91 A92	P88-A91 PolarHBondContact O-N 2.8Å; P88-A92 WeakPolarHBondContact O-CB 3.38Å; P88-A92 PolarHBondContact O-N 2.85Å
89	A	89.1	Confident	89.4	Confident	78 Å²	78	64.7 Å²	64.7	65%	0.645	36%	0.361	S	S	*	.	H	α-helix	trans	-64.2	-42.5	177.2	0	0	0	0	0	112.3	S87 A92 S93	S87-A89 VanDerWaalsContact C-N 3.26Å; S87-A89 PolarHBondContact O-N 2.94Å; A89-A92 PolarHBondContact O-N 3.09Å; A89-S93 WeakPolarHBondContact O-CB 3.37Å; A89-S93 PolarHBondContact O-N 3.02Å
90	K	91.3	Very high	89.3	Confident	133 Å²	133	64.2 Å²	64.2	58%	0.578	36%	0.357	S	S	*	.	H	α-helix	trans	-68.6	-40.3	176.6	-172.9	170.5	-177.4	175.6	0	111.2	T86 S87 S93 V94	T86-K90 HydrophobicContact CG2-CB 3.8Å; T86-K90 HydrophobicContact CG2-CD 4.15Å; T86-K90 HydrophobicContact CG2-CG 3.86Å; S87-K90 PolarHBondContact O-N 2.87Å; S87-K90 WeakPolarHBondContact OG-CB 3.49Å; S87-K90 PolarHBondContact OG-N 3.19Å; K90-S93 PolarHBondContact O-N 3.47Å; K90-V94 WeakPolarHBondContact O-CG2 3.13Å; K90-V94 PolarHBondContact O-N 3.36Å
91	A	91.1	Very high	89.1	Confident	9 Å²	9	65.7 Å²	65.7	7%	0.074	37%	0.374	C	S	.	.	H	α-helix	trans	-60.2	-46.1	174.3	0	0	0	0	0	111.4	L82 T86 S87 P88 S93 V94 L95 V228	L82-A91 HydrophobicContact CD1-CB 4.07Å; L82-A91 HydrophobicContact CD2-CB 4.35Å; T86-A91 HydrophobicContact CG2-CB 4.13Å; S87-A91 PolarHBondContact O-N 3.05Å; P88-A91 PolarHBondContact O-N 2.8Å; A91-S93 PolarHBondContact O-N 2.86Å; A91-V94 PolarHBondContact O-N 3.44Å; A91-L95 WeakPolarHBondContact O-CB 3.16Å; A91-L95 VanDerWaalsContact O-CG 3.27Å; A91-L95 WeakPolarHBondContact O-CG 3.33Å; A91-L95 PolarHBondContact O-N 2.86Å; A91-V228 HydrophobicContact CB-CG2 4.2Å
92	A	91.6	Very high	89.1	Confident	17 Å²	17	59.2 Å²	59.2	14%	0.14	36%	0.356	C	S	.	.	H	α-helix	trans	-61	-43.8	176.3	0	0	0	0	0	112.2	P88 A89 V94 L95 Q96 V236	P88-A92 WeakPolarHBondContact O-CB 3.38Å; P88-A92 PolarHBondContact O-N 2.85Å; A89-A92 PolarHBondContact O-N 3.09Å; A92-V94 PolarHBondContact O-N 3.08Å; A92-L95 PolarHBondContact O-N 2.85Å; A92-Q96 WeakPolarHBondContact O-CG 3.49Å; A92-Q96 PolarHBondContact O-N 3.27Å; A92-V236 HydrophobicContact CB-CG1 4.24Å; A92-V236 HydrophobicContact CB-CG2 3.82Å
93	S	92.8	Very high	89.1	Confident	72 Å²	72	58.3 Å²	58.3	50%	0.503	35%	0.353	S	S	.	.	H	α-helix	trans	-60.7	-44.1	176.1	177.7	0	0	0	0	112.5	A89 K90 A91 Q96 S97	A89-S93 WeakPolarHBondContact O-CB 3.37Å; A89-S93 PolarHBondContact O-N 3.02Å; K90-S93 PolarHBondContact O-N 3.47Å; A91-S93 PolarHBondContact O-N 2.86Å; S93-Q96 PolarHBondContact O-N 3.5Å; S93-S97 PolarHBondContact O-N 2.99Å; S93-S97 PolarHBondContact O-OG 2.53Å
94	V	93.4	Very high	89.4	Confident	38 Å²	38	59.3 Å²	59.3	23%	0.23	36%	0.359	C	S	.	.	H	α-helix	trans	-63.6	-42.9	175.1	172.4	0	0	0	0	111	V80 L82 K90 A91 A92 S97 R98	V80-V94 HydrophobicContact CG1-CG1 3.89Å; L82-V94 HydrophobicContact CD2-CB 3.92Å; L82-V94 HydrophobicContact CD2-CG1 3.83Å; L82-V94 HydrophobicContact CD2-CG2 4.21Å; K90-V94 WeakPolarHBondContact O-CG2 3.13Å; K90-V94 PolarHBondContact O-N 3.36Å; A91-V94 PolarHBondContact O-N 3.44Å; A92-V94 PolarHBondContact O-N 3.08Å; V94-S97 WeakPolarHBondContact CA-OG 3.33Å; V94-S97 PolarHBondContact O-OG 2.89Å; V94-R98 HydrophobicContact CG1-CG 4.22Å; V94-R98 VanDerWaalsContact O-CB 3.29Å; V94-R98 WeakPolarHBondContact O-CB 3.18Å; V94-R98 WeakPolarHBondContact O-CG 3.44Å; V94-R98 PolarHBondContact O-N 2.74Å
95	L	93.3	Very high	90	Very high	1 Å²	1	59.7 Å²	59.7	1%	0.005	35%	0.354	C	S	.	.	H	α-helix	trans	-64.6	-42.5	177.4	-71	166.4	0	0	0	111.8	V80 A91 A92 R98 L99 V228 V233 V236 L262	V80-L95 HydrophobicContact CG1-CD2 4.14Å; A91-L95 WeakPolarHBondContact O-CB 3.16Å; A91-L95 VanDerWaalsContact O-CG 3.27Å; A91-L95 WeakPolarHBondContact O-CG 3.33Å; A91-L95 PolarHBondContact O-N 2.86Å; A92-L95 PolarHBondContact O-N 2.85Å; L95-R98 PolarHBondContact O-N 3.4Å; L95-L99 HydrophobicContact CB-CD1 4.24Å; L95-L99 HydrophobicContact CD2-CD1 3.82Å; L95-L99 WeakPolarHBondContact O-CB 3.42Å; L95-L99 WeakPolarHBondContact O-CG 3.41Å; L95-L99 PolarHBondContact O-N 3.32Å; L95-V228 HydrophobicContact CD1-CG1 4.03Å; L95-V228 HydrophobicContact CD1-CG2 4.43Å; L95-V233 HydrophobicContact CD1-CG2 4.17Å; L95-V233 HydrophobicContact CD2-CG2 4.24Å; L95-V236 HydrophobicContact CB-CG1 3.94Å; L95-L262 HydrophobicContact CD2-CD1 4.43Å
96	Q	92.3	Very high	90.6	Very high	55 Å²	55	51.8 Å²	51.8	26%	0.257	32%	0.317	S	S	.	.	H	α-helix	trans	-62.2	-51	177.9	-74.3	-179.8	-13.9	0	0	111.6	A92 S93 R98 L99 L100 V236	A92-Q96 WeakPolarHBondContact O-CG 3.49Å; A92-Q96 PolarHBondContact O-N 3.27Å; S93-Q96 PolarHBondContact O-N 3.5Å; Q96-R98 VanDerWaalsContact C-N 3.3Å; Q96-R98 PolarHBondContact O-N 3.43Å; Q96-L99 PolarHBondContact O-N 2.97Å; Q96-L100 HydrophobicContact CB-CD1 3.9Å; Q96-L100 HydrophobicContact CG-CD1 3.98Å; Q96-L100 VanDerWaalsContact O-CB 3.31Å; Q96-L100 WeakPolarHBondContact O-CB 3.5Å; Q96-L100 WeakPolarHBondContact O-CG 3.3Å; Q96-L100 PolarHBondContact O-N 3.48Å; Q96-V236 HydrophobicContact CG-CG1 3.5Å
97	S	91.6	Very high	90.9	Very high	81 Å²	81	53.4 Å²	53.4	57%	0.566	32%	0.324	S	S	*	.	H	α-helix	trans	-60.6	-39.1	179.2	55.7	0	0	0	0	112.5	S93 V94	S93-S97 PolarHBondContact O-N 2.99Å; S93-S97 PolarHBondContact O-OG 2.53Å; V94-S97 WeakPolarHBondContact CA-OG 3.33Å; V94-S97 PolarHBondContact O-OG 2.89Å
98	R	92.4	Very high	91	Very high	58 Å²	58	53.5 Å²	53.5	22%	0.219	33%	0.325	C	S	.	.	H	α-helix	trans	-79.9	-35.1	-178.2	-65.2	-63.3	-58.1	-77.8	-4	113.6	K75 S78 P79 V80 V94 L95 Q96	K75-R98 PolarHBondContact NZ-O 2.81Å; S78-R98 PolarHBondContact O-NH2 2.94Å; S78-R98 PolarHBondContact OG-NH2 3Å; S78-R98 VanDerWaalsContact OG-NH2 3.09Å; P79-R98 PolarHBondContact O-NH1 3.01Å; P79-R98 VanDerWaalsContact O-NH1 3.08Å; P79-R98 PolarHBondContact O-NH2 3.01Å; V80-R98 HydrophobicContact CG2-CB 4.25Å; V94-R98 HydrophobicContact CG1-CG 4.22Å; V94-R98 VanDerWaalsContact O-CB 3.29Å; V94-R98 WeakPolarHBondContact O-CB 3.18Å; V94-R98 WeakPolarHBondContact O-CG 3.44Å; V94-R98 PolarHBondContact O-N 2.74Å; L95-R98 PolarHBondContact O-N 3.4Å; Q96-R98 VanDerWaalsContact C-N 3.3Å; Q96-R98 PolarHBondContact O-N 3.43Å
99	L	92.4	Very high	91.3	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-100.9	-28.5	-168.9	-55.8	177.7	0	0	0	114.1	V80 L95 Q96 V233 M237 L262 C267 L269	V80-L99 HydrophobicContact CG2-CD2 4.4Å; L95-L99 HydrophobicContact CB-CD1 4.24Å; L95-L99 HydrophobicContact CD2-CD1 3.82Å; L95-L99 WeakPolarHBondContact O-CB 3.42Å; L95-L99 WeakPolarHBondContact O-CG 3.41Å; L95-L99 PolarHBondContact O-N 3.32Å; Q96-L99 PolarHBondContact O-N 2.97Å; L99-V233 HydrophobicContact CD1-CG1 3.88Å; L99-M237 HydrophobicContact CB-CE 3.98Å; L99-M237 HydrophobicContact CB-CG 3.98Å; L99-M237 HydrophobicContact CB-SD 3.83Å; L99-M237 HydrophobicContact CD1-CG 3.73Å; L99-M237 HydrophobicContact CD1-SD 3.55Å; L99-M237 VanDerWaalsContact CD1-SD 3.55Å; L99-M237 HydrophobicContact CG-SD 4.24Å; L99-L262 HydrophobicContact CD1-CD1 4.33Å; L99-L262 HydrophobicContact CD2-CD2 3.92Å; L99-C267 WeakPolarHBondContact CD2-SG 3.24Å; L99-L269 HydrophobicContact CD2-CD1 4.15Å
100	L	91.4	Very high	91.5	Very high	18 Å²	18	46.6 Å²	46.6	9%	0.094	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-41.1	-176.9	-61.2	172.3	0	0	0	112.3	Q96 W106 L241	Q96-L100 HydrophobicContact CB-CD1 3.9Å; Q96-L100 HydrophobicContact CG-CD1 3.98Å; Q96-L100 VanDerWaalsContact O-CB 3.31Å; Q96-L100 WeakPolarHBondContact O-CB 3.5Å; Q96-L100 WeakPolarHBondContact O-CG 3.3Å; Q96-L100 PolarHBondContact O-N 3.48Å; L100-W106 PolarHBondContact O-NE1 3.08Å; L100-L241 HydrophobicContact CD2-CD2 3.89Å; L100-L241 HydrophobicContact CD2-CG 3.8Å
101	G	85.9	Confident	91.7	Very high	40 Å²	40	47.2 Å²	47.2	41%	0.412	27%	0.273	S	S	.	.			trans	53.7	-143.1	-177.3	0	0	0	0	0	112.8
102	D	86.9	Confident	91.9	Very high	84 Å²	84	48.3 Å²	48.3	45%	0.449	28%	0.278	S	S	.	.			trans	-90.7	135.4	-179.1	173.5	20.5	0	0	0	112.1	C104 Q105	D102-C104 PolarHBondContact O-N 2.99Å; D102-C104 PolarHBondContact OD1-N 3.09Å; D102-C104 WeakPolarHBondContact OD2-CB 3.43Å; D102-Q105 HydrophobicContact CB-CG 4.27Å; D102-Q105 WeakPolarHBondContact O-CB 3.21Å; D102-Q105 PolarHBondContact O-N 3.39Å; D102-Q105 VanDerWaalsContact O-N 3.15Å
103	G	88.3	Confident	92.1	Very high	8 Å²	8	49.5 Å²	49.5	8%	0.082	28%	0.279	C	S	.	.	H	α-helix	trans	-58.7	-32.5	176.5	0	0	0	0	0	113.5	Q105 W106 I107	G103-Q105 VanDerWaalsContact C-N 3.26Å; G103-Q105 PolarHBondContact O-N 2.74Å; G103-W106 PolarHBondContact O-N 3.33Å; G103-I107 WeakPolarHBondContact O-CG1 3.38Å; G103-I107 PolarHBondContact O-N 3.49Å; G103-I107 VanDerWaalsContact O-N 3.09Å
104	C	89.8	Confident	92.1	Very high	84 Å²	84	49.4 Å²	49.4	57%	0.568	28%	0.279	S	S	*	.	H	α-helix	trans	-63.5	-33.4	178.2	-58	0	0	0	0	112.1	D102 I107 S108	D102-C104 PolarHBondContact O-N 2.99Å; D102-C104 PolarHBondContact OD1-N 3.09Å; D102-C104 WeakPolarHBondContact OD2-CB 3.43Å; C104-I107 PolarHBondContact O-N 3.14Å; C104-S108 VanDerWaalsContact O-CB 3.32Å; C104-S108 WeakPolarHBondContact O-CB 3.32Å; C104-S108 PolarHBondContact O-N 3.07Å
105	Q	91.4	Very high	92.2	Very high	105 Å²	105	52.1 Å²	52.1	49%	0.491	28%	0.284	S	S	.	.	H	α-helix	trans	-65.4	-41.4	176.8	-64.3	-175.3	2.4	0	0	111.5	D102 G103 S108 A109	D102-Q105 HydrophobicContact CB-CG 4.27Å; D102-Q105 WeakPolarHBondContact O-CB 3.21Å; D102-Q105 PolarHBondContact O-N 3.39Å; D102-Q105 VanDerWaalsContact O-N 3.15Å; G103-Q105 VanDerWaalsContact C-N 3.26Å; G103-Q105 PolarHBondContact O-N 2.74Å; Q105-S108 PolarHBondContact O-N 2.8Å; Q105-A109 VanDerWaalsContact O-CB 3.29Å; Q105-A109 WeakPolarHBondContact O-CB 3.41Å; Q105-A109 PolarHBondContact O-N 3.31Å
106	W	93.7	Very high	92.3	Very high	3 Å²	3	52.2 Å²	52.2	1%	0.011	29%	0.285	C	S	.	.	H	α-helix	trans	-64.8	-44.5	175.7	-69.8	95.5	0	0	0	112.4	L74 L100 G103 S108 A109 V110 M237 L241 L245 W247 I258 L269	L74-W106 HydrophobicContact CD1-CD2 4.01Å; L74-W106 HydrophobicContact CD1-CE3 3.39Å; L74-W106 HydrophobicContact CD1-CH2 4.2Å; L74-W106 HydrophobicContact CD1-CZ3 3.5Å; L74-W106 HydrophobicContact CD2-CD2 4.22Å; L74-W106 HydrophobicContact CD2-CE3 4.08Å; L74-W106 HydrophobicContact CD2-CH2 3.51Å; L74-W106 HydrophobicContact CD2-CZ2 3.64Å; L74-W106 HydrophobicContact CD2-CZ3 3.72Å; L74-W106 HydrophobicContact CG-CE3 4.39Å; L74-W106 HydrophobicContact CG-CZ3 4.28Å; L100-W106 PolarHBondContact O-NE1 3.08Å; G103-W106 PolarHBondContact O-N 3.33Å; W106-S108 VanDerWaalsContact C-N 3.35Å; W106-A109 PolarHBondContact O-N 3.2Å; W106-V110 WeakPolarHBondContact O-CG2 3.48Å; W106-V110 PolarHBondContact O-N 3.18Å; W106-M237 HydrophobicContact CH2-CE 4.01Å; W106-M237 HydrophobicContact CZ2-CE 4.23Å; W106-L241 HydrophobicContact CD2-CD2 3.69Å; W106-L241 HydrophobicContact CE3-CD2 4.11Å; W106-L241 HydrophobicContact CG-CD2 4.1Å; W106-L241 HydrophobicContact CH2-CD1 4.2Å; W106-L241 HydrophobicContact CH2-CD2 4.3Å; W106-L241 HydrophobicContact CZ2-CD2 3.92Å; W106-L241 HydrophobicContact CZ3-CD1 4.23Å; W106-L241 HydrophobicContact CZ3-CD2 4.4Å; W106-L245 HydrophobicContact CB-CD1 3.51Å; W106-L245 HydrophobicContact CG-CD1 3.94Å; W106-W247 HydrophobicContact CB-CH2 4.18Å; W106-W247 HydrophobicContact CE3-CH2 4.32Å; W106-W247 HydrophobicContact CE3-CZ3 4.34Å; W106-I258 HydrophobicContact CE3-CD1 4.45Å; W106-I258 HydrophobicContact CH2-CD1 4.46Å; W106-I258 HydrophobicContact CH2-CG2 4.07Å; W106-I258 HydrophobicContact CZ3-CD1 3.75Å; W106-I258 HydrophobicContact CZ3-CG1 4.25Å; W106-I258 HydrophobicContact CZ3-CG2 3.96Å; W106-L269 HydrophobicContact CH2-CD2 3.89Å; W106-L269 HydrophobicContact CZ2-CD2 4.02Å
107	I	92.5	Very high	92.4	Very high	71 Å²	71	52.5 Å²	52.5	36%	0.364	29%	0.286	S	S	.	.	H	α-helix	trans	-61.8	-46	178.2	-65.9	168.1	0	0	0	110	G103 C104 V110 R111 L245	G103-I107 WeakPolarHBondContact O-CG1 3.38Å; G103-I107 PolarHBondContact O-N 3.49Å; G103-I107 VanDerWaalsContact O-N 3.09Å; C104-I107 PolarHBondContact O-N 3.14Å; I107-V110 PolarHBondContact O-N 2.98Å; I107-R111 WeakPolarHBondContact O-CB 3.43Å; I107-R111 PolarHBondContact O-N 2.85Å; I107-L245 HydrophobicContact CD1-CD2 4.13Å; I107-L245 HydrophobicContact CG1-CD2 4.09Å
108	S	92.4	Very high	92.4	Very high	65 Å²	65	50.6 Å²	50.6	46%	0.455	28%	0.279	S	S	.	.	H	α-helix	trans	-61.4	-44.2	176.9	-176.4	0	0	0	0	112.2	C104 Q105 W106 R111 T112	C104-S108 VanDerWaalsContact O-CB 3.32Å; C104-S108 WeakPolarHBondContact O-CB 3.32Å; C104-S108 PolarHBondContact O-N 3.07Å; Q105-S108 PolarHBondContact O-N 2.8Å; W106-S108 VanDerWaalsContact C-N 3.35Å; S108-R111 PolarHBondContact O-N 3.05Å; S108-T112 WeakPolarHBondContact O-CB 3.36Å; S108-T112 PolarHBondContact O-N 2.91Å; S108-T112 PolarHBondContact O-OG1 2.92Å
109	A	93.5	Very high	92.4	Very high	13 Å²	13	51 Å²	51	11%	0.107	28%	0.284	C	S	.	.	H	α-helix	trans	-64.7	-41.3	177.8	0	0	0	0	0	112.3	L72 L74 Q105 W106 T112 W113 I271	L72-A109 HydrophobicContact CD2-CB 4.48Å; L72-A109 VanDerWaalsContact CD2-O 3.25Å; L72-A109 WeakPolarHBondContact CD2-O 3.34Å; L74-A109 HydrophobicContact CD1-CB 3.55Å; L74-A109 HydrophobicContact CG-CB 4.34Å; Q105-A109 VanDerWaalsContact O-CB 3.29Å; Q105-A109 WeakPolarHBondContact O-CB 3.41Å; Q105-A109 PolarHBondContact O-N 3.31Å; W106-A109 PolarHBondContact O-N 3.2Å; A109-T112 PolarHBondContact O-N 2.84Å; A109-W113 WeakPolarHBondContact O-CB 3.35Å; A109-W113 PolarHBondContact O-N 3.03Å; A109-I271 HydrophobicContact CB-CD1 4.33Å
110	V	94.3	Very high	92.3	Very high	22 Å²	22	52.1 Å²	52.1	13%	0.133	29%	0.29	C	S	.	.	H	α-helix	trans	-68.1	-38.7	176.3	170.4	0	0	0	0	111.8	W106 I107 T112 W113 S114 W247 L256 I271	W106-V110 WeakPolarHBondContact O-CG2 3.48Å; W106-V110 PolarHBondContact O-N 3.18Å; I107-V110 PolarHBondContact O-N 2.98Å; V110-T112 VanDerWaalsContact C-N 3.34Å; V110-W113 PolarHBondContact O-N 3.29Å; V110-S114 VanDerWaalsContact O-CB 3.27Å; V110-S114 WeakPolarHBondContact O-CB 3.43Å; V110-S114 PolarHBondContact O-N 3.46Å; V110-W247 HydrophobicContact CB-CH2 4.44Å; V110-W247 HydrophobicContact CB-CZ2 4.42Å; V110-W247 HydrophobicContact CG2-CH2 3.31Å; V110-W247 HydrophobicContact CG2-CZ2 3.71Å; V110-W247 HydrophobicContact CG2-CZ3 4.27Å; V110-L256 HydrophobicContact CG2-CD1 4.5Å; V110-L256 HydrophobicContact CG2-CD2 3.6Å; V110-I271 HydrophobicContact CG2-CD1 4.37Å
111	R	94.2	Very high	92.1	Very high	147 Å²	147	53.5 Å²	53.5	56%	0.555	30%	0.304	S	S	*	.	H	α-helix	trans	-61	-45.6	173.8	-171.5	-178.9	-66.9	156.2	-0.9	110.8	I107 S108 S114 R115	I107-R111 WeakPolarHBondContact O-CB 3.43Å; I107-R111 PolarHBondContact O-N 2.85Å; S108-R111 PolarHBondContact O-N 3.05Å; R111-S114 PolarHBondContact O-N 3.25Å; R111-R115 PolarHBondContact O-N 3.04Å
112	T	95.7	Very high	92.1	Very high	32 Å²	32	54.4 Å²	54.4	20%	0.196	31%	0.307	C	S	.	.	H	α-helix	trans	-61.5	-48.1	175.7	-59.5	0	0	0	0	111.2	V16 L72 S108 A109 V110 S114 R115 L116	V16-T112 HydrophobicContact CG1-CG2 4.26Å; V16-T112 HydrophobicContact CG2-CG2 4.21Å; L72-T112 HydrophobicContact CD1-CG2 4.02Å; L72-T112 HydrophobicContact CD2-CG2 4.21Å; S108-T112 WeakPolarHBondContact O-CB 3.36Å; S108-T112 PolarHBondContact O-N 2.91Å; S108-T112 PolarHBondContact O-OG1 2.92Å; A109-T112 PolarHBondContact O-N 2.84Å; V110-T112 VanDerWaalsContact C-N 3.34Å; T112-S114 PolarHBondContact O-N 3.4Å; T112-R115 PolarHBondContact O-N 3.01Å; T112-L116 HydrophobicContact CG2-CD1 4.1Å; T112-L116 VanDerWaalsContact O-CG 3.29Å; T112-L116 WeakPolarHBondContact O-CG 3.32Å; T112-L116 PolarHBondContact O-N 3.25Å
113	W	95.7	Very high	91.5	Very high	42 Å²	42	52 Å²	52	16%	0.159	30%	0.297	C	S	.	.	H	α-helix	trans	-59.4	-45.7	176.9	175.3	84.8	0	0	0	111.9	L72 A109 V110 R115 L116 Q117 K255 L256 I271 P272 L273	L72-W113 HydrophobicContact CD2-CB 3.81Å; A109-W113 WeakPolarHBondContact O-CB 3.35Å; A109-W113 PolarHBondContact O-N 3.03Å; V110-W113 PolarHBondContact O-N 3.29Å; W113-R115 VanDerWaalsContact C-N 3.34Å; W113-R115 PolarHBondContact O-N 3.09Å; W113-L116 PolarHBondContact O-N 3.48Å; W113-Q117 HydrophobicContact CD2-CG 3.88Å; W113-Q117 HydrophobicContact CE3-CG 4.26Å; W113-Q117 HydrophobicContact CG-CG 4.46Å; W113-Q117 HydrophobicContact CH2-CG 4.04Å; W113-Q117 HydrophobicContact CZ2-CG 3.63Å; W113-Q117 HydrophobicContact CZ3-CG 4.33Å; W113-Q117 WeakPolarHBondContact O-CG 3.49Å; W113-Q117 PolarHBondContact O-N 2.89Å; W113-K255 WeakPolarHBondContact CH2-O 3.26Å; W113-L256 HydrophobicContact CD2-CD1 3.74Å; W113-L256 HydrophobicContact CE3-CD1 3.69Å; W113-L256 HydrophobicContact CG-CD1 4.38Å; W113-L256 HydrophobicContact CH2-CD1 4.03Å; W113-L256 HydrophobicContact CZ2-CD1 4.07Å; W113-L256 HydrophobicContact CZ3-CD1 3.84Å; W113-I271 HydrophobicContact CB-CD1 4.42Å; W113-I271 HydrophobicContact CB-CG2 4.45Å; W113-I271 HydrophobicContact CD2-CG2 4.09Å; W113-I271 HydrophobicContact CG-CB 4.5Å; W113-I271 HydrophobicContact CG-CG2 3.7Å; W113-I271 VanDerWaalsContact NE1-CG2 3.34Å; W113-P272 PolarHBondContact NE1-O 3.13Å; W113-P272 VanDerWaalsContact NE1-O 3.1Å; W113-L273 HydrophobicContact CG-CD2 4.46Å
114	S	94.2	Very high	90.8	Very high	70 Å²	70	60.2 Å²	60.2	49%	0.49	33%	0.325	S	S	.	.	H	α-helix	trans	-63.4	-40.5	-179.4	-170.4	0	0	0	0	111.7	V110 R111 T112 Q117 G118	V110-S114 VanDerWaalsContact O-CB 3.27Å; V110-S114 WeakPolarHBondContact O-CB 3.43Å; V110-S114 PolarHBondContact O-N 3.46Å; R111-S114 PolarHBondContact O-N 3.25Å; T112-S114 PolarHBondContact O-N 3.4Å; S114-Q117 PolarHBondContact O-N 3.35Å; S114-G118 PolarHBondContact O-N 2.96Å
115	R	95.2	Very high	89.7	Confident	94 Å²	94	61.5 Å²	61.5	36%	0.355	33%	0.327	S	S	.	.	H	α-helix	trans	-58	-51.4	171.6	178	179.8	64.4	113.9	-14.8	111.4	S14 R111 T112 W113 Q117 G118 E119	S14-R115 PolarHBondContact OG-NH2 3.24Å; R111-R115 PolarHBondContact O-N 3.04Å; T112-R115 PolarHBondContact O-N 3.01Å; W113-R115 VanDerWaalsContact C-N 3.34Å; W113-R115 PolarHBondContact O-N 3.09Å; R115-Q117 VanDerWaalsContact C-N 3.3Å; R115-Q117 PolarHBondContact O-N 3.34Å; R115-G118 WeakPolarHBondContact O-CA 3.42Å; R115-G118 PolarHBondContact O-N 3.02Å; R115-E119 IonicContact CZ-OE1 2.66Å; R115-E119 IonicContact NH1-OE1 3.78Å; R115-E119 PolarHBondContact NH1-OE1 2.9Å; R115-E119 PolarHBondContact O-N 3.42Å
116	L	95.1	Very high	88.2	Confident	3 Å²	3	59.3 Å²	59.3	2%	0.016	33%	0.326	C	S	.	.	H	α-helix	trans	-62.8	-35.1	-180	-64.4	170.6	0	0	0	112.5	V16 Y18 I58 L72 T112 W113 E119 L120 L273	V16-L116 HydrophobicContact CG1-CD1 4.23Å; Y18-L116 HydrophobicContact CE1-CD1 4.24Å; I58-L116 HydrophobicContact CB-CD2 3.97Å; I58-L116 HydrophobicContact CD1-CD2 4.42Å; I58-L116 HydrophobicContact CG1-CB 4.43Å; I58-L116 HydrophobicContact CG1-CD2 4.35Å; L72-L116 HydrophobicContact CD1-CD1 4.4Å; T112-L116 HydrophobicContact CG2-CD1 4.1Å; T112-L116 VanDerWaalsContact O-CG 3.29Å; T112-L116 WeakPolarHBondContact O-CG 3.32Å; T112-L116 PolarHBondContact O-N 3.25Å; W113-L116 PolarHBondContact O-N 3.48Å; L116-E119 PolarHBondContact O-N 3.2Å; L116-L120 WeakPolarHBondContact O-CB 3.32Å; L116-L120 WeakPolarHBondContact O-CG 3.49Å; L116-L120 PolarHBondContact O-N 2.99Å; L116-L273 HydrophobicContact CB-CD2 3.98Å; L116-L273 HydrophobicContact CD1-CD1 4.24Å; L116-L273 HydrophobicContact CD1-CD2 3.89Å
117	Q	93.5	Very high	86.5	Confident	61 Å²	61	62 Å²	62	29%	0.285	34%	0.343	S	S	.	.	H	α-helix	trans	-64.8	-39.5	172.4	-70.1	-57.8	-54.8	0	0	111.8	W113 S114 R115 L120 A121 L273	W113-Q117 HydrophobicContact CD2-CG 3.88Å; W113-Q117 HydrophobicContact CE3-CG 4.26Å; W113-Q117 HydrophobicContact CG-CG 4.46Å; W113-Q117 HydrophobicContact CH2-CG 4.04Å; W113-Q117 HydrophobicContact CZ2-CG 3.63Å; W113-Q117 HydrophobicContact CZ3-CG 4.33Å; W113-Q117 WeakPolarHBondContact O-CG 3.49Å; W113-Q117 PolarHBondContact O-N 2.89Å; S114-Q117 PolarHBondContact O-N 3.35Å; R115-Q117 VanDerWaalsContact C-N 3.3Å; R115-Q117 PolarHBondContact O-N 3.34Å; Q117-L120 PolarHBondContact O-N 2.96Å; Q117-A121 WeakPolarHBondContact O-CB 3.32Å; Q117-A121 PolarHBondContact O-N 3.34Å; Q117-L273 PolarHBondContact NE2-O 3.36Å
118	G	92.4	Very high	84.6	Confident	41 Å²	41	61.7 Å²	61.7	42%	0.423	35%	0.345	S	S	.	.	H	α-helix	trans	-61	-47.1	174.1	0	0	0	0	0	112.3	S114 R115 L120 A121 A122	S114-G118 PolarHBondContact O-N 2.96Å; R115-G118 WeakPolarHBondContact O-CA 3.42Å; R115-G118 PolarHBondContact O-N 3.02Å; G118-L120 VanDerWaalsContact C-N 3.34Å; G118-L120 PolarHBondContact O-N 2.82Å; G118-A121 PolarHBondContact O-N 3.38Å; G118-A122 PolarHBondContact O-N 2.9Å
119	E	92.2	Very high	82	Confident	68 Å²	68	61 Å²	61	32%	0.318	34%	0.343	S	S	.	.	H	α-helix	trans	-59.1	-43	175.3	-69.2	173.7	-151.4	0	0	112	I58 R115 L116 A122 S123	I58-E119 HydrophobicContact CG2-CB 3.67Å; I58-E119 WeakPolarHBondContact CG2-OE2 3.37Å; R115-E119 IonicContact CZ-OE1 2.66Å; R115-E119 IonicContact NH1-OE1 3.78Å; R115-E119 PolarHBondContact NH1-OE1 2.9Å; R115-E119 PolarHBondContact O-N 3.42Å; L116-E119 PolarHBondContact O-N 3.2Å; E119-A122 PolarHBondContact O-N 2.95Å; E119-S123 PolarHBondContact O-N 2.98Å; E119-S123 VanDerWaalsContact O-N 3.1Å
120	L	89.9	Confident	79.6	Confident	24 Å²	24	63.8 Å²	63.8	13%	0.126	36%	0.362	C	S	.	.	H	α-helix	trans	-64.5	-38.6	176	-77.8	169.5	0	0	0	112.8	I58 L116 Q117 G118 R124	I58-L120 HydrophobicContact CG1-CD1 3.85Å; I58-L120 HydrophobicContact CG1-CD2 3.92Å; I58-L120 HydrophobicContact CG1-CG 3.74Å; I58-L120 HydrophobicContact CG2-CD2 4.11Å; I58-L120 HydrophobicContact CG2-CG 3.92Å; L116-L120 WeakPolarHBondContact O-CB 3.32Å; L116-L120 WeakPolarHBondContact O-CG 3.49Å; L116-L120 PolarHBondContact O-N 2.99Å; Q117-L120 PolarHBondContact O-N 2.96Å; G118-L120 VanDerWaalsContact C-N 3.34Å; G118-L120 PolarHBondContact O-N 2.82Å; L120-R124 PolarHBondContact O-N 3.26Å
121	A	88.3	Confident	77.1	Confident	46 Å²	46	66 Å²	66	38%	0.38	38%	0.376	S	S	.	.	H	α-helix	trans	-68.4	-44.8	177.3	0	0	0	0	0	111.6	Q117 G118 S123 R124 N125	Q117-A121 WeakPolarHBondContact O-CB 3.32Å; Q117-A121 PolarHBondContact O-N 3.34Å; G118-A121 PolarHBondContact O-N 3.38Å; A121-S123 VanDerWaalsContact C-N 3.31Å; A121-S123 PolarHBondContact O-N 2.8Å; A121-R124 PolarHBondContact O-N 2.95Å; A121-R124 VanDerWaalsContact O-N 3.11Å; A121-N125 PolarHBondContact O-N 2.84Å
122	A	85.1	Confident	74.3	Confident	59 Å²	59	63.6 Å²	63.6	49%	0.488	38%	0.377	S	S	.	.	H	α-helix	trans	-58.9	-42.2	177	0	0	0	0	0	111.8	G118 E119 R124 N125 A126	G118-A122 PolarHBondContact O-N 2.9Å; E119-A122 PolarHBondContact O-N 2.95Å; A122-R124 VanDerWaalsContact C-N 3.29Å; A122-R124 PolarHBondContact O-N 2.82Å; A122-N125 PolarHBondContact O-N 2.9Å; A122-A126 PolarHBondContact O-N 3.02Å
123	S	74.6	Confident	71.5	Confident	33 Å²	33	69.8 Å²	69.8	23%	0.231	40%	0.404	C	S	.	.	H	α-helix	trans	-64.7	-30.4	177.3	-177	0	0	0	0	113.3	R59 E119 A121 V127	R59-S123 PolarHBondContact NH1-OG 3.11Å; E119-S123 PolarHBondContact O-N 2.98Å; E119-S123 VanDerWaalsContact O-N 3.1Å; A121-S123 VanDerWaalsContact C-N 3.31Å; A121-S123 PolarHBondContact O-N 2.8Å; S123-V127 WeakPolarHBondContact O-CG2 3.5Å; S123-V127 PolarHBondContact O-N 2.81Å
124	R	72.5	Confident	68.4	Low	181 Å²	181	70.4 Å²	70.4	68%	0.683	42%	0.423	S	S	*	.	H	α-helix	trans	-69.9	-43.1	175.5	-73.5	176.7	178.9	164.8	4.1	110.9	L120 A121 A122 A126 V127 T128	L120-R124 PolarHBondContact O-N 3.26Å; A121-R124 PolarHBondContact O-N 2.95Å; A121-R124 VanDerWaalsContact O-N 3.11Å; A122-R124 VanDerWaalsContact C-N 3.29Å; A122-R124 PolarHBondContact O-N 2.82Å; R124-A126 PolarHBondContact O-N 2.85Å; R124-V127 PolarHBondContact O-N 2.95Å; R124-T128 PolarHBondContact O-N 2.89Å; R124-T128 VanDerWaalsContact O-N 3.13Å; R124-T128 PolarHBondContact O-OG1 3.33Å
125	N	67.6	Low	65.7	Low	111 Å²	111	73.3 Å²	73.3	59%	0.594	43%	0.433	S	S	*	.	H	α-helix	trans	-65.1	-39.3	-179.1	-67.2	-9.3	0	0	0	111.8	A121 A122 V127 T128 A129	A121-N125 PolarHBondContact O-N 2.84Å; A122-N125 PolarHBondContact O-N 2.9Å; N125-V127 VanDerWaalsContact C-N 3.34Å; N125-V127 PolarHBondContact O-N 2.89Å; N125-T128 WeakPolarHBondContact CA-OG1 3.48Å; N125-T128 PolarHBondContact O-N 3.35Å; N125-T128 PolarHBondContact O-OG1 3.28Å; N125-A129 WeakPolarHBondContact O-CB 3.38Å; N125-A129 PolarHBondContact O-N 2.91Å
126	A	59.6	Low	62.7	Low	59 Å²	59	79.9 Å²	79.9	49%	0.488	46%	0.458	S	S	.	.	H	α-helix	trans	-63.4	-36.3	175.4	0	0	0	0	0	113	A122 R124 S130	A122-A126 PolarHBondContact O-N 3.02Å; R124-A126 PolarHBondContact O-N 2.85Å; A126-S130 PolarHBondContact O-N 3.42Å; A126-S130 PolarHBondContact O-OG 3.21Å
127	V	58.5	Low	59.9	Low	61 Å²	61	88.2 Å²	88.2	37%	0.37	50%	0.497	S	S	.	.	H	α-helix	trans	-68.4	-42.3	175.3	174.5	0	0	0	0	110.6	S123 R124 N125 S130 T131	S123-V127 WeakPolarHBondContact O-CG2 3.5Å; S123-V127 PolarHBondContact O-N 2.81Å; R124-V127 PolarHBondContact O-N 2.95Å; N125-V127 VanDerWaalsContact C-N 3.34Å; N125-V127 PolarHBondContact O-N 2.89Å; V127-S130 WeakPolarHBondContact CA-OG 3.37Å; V127-S130 PolarHBondContact O-OG 3.49Å; V127-T131 PolarHBondContact O-N 3.17Å; V127-T131 PolarHBondContact O-OG1 3.22Å
128	T	51.4	Low	56.9	Low	63 Å²	63	94.9 Å²	94.9	39%	0.387	53%	0.525	S	S	.	.	H	α-helix	trans	-67.9	-33.8	175.1	29.6	0	0	0	0	114	R124 N125 T132	R124-T128 PolarHBondContact O-N 2.89Å; R124-T128 VanDerWaalsContact O-N 3.13Å; R124-T128 PolarHBondContact O-OG1 3.33Å; N125-T128 WeakPolarHBondContact CA-OG1 3.48Å; N125-T128 PolarHBondContact O-N 3.35Å; N125-T128 PolarHBondContact O-OG1 3.28Å; T128-T132 PolarHBondContact O-N 2.96Å; T128-T132 PolarHBondContact O-OG1 2.9Å
129	A	38.3	Very low	53.9	Low	50 Å²	50	96.6 Å²	96.6	41%	0.413	54%	0.543	S	S	.	.	H	α-helix	trans	-69.9	-39	177	0	0	0	0	0	112.2	N125 T132 Q133	N125-A129 WeakPolarHBondContact O-CB 3.38Å; N125-A129 PolarHBondContact O-N 2.91Å; A129-T132 WeakPolarHBondContact CA-OG1 3.27Å; A129-T132 PolarHBondContact O-N 3Å; A129-T132 PolarHBondContact O-OG1 2.8Å; A129-T132 VanDerWaalsContact O-OG1 3.07Å; A129-Q133 PolarHBondContact O-N 2.87Å; A129-Q133 VanDerWaalsContact O-N 3.14Å
130	S	42.9	Very low	51.1	Low	73 Å²	73	105.6 Å²	105.6	51%	0.51	57%	0.574	S	S	.	*	H	α-helix	trans	-69.6	-32.8	175.7	47.2	0	0	0	0	112.9	A126 V127 G134	A126-S130 PolarHBondContact O-N 3.42Å; A126-S130 PolarHBondContact O-OG 3.21Å; V127-S130 WeakPolarHBondContact CA-OG 3.37Å; V127-S130 PolarHBondContact O-OG 3.49Å; S130-G134 PolarHBondContact O-N 3.41Å
131	T	42.6	Very low	48.2	Very low	69 Å²	69	108.3 Å²	108.3	42%	0.423	61%	0.607	S	S	.	*	H	α-helix	trans	-67.7	-34.8	172	-38.9	0	0	0	0	112.1	V127	V127-T131 PolarHBondContact O-N 3.17Å; V127-T131 PolarHBondContact O-OG1 3.22Å
132	T	35.8	Very low	45.5	Very low	96 Å²	96	110 Å²	110	59%	0.589	62%	0.616	S	S	*	*	H	α-helix	trans	-80.9	-16.3	-179.4	36.5	0	0	0	0	114.2	T128 A129	T128-T132 PolarHBondContact O-N 2.96Å; T128-T132 PolarHBondContact O-OG1 2.9Å; A129-T132 WeakPolarHBondContact CA-OG1 3.27Å; A129-T132 PolarHBondContact O-N 3Å; A129-T132 PolarHBondContact O-OG1 2.8Å; A129-T132 VanDerWaalsContact O-OG1 3.07Å
133	Q	35.5	Very low	42.8	Very low	162 Å²	162	116.3 Å²	116.3	76%	0.757	64%	0.635	S	S	*	*	H	α-helix	trans	-83.6	-21.4	171.2	-107.4	174.6	-23.7	0	0	113.4	A129	A129-Q133 PolarHBondContact O-N 2.87Å; A129-Q133 VanDerWaalsContact O-N 3.14Å
134	G	32.2	Very low	40.7	Very low	55 Å²	55	122.9 Å²	122.9	57%	0.567	66%	0.659	S	S	*	*	H	α-helix	trans	-76.4	-18.5	174.1	0	0	0	0	0	114.8	S130	S130-G134 PolarHBondContact O-N 3.41Å
135	D	36.3	Very low	39	Very low	130 Å²	130	120.9 Å²	120.9	70%	0.695	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	7.6	-175.5	-82.3	-22.9	0	0	0	114.5
136	R	32.5	Very low	37.4	Very low	232 Å²	232	119.7 Å²	119.7	88%	0.875	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-5.9	173.6	-79.6	-171.6	177.4	177.6	0	114.7
137	E	37.3	Very low	36	Very low	179 Å²	179	121.7 Å²	121.7	84%	0.836	66%	0.66	S	S	*	*	S	Bend	trans	-126.6	63.8	173.8	-77.2	-171.7	155.9	0	0	111.7
138	K	30.5	Very low	35	Very low	200 Å²	200	124.6 Å²	124.6	87%	0.87	67%	0.67	S	S	*	*	S	Bend	trans	-171.6	131.1	143.6	-102.3	159	-169.3	-175.7	0	109.6
139	G	27.9	Very low	34.3	Very low	77 Å²	77	128.1 Å²	128.1	79%	0.794	68%	0.676	S	S	*	*			trans	-63	150.2	-164.8	0	0	0	0	0	116.2
140	R	33.4	Very low	34.1	Very low	258 Å²	258	131 Å²	131	97%	0.974	68%	0.684	S	S	*	*	S	Bend	trans	18.5	108	155.2	-74.4	-177.8	-178.7	-150.8	-1.3	117.3
141	G	30.5	Very low	33.5	Very low	80 Å²	80	133.6 Å²	133.6	83%	0.825	69%	0.686	S	S	*	*			trans	142.7	74.1	142.2	0	0	0	0	0	115.7
142	C	30.8	Very low	33.3	Very low	83 Å²	83	133.2 Å²	133.2	56%	0.561	69%	0.686	S	S	*	*			trans	-172.9	80.3	147.5	-140.7	0	0	0	0	113	K144	C142-K144 PolarHBondContact O-N 2.65Å
143	E	28.1	Very low	33.3	Very low	191 Å²	191	134 Å²	134	89%	0.893	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	17.7	170.2	-82.5	-178.1	153.4	0	0	113.9
144	K	31	Very low	33.1	Very low	171 Å²	171	131.4 Å²	131.4	74%	0.743	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	-7.2	-176	-70.6	-174.9	177.8	-179.9	0	115.3	C142	C142-K144 PolarHBondContact O-N 2.65Å
145	Q	35.6	Very low	33.1	Very low	139 Å²	139	134.5 Å²	134.5	65%	0.65	67%	0.673	S	S	*	*	H	α-helix	trans	-91.3	-21.9	-172.3	-71.6	-177.2	-0.1	0	0	115
146	S	33.8	Very low	33.1	Very low	86 Å²	86	131.7 Å²	131.7	60%	0.601	66%	0.664	S	S	*	*	H	α-helix	trans	-71.2	-30.8	178	52.4	0	0	0	0	113.2
147	D	31.9	Very low	33.2	Very low	100 Å²	100	129.2 Å²	129.2	54%	0.535	65%	0.654	S	S	.	*	H	α-helix	trans	-75	-29.4	-179.5	-92.3	-4.9	0	0	0	113.4	L150 K151	D147-L150 PolarHBondContact O-N 2.88Å; D147-K151 WeakPolarHBondContact O-CB 3.33Å; D147-K151 WeakPolarHBondContact O-CG 3Å; D147-K151 PolarHBondContact O-N 2.9Å
148	E	36.2	Very low	32.9	Very low	123 Å²	123	128.7 Å²	128.7	58%	0.575	65%	0.65	S	S	*	*	H	α-helix	trans	-69.1	-34.2	177.3	-78.3	-166.2	154.7	0	0	112.5	L150 K151 C152	E148-L150 VanDerWaalsContact C-N 3.3Å; E148-L150 PolarHBondContact O-N 3.44Å; E148-K151 PolarHBondContact O-N 2.88Å; E148-C152 WeakPolarHBondContact O-CB 3.36Å; E148-C152 PolarHBondContact O-N 3.46Å
149	R	37.7	Very low	33.2	Very low	137 Å²	137	127.1 Å²	127.1	52%	0.517	64%	0.638	S	S	.	*	H	α-helix	trans	-64.8	-34.8	177.5	-151.7	177.4	-170.2	-172.9	6.1	111.7
150	L	33.2	Very low	33.6	Very low	109 Å²	109	132.4 Å²	132.4	57%	0.571	63%	0.634	S	S	*	*	H	α-helix	trans	-78.2	-37	173.7	-118	86	0	0	0	112.5	D147 E148 L153 Q154	D147-L150 PolarHBondContact O-N 2.88Å; E148-L150 VanDerWaalsContact C-N 3.3Å; E148-L150 PolarHBondContact O-N 3.44Å; L150-L153 PolarHBondContact O-N 2.88Å; L150-Q154 PolarHBondContact O-N 3.38Å; L150-Q154 VanDerWaalsContact O-N 3.14Å
151	K	30.7	Very low	33.4	Very low	129 Å²	129	127.4 Å²	127.4	56%	0.561	62%	0.621	S	S	*	*	H	α-helix	trans	-64.6	-39.3	176.2	-79.5	174.9	179.5	173.5	0	112.6	D147 E148 L153 Q154 E155	D147-K151 WeakPolarHBondContact O-CB 3.33Å; D147-K151 WeakPolarHBondContact O-CG 3Å; D147-K151 PolarHBondContact O-N 2.9Å; E148-K151 PolarHBondContact O-N 2.88Å; K151-L153 VanDerWaalsContact C-N 3.31Å; K151-L153 PolarHBondContact O-N 3.05Å; K151-Q154 CarbonylContact O-C 3.56Å; K151-Q154 WeakPolarHBondContact O-CA 3.44Å; K151-Q154 PolarHBondContact O-N 3.43Å; K151-E155 PolarHBondContact O-N 3.21Å
152	C	38.5	Very low	33.4	Very low	61 Å²	61	130.5 Å²	130.5	41%	0.412	61%	0.614	S	S	.	*	H	α-helix	trans	-62.9	-36.5	175.8	-172.2	0	0	0	0	112.5	E148 Q154 S156	E148-C152 WeakPolarHBondContact O-CB 3.36Å; E148-C152 PolarHBondContact O-N 3.46Å; C152-Q154 VanDerWaalsContact C-N 3.33Å; C152-S156 WeakPolarHBondContact O-CB 3.38Å; C152-S156 PolarHBondContact O-N 2.86Å; C152-S156 PolarHBondContact O-OG 2.82Å
153	L	35.1	Very low	33.2	Very low	112 Å²	112	135.3 Å²	135.3	59%	0.586	63%	0.626	S	S	*	*	H	α-helix	trans	-68.4	-30.6	172.9	-73.9	164.9	0	0	0	112.5	L150 K151 R157	L150-L153 PolarHBondContact O-N 2.88Å; K151-L153 VanDerWaalsContact C-N 3.31Å; K151-L153 PolarHBondContact O-N 3.05Å; L153-R157 PolarHBondContact O-N 3.15Å
154	Q	31.4	Very low	33.2	Very low	108 Å²	108	130.5 Å²	130.5	51%	0.505	61%	0.61	S	S	.	*	H	α-helix	trans	-80	-36.2	175.3	-73.3	-179.1	-11.2	0	0	113	L150 K151 C152 S156 R157 K158	L150-Q154 PolarHBondContact O-N 3.38Å; L150-Q154 VanDerWaalsContact O-N 3.14Å; K151-Q154 CarbonylContact O-C 3.56Å; K151-Q154 WeakPolarHBondContact O-CA 3.44Å; K151-Q154 PolarHBondContact O-N 3.43Å; C152-Q154 VanDerWaalsContact C-N 3.33Å; Q154-S156 VanDerWaalsContact C-N 3.31Å; Q154-S156 PolarHBondContact O-N 2.93Å; Q154-R157 WeakPolarHBondContact O-CA 3.45Å; Q154-R157 VanDerWaalsContact O-CB 3.26Å; Q154-R157 WeakPolarHBondContact O-CB 3.39Å; Q154-R157 PolarHBondContact O-N 2.79Å; Q154-K158 PolarHBondContact O-N 2.91Å; Q154-K158 VanDerWaalsContact O-N 3.13Å
155	E	33.3	Very low	33.1	Very low	119 Å²	119	125.4 Å²	125.4	56%	0.556	60%	0.596	S	S	*	*	H	α-helix	trans	-65	-36.3	171.5	-90.3	-175.5	149	0	0	112	K151 R157 K158 R159	K151-E155 PolarHBondContact O-N 3.21Å; E155-R157 PolarHBondContact O-N 2.72Å; E155-K158 PolarHBondContact O-N 3.35Å; E155-R159 PolarHBondContact O-N 2.95Å
156	S	35	Very low	32.7	Very low	72 Å²	72	127.5 Å²	127.5	50%	0.503	61%	0.606	S	S	.	*	H	α-helix	trans	-61.2	-25.9	169.6	-59.9	0	0	0	0	112.7	C152 Q154	C152-S156 WeakPolarHBondContact O-CB 3.38Å; C152-S156 PolarHBondContact O-N 2.86Å; C152-S156 PolarHBondContact O-OG 2.82Å; Q154-S156 VanDerWaalsContact C-N 3.31Å; Q154-S156 PolarHBondContact O-N 2.93Å
157	R	36.1	Very low	32.5	Very low	179 Å²	179	132.1 Å²	132.1	68%	0.675	62%	0.618	S	S	*	*	H	α-helix	trans	-76.6	-34.2	170.5	-68.6	175.4	175.3	179	-1.4	112.3	L153 Q154 E155 R160	L153-R157 PolarHBondContact O-N 3.15Å; Q154-R157 WeakPolarHBondContact O-CA 3.45Å; Q154-R157 VanDerWaalsContact O-CB 3.26Å; Q154-R157 WeakPolarHBondContact O-CB 3.39Å; Q154-R157 PolarHBondContact O-N 2.79Å; E155-R157 PolarHBondContact O-N 2.72Å; R157-R160 WeakPolarHBondContact O-CB 3.41Å; R157-R160 PolarHBondContact O-N 3.43Å
158	K	30.2	Very low	32.4	Very low	169 Å²	169	132 Å²	132	74%	0.735	63%	0.625	S	S	*	*	H	α-helix	trans	-69.2	-39.8	175.2	-91	-176.2	174.4	-178.3	0	112.4	Q154 E155 R160 H161	Q154-K158 PolarHBondContact O-N 2.91Å; Q154-K158 VanDerWaalsContact O-N 3.13Å; E155-K158 PolarHBondContact O-N 3.35Å; K158-R160 PolarHBondContact O-N 2.94Å; K158-H161 PolarHBondContact O-N 3.09Å
159	R	36.8	Very low	31.9	Very low	166 Å²	166	133.3 Å²	133.3	63%	0.626	64%	0.636	S	S	*	*	H	α-helix	trans	-63.9	-11.7	175.8	-67.5	-173.8	-172.1	-174.4	4.7	114.2	E155 H161	E155-R159 PolarHBondContact O-N 2.95Å; R159-H161 PolarHBondContact O-N 3.25Å
160	R	36.8	Very low	31.5	Very low	188 Å²	188	135.7 Å²	135.7	71%	0.709	65%	0.653	S	S	*	*	H	α-helix	trans	-63	-28.6	168	-80.7	-177.3	167.1	-172.1	-5.9	112.8	R157 K158 T164	R157-R160 WeakPolarHBondContact O-CB 3.41Å; R157-R160 PolarHBondContact O-N 3.43Å; K158-R160 PolarHBondContact O-N 2.94Å; R160-T164 PolarHBondContact O-OG1 2.88Å
161	H	29.2	Very low	31.3	Very low	153 Å²	153	140.1 Å²	140.1	71%	0.708	67%	0.667	S	S	*	*	H	α-helix	trans	-84.6	-33.6	-174.2	-100.7	-46.7	0	0	0	113.8	K158 R159 T164 S165	K158-H161 PolarHBondContact O-N 3.09Å; R159-H161 PolarHBondContact O-N 3.25Å; H161-T164 PolarHBondContact O-OG1 3.05Å; H161-S165 PolarHBondContact O-OG 2.99Å
162	E	29.9	Very low	31.1	Very low	145 Å²	145	145.8 Å²	145.8	68%	0.678	69%	0.685	S	S	*	*	H	α-helix	trans	-74.7	-32.3	178.3	-82	173.6	153.4	0	0	113.2	T164 S165	E162-T164 VanDerWaalsContact C-N 3.3Å; E162-T164 PolarHBondContact O-N 2.79Å; E162-S165 PolarHBondContact O-OG 2.95Å; E162-S165 VanDerWaalsContact O-OG 3.1Å
163	F	27.2	Very low	30.6	Very low	185 Å²	185	154.5 Å²	154.5	81%	0.811	71%	0.709	S	S	*	*	H	α-helix	trans	-81.3	-9.4	-179.5	-130.4	-91.3	0	0	0	113.7
164	T	28.1	Very low	30.2	Very low	90 Å²	90	161.4 Å²	161.4	55%	0.552	73%	0.728	S	S	*	*	H	α-helix	trans	-102.5	-9.9	176.8	47.8	0	0	0	0	113.7	R160 H161 E162	R160-T164 PolarHBondContact O-OG1 2.88Å; H161-T164 PolarHBondContact O-OG1 3.05Å; E162-T164 VanDerWaalsContact C-N 3.3Å; E162-T164 PolarHBondContact O-N 2.79Å
165	S	27.7	Very low	30	Very low	64 Å²	64	160.2 Å²	160.2	45%	0.448	74%	0.744	S	S	.	*	H	α-helix	trans	-88	-17.1	-177.9	48.6	0	0	0	0	114.4	H161 E162	H161-S165 PolarHBondContact O-OG 2.99Å; E162-S165 PolarHBondContact O-OG 2.95Å; E162-S165 VanDerWaalsContact O-OG 3.1Å
166	E	28.4	Very low	29.6	Very low	182 Å²	182	165.7 Å²	165.7	85%	0.85	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	-0.3	-179.6	-69.9	-172.5	161.4	0	0	114.4
167	E	29.8	Very low	29.1	Very low	183 Å²	183	170.4 Å²	170.4	86%	0.855	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.4	17.8	179.6	-122.3	-179.5	-177.2	0	0	113.5
168	S	29.1	Very low	28.6	Very low	98 Å²	98	170.3 Å²	170.3	69%	0.685	78%	0.781	S	S	*	*	S	Bend	trans	-138.4	-1.7	-179.8	-62.9	0	0	0	0	116.4	E170	S168-E170 PolarHBondContact O-N 2.99Å
169	D	26.5	Very low	28.3	Very low	150 Å²	150	166 Å²	166	80%	0.802	78%	0.784	S	S	*	*			trans	-97.8	54.5	-178.6	-92.2	-24.8	0	0	0	113.4
170	E	27.6	Very low	27.7	Very low	187 Å²	187	163.1 Å²	163.1	87%	0.874	80%	0.797	S	S	*	*	S	Bend	trans	-151.9	44.3	158.4	-153.8	149.5	-165.3	0	0	113.8	S168	S168-E170 PolarHBondContact O-N 2.99Å
171	K	29.5	Very low	27.1	Very low	202 Å²	202	165.3 Å²	165.3	88%	0.878	81%	0.805	S	S	*	*	S	Bend	trans	-161.6	46.5	165.4	-118.4	170.7	-167.4	179.4	0	114.7
172	R	27.8	Very low	26.9	Very low	248 Å²	248	166.2 Å²	166.2	94%	0.936	81%	0.814	S	S	*	*			trans	-142.6	65	167.1	-100.6	-177.8	175	173.3	-2.3	112.4
173	R	28.2	Very low	26.6	Very low	244 Å²	244	164.1 Å²	164.1	92%	0.921	82%	0.815	S	S	*	*			trans	-138.3	88.9	154.6	-79.2	-170.5	167.2	165.2	-3.3	109.4
174	R	26.6	Very low	26.7	Very low	257 Å²	257	161.4 Å²	161.4	97%	0.97	82%	0.816	S	S	*	*	S	Bend	trans	170	131.4	145	-94.5	166.5	-169.2	-129.6	3.5	109.4
175	G	26.3	Very low	26.4	Very low	83 Å²	83	163.8 Å²	163.8	86%	0.856	83%	0.826	S	S	*	*			trans	109.4	79.3	168.2	0	0	0	0	0	114.8
176	R	23.9	Very low	26.3	Very low	235 Å²	235	168.3 Å²	168.3	89%	0.887	84%	0.844	S	S	*	*			trans	-100.6	158	158.2	-174.5	-179.2	-173.4	-155.9	1.8	106.7
177	E	25.8	Very low	26.1	Very low	171 Å²	171	168.7 Å²	168.7	80%	0.799	85%	0.846	S	S	*	*			trans	101.1	128	178.5	-63.8	171	-171.6	0	0	112.1
178	E	25.9	Very low	25.7	Very low	176 Å²	176	169.7 Å²	169.7	82%	0.822	85%	0.847	S	S	*	*			cis	-158.3	151.1	1.5	-101	174.5	160.3	0	0	106.4
179	G	23.1	Very low	25.4	Very low	78 Å²	78	168.8 Å²	168.8	80%	0.804	85%	0.846	S	S	*	*				58	123.4	113.3	0	0	0	0	0	114.6
180	A	24.4	Very low	25.3	Very low	107 Å²	107	169.5 Å²	169.5	88%	0.884	85%	0.85	S	S	*	*			cis	-170.6	171.2	35.1	0	0	0	0	0	110.6
181	R	24	Very low	25	Very low	234 Å²	234	167.5 Å²	167.5	88%	0.883	85%	0.845	S	S	*	*			trans	-61	154.9	179.9	-60.1	168.3	-175.3	-168.9	-0.8	112.7
182	L	24.9	Very low	24.8	Very low	172 Å²	172	164.5 Å²	164.5	90%	0.901	84%	0.843	S	S	*	*				172.8	127	119.2	-87.2	158.7	0	0	0	110.8
183	S	23.5	Very low	24.7	Very low	101 Å²	101	157.5 Å²	157.5	71%	0.706	83%	0.832	S	S	*	*			trans	-75.9	159.2	156.9	44.8	0	0	0	0	109.8
184	P	29.7	Very low	24.5	Very low	128 Å²	128	153.1 Å²	153.1	83%	0.831	82%	0.822	S	S	*	*				-148.6	174.4	94.3	35.4	-15.3	0	0	0	116.3
185	D	21.5	Very low	24.4	Very low	140 Å²	140	147.2 Å²	147.2	75%	0.749	82%	0.817	S	S	*	*			trans	-77.7	162.4	-173.7	-67	-61.6	0	0	0	117
186	L	25	Very low	24.3	Very low	159 Å²	159	151.7 Å²	151.7	83%	0.832	81%	0.813	S	S	*	*			trans	65.9	138.7	150.5	-64.8	155.1	0	0	0	117.8
187	E	24.1	Very low	24.2	Very low	189 Å²	189	150 Å²	150	88%	0.883	81%	0.812	S	S	*	*				-159.6	167.2	58.4	-73	-177.7	146.5	0	0	114.3
188	K	21.8	Very low	24.2	Very low	204 Å²	204	147.9 Å²	147.9	89%	0.887	81%	0.811	S	S	*	*			trans	-72.5	172.1	166.5	-60.5	171	176.5	175.6	0	110.1
189	A	23.2	Very low	24.1	Very low	80 Å²	80	145.1 Å²	145.1	66%	0.661	81%	0.809	S	S	*	*			cis	-152.2	171.4	15.5	0	0	0	0	0	106.7
190	D	23.6	Very low	24.2	Very low	165 Å²	165	145.9 Å²	145.9	88%	0.882	81%	0.808	S	S	*	*				-176.6	163.1	68.5	-100.1	-32.1	0	0	0	111.7
191	D	22.1	Very low	24.2	Very low	144 Å²	144	147.1 Å²	147.1	77%	0.77	80%	0.8	S	S	*	*			trans	-72.1	138.9	-173.6	-171.3	20.4	0	0	0	115.4
192	V	26.2	Very low	24.4	Very low	139 Å²	139	147.2 Å²	147.2	84%	0.842	80%	0.802	S	S	*	*			trans	-150	130.3	148.3	-174.7	0	0	0	0	111.1
193	S	25	Very low	24.6	Very low	101 Å²	101	143.3 Å²	143.3	71%	0.706	79%	0.789	S	S	*	*			trans	-56.6	153.4	-173	53.1	0	0	0	0	120.9
194	E	23.6	Very low	24.9	Very low	153 Å²	153	147 Å²	147	72%	0.715	79%	0.792	S	S	*	*			trans	-55.7	171.6	167.6	-61.2	-176.1	147.2	0	0	116.2
195	P	25	Very low	24.9	Very low	133 Å²	133	147.9 Å²	147.9	86%	0.864	79%	0.789	S	S	*	*				-126.3	137.3	124.1	34.7	-25.4	0	0	0	114.3
196	K	23.4	Very low	25.3	Very low	176 Å²	176	149.4 Å²	149.4	77%	0.765	79%	0.792	S	S	*	*			trans	-72.9	151	173.2	-66.8	174.7	175.7	174.4	0	112.9
197	K	23.4	Very low	26	Very low	200 Å²	200	146.2 Å²	146.2	87%	0.87	78%	0.775	S	S	*	*				-169.9	122.1	126.7	-104.1	-173.8	177.7	176.4	0	114.4
198	V	24.1	Very low	26.7	Very low	126 Å²	126	145.9 Å²	145.9	76%	0.764	77%	0.773	S	S	*	*			trans	68.1	98.8	141.6	-169.5	0	0	0	0	118.3
199	C	23.7	Very low	27.8	Very low	118 Å²	118	145 Å²	145	80%	0.797	77%	0.772	S	S	*	*				67	110.6	81	-94.9	0	0	0	0	116.9
200	A	25.8	Very low	29.4	Very low	95 Å²	95	146.8 Å²	146.8	79%	0.785	77%	0.771	S	S	*	*			trans	-139.5	119.3	137.8	0	0	0	0	0	108.1
201	D	24.6	Very low	31.7	Very low	133 Å²	133	143 Å²	143	71%	0.711	75%	0.754	S	S	*	*			trans	-57.5	124.5	-177.4	-94.7	-54.9	0	0	0	113.6
202	Y	28.5	Very low	34.9	Very low	236 Å²	236	137.6 Å²	137.6	93%	0.925	73%	0.726	S	S	*	*			trans	-124.4	74.2	151	-84	-84.3	0	0	0	107.3
203	S	29.1	Very low	38.2	Very low	90 Å²	90	132 Å²	132	63%	0.629	69%	0.692	S	S	*	*			trans	-82.4	126.9	174.4	42.4	0	0	0	0	110.8
204	K	28.9	Very low	41.6	Very low	177 Å²	177	127.2 Å²	127.2	77%	0.77	66%	0.659	S	S	*	*			trans	69.4	80.8	158.1	-67.6	-178.2	173.6	-174.6	0	118
205	I	30.6	Very low	45	Very low	148 Å²	148	123.3 Å²	123.3	76%	0.759	64%	0.637	S	S	*	*			trans	-109.4	103.9	133.9	-60.8	175.1	0	0	0	105.8	L207	I205-L207 HydrophobicContact CG2-CD1 3.9Å; I205-L207 HydrophobicContact CG2-CG 4.06Å; I205-L207 PolarHBondContact O-N 3.18Å
206	E	29.4	Very low	48.5	Very low	172 Å²	172	117.8 Å²	117.8	80%	0.804	60%	0.601	S	S	*	*			trans	-66.6	79.9	169	-74.3	174.8	176.5	0	0	108.8
207	L	39.1	Very low	51.9	Low	92 Å²	92	112 Å²	112	48%	0.482	58%	0.578	S	S	.	*			trans	-79.9	114.2	155.7	-82.7	142.3	0	0	0	105.4	I205 Q209	I205-L207 HydrophobicContact CG2-CD1 3.9Å; I205-L207 HydrophobicContact CG2-CG 4.06Å; I205-L207 PolarHBondContact O-N 3.18Å; L207-Q209 PolarHBondContact O-N 2.91Å
208	E	39.7	Very low	55.4	Low	182 Å²	182	103.6 Å²	103.6	85%	0.85	54%	0.544	S	S	*	.			trans	-42.9	103.7	166.3	-68.9	179.5	159.7	0	0	108.8	N210	E208-N210 PolarHBondContact O-N 3.34Å
209	Q	45.8	Very low	58.7	Low	185 Å²	185	104.2 Å²	104.2	86%	0.864	54%	0.537	S	S	*	.			trans	-74.3	71.9	-173.4	-81.9	177	-20.8	0	0	109.5	L207 V211	L207-Q209 PolarHBondContact O-N 2.91Å; Q209-V211 VanDerWaalsContact C-N 3.33Å; Q209-V211 PolarHBondContact O-N 2.99Å
210	N	55.8	Low	61.9	Low	117 Å²	117	99.2 Å²	99.2	63%	0.626	50%	0.503	S	S	*	.			trans	-66.3	99.8	156.8	-88.2	-51.6	0	0	0	107.2	E208 V212	E208-N210 PolarHBondContact O-N 3.34Å; N210-V212 PolarHBondContact O-N 3.49Å
211	V	73.1	Confident	65	Low	87 Å²	87	97.1 Å²	97.1	53%	0.527	48%	0.483	S	S	.	.			trans	-49	113.2	170.5	177.6	0	0	0	0	108.1	Q209 S213 K248	Q209-V211 VanDerWaalsContact C-N 3.33Å; Q209-V211 PolarHBondContact O-N 2.99Å; V211-S213 PolarHBondContact O-N 3.34Å; V211-K248 HydrophobicContact CG1-CB 3.86Å
212	V	87.9	Confident	68.1	Low	30 Å²	30	92.5 Å²	92.5	18%	0.182	47%	0.467	C	S	.	.			trans	-75.7	121.1	-178.9	179.5	0	0	0	0	107.8	N210 W247 K248 L256	N210-V212 PolarHBondContact O-N 3.49Å; V212-W247 HydrophobicContact CB-CD2 4.01Å; V212-W247 HydrophobicContact CB-CG 4.01Å; V212-W247 HydrophobicContact CG1-CD2 4.29Å; V212-W247 HydrophobicContact CG1-CE3 4.47Å; V212-K248 PolarHBondContact O-N 3.12Å; V212-L256 HydrophobicContact CG1-CB 3.99Å; V212-L256 HydrophobicContact CG1-CD2 4.24Å
213	S	94.9	Very high	71	Confident	20 Å²	20	88.6 Å²	88.6	14%	0.14	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	134.2	169.3	69.6	0	0	0	0	110.4	V211 K248 K255 L256	V211-S213 PolarHBondContact O-N 3.34Å; S213-K248 CarbonylContact C-O 3.53Å; S213-K248 WeakPolarHBondContact CA-O 3.36Å; S213-K255 PolarHBondContact O-N 3.25Å; S213-K255 WeakPolarHBondContact OG-CG 3.21Å; S213-K255 PolarHBondContact OG-N 3.37Å; S213-L256 PolarHBondContact O-N 2.96Å
214	F	96.6	Very high	73.7	Confident	1 Å²	1	84.5 Å²	84.5	0%	0.004	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	160.1	-174	75.7	-77.7	0	0	0	114.3	I216 L241 W247 K248 A249 D250 L256 I258	F214-I216 HydrophobicContact CD2-CG1 4.05Å; F214-I216 HydrophobicContact CE2-CD1 4.01Å; F214-I216 HydrophobicContact CE2-CG1 3.87Å; F214-L241 HydrophobicContact CD2-CD1 4.34Å; F214-L241 HydrophobicContact CE2-CB 4.23Å; F214-L241 HydrophobicContact CE2-CD1 3.88Å; F214-L241 HydrophobicContact CZ-CB 3.87Å; F214-L241 HydrophobicContact CZ-CD1 4.37Å; F214-W247 HydrophobicContact CB-CE3 4.48Å; F214-W247 HydrophobicContact CD1-CB 3.6Å; F214-W247 HydrophobicContact CD1-CE3 4.07Å; F214-W247 HydrophobicContact CD1-CG 4.5Å; F214-W247 HydrophobicContact CE1-CB 3.52Å; F214-W247 HydrophobicContact CG-CE3 4.19Å; F214-K248 VanDerWaalsContact CD1-O 3.29Å; F214-K248 WeakPolarHBondContact CD1-O 3.11Å; F214-K248 PolarHBondContact N-O 3.48Å; F214-A249 CarbonylContact O-C 3.5Å; F214-A249 WeakPolarHBondContact O-CA 3.33Å; F214-D250 PolarHBondContact O-N 2.74Å; F214-L256 CarbonylContact C-O 3.51Å; F214-L256 WeakPolarHBondContact CA-O 3.43Å; F214-L256 HydrophobicContact CB-CB 4.1Å; F214-L256 WeakPolarHBondContact CB-O 3.41Å; F214-I258 HydrophobicContact CD2-CD1 3.92Å
215	R	96.4	Very high	76.5	Confident	71 Å²	71	81.2 Å²	81.2	27%	0.268	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	155.1	165	74.3	174.9	174	-173.3	6.6	111.7	L251 P254 L256 E257 I258	R215-L251 HydrophobicContact CB-CD2 4.25Å; R215-P254 HydrophobicContact CB-CB 4.17Å; R215-P254 HydrophobicContact CB-CG 4.21Å; R215-P254 HydrophobicContact CG-CB 4.06Å; R215-P254 HydrophobicContact CG-CG 3.73Å; R215-L256 PolarHBondContact N-O 3.44Å; R215-E257 HydrophobicContact CG-CB 4.42Å; R215-E257 HydrophobicContact CG-CG 4.05Å; R215-E257 IonicContact CZ-OE1 2.62Å; R215-E257 IonicContact CZ-OE2 3.26Å; R215-E257 IonicContact NE-OE1 3.54Å; R215-E257 IonicContact NE-OE2 3.33Å; R215-E257 PolarHBondContact NE-OE2 3.27Å; R215-E257 VanDerWaalsContact NE-OE2 3.15Å; R215-E257 IonicContact NH2-OE1 3.3Å; R215-E257 PolarHBondContact NH2-OE1 2.56Å; R215-E257 IonicContact NH2-OE2 2.67Å; R215-E257 PolarHBondContact NH2-OE2 3.03Å; R215-I258 PolarHBondContact O-N 3.39Å
216	I	97	Very high	79.1	Confident	18 Å²	18	84 Å²	84	9%	0.092	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	118.5	176.1	-55.3	-173.4	0	0	0	109.8	F214 S234 M237 G238 L241 I258 V260	F214-I216 HydrophobicContact CD2-CG1 4.05Å; F214-I216 HydrophobicContact CE2-CD1 4.01Å; F214-I216 HydrophobicContact CE2-CG1 3.87Å; I216-S234 PolarHBondContact O-OG 3.42Å; I216-M237 HydrophobicContact CD1-CB 3.22Å; I216-M237 HydrophobicContact CD1-CE 4.5Å; I216-M237 HydrophobicContact CD1-CG 4.43Å; I216-G238 VanDerWaalsContact CD1-N 3.34Å; I216-L241 HydrophobicContact CD1-CD1 4.26Å; I216-I258 WeakPolarHBondContact CA-O 3.38Å; I216-V260 HydrophobicContact CG2-CG2 3.74Å
217	N	95.9	Very high	81.8	Confident	53 Å²	53	77.7 Å²	77.7	28%	0.283	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	102	172.5	-58	-38.2	0	0	0	108.4	E257 I258 N259 V260	N217-E257 PolarHBondContact ND2-OE2 3.12Å; N217-I258 PolarHBondContact N-O 3.1Å; N217-N259 WeakPolarHBondContact CB-OD1 3.29Å; N217-N259 PolarHBondContact ND2-OD1 3.11Å; N217-N259 WeakPolarHBondContact O-CA 3.24Å; N217-V260 PolarHBondContact O-N 2.96Å
218	C	95.8	Very high	84.2	Confident	25 Å²	25	73.8 Å²	73.8	17%	0.169	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	136.9	-179.5	-169.5	0	0	0	0	111.5	C220 A230 V233 S234 V260	C218-C220 PolarHBondContact SG-SG 2.87Å; C218-A230 HydrophobicContact CB-CB 4.21Å; C218-V233 HydrophobicContact CB-CB 4.43Å; C218-V233 HydrophobicContact CB-CG1 4.41Å; C218-V233 VanDerWaalsContact SG-CG1 3.54Å; C218-S234 WeakPolarHBondContact CB-OG 3.38Å; C218-V260 CarbonylContact C-O 3.6Å; C218-V260 WeakPolarHBondContact CA-O 3.42Å; C218-V260 HydrophobicContact CB-CB 4.38Å
219	K	93.8	Very high	86.6	Confident	138 Å²	138	67.6 Å²	67.6	60%	0.6	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121	114.3	165.9	-173.1	173	-177	173.7	0	108.7	V260 Y261 L262	K219-V260 PolarHBondContact N-O 3.4Å; K219-Y261 HydrophobicContact CB-CD1 3.84Å; K219-Y261 HydrophobicContact CB-CE1 4.1Å; K219-Y261 HydrophobicContact CD-CD1 4.24Å; K219-Y261 HydrophobicContact CD-CE1 4.18Å; K219-Y261 HydrophobicContact CG-CD1 4.48Å; K219-Y261 WeakPolarHBondContact O-CA 3.47Å; K219-L262 PolarHBondContact O-N 3.23Å
220	C	91.9	Very high	88.9	Confident	13 Å²	13	59.9 Å²	59.9	9%	0.088	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	134.9	174.2	-64.5	0	0	0	0	109.6	C218 H225 L262	C218-C220 PolarHBondContact SG-SG 2.87Å; C220-H225 HydrophobicContact CB-CB 4.24Å; C220-H225 PolarHBondContact O-CD2 3.23Å; C220-L262 WeakPolarHBondContact CA-O 3.44Å
221	S	90.9	Very high	90.7	Very high	52 Å²	52	61.2 Å²	61.2	36%	0.364	32%	0.315	S	S	.	.			trans	-138.9	170.5	173	55.5	0	0	0	0	110.7	L262 N263	S221-L262 PolarHBondContact N-O 2.99Å; S221-N263 VanDerWaalsContact OG-CB 3.24Å; S221-N263 WeakPolarHBondContact OG-CB 3.28Å
222	G	89.4	Confident	91.7	Very high	36 Å²	36	59.4 Å²	59.4	37%	0.371	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.5	-150.8	177.2	0	0	0	0	0	113.6	L224 H225 D264	G222-L224 VanDerWaalsContact C-N 3.32Å; G222-L224 PolarHBondContact O-N 3.15Å; G222-H225 PolarHBondContact O-N 2.66Å; G222-D264 WeakPolarHBondContact CA-OD2 3.34Å
223	K	88.3	Confident	92	Very high	153 Å²	153	58 Å²	58	67%	0.665	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-38.5	-178.8	-62.2	174.3	-175.6	175.2	0	111.6	H225 R226 D264	K223-H225 VanDerWaalsContact C-N 3.29Å; K223-H225 PolarHBondContact O-N 3.19Å; K223-R226 WeakPolarHBondContact O-CB 3.29Å; K223-R226 PolarHBondContact O-N 2.88Å; K223-D264 VanDerWaalsContact CB-OD1 3.3Å; K223-D264 WeakPolarHBondContact CB-OD1 3.15Å; K223-D264 VanDerWaalsContact N-CG 3.33Å; K223-D264 PolarHBondContact N-OD1 2.78Å; K223-D264 PolarHBondContact N-OD2 2.97Å
224	L	86.1	Confident	92	Very high	4 Å²	4	58.3 Å²	58.3	2%	0.021	30%	0.295	C	S	.	.	H	α-helix	trans	-60.8	-37.1	-178.1	-170.5	69.3	0	0	0	112.8	V80 L82 G222 R226 C227 V228 L262	V80-L224 HydrophobicContact CB-CD1 4.36Å; V80-L224 HydrophobicContact CB-CD2 4.25Å; V80-L224 HydrophobicContact CG1-CD1 4.34Å; L82-L224 HydrophobicContact CB-CD1 3.96Å; L82-L224 HydrophobicContact CD1-CD1 3.66Å; L82-L224 HydrophobicContact CG-CD1 3.92Å; G222-L224 VanDerWaalsContact C-N 3.32Å; G222-L224 PolarHBondContact O-N 3.15Å; L224-R226 PolarHBondContact O-N 3.49Å; L224-C227 PolarHBondContact O-N 3.12Å; L224-V228 PolarHBondContact O-N 2.79Å; L224-L262 HydrophobicContact CD2-CB 3.5Å; L224-L262 VanDerWaalsContact CD2-CB 3.5Å; L224-L262 HydrophobicContact CD2-CD1 3.68Å; L224-L262 HydrophobicContact CD2-CG 4.19Å
225	H	87.3	Confident	91.9	Very high	108 Å²	108	63.9 Å²	63.9	50%	0.5	32%	0.316	S	S	.	.	H	α-helix	trans	-61.2	-23.8	177	179.9	-87.4	0	0	0	112.8	C220 G222 K223 C227	C220-H225 HydrophobicContact CB-CB 4.24Å; C220-H225 PolarHBondContact O-CD2 3.23Å; G222-H225 PolarHBondContact O-N 2.66Å; K223-H225 VanDerWaalsContact C-N 3.29Å; K223-H225 PolarHBondContact O-N 3.19Å; H225-C227 VanDerWaalsContact C-N 3.32Å
226	R	86.9	Confident	91.9	Very high	206 Å²	206	60.5 Å²	60.5	78%	0.777	30%	0.303	S	S	*	.	H	α-helix	trans	-78.5	-19.4	175.2	-52.9	-175.2	-174.1	-152	0.9	112.7	K223 L224	K223-R226 WeakPolarHBondContact O-CB 3.29Å; K223-R226 PolarHBondContact O-N 2.88Å; L224-R226 PolarHBondContact O-N 3.49Å
227	C	86.1	Confident	91.8	Very high	41 Å²	41	59.6 Å²	59.6	28%	0.277	30%	0.298	S	S	.	.	H	α-helix	trans	-100	-37	-177.2	-55.3	0	0	0	0	112	L82 L224 H225	L82-C227 HydrophobicContact CB-CB 4.13Å; L224-C227 PolarHBondContact O-N 3.12Å; H225-C227 VanDerWaalsContact C-N 3.32Å
228	V	88.3	Confident	91.8	Very high	9 Å²	9	57.6 Å²	57.6	6%	0.055	29%	0.29	C	S	.	.	S	Bend	trans	-142.5	132	-175.4	-173	0	0	0	0	110.2	L82 A91 L95 L224 E232 V233	L82-V228 HydrophobicContact CD1-CG2 3.49Å; L82-V228 VanDerWaalsContact CD1-CG2 3.49Å; A91-V228 HydrophobicContact CB-CG2 4.2Å; L95-V228 HydrophobicContact CD1-CG1 4.03Å; L95-V228 HydrophobicContact CD1-CG2 4.43Å; L224-V228 PolarHBondContact O-N 2.79Å; V228-E232 HydrophobicContact CG1-CB 3.7Å; V228-E232 HydrophobicContact CG1-CG 3.61Å; V228-V233 HydrophobicContact CB-CG2 4.47Å; V228-V233 HydrophobicContact CG1-CG2 3.74Å
229	S	91.3	Very high	91.8	Very high	52 Å²	52	59.4 Å²	59.4	36%	0.364	30%	0.297	S	S	.	.			trans	-73.1	154	175	71.7	0	0	0	0	111.7	Q231 E232 V233	S229-Q231 PolarHBondContact O-N 3.38Å; S229-E232 PolarHBondContact O-N 2.87Å; S229-E232 VanDerWaalsContact O-N 3.12Å; S229-E232 WeakPolarHBondContact OG-CB 3.12Å; S229-E232 PolarHBondContact OG-N 2.96Å; S229-E232 VanDerWaalsContact OG-N 3.15Å; S229-V233 PolarHBondContact O-N 3.26Å; S229-V233 VanDerWaalsContact O-N 3.11Å
230	A	93.3	Very high	91.9	Very high	24 Å²	24	53.1 Å²	53.1	20%	0.198	27%	0.271	C	S	.	.	H	α-helix	trans	-59.8	-35.1	175.6	0	0	0	0	0	112.1	C218 E232 V233 S234	C218-A230 HydrophobicContact CB-CB 4.21Å; A230-E232 VanDerWaalsContact C-N 3.34Å; A230-V233 PolarHBondContact O-N 3.04Å; A230-S234 PolarHBondContact O-N 3.42Å; A230-S234 PolarHBondContact O-OG 3.47Å
231	Q	93.5	Very high	92	Very high	144 Å²	144	52.5 Å²	52.5	67%	0.673	27%	0.267	S	S	*	.	H	α-helix	trans	-63.4	-40.3	175.6	-62.7	87.5	-13.2	0	0	111.8	S229 S234 R235	S229-Q231 PolarHBondContact O-N 3.38Å; Q231-S234 PolarHBondContact O-N 2.98Å; Q231-R235 WeakPolarHBondContact O-CB 3.37Å; Q231-R235 PolarHBondContact O-N 3.11Å
232	E	93.2	Very high	92.2	Very high	49 Å²	49	51.9 Å²	51.9	23%	0.229	26%	0.263	C	S	.	.	H	α-helix	trans	-67.4	-41.2	179	179.3	58.8	-163.6	0	0	111.4	V228 S229 A230 S234 R235 V236	V228-E232 HydrophobicContact CG1-CB 3.7Å; V228-E232 HydrophobicContact CG1-CG 3.61Å; S229-E232 PolarHBondContact O-N 2.87Å; S229-E232 VanDerWaalsContact O-N 3.12Å; S229-E232 WeakPolarHBondContact OG-CB 3.12Å; S229-E232 PolarHBondContact OG-N 2.96Å; S229-E232 VanDerWaalsContact OG-N 3.15Å; A230-E232 VanDerWaalsContact C-N 3.34Å; E232-S234 PolarHBondContact O-N 2.93Å; E232-R235 PolarHBondContact O-N 2.93Å; E232-R235 IonicContact OE1-CZ 3.29Å; E232-R235 IonicContact OE1-NE 3.15Å; E232-R235 IonicContact OE1-NH2 2.81Å; E232-R235 PolarHBondContact OE1-NH2 3.11Å; E232-R235 IonicContact OE2-CZ 4Å; E232-R235 IonicContact OE2-NE 2.82Å; E232-R235 PolarHBondContact OE2-NE 3.03Å; E232-R235 IonicContact OE2-NH2 3.91Å; E232-R235 PolarHBondContact OE2-NH2 3.13Å; E232-V236 VanDerWaalsContact O-CG2 3.32Å; E232-V236 WeakPolarHBondContact O-CG2 3.44Å; E232-V236 PolarHBondContact O-N 2.77Å; E232-V236 WeakPolarHBondContact OE1-CG2 3.41Å
233	V	94.7	Very high	92.4	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-59.2	-48.5	171.9	178.3	0	0	0	0	110.9	L95 L99 C218 V228 S229 A230 R235 V236 M237 L262	L95-V233 HydrophobicContact CD1-CG2 4.17Å; L95-V233 HydrophobicContact CD2-CG2 4.24Å; L99-V233 HydrophobicContact CD1-CG1 3.88Å; C218-V233 HydrophobicContact CB-CB 4.43Å; C218-V233 HydrophobicContact CB-CG1 4.41Å; C218-V233 VanDerWaalsContact SG-CG1 3.54Å; V228-V233 HydrophobicContact CB-CG2 4.47Å; V228-V233 HydrophobicContact CG1-CG2 3.74Å; S229-V233 PolarHBondContact O-N 3.26Å; S229-V233 VanDerWaalsContact O-N 3.11Å; A230-V233 PolarHBondContact O-N 3.04Å; V233-R235 VanDerWaalsContact C-N 3.28Å; V233-R235 PolarHBondContact O-N 3.4Å; V233-V236 PolarHBondContact O-N 2.95Å; V233-M237 HydrophobicContact CG1-CG 4.47Å; V233-M237 HydrophobicContact CG1-SD 4.3Å; V233-M237 WeakPolarHBondContact O-CB 3.29Å; V233-M237 PolarHBondContact O-N 2.91Å; V233-L262 HydrophobicContact CG1-CD1 3.84Å; V233-L262 HydrophobicContact CG2-CD1 4.06Å
234	S	95.4	Very high	92.6	Very high	27 Å²	27	55.5 Å²	55.5	19%	0.189	27%	0.267	C	S	.	.	H	α-helix	trans	-58.6	-39.2	176.9	-73.4	0	0	0	0	112.2	I216 C218 A230 Q231 E232 G238	I216-S234 PolarHBondContact O-OG 3.42Å; C218-S234 WeakPolarHBondContact CB-OG 3.38Å; A230-S234 PolarHBondContact O-N 3.42Å; A230-S234 PolarHBondContact O-OG 3.47Å; Q231-S234 PolarHBondContact O-N 2.98Å; E232-S234 PolarHBondContact O-N 2.93Å; S234-G238 PolarHBondContact O-N 2.81Å
235	R	95.3	Very high	92.9	Very high	118 Å²	118	57 Å²	57	45%	0.445	28%	0.275	S	S	.	.	H	α-helix	trans	-66.5	-49.5	177.5	-172	-170.4	72	85.3	1.8	111.7	Q231 E232 V233 G238 M239	Q231-R235 WeakPolarHBondContact O-CB 3.37Å; Q231-R235 PolarHBondContact O-N 3.11Å; E232-R235 PolarHBondContact O-N 2.93Å; E232-R235 IonicContact OE1-CZ 3.29Å; E232-R235 IonicContact OE1-NE 3.15Å; E232-R235 IonicContact OE1-NH2 2.81Å; E232-R235 PolarHBondContact OE1-NH2 3.11Å; E232-R235 IonicContact OE2-CZ 4Å; E232-R235 IonicContact OE2-NE 2.82Å; E232-R235 PolarHBondContact OE2-NE 3.03Å; E232-R235 IonicContact OE2-NH2 3.91Å; E232-R235 PolarHBondContact OE2-NH2 3.13Å; V233-R235 VanDerWaalsContact C-N 3.28Å; V233-R235 PolarHBondContact O-N 3.4Å; R235-G238 PolarHBondContact O-N 2.95Å; R235-M239 HydrophobicContact CG-CE 4.43Å; R235-M239 WeakPolarHBondContact O-CG 3.37Å; R235-M239 PolarHBondContact O-N 3.23Å
236	V	95.4	Very high	93.1	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-61.7	-46.6	-178.9	170.8	0	0	0	0	111.1	A92 L95 Q96 E232 V233 G240	A92-V236 HydrophobicContact CB-CG1 4.24Å; A92-V236 HydrophobicContact CB-CG2 3.82Å; L95-V236 HydrophobicContact CB-CG1 3.94Å; Q96-V236 HydrophobicContact CG-CG1 3.5Å; E232-V236 VanDerWaalsContact O-CG2 3.32Å; E232-V236 WeakPolarHBondContact O-CG2 3.44Å; E232-V236 PolarHBondContact O-N 2.77Å; E232-V236 WeakPolarHBondContact OE1-CG2 3.41Å; V233-V236 PolarHBondContact O-N 2.95Å; V236-G240 PolarHBondContact O-N 2.89Å
237	M	95.3	Very high	93.5	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-67.6	-39.2	176.3	-73.8	-169.5	69.5	0	0	112.2	L99 W106 I216 V233 G240 L241 V260 L269	L99-M237 HydrophobicContact CB-CE 3.98Å; L99-M237 HydrophobicContact CB-CG 3.98Å; L99-M237 HydrophobicContact CB-SD 3.83Å; L99-M237 HydrophobicContact CD1-CG 3.73Å; L99-M237 HydrophobicContact CD1-SD 3.55Å; L99-M237 VanDerWaalsContact CD1-SD 3.55Å; L99-M237 HydrophobicContact CG-SD 4.24Å; W106-M237 HydrophobicContact CH2-CE 4.01Å; W106-M237 HydrophobicContact CZ2-CE 4.23Å; I216-M237 HydrophobicContact CD1-CB 3.22Å; I216-M237 HydrophobicContact CD1-CE 4.5Å; I216-M237 HydrophobicContact CD1-CG 4.43Å; V233-M237 HydrophobicContact CG1-CG 4.47Å; V233-M237 HydrophobicContact CG1-SD 4.3Å; V233-M237 WeakPolarHBondContact O-CB 3.29Å; V233-M237 PolarHBondContact O-N 2.91Å; M237-G240 PolarHBondContact O-N 2.95Å; M237-L241 PolarHBondContact O-N 3.19Å; M237-V260 HydrophobicContact CE-CG2 4Å; M237-V260 HydrophobicContact SD-CB 4.46Å; M237-V260 HydrophobicContact SD-CG1 4.1Å; M237-V260 HydrophobicContact SD-CG2 3.65Å; M237-L269 HydrophobicContact CE-CD2 3.86Å
238	G	95.8	Very high	93.9	Very high	11 Å²	11	50.7 Å²	50.7	11%	0.113	26%	0.26	C	S	.	.	H	α-helix	trans	-60.1	-50.4	179	0	0	0	0	0	111.9	I216 S234 R235 G240 L241 S242	I216-G238 VanDerWaalsContact CD1-N 3.34Å; S234-G238 PolarHBondContact O-N 2.81Å; R235-G238 PolarHBondContact O-N 2.95Å; G238-G240 VanDerWaalsContact C-N 3.29Å; G238-G240 PolarHBondContact O-N 3.32Å; G238-L241 PolarHBondContact O-N 3.04Å; G238-S242 WeakPolarHBondContact O-CB 3.44Å; G238-S242 PolarHBondContact O-N 3.43Å; G238-S242 PolarHBondContact O-OG 2.96Å
239	M	95.4	Very high	94.3	Very high	63 Å²	63	53 Å²	53	31%	0.31	28%	0.28	S	S	.	.	H	α-helix	trans	-61.3	-39	174.1	-67.4	-171.9	-57.3	0	0	112.2	R235 S242 R243	R235-M239 HydrophobicContact CG-CE 4.43Å; R235-M239 WeakPolarHBondContact O-CG 3.37Å; R235-M239 PolarHBondContact O-N 3.23Å; M239-S242 PolarHBondContact O-N 3.41Å; M239-R243 WeakPolarHBondContact O-CG 3.16Å; M239-R243 PolarHBondContact O-N 3.14Å
240	G	95.2	Very high	94.5	Very high	5 Å²	5	52.9 Å²	52.9	5%	0.052	28%	0.276	C	S	.	.	H	α-helix	trans	-60.7	-51.2	178.5	0	0	0	0	0	113.1	V236 M237 G238 R243 L244	V236-G240 PolarHBondContact O-N 2.89Å; M237-G240 PolarHBondContact O-N 2.95Å; G238-G240 VanDerWaalsContact C-N 3.29Å; G238-G240 PolarHBondContact O-N 3.32Å; G240-R243 PolarHBondContact O-N 2.71Å; G240-L244 VanDerWaalsContact O-CB 3.28Å; G240-L244 WeakPolarHBondContact O-CB 3.48Å; G240-L244 PolarHBondContact O-N 3.16Å
241	L	94.7	Very high	94.5	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-66.1	-37.6	178	-70.5	173.8	0	0	0	112.3	L100 W106 F214 I216 M237 G238 R243 L244 L245 I258	L100-L241 HydrophobicContact CD2-CD2 3.89Å; L100-L241 HydrophobicContact CD2-CG 3.8Å; W106-L241 HydrophobicContact CD2-CD2 3.69Å; W106-L241 HydrophobicContact CE3-CD2 4.11Å; W106-L241 HydrophobicContact CG-CD2 4.1Å; W106-L241 HydrophobicContact CH2-CD1 4.2Å; W106-L241 HydrophobicContact CH2-CD2 4.3Å; W106-L241 HydrophobicContact CZ2-CD2 3.92Å; W106-L241 HydrophobicContact CZ3-CD1 4.23Å; W106-L241 HydrophobicContact CZ3-CD2 4.4Å; F214-L241 HydrophobicContact CD2-CD1 4.34Å; F214-L241 HydrophobicContact CE2-CB 4.23Å; F214-L241 HydrophobicContact CE2-CD1 3.88Å; F214-L241 HydrophobicContact CZ-CB 3.87Å; F214-L241 HydrophobicContact CZ-CD1 4.37Å; I216-L241 HydrophobicContact CD1-CD1 4.26Å; M237-L241 PolarHBondContact O-N 3.19Å; G238-L241 PolarHBondContact O-N 3.04Å; L241-R243 VanDerWaalsContact C-N 3.32Å; L241-R243 PolarHBondContact O-N 3.03Å; L241-L244 PolarHBondContact O-N 3.44Å; L241-L245 HydrophobicContact CD2-CD1 4Å; L241-L245 PolarHBondContact O-N 3.17Å; L241-I258 HydrophobicContact CD1-CD1 3.63Å
242	S	95	Very high	94.4	Very high	40 Å²	40	61 Å²	61	28%	0.28	31%	0.31	S	S	.	.	H	α-helix	trans	-61.4	-40.2	174.3	-71.3	0	0	0	0	112.4	G238 M239 G246 W247	G238-S242 WeakPolarHBondContact O-CB 3.44Å; G238-S242 PolarHBondContact O-N 3.43Å; G238-S242 PolarHBondContact O-OG 2.96Å; M239-S242 PolarHBondContact O-N 3.41Å; S242-G246 WeakPolarHBondContact O-CA 3.34Å; S242-G246 PolarHBondContact O-N 2.78Å; S242-W247 WeakPolarHBondContact CA-O 3.37Å; S242-W247 VanDerWaalsContact CB-O 3.31Å; S242-W247 WeakPolarHBondContact CB-O 3.29Å; S242-W247 PolarHBondContact OG-O 3.44Å
243	R	93.9	Very high	94.3	Very high	183 Å²	183	64.8 Å²	64.8	69%	0.691	33%	0.332	S	S	*	.	H	α-helix	trans	-72.7	-41.5	176	-70.4	174.6	-170	163.3	1.4	112.6	M239 G240 L241	M239-R243 WeakPolarHBondContact O-CG 3.16Å; M239-R243 PolarHBondContact O-N 3.14Å; G240-R243 PolarHBondContact O-N 2.71Å; L241-R243 VanDerWaalsContact C-N 3.32Å; L241-R243 PolarHBondContact O-N 3.03Å
244	L	91.9	Very high	94.3	Very high	81 Å²	81	65.7 Å²	65.7	42%	0.424	34%	0.338	S	S	.	.	H	α-helix	trans	-73.6	-38.3	-174.1	-176.8	64	0	0	0	112.7	G240 L241	G240-L244 VanDerWaalsContact O-CB 3.28Å; G240-L244 WeakPolarHBondContact O-CB 3.48Å; G240-L244 PolarHBondContact O-N 3.16Å; L241-L244 PolarHBondContact O-N 3.44Å
245	L	92.4	Very high	94.1	Very high	36 Å²	36	70.8 Å²	70.8	19%	0.188	36%	0.357	C	S	.	.	H	α-helix	trans	-124.1	-2.5	-168.7	-57.7	174.2	0	0	0	113.8	W106 I107 L241 W247	W106-L245 HydrophobicContact CB-CD1 3.51Å; W106-L245 HydrophobicContact CG-CD1 3.94Å; I107-L245 HydrophobicContact CD1-CD2 4.13Å; I107-L245 HydrophobicContact CG1-CD2 4.09Å; L241-L245 HydrophobicContact CD2-CD1 4Å; L241-L245 PolarHBondContact O-N 3.17Å; L245-W247 HydrophobicContact CB-CD2 4.17Å; L245-W247 HydrophobicContact CB-CG 3.93Å; L245-W247 HydrophobicContact CD1-CD2 4.01Å; L245-W247 HydrophobicContact CD1-CE3 4.31Å; L245-W247 HydrophobicContact CD1-CH2 3.85Å; L245-W247 HydrophobicContact CD1-CZ2 3.57Å; L245-W247 HydrophobicContact CD1-CZ3 4.23Å; L245-W247 VanDerWaalsContact O-CD1 3.3Å; L245-W247 PolarHBondContact O-N 2.98Å
246	G	92.9	Very high	94.1	Very high	51 Å²	51	65.2 Å²	65.2	53%	0.526	34%	0.336	S	S	.	.			trans	68.2	15.1	-174.9	0	0	0	0	0	114.1	S242	S242-G246 WeakPolarHBondContact O-CA 3.34Å; S242-G246 PolarHBondContact O-N 2.78Å
247	W	94.8	Very high	94.1	Very high	23 Å²	23	67.8 Å²	67.8	9%	0.087	35%	0.348	C	S	.	.			trans	-72.9	152	-179.7	-68.2	6.5	0	0	0	112	W106 V110 V212 F214 S242 L245 L256 I258	W106-W247 HydrophobicContact CB-CH2 4.18Å; W106-W247 HydrophobicContact CE3-CH2 4.32Å; W106-W247 HydrophobicContact CE3-CZ3 4.34Å; V110-W247 HydrophobicContact CB-CH2 4.44Å; V110-W247 HydrophobicContact CB-CZ2 4.42Å; V110-W247 HydrophobicContact CG2-CH2 3.31Å; V110-W247 HydrophobicContact CG2-CZ2 3.71Å; V110-W247 HydrophobicContact CG2-CZ3 4.27Å; V212-W247 HydrophobicContact CB-CD2 4.01Å; V212-W247 HydrophobicContact CB-CG 4.01Å; V212-W247 HydrophobicContact CG1-CD2 4.29Å; V212-W247 HydrophobicContact CG1-CE3 4.47Å; F214-W247 HydrophobicContact CB-CE3 4.48Å; F214-W247 HydrophobicContact CD1-CB 3.6Å; F214-W247 HydrophobicContact CD1-CE3 4.07Å; F214-W247 HydrophobicContact CD1-CG 4.5Å; F214-W247 HydrophobicContact CE1-CB 3.52Å; F214-W247 HydrophobicContact CG-CE3 4.19Å; S242-W247 WeakPolarHBondContact CA-O 3.37Å; S242-W247 VanDerWaalsContact CB-O 3.31Å; S242-W247 WeakPolarHBondContact CB-O 3.29Å; S242-W247 PolarHBondContact OG-O 3.44Å; L245-W247 HydrophobicContact CB-CD2 4.17Å; L245-W247 HydrophobicContact CB-CG 3.93Å; L245-W247 HydrophobicContact CD1-CD2 4.01Å; L245-W247 HydrophobicContact CD1-CE3 4.31Å; L245-W247 HydrophobicContact CD1-CH2 3.85Å; L245-W247 HydrophobicContact CD1-CZ2 3.57Å; L245-W247 HydrophobicContact CD1-CZ3 4.23Å; L245-W247 VanDerWaalsContact O-CD1 3.3Å; L245-W247 PolarHBondContact O-N 2.98Å; W247-L256 HydrophobicContact CE3-CD2 4.41Å; W247-L256 HydrophobicContact CH2-CD2 3.98Å; W247-L256 HydrophobicContact CZ3-CD2 3.66Å; W247-I258 HydrophobicContact CZ3-CD1 4.14Å
248	K	95.1	Very high	94.1	Very high	148 Å²	148	67.8 Å²	67.8	64%	0.643	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107	126.2	-177.3	-172.4	174.2	179.8	178	0	111.6	V211 V212 S213 F214 D250	V211-K248 HydrophobicContact CG1-CB 3.86Å; V212-K248 PolarHBondContact O-N 3.12Å; S213-K248 CarbonylContact C-O 3.53Å; S213-K248 WeakPolarHBondContact CA-O 3.36Å; F214-K248 VanDerWaalsContact CD1-O 3.29Å; F214-K248 WeakPolarHBondContact CD1-O 3.11Å; F214-K248 PolarHBondContact N-O 3.48Å; K248-D250 PolarHBondContact O-N 3.3Å
249	A	95.3	Very high	94.2	Very high	57 Å²	57	67.9 Å²	67.9	47%	0.471	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	129.6	173.3	0	0	0	0	0	111	F214	F214-A249 CarbonylContact O-C 3.5Å; F214-A249 WeakPolarHBondContact O-CA 3.33Å
250	D	95.3	Very high	94.3	Very high	51 Å²	51	64.9 Å²	64.9	27%	0.273	33%	0.331	S	S	.	.			trans	-137.7	107	172.2	-176.2	-12.7	0	0	0	109.5	F214 K248 K252 N253 P254	F214-D250 PolarHBondContact O-N 2.74Å; K248-D250 PolarHBondContact O-N 3.3Å; D250-K252 PolarHBondContact OD1-N 3.5Å; D250-N253 PolarHBondContact OD1-N 3.08Å; D250-N253 VanDerWaalsContact OD2-O 3.08Å; D250-P254 WeakPolarHBondContact O-CB 3.45Å; D250-P254 WeakPolarHBondContact O-CD 3.24Å
251	L	93.2	Very high	94.3	Very high	136 Å²	136	66.4 Å²	66.4	71%	0.712	34%	0.335	S	S	*	.	S	Bend	trans	-80.8	-18.3	-177.4	-56	-178	0	0	0	113.1	R215	R215-L251 HydrophobicContact CB-CD2 4.25Å
252	K	92.1	Very high	94.3	Very high	201 Å²	201	66.5 Å²	66.5	87%	0.874	34%	0.336	S	S	*	.	S	Bend	trans	-97.1	-48.4	-173.7	-68.6	-176	179.2	179.7	0	111.7	D250 P254	D250-K252 PolarHBondContact OD1-N 3.5Å; K252-P254 VanDerWaalsContact C-CD 3.5Å
253	N	91.6	Very high	94.1	Very high	129 Å²	129	65.6 Å²	65.6	69%	0.69	33%	0.328	S	S	*	.	S	Bend	trans	-135.2	58.3	-176.1	-165.1	42.4	0	0	0	113	D250	D250-N253 PolarHBondContact OD1-N 3.08Å; D250-N253 VanDerWaalsContact OD2-O 3.08Å
254	P	94	Very high	93.9	Very high	20 Å²	20	60.1 Å²	60.1	13%	0.13	31%	0.312	C	S	.	.			trans	-64.3	140.9	178.8	29.9	-37.3	0	0	0	111.6	R215 D250 K252 L256 E257	R215-P254 HydrophobicContact CB-CB 4.17Å; R215-P254 HydrophobicContact CB-CG 4.21Å; R215-P254 HydrophobicContact CG-CB 4.06Å; R215-P254 HydrophobicContact CG-CG 3.73Å; D250-P254 WeakPolarHBondContact O-CB 3.45Å; D250-P254 WeakPolarHBondContact O-CD 3.24Å; K252-P254 VanDerWaalsContact C-CD 3.5Å; P254-L256 WeakPolarHBondContact CB-O 3.27Å; P254-E257 HydrophobicContact CG-CG 4.21Å
255	K	92.3	Very high	93.9	Very high	134 Å²	134	61.9 Å²	61.9	58%	0.583	32%	0.322	S	S	*	.	S	Bend	trans	-70.5	-37.8	163.3	-73.2	-178.8	179.3	179.8	0	110.8	W113 S213	W113-K255 WeakPolarHBondContact CH2-O 3.26Å; S213-K255 PolarHBondContact O-N 3.25Å; S213-K255 WeakPolarHBondContact OG-CG 3.21Å; S213-K255 PolarHBondContact OG-N 3.37Å
256	L	93.8	Very high	93.9	Very high	1 Å²	1	61.2 Å²	61.2	1%	0.005	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	131.4	-175.8	-169.1	72.3	0	0	0	111.8	V110 W113 V212 S213 F214 R215 W247 P254 I258 I271	V110-L256 HydrophobicContact CG2-CD1 4.5Å; V110-L256 HydrophobicContact CG2-CD2 3.6Å; W113-L256 HydrophobicContact CD2-CD1 3.74Å; W113-L256 HydrophobicContact CE3-CD1 3.69Å; W113-L256 HydrophobicContact CG-CD1 4.38Å; W113-L256 HydrophobicContact CH2-CD1 4.03Å; W113-L256 HydrophobicContact CZ2-CD1 4.07Å; W113-L256 HydrophobicContact CZ3-CD1 3.84Å; V212-L256 HydrophobicContact CG1-CB 3.99Å; V212-L256 HydrophobicContact CG1-CD2 4.24Å; S213-L256 PolarHBondContact O-N 2.96Å; F214-L256 CarbonylContact C-O 3.51Å; F214-L256 WeakPolarHBondContact CA-O 3.43Å; F214-L256 HydrophobicContact CB-CB 4.1Å; F214-L256 WeakPolarHBondContact CB-O 3.41Å; R215-L256 PolarHBondContact N-O 3.44Å; W247-L256 HydrophobicContact CE3-CD2 4.41Å; W247-L256 HydrophobicContact CH2-CD2 3.98Å; W247-L256 HydrophobicContact CZ3-CD2 3.66Å; P254-L256 WeakPolarHBondContact CB-O 3.27Å; L256-I258 HydrophobicContact CD2-CD1 4.31Å; L256-I258 HydrophobicContact CD2-CG1 4.19Å; L256-I258 HydrophobicContact CG-CG1 4.4Å; L256-I271 HydrophobicContact CD1-CD1 4.28Å; L256-I271 HydrophobicContact CD1-CG2 3.49Å; L256-I271 VanDerWaalsContact CD1-CG2 3.49Å; L256-I271 HydrophobicContact CG-CG2 4.35Å
257	E	95.5	Very high	93.9	Very high	53 Å²	53	58.8 Å²	58.8	25%	0.248	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	138.9	168.6	-58	-167.5	-158.2	0	0	109.6	R215 N217 P254 I271 P272	R215-E257 HydrophobicContact CG-CB 4.42Å; R215-E257 HydrophobicContact CG-CG 4.05Å; R215-E257 IonicContact CZ-OE1 2.62Å; R215-E257 IonicContact CZ-OE2 3.26Å; R215-E257 IonicContact NE-OE1 3.54Å; R215-E257 IonicContact NE-OE2 3.33Å; R215-E257 PolarHBondContact NE-OE2 3.27Å; R215-E257 VanDerWaalsContact NE-OE2 3.15Å; R215-E257 IonicContact NH2-OE1 3.3Å; R215-E257 PolarHBondContact NH2-OE1 2.56Å; R215-E257 IonicContact NH2-OE2 2.67Å; R215-E257 PolarHBondContact NH2-OE2 3.03Å; N217-E257 PolarHBondContact ND2-OE2 3.12Å; P254-E257 HydrophobicContact CG-CG 4.21Å; E257-I271 WeakPolarHBondContact O-CG2 3.2Å; E257-P272 HydrophobicContact CB-CG 3.74Å; E257-P272 WeakPolarHBondContact O-CD 3.09Å
258	I	96.9	Very high	94	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	118.1	175.7	-58	162.9	0	0	0	107.1	W106 F214 R215 I216 N217 L241 W247 L256 V260	W106-I258 HydrophobicContact CE3-CD1 4.45Å; W106-I258 HydrophobicContact CH2-CD1 4.46Å; W106-I258 HydrophobicContact CH2-CG2 4.07Å; W106-I258 HydrophobicContact CZ3-CD1 3.75Å; W106-I258 HydrophobicContact CZ3-CG1 4.25Å; W106-I258 HydrophobicContact CZ3-CG2 3.96Å; F214-I258 HydrophobicContact CD2-CD1 3.92Å; R215-I258 PolarHBondContact O-N 3.39Å; I216-I258 WeakPolarHBondContact CA-O 3.38Å; N217-I258 PolarHBondContact N-O 3.1Å; L241-I258 HydrophobicContact CD1-CD1 3.63Å; W247-I258 HydrophobicContact CZ3-CD1 4.14Å; L256-I258 HydrophobicContact CD2-CD1 4.31Å; L256-I258 HydrophobicContact CD2-CG1 4.19Å; L256-I258 HydrophobicContact CG-CG1 4.4Å; I258-V260 HydrophobicContact CG2-CG2 4.24Å
259	N	96.8	Very high	94.1	Very high	14 Å²	14	50.7 Å²	50.7	8%	0.075	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	132.3	176	-83.7	33.7	0	0	0	110.1	F71 N217 Y261 L269 G270	F71-N259 HydrophobicContact CD1-CB 4.4Å; F71-N259 HydrophobicContact CE1-CB 4Å; F71-N259 WeakPolarHBondContact CE1-ND2 3.49Å; N217-N259 WeakPolarHBondContact CB-OD1 3.29Å; N217-N259 PolarHBondContact ND2-OD1 3.11Å; N217-N259 WeakPolarHBondContact O-CA 3.24Å; N259-Y261 HydrophobicContact CB-CE2 3.94Å; N259-Y261 PolarHBondContact ND2-OH 3.27Å; N259-L269 WeakPolarHBondContact O-CA 3.41Å; N259-G270 PolarHBondContact N-O 3.38Å; N259-G270 PolarHBondContact O-N 3.2Å
260	V	96.8	Very high	94.2	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	120.7	-178.7	-172	0	0	0	0	107.9	I216 N217 C218 K219 M237 I258 L262 L269	I216-V260 HydrophobicContact CG2-CG2 3.74Å; N217-V260 PolarHBondContact O-N 2.96Å; C218-V260 CarbonylContact C-O 3.6Å; C218-V260 WeakPolarHBondContact CA-O 3.42Å; C218-V260 HydrophobicContact CB-CB 4.38Å; K219-V260 PolarHBondContact N-O 3.4Å; M237-V260 HydrophobicContact CE-CG2 4Å; M237-V260 HydrophobicContact SD-CB 4.46Å; M237-V260 HydrophobicContact SD-CG1 4.1Å; M237-V260 HydrophobicContact SD-CG2 3.65Å; I258-V260 HydrophobicContact CG2-CG2 4.24Å; V260-L262 HydrophobicContact CG1-CD1 4.37Å; V260-L262 HydrophobicContact CG1-CD2 3.88Å; V260-L262 HydrophobicContact CG1-CG 3.95Å; V260-L269 HydrophobicContact CG1-CD1 4.12Å; V260-L269 HydrophobicContact CG1-CG 4.28Å; V260-L269 HydrophobicContact CG2-CG 4.29Å
261	Y	95.4	Very high	94.3	Very high	36 Å²	36	45.5 Å²	45.5	14%	0.141	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	118.2	175.4	-61.3	-86.4	0	0	0	109	Y19 K219 N259 L268	Y19-Y261 HydrophobicContact CE2-CE2 4.27Å; Y19-Y261 WeakPolarHBondContact OH-CE2 3.47Å; K219-Y261 HydrophobicContact CB-CD1 3.84Å; K219-Y261 HydrophobicContact CB-CE1 4.1Å; K219-Y261 HydrophobicContact CD-CD1 4.24Å; K219-Y261 HydrophobicContact CD-CE1 4.18Å; K219-Y261 HydrophobicContact CG-CD1 4.48Å; K219-Y261 WeakPolarHBondContact O-CA 3.47Å; N259-Y261 HydrophobicContact CB-CE2 3.94Å; N259-Y261 PolarHBondContact ND2-OH 3.27Å; Y261-L268 HydrophobicContact CD2-CD2 4.43Å; Y261-L268 PolarHBondContact N-O 3.08Å; Y261-L268 PolarHBondContact O-N 2.8Å
262	L	94.8	Very high	94.4	Very high	3 Å²	3	39.8 Å²	39.8	2%	0.016	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	124.7	178.2	-51.7	-179.9	0	0	0	109.3	V80 L95 L99 K219 C220 S221 L224 V233 V260 C267	V80-L262 HydrophobicContact CG2-CD2 4.45Å; L95-L262 HydrophobicContact CD2-CD1 4.43Å; L99-L262 HydrophobicContact CD1-CD1 4.33Å; L99-L262 HydrophobicContact CD2-CD2 3.92Å; K219-L262 PolarHBondContact O-N 3.23Å; C220-L262 WeakPolarHBondContact CA-O 3.44Å; S221-L262 PolarHBondContact N-O 2.99Å; L224-L262 HydrophobicContact CD2-CB 3.5Å; L224-L262 VanDerWaalsContact CD2-CB 3.5Å; L224-L262 HydrophobicContact CD2-CD1 3.68Å; L224-L262 HydrophobicContact CD2-CG 4.19Å; V233-L262 HydrophobicContact CG1-CD1 3.84Å; V233-L262 HydrophobicContact CG2-CD1 4.06Å; V260-L262 HydrophobicContact CG1-CD1 4.37Å; V260-L262 HydrophobicContact CG1-CD2 3.88Å; V260-L262 HydrophobicContact CG1-CG 3.95Å; L262-C267 HydrophobicContact CD2-CB 3.9Å; L262-C267 WeakPolarHBondContact CD2-SG 3.45Å
263	N	91.6	Very high	94.5	Very high	21 Å²	21	30.4 Å²	30.4	11%	0.112	15%	0.153	C	C	.	.			trans	-143	-170	172.1	71.1	5.7	0	0	0	110.7	S221 D265 Y266	S221-N263 VanDerWaalsContact OG-CB 3.24Å; S221-N263 WeakPolarHBondContact OG-CB 3.28Å; N263-D265 PolarHBondContact O-N 3.09Å; N263-D265 PolarHBondContact OD1-N 3.11Å; N263-Y266 PolarHBondContact N-O 2.9Å; N263-Y266 VanDerWaalsContact N-O 3.13Å; N263-Y266 WeakPolarHBondContact ND2-CE1 3.47Å; N263-Y266 WeakPolarHBondContact OD1-CD1 3.48Å; N263-Y266 PolarHBondContact OD1-N 3.46Å; N263-Y266 PolarHBondContact OD1-O 3.45Å; N263-Y266 VanDerWaalsContact OD1-O 3.11Å
264	D	90.6	Very high	94.4	Very high	67 Å²	67	25.3 Å²	25.3	36%	0.358	13%	0.126	S	C	.	.	S	Bend	trans	-73.5	-10.7	-177.3	-64.6	-29.2	0	0	0	113.3	P79 G222 K223	P79-D264 VanDerWaalsContact CG-C 3.49Å; P79-D264 WeakPolarHBondContact CG-O 3.32Å; G222-D264 WeakPolarHBondContact CA-OD2 3.34Å; K223-D264 VanDerWaalsContact CB-OD1 3.3Å; K223-D264 WeakPolarHBondContact CB-OD1 3.15Å; K223-D264 VanDerWaalsContact N-CG 3.33Å; K223-D264 PolarHBondContact N-OD1 2.78Å; K223-D264 PolarHBondContact N-OD2 2.97Å
265	D	90.8	Very high	93.9	Very high	119 Å²	119	35.3 Å²	35.3	64%	0.636	16%	0.161	S	C	*	.	S	Bend	trans	-113.4	-30.4	-171.8	-53.5	-49.3	0	0	0	113.3	P79 N263	P79-D265 WeakPolarHBondContact CD-O 3.3Å; P79-D265 WeakPolarHBondContact CG-O 3.48Å; N263-D265 PolarHBondContact O-N 3.09Å; N263-D265 PolarHBondContact OD1-N 3.11Å
266	Y	92.3	Very high	93.6	Very high	21 Å²	21	33.7 Å²	33.7	8%	0.082	16%	0.158	C	C	.	.			trans	-157.3	162.3	-178	58.4	-96.2	0	0	0	113.8	I46 K49 N263 L268	I46-Y266 HydrophobicContact CB-CE1 4.29Å; I46-Y266 HydrophobicContact CD1-CD1 3.99Å; I46-Y266 HydrophobicContact CD1-CD2 4.27Å; I46-Y266 HydrophobicContact CD1-CE1 3.57Å; I46-Y266 HydrophobicContact CD1-CE2 3.87Å; I46-Y266 HydrophobicContact CD1-CG 4.32Å; I46-Y266 HydrophobicContact CG1-CE1 4.37Å; K49-Y266 PolarHBondContact NZ-OH 2.92Å; N263-Y266 PolarHBondContact N-O 2.9Å; N263-Y266 VanDerWaalsContact N-O 3.13Å; N263-Y266 WeakPolarHBondContact ND2-CE1 3.47Å; N263-Y266 WeakPolarHBondContact OD1-CD1 3.48Å; N263-Y266 PolarHBondContact OD1-N 3.46Å; N263-Y266 PolarHBondContact OD1-O 3.45Å; N263-Y266 VanDerWaalsContact OD1-O 3.11Å; Y266-L268 HydrophobicContact CD2-CB 3.83Å; Y266-L268 HydrophobicContact CE2-CB 4.05Å
267	C	94.4	Very high	93.2	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.007	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	126.3	162.5	173	0	0	0	0	108.2	Q76 D77 L99 L262 L269	Q76-C267 CarbonylContact C-O 3.58Å; Q76-C267 WeakPolarHBondContact CA-O 3.33Å; D77-C267 HydrophobicContact CB-CB 4.06Å; D77-C267 PolarHBondContact N-O 3.48Å; D77-C267 PolarHBondContact O-N 3.33Å; L99-C267 WeakPolarHBondContact CD2-SG 3.24Å; L262-C267 HydrophobicContact CD2-CB 3.9Å; L262-C267 WeakPolarHBondContact CD2-SG 3.45Å; C267-L269 WeakPolarHBondContact SG-CD1 3.27Å
268	L	95.9	Very high	92.9	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	122.7	-177.4	-172.8	74.6	0	0	0	111	Y19 K49 L51 L73 Q76 Y261 Y266	Y19-L268 HydrophobicContact CD1-CD2 4.25Å; Y19-L268 HydrophobicContact CD1-CG 4.46Å; Y19-L268 HydrophobicContact CD2-CD2 4.01Å; Y19-L268 HydrophobicContact CE1-CD2 4.17Å; Y19-L268 HydrophobicContact CE1-CG 4.24Å; Y19-L268 HydrophobicContact CE2-CD2 3.97Å; Y19-L268 HydrophobicContact CG-CD2 4.16Å; K49-L268 HydrophobicContact CD-CD2 3.53Å; L51-L268 HydrophobicContact CD2-CD1 3.84Å; L73-L268 HydrophobicContact CD1-CD1 3.35Å; L73-L268 HydrophobicContact CD1-CG 4.29Å; Q76-L268 HydrophobicContact CB-CD1 3.91Å; Q76-L268 HydrophobicContact CG-CD1 4.06Å; Y261-L268 HydrophobicContact CD2-CD2 4.43Å; Y261-L268 PolarHBondContact N-O 3.08Å; Y261-L268 PolarHBondContact O-N 2.8Å; Y266-L268 HydrophobicContact CD2-CB 3.83Å; Y266-L268 HydrophobicContact CE2-CB 4.05Å
269	L	97	Very high	92	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	139.6	177.8	-73.4	63.7	0	0	0	109.7	L74 K75 L99 W106 M237 N259 V260 C267	L74-L269 HydrophobicContact CB-CB 4.18Å; L74-L269 HydrophobicContact CD2-CB 3.89Å; L74-L269 HydrophobicContact CD2-CD2 3.82Å; L74-L269 PolarHBondContact N-O 3.03Å; K75-L269 HydrophobicContact CB-CB 4.19Å; K75-L269 PolarHBondContact N-O 3.11Å; K75-L269 PolarHBondContact O-N 3.4Å; L99-L269 HydrophobicContact CD2-CD1 4.15Å; W106-L269 HydrophobicContact CH2-CD2 3.89Å; W106-L269 HydrophobicContact CZ2-CD2 4.02Å; M237-L269 HydrophobicContact CE-CD2 3.86Å; N259-L269 WeakPolarHBondContact O-CA 3.41Å; V260-L269 HydrophobicContact CG1-CD1 4.12Å; V260-L269 HydrophobicContact CG1-CG 4.28Å; V260-L269 HydrophobicContact CG2-CG 4.29Å; C267-L269 WeakPolarHBondContact SG-CD1 3.27Å
270	G	96.9	Very high	91.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.6	172.7	167.5	0	0	0	0	0	114.7	L72 N259	L72-G270 CarbonylContact O-C 3.54Å; L72-G270 WeakPolarHBondContact O-CA 3.4Å; N259-G270 PolarHBondContact N-O 3.38Å; N259-G270 PolarHBondContact O-N 3.2Å
271	I	97.4	Very high	90.9	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	120.2	-174.3	-55.6	170.1	0	0	0	107.3	F71 L72 L74 A109 V110 W113 L256 E257 L273	F71-I271 CarbonylContact C-O 3.59Å; F71-I271 WeakPolarHBondContact CA-O 3.37Å; L72-I271 HydrophobicContact CB-CB 4.41Å; L72-I271 HydrophobicContact CD2-CD1 4.45Å; L72-I271 PolarHBondContact N-O 3.31Å; L72-I271 PolarHBondContact O-N 2.95Å; L74-I271 HydrophobicContact CD1-CD1 4.2Å; A109-I271 HydrophobicContact CB-CD1 4.33Å; V110-I271 HydrophobicContact CG2-CD1 4.37Å; W113-I271 HydrophobicContact CB-CD1 4.42Å; W113-I271 HydrophobicContact CB-CG2 4.45Å; W113-I271 HydrophobicContact CD2-CG2 4.09Å; W113-I271 HydrophobicContact CG-CB 4.5Å; W113-I271 HydrophobicContact CG-CG2 3.7Å; W113-I271 VanDerWaalsContact NE1-CG2 3.34Å; L256-I271 HydrophobicContact CD1-CD1 4.28Å; L256-I271 HydrophobicContact CD1-CG2 3.49Å; L256-I271 VanDerWaalsContact CD1-CG2 3.49Å; L256-I271 HydrophobicContact CG-CG2 4.35Å; E257-I271 WeakPolarHBondContact O-CG2 3.2Å; I271-L273 PolarHBondContact O-N 3.3Å
272	P	96.1	Very high	90.4	Very high	15 Å²	15	42.9 Å²	42.9	10%	0.097	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	133.2	179	25.9	-29.7	0	0	0	110.2	F71 W113 E257	F71-P272 HydrophobicContact CD1-CB 3.83Å; F71-P272 HydrophobicContact CE1-CB 3.75Å; F71-P272 HydrophobicContact CE1-CG 4.47Å; W113-P272 PolarHBondContact NE1-O 3.13Å; W113-P272 VanDerWaalsContact NE1-O 3.1Å; E257-P272 HydrophobicContact CB-CG 3.74Å; E257-P272 WeakPolarHBondContact O-CD 3.09Å
273	L	94.8	Very high	90	Very high	5 Å²	5	45 Å²	45	3%	0.026	23%	0.233	C	C	.	.	S	Bend	trans	-92.8	-26	178	-73.5	166.1	0	0	0	111.8	Y18 I58 L70 L72 W113 L116 Q117 I271	Y18-L273 HydrophobicContact CD1-CD1 3.74Å; Y18-L273 HydrophobicContact CE1-CD1 3.6Å; I58-L273 HydrophobicContact CD1-CD1 4Å; L70-L273 HydrophobicContact CD2-CB 4.18Å; L70-L273 HydrophobicContact CD2-CD1 4.08Å; L70-L273 HydrophobicContact CG-CB 4.14Å; L70-L273 HydrophobicContact CG-CD1 3.94Å; L70-L273 PolarHBondContact O-N 2.82Å; L72-L273 HydrophobicContact CB-CD1 4.15Å; L72-L273 HydrophobicContact CB-CD2 4.44Å; L72-L273 HydrophobicContact CB-CG 4.26Å; W113-L273 HydrophobicContact CG-CD2 4.46Å; L116-L273 HydrophobicContact CB-CD2 3.98Å; L116-L273 HydrophobicContact CD1-CD1 4.24Å; L116-L273 HydrophobicContact CD1-CD2 3.89Å; Q117-L273 PolarHBondContact NE2-O 3.36Å; I271-L273 PolarHBondContact O-N 3.3Å
274	T	88.3	Confident	89.8	Confident	21 Å²	21	45 Å²	45	13%	0.129	23%	0.233	C	C	.	.			trans	-119.7	139.7	177.8	65.1	0	0	0	0	111.7	L276 L278	T274-L276 WeakPolarHBondContact CB-O 2.91Å; T274-L276 PolarHBondContact OG1-O 3.12Å; T274-L278 HydrophobicContact CG2-CD2 3.83Å
275	R	84.1	Confident	89.7	Confident	230 Å²	230	46.1 Å²	46.1	87%	0.868	23%	0.234	S	C	*	.	S	Bend	trans	-74.5	-41.8	174.1	-69.3	-175.3	177.6	-177.3	-2	111.8
276	L	85.2	Confident	89.5	Confident	100 Å²	100	42.5 Å²	42.5	52%	0.524	22%	0.217	S	C	.	.	S	Bend	trans	-97.9	153.1	178.8	-59.1	177.1	0	0	0	109.9	T274 N280	T274-L276 WeakPolarHBondContact CB-O 2.91Å; T274-L276 PolarHBondContact OG1-O 3.12Å; L276-N280 HydrophobicContact CB-CB 4.33Å; L276-N280 VanDerWaalsContact CD1-ND2 3.27Å; L276-N280 WeakPolarHBondContact CD1-ND2 3.4Å
277	P	86.8	Confident	89	Confident	37 Å²	37	45.2 Å²	45.2	24%	0.24	24%	0.237	C	C	.	.			trans	-56.5	148.7	170.8	-22.3	33.5	0	0	0	111.4	E68 A279 N280	E68-P277 CarbonylContact O-C 3.59Å; E68-P277 WeakPolarHBondContact O-CA 3.4Å; E68-P277 WeakPolarHBondContact O-CB 3.41Å; P277-A279 PolarHBondContact O-N 2.92Å; P277-N280 VanDerWaalsContact O-CB 3.28Å; P277-N280 WeakPolarHBondContact O-CB 3.46Å; P277-N280 PolarHBondContact O-N 3.4Å
278	L	87.3	Confident	88.1	Confident	13 Å²	13	46.5 Å²	46.5	7%	0.068	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-24.9	176.9	-63.5	-175.5	0	0	0	112.4	C62 L64 A67 E68 L70 T274 N280 R281	C62-L278 HydrophobicContact CB-CD2 4.31Å; L64-L278 HydrophobicContact CB-CD1 4.26Å; A67-L278 HydrophobicContact CB-CD1 3.74Å; E68-L278 PolarHBondContact O-N 3.24Å; L70-L278 HydrophobicContact CB-CD1 4.15Å; L70-L278 HydrophobicContact CB-CD2 4.47Å; L70-L278 HydrophobicContact CB-CG 4.49Å; T274-L278 HydrophobicContact CG2-CD2 3.83Å; L278-N280 PolarHBondContact O-N 2.81Å; L278-N280 VanDerWaalsContact O-N 3.11Å; L278-R281 PolarHBondContact O-NE 3.02Å; L278-R281 PolarHBondContact O-NH1 3.45Å; L278-R281 VanDerWaalsContact O-NH1 3.12Å; L278-R281 PolarHBondContact O-NH2 2.93Å
279	A	79.8	Confident	86.7	Confident	30 Å²	30	49.8 Å²	49.8	25%	0.248	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-15.9	170.6	0	0	0	0	0	113.5	P277 R281	P277-A279 PolarHBondContact O-N 2.92Å; A279-R281 PolarHBondContact O-N 2.77Å; A279-R281 VanDerWaalsContact O-N 3.1Å
280	N	83.5	Confident	85.1	Confident	88 Å²	88	58.8 Å²	58.8	47%	0.471	30%	0.301	S	S	.	.	S	Bend	trans	-79.3	89.7	172.4	-171	44.5	0	0	0	110.4	L276 P277 L278	L276-N280 HydrophobicContact CB-CB 4.33Å; L276-N280 VanDerWaalsContact CD1-ND2 3.27Å; L276-N280 WeakPolarHBondContact CD1-ND2 3.4Å; P277-N280 VanDerWaalsContact O-CB 3.28Å; P277-N280 WeakPolarHBondContact O-CB 3.46Å; P277-N280 PolarHBondContact O-N 3.4Å; L278-N280 PolarHBondContact O-N 2.81Å; L278-N280 VanDerWaalsContact O-N 3.11Å
281	R	85.1	Confident	83.1	Confident	20 Å²	20	58.9 Å²	58.9	8%	0.075	30%	0.302	C	S	.	.			trans	-80.3	131.7	-176.2	-55.3	-59.4	178.5	-164.4	-19.4	111	L64 K65 L278 A279 Y283 L284 E322	L64-R281 PolarHBondContact O-NH1 3.31Å; L64-R281 PolarHBondContact O-NH2 3.39Å; L64-R281 VanDerWaalsContact O-NH2 3.09Å; K65-R281 VanDerWaalsContact CA-NH2 3.33Å; K65-R281 PolarHBondContact O-NH2 2.94Å; L278-R281 PolarHBondContact O-NE 3.02Å; L278-R281 PolarHBondContact O-NH1 3.45Å; L278-R281 VanDerWaalsContact O-NH1 3.12Å; L278-R281 PolarHBondContact O-NH2 2.93Å; A279-R281 PolarHBondContact O-N 2.77Å; A279-R281 VanDerWaalsContact O-N 3.1Å; R281-Y283 HydrophobicContact CB-CD1 4.17Å; R281-Y283 HydrophobicContact CB-CD2 4.01Å; R281-Y283 HydrophobicContact CB-CE1 3.86Å; R281-Y283 HydrophobicContact CB-CE2 3.66Å; R281-Y283 HydrophobicContact CB-CG 4.25Å; R281-Y283 VanDerWaalsContact CD-OH 3.29Å; R281-Y283 WeakPolarHBondContact CD-OH 3.5Å; R281-Y283 HydrophobicContact CG-CE1 4.21Å; R281-Y283 HydrophobicContact CG-CE2 3.91Å; R281-Y283 WeakPolarHBondContact CG-OH 3.47Å; R281-Y283 PolarHBondContact O-N 2.95Å; R281-Y283 VanDerWaalsContact O-N 3.16Å; R281-L284 HydrophobicContact CB-CB 4.31Å; R281-L284 HydrophobicContact CB-CD1 3.98Å; R281-L284 HydrophobicContact CB-CG 4.1Å; R281-L284 HydrophobicContact CG-CD1 4.07Å; R281-L284 PolarHBondContact O-N 3.17Å; R281-E322 WeakPolarHBondContact CG-OE1 3.49Å; R281-E322 IonicContact NE-OE1 3.25Å
282	S	85.8	Confident	81.1	Confident	110 Å²	110	59.1 Å²	59.1	77%	0.769	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-12.2	178.2	59.2	0	0	0	0	114	F351	S282-F351 WeakPolarHBondContact O-CE1 3.31Å
283	Y	87.1	Confident	79.4	Confident	48 Å²	48	59.7 Å²	59.7	19%	0.188	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	9.1	178.1	55	-103.2	0	0	0	113	R281 I321 E322 K325 F351 A352	R281-Y283 HydrophobicContact CB-CD1 4.17Å; R281-Y283 HydrophobicContact CB-CD2 4.01Å; R281-Y283 HydrophobicContact CB-CE1 3.86Å; R281-Y283 HydrophobicContact CB-CE2 3.66Å; R281-Y283 HydrophobicContact CB-CG 4.25Å; R281-Y283 VanDerWaalsContact CD-OH 3.29Å; R281-Y283 WeakPolarHBondContact CD-OH 3.5Å; R281-Y283 HydrophobicContact CG-CE1 4.21Å; R281-Y283 HydrophobicContact CG-CE2 3.91Å; R281-Y283 WeakPolarHBondContact CG-OH 3.47Å; R281-Y283 PolarHBondContact O-N 2.95Å; R281-Y283 VanDerWaalsContact O-N 3.16Å; Y283-I321 HydrophobicContact CD2-CG2 4.12Å; Y283-I321 HydrophobicContact CE2-CG2 4.27Å; Y283-E322 VanDerWaalsContact CE2-OE1 3.24Å; Y283-E322 WeakPolarHBondContact CE2-OE1 3.45Å; Y283-E322 VanDerWaalsContact CZ-OE1 3.28Å; Y283-E322 VanDerWaalsContact OH-CD 3.25Å; Y283-E322 PolarHBondContact OH-OE1 3.4Å; Y283-E322 PolarHBondContact OH-OE2 3.07Å; Y283-K325 HydrophobicContact CD2-CG 4.39Å; Y283-K325 HydrophobicContact CE2-CG 4.19Å; Y283-F351 WeakPolarHBondContact O-CD1 3.32Å; Y283-A352 WeakPolarHBondContact O-CB 3.01Å
284	L	86.6	Confident	77.6	Confident	19 Å²	19	59.8 Å²	59.8	10%	0.099	31%	0.306	C	S	.	.			trans	-115.2	123.5	172.3	-71.8	174.1	0	0	0	109.2	R281 T318 I321 N348	R281-L284 HydrophobicContact CB-CB 4.31Å; R281-L284 HydrophobicContact CB-CD1 3.98Å; R281-L284 HydrophobicContact CB-CG 4.1Å; R281-L284 HydrophobicContact CG-CD1 4.07Å; R281-L284 PolarHBondContact O-N 3.17Å; L284-T318 HydrophobicContact CD1-CG2 3.94Å; L284-I321 HydrophobicContact CD2-CB 4.17Å; L284-I321 HydrophobicContact CD2-CD1 3.81Å; L284-I321 HydrophobicContact CD2-CG2 3.68Å; L284-N348 HydrophobicContact CD2-CB 4.5Å
285	K	88.6	Confident	76.2	Confident	91 Å²	91	58.8 Å²	58.8	40%	0.396	30%	0.3	S	S	.	.	S	Bend	trans	-79.5	-47	178.2	-170.5	-176.7	-179.5	-165.7	0	110.6	E347 N348 F351	K285-E347 HydrophobicContact CD-CB 4.35Å; K285-E347 WeakPolarHBondContact CE-OE2 3.34Å; K285-E347 IonicContact NZ-OE2 2.72Å; K285-E347 PolarHBondContact NZ-OE2 3.46Å; K285-N348 WeakPolarHBondContact CB-OD1 3.09Å; K285-N348 PolarHBondContact N-OD1 2.78Å; K285-F351 HydrophobicContact CB-CB 4.22Å; K285-F351 HydrophobicContact CB-CD1 3.95Å; K285-F351 HydrophobicContact CB-CE1 4.49Å; K285-F351 HydrophobicContact CB-CG 4.03Å
286	T	87.4	Confident	75	Confident	43 Å²	43	47.9 Å²	47.9	26%	0.264	26%	0.259	S	S	.	.	S	Bend	trans	-118.5	102.5	178.7	-59.4	0	0	0	0	109.3	V316 K344 N348	T286-V316 HydrophobicContact CG2-CG1 4.27Å; T286-K344 HydrophobicContact CG2-CD 4.37Å; T286-N348 PolarHBondContact N-OD1 2.93Å; T286-N348 PolarHBondContact O-ND2 2.99Å
287	P	80.1	Confident	74	Confident	79 Å²	79	45.4 Å²	45.4	51%	0.513	24%	0.243	S	C	.	.			trans	-71.2	132.9	-178.4	28.2	-33.6	0	0	0	111.6
288	G	76.8	Confident	72.7	Confident	27 Å²	27	44.3 Å²	44.3	28%	0.278	24%	0.236	S	C	.	.			trans	-85.1	-163.6	170.3	0	0	0	0	0	113.7	V316 T318	G288-V316 VanDerWaalsContact CA-CG2 3.49Å; G288-T318 WeakPolarHBondContact CA-OG1 3.24Å; G288-T318 PolarHBondContact N-OG1 3.06Å
289	L	65.9	Low	71.5	Confident	70 Å²	70	43.7 Å²	43.7	37%	0.366	23%	0.233	S	C	.	.			trans	-65.7	139.8	-179.4	-154.6	76.6	0	0	0	111.4	S291 T292 D381 F384 L489	L289-S291 PolarHBondContact O-N 3.04Å; L289-T292 PolarHBondContact O-OG1 3.41Å; L289-D381 WeakPolarHBondContact CD2-OD2 3.44Å; L289-F384 HydrophobicContact CD2-CD2 4.41Å; L289-F384 HydrophobicContact CD2-CE2 3.73Å; L289-L489 HydrophobicContact CD2-CD1 4.38Å
290	R	63.2	Low	70.6	Confident	188 Å²	188	43.3 Å²	43.3	71%	0.709	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.6	9.2	-170.5	-76.3	-169.5	179.2	135.5	3.7	116.3
291	S	56.3	Low	69.4	Low	3 Å²	3	43.6 Å²	43.6	2%	0.021	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-16.6	-177.3	-157.4	0	0	0	0	115.3	L289 L293 I294 L418 L489	L289-S291 PolarHBondContact O-N 3.04Å; S291-L293 PolarHBondContact O-N 2.93Å; S291-I294 PolarHBondContact O-N 3.39Å; S291-L418 WeakPolarHBondContact OG-CD2 3.27Å; S291-L489 WeakPolarHBondContact OG-CD2 3.34Å
292	T	55.2	Low	68.1	Low	5 Å²	5	45.1 Å²	45.1	3%	0.031	25%	0.248	C	C	.	.	H	α-helix	trans	-46.9	-37.1	-167.9	-66.8	0	0	0	0	116.2	L289 I294 T295 V296 T318 I319 E322	L289-T292 PolarHBondContact O-OG1 3.41Å; T292-I294 VanDerWaalsContact C-N 3.27Å; T292-I294 PolarHBondContact O-N 2.98Å; T292-T295 PolarHBondContact O-N 3.27Å; T292-V296 HydrophobicContact CG2-CG2 4.41Å; T292-V296 PolarHBondContact O-N 3.08Å; T292-T318 HydrophobicContact CG2-CG2 4.04Å; T292-I319 HydrophobicContact CG2-CB 4Å; T292-I319 HydrophobicContact CG2-CG1 3.63Å; T292-I319 WeakPolarHBondContact OG1-CG1 3.39Å; T292-E322 HydrophobicContact CG2-CB 3.79Å; T292-E322 HydrophobicContact CG2-CG 3.78Å
293	L	58.9	Low	67.3	Low	27 Å²	27	41.1 Å²	41.1	14%	0.141	22%	0.217	C	C	.	.	H	α-helix	trans	-69.5	-26.2	-166	-58.5	173.8	0	0	0	112.8	K65 S291 R297 E322	K65-L293 HydrophobicContact CB-CB 4.44Å; K65-L293 HydrophobicContact CB-CD1 4.14Å; K65-L293 HydrophobicContact CB-CD2 4.22Å; K65-L293 HydrophobicContact CD-CD2 4.2Å; K65-L293 HydrophobicContact CG-CD2 4.39Å; K65-L293 WeakPolarHBondContact O-CD1 3.33Å; S291-L293 PolarHBondContact O-N 2.93Å; L293-R297 VanDerWaalsContact O-CB 3.31Å; L293-R297 WeakPolarHBondContact O-CB 3.3Å; L293-R297 PolarHBondContact O-N 3.42Å; L293-E322 HydrophobicContact CD2-CB 4.08Å; L293-E322 HydrophobicContact CD2-CG 3.51Å; L293-E322 WeakPolarHBondContact CD2-OE2 3.37Å
294	I	58.3	Low	66.5	Low	6 Å²	6	45 Å²	45	3%	0.031	24%	0.237	C	C	.	.	H	α-helix	trans	-81.3	-40.2	-179.3	-47.4	159.5	0	0	0	110.7	M26 F29 S291 T292 V296 R297 S298 V487 I496	M26-I294 HydrophobicContact CE-CD1 3.91Å; M26-I294 HydrophobicContact CE-CG1 3.4Å; M26-I294 HydrophobicContact CG-CD1 4.43Å; M26-I294 HydrophobicContact SD-CD1 2.97Å; M26-I294 WeakPolarHBondContact SD-CD1 3.16Å; M26-I294 HydrophobicContact SD-CG1 3.14Å; M26-I294 WeakPolarHBondContact SD-CG1 3.37Å; F29-I294 HydrophobicContact CD2-CG2 4.35Å; F29-I294 HydrophobicContact CE1-CG2 4.11Å; F29-I294 HydrophobicContact CE2-CG2 3.94Å; F29-I294 HydrophobicContact CZ-CG2 3.82Å; S291-I294 PolarHBondContact O-N 3.39Å; T292-I294 VanDerWaalsContact C-N 3.27Å; T292-I294 PolarHBondContact O-N 2.98Å; I294-V296 VanDerWaalsContact C-N 3.32Å; I294-V296 PolarHBondContact O-N 3.45Å; I294-R297 PolarHBondContact O-N 2.88Å; I294-S298 VanDerWaalsContact O-CB 3.31Å; I294-S298 WeakPolarHBondContact O-CB 3.37Å; I294-S298 PolarHBondContact O-N 2.82Å; I294-S298 PolarHBondContact O-OG 3.05Å; I294-V487 HydrophobicContact CD1-CB 3.69Å; I294-V487 HydrophobicContact CD1-CG1 3.45Å; I294-V487 VanDerWaalsContact CD1-CG1 3.45Å; I294-V487 HydrophobicContact CD1-CG2 4.07Å; I294-I496 HydrophobicContact CB-CD1 3.42Å; I294-I496 VanDerWaalsContact CB-CD1 3.42Å; I294-I496 HydrophobicContact CD1-CD1 3.88Å; I294-I496 HydrophobicContact CG1-CD1 4.28Å; I294-I496 HydrophobicContact CG2-CD1 3.3Å
295	T	59	Low	66.1	Low	0 Å²	0	49 Å²	49	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.3	-47.3	-177.6	-34	0	0	0	0	109.2	T292 S298 V299 V379 V416	T292-T295 PolarHBondContact O-N 3.27Å; T295-S298 PolarHBondContact O-N 3.34Å; T295-V299 WeakPolarHBondContact O-CG2 3.47Å; T295-V299 PolarHBondContact O-N 3.14Å; T295-V379 HydrophobicContact CG2-CG1 3.31Å; T295-V416 HydrophobicContact CG2-CB 4.07Å; T295-V416 HydrophobicContact CG2-CG1 3.4Å
296	V	59.3	Low	65.8	Low	2 Å²	2	47.5 Å²	47.5	1%	0.012	27%	0.274	C	S	.	.	H	α-helix	trans	-60.9	-45.4	173.8	175.6	0	0	0	0	112	T292 I294 S298 V299 A300 I319 E322 A323	T292-V296 HydrophobicContact CG2-CG2 4.41Å; T292-V296 PolarHBondContact O-N 3.08Å; I294-V296 VanDerWaalsContact C-N 3.32Å; I294-V296 PolarHBondContact O-N 3.45Å; V296-S298 VanDerWaalsContact C-N 3.32Å; V296-S298 PolarHBondContact O-N 2.96Å; V296-V299 CarbonylContact O-C 3.51Å; V296-V299 WeakPolarHBondContact O-CG2 3.49Å; V296-V299 PolarHBondContact O-N 3.27Å; V296-A300 PolarHBondContact O-N 3.06Å; V296-I319 HydrophobicContact CG2-CG2 3.88Å; V296-I319 WeakPolarHBondContact CG2-O 3.42Å; V296-E322 HydrophobicContact CG2-CB 4.39Å; V296-A323 HydrophobicContact CB-CB 4.35Å; V296-A323 VanDerWaalsContact CG1-CA 3.43Å; V296-A323 HydrophobicContact CG1-CB 3.63Å; V296-A323 HydrophobicContact CG2-CB 3.78Å
297	R	63.4	Low	65.9	Low	48 Å²	48	45.5 Å²	45.5	18%	0.181	26%	0.261	C	S	.	.	H	α-helix	trans	-69.7	-30.3	-177.9	-168	140.3	-177.6	67.2	27.7	113	D32 L293 I294 V299 A300 E326	D32-R297 IonicContact OD2-CZ 3.49Å; D32-R297 IonicContact OD2-NE 3.41Å; D32-R297 IonicContact OD2-NH2 3.43Å; D32-R297 PolarHBondContact OD2-NH2 3.44Å; L293-R297 VanDerWaalsContact O-CB 3.31Å; L293-R297 WeakPolarHBondContact O-CB 3.3Å; L293-R297 PolarHBondContact O-N 3.42Å; I294-R297 PolarHBondContact O-N 2.88Å; R297-V299 PolarHBondContact O-N 2.91Å; R297-A300 WeakPolarHBondContact O-CB 3.47Å; R297-A300 PolarHBondContact O-N 3Å; R297-E326 IonicContact NH1-OE1 2.75Å; R297-E326 PolarHBondContact NH1-OE1 2.93Å
298	S	60.1	Low	66.5	Low	14 Å²	14	43.7 Å²	43.7	10%	0.098	25%	0.25	C	S	.	.	H	α-helix	trans	-68.4	-21.2	175.7	-58.9	0	0	0	0	112.9	I294 T295 V296 K498	I294-S298 VanDerWaalsContact O-CB 3.31Å; I294-S298 WeakPolarHBondContact O-CB 3.37Å; I294-S298 PolarHBondContact O-N 2.82Å; I294-S298 PolarHBondContact O-OG 3.05Å; T295-S298 PolarHBondContact O-N 3.34Å; V296-S298 VanDerWaalsContact C-N 3.32Å; V296-S298 PolarHBondContact O-N 2.96Å; S298-K498 PolarHBondContact O-NZ 2.98Å
299	V	62.2	Low	67.3	Low	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-105.6	-7.4	174.7	-62.1	0	0	0	0	114.1	T295 V296 R297 S301 L302 F303 V379 T414 V416	T295-V299 WeakPolarHBondContact O-CG2 3.47Å; T295-V299 PolarHBondContact O-N 3.14Å; V296-V299 CarbonylContact O-C 3.51Å; V296-V299 WeakPolarHBondContact O-CG2 3.49Å; V296-V299 PolarHBondContact O-N 3.27Å; R297-V299 PolarHBondContact O-N 2.91Å; V299-S301 PolarHBondContact O-N 2.85Å; V299-L302 HydrophobicContact CB-CD1 4.04Å; V299-L302 HydrophobicContact CG1-CD1 4.25Å; V299-L302 WeakPolarHBondContact O-CB 3.34Å; V299-L302 WeakPolarHBondContact O-CG 3.37Å; V299-L302 PolarHBondContact O-N 2.83Å; V299-F303 HydrophobicContact CB-CE1 4.37Å; V299-F303 HydrophobicContact CB-CE2 4.35Å; V299-F303 HydrophobicContact CB-CZ 3.9Å; V299-F303 HydrophobicContact CG2-CE1 4.12Å; V299-F303 HydrophobicContact CG2-CE2 3.64Å; V299-F303 HydrophobicContact CG2-CZ 3.23Å; V299-V379 HydrophobicContact CG1-CG2 4.08Å; V299-V379 HydrophobicContact CG2-CG2 3.85Å; V299-T414 HydrophobicContact CG1-CG2 4.17Å; V299-V416 HydrophobicContact CG1-CB 3.82Å; V299-V416 HydrophobicContact CG1-CG2 3.14Å
300	A	60.1	Low	68.7	Low	21 Å²	21	39.1 Å²	39.1	17%	0.174	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-56.5	-28.9	-175.2	0	0	0	0	0	114.5	V296 R297 L302 H327	V296-A300 PolarHBondContact O-N 3.06Å; R297-A300 WeakPolarHBondContact O-CB 3.47Å; R297-A300 PolarHBondContact O-N 3Å; A300-L302 PolarHBondContact O-N 3.46Å; A300-H327 WeakPolarHBondContact CA-NE2 2.97Å; A300-H327 VanDerWaalsContact CB-CE1 3.46Å; A300-H327 WeakPolarHBondContact CB-CE1 3.08Å; A300-H327 VanDerWaalsContact CB-NE2 3.3Å; A300-H327 WeakPolarHBondContact CB-NE2 3.42Å; A300-H327 PolarHBondContact O-CE1 3.26Å
301	S	58.8	Low	70.2	Confident	94 Å²	94	30.2 Å²	30.2	66%	0.657	19%	0.186	S	C	*	.	G	3₁₀ helix	trans	-71.8	-1.4	176.6	65.8	0	0	0	0	114	V299	V299-S301 PolarHBondContact O-N 2.85Å
302	L	57.4	Low	72.1	Confident	53 Å²	53	30.1 Å²	30.1	28%	0.277	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-115.2	-12.7	-167.6	-53.3	169.2	0	0	0	113.4	V299 A300 Q304 T414	V299-L302 HydrophobicContact CB-CD1 4.04Å; V299-L302 HydrophobicContact CG1-CD1 4.25Å; V299-L302 WeakPolarHBondContact O-CB 3.34Å; V299-L302 WeakPolarHBondContact O-CG 3.37Å; V299-L302 PolarHBondContact O-N 2.83Å; A300-L302 PolarHBondContact O-N 3.46Å; L302-Q304 PolarHBondContact O-N 3.48Å; L302-Q304 VanDerWaalsContact O-N 3.11Å; L302-T414 HydrophobicContact CD1-CG2 3.51Å; L302-T414 WeakPolarHBondContact CD1-OG1 3.22Å
303	F	68.9	Low	73.9	Confident	25 Å²	25	31.8 Å²	31.8	11%	0.11	19%	0.194	C	C	.	.			trans	-82.9	96.9	-177.5	-55.9	-46.8	0	0	0	109.9	V299 V309 H327 A330 A377	V299-F303 HydrophobicContact CB-CE1 4.37Å; V299-F303 HydrophobicContact CB-CE2 4.35Å; V299-F303 HydrophobicContact CB-CZ 3.9Å; V299-F303 HydrophobicContact CG2-CE1 4.12Å; V299-F303 HydrophobicContact CG2-CE2 3.64Å; V299-F303 HydrophobicContact CG2-CZ 3.23Å; F303-V309 HydrophobicContact CD1-CG2 3.6Å; F303-V309 HydrophobicContact CE1-CB 4.23Å; F303-V309 HydrophobicContact CE1-CG1 4.05Å; F303-V309 HydrophobicContact CE1-CG2 3.15Å; F303-V309 HydrophobicContact CZ-CG1 4.17Å; F303-V309 HydrophobicContact CZ-CG2 3.84Å; F303-H327 HydrophobicContact CB-CB 4.38Å; F303-H327 HydrophobicContact CD2-CB 4.01Å; F303-H327 AromaticContact CD2-CD2 3.27Å; F303-H327 WeakPolarHBondContact CD2-CD2 3.31Å; F303-H327 AromaticContact CD2-CE1 3.59Å; F303-H327 AromaticContact CD2-CG 3.29Å; F303-H327 AromaticContact CD2-ND1 3.51Å; F303-H327 AromaticContact CD2-NE2 3.47Å; F303-H327 WeakPolarHBondContact CD2-NE2 3.49Å; F303-H327 AromaticContact CE2-CD2 3.45Å; F303-H327 VanDerWaalsContact CE2-CD2 3.45Å; F303-H327 WeakPolarHBondContact CE2-CD2 3.14Å; F303-H327 AromaticContact CE2-CG 3.95Å; F303-H327 AromaticContact CE2-NE2 3.7Å; F303-H327 HydrophobicContact CG-CB 4.48Å; F303-A330 HydrophobicContact CB-CB 4.38Å; F303-A377 HydrophobicContact CE1-CB 4.04Å
304	Q	70.4	Confident	75.5	Confident	131 Å²	131	31 Å²	31	61%	0.612	19%	0.19	S	C	*	.			trans	-72	155.6	161.5	-65.2	-59.2	-40.6	0	0	108.9	L302 G306 S307	L302-Q304 PolarHBondContact O-N 3.48Å; L302-Q304 VanDerWaalsContact O-N 3.11Å; Q304-G306 PolarHBondContact O-N 2.98Å; Q304-S307 PolarHBondContact N-OG 3.13Å; Q304-S307 VanDerWaalsContact N-OG 3.08Å; Q304-S307 WeakPolarHBondContact O-CB 3.37Å; Q304-S307 PolarHBondContact O-N 3.43Å; Q304-S307 PolarHBondContact O-OG 2.91Å; Q304-S307 VanDerWaalsContact O-OG 3.11Å
305	P	77.8	Confident	77.2	Confident	102 Å²	102	31.4 Å²	31.4	66%	0.662	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.4	127.9	165.7	-26.3	36	0	0	0	110.7	A329	P305-A329 HydrophobicContact CB-CB 3.82Å; P305-A329 HydrophobicContact CG-CB 4.14Å
306	G	82.1	Confident	78.8	Confident	59 Å²	59	32.1 Å²	32.1	61%	0.608	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.9	-2.4	-176.3	0	0	0	0	0	115.5	Q304 C308 A329	Q304-G306 PolarHBondContact O-N 2.98Å; G306-C308 PolarHBondContact O-N 3.01Å; G306-A329 PolarHBondContact N-O 3.04Å
307	S	89.6	Confident	80.4	Confident	1 Å²	1	32 Å²	32	1%	0.007	20%	0.2	C	C	.	.			trans	-60.3	136.6	177.5	-72	0	0	0	0	112.1	Q304 A330 C331 D376	Q304-S307 PolarHBondContact N-OG 3.13Å; Q304-S307 VanDerWaalsContact N-OG 3.08Å; Q304-S307 WeakPolarHBondContact O-CB 3.37Å; Q304-S307 PolarHBondContact O-N 3.43Å; Q304-S307 PolarHBondContact O-OG 2.91Å; Q304-S307 VanDerWaalsContact O-OG 3.11Å; S307-A330 WeakPolarHBondContact O-CA 3.49Å; S307-A330 WeakPolarHBondContact O-CB 3.16Å; S307-C331 PolarHBondContact O-N 3.34Å; S307-D376 WeakPolarHBondContact CA-OD2 3.49Å; S307-D376 PolarHBondContact OG-OD1 3.47Å
308	C	92.8	Very high	81.7	Confident	41 Å²	41	30.4 Å²	30.4	28%	0.277	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	120.6	175.8	-177.2	0	0	0	0	110.4	G306 D376 A377	G306-C308 PolarHBondContact O-N 3.01Å; C308-D376 PolarHBondContact N-OD2 3.47Å; C308-D376 WeakPolarHBondContact O-CB 3.47Å; C308-D376 PolarHBondContact O-N 2.79Å; C308-A377 PolarHBondContact O-N 2.92Å
309	V	93.3	Very high	83	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.006	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	129.1	-175.7	-170.6	0	0	0	0	109.7	F303 C331 F332 L333 A377 V379	F303-V309 HydrophobicContact CD1-CG2 3.6Å; F303-V309 HydrophobicContact CE1-CB 4.23Å; F303-V309 HydrophobicContact CE1-CG1 4.05Å; F303-V309 HydrophobicContact CE1-CG2 3.15Å; F303-V309 HydrophobicContact CZ-CG1 4.17Å; F303-V309 HydrophobicContact CZ-CG2 3.84Å; V309-C331 PolarHBondContact N-O 2.83Å; V309-F332 HydrophobicContact CB-CD1 3.65Å; V309-F332 HydrophobicContact CB-CE1 3.85Å; V309-F332 HydrophobicContact CG1-CD1 4.12Å; V309-F332 HydrophobicContact CG1-CE1 4.23Å; V309-F332 HydrophobicContact CG2-CD1 4.05Å; V309-F332 HydrophobicContact CG2-CE1 3.76Å; V309-F332 CarbonylContact O-C 3.57Å; V309-F332 WeakPolarHBondContact O-CA 3.48Å; V309-L333 PolarHBondContact O-N 2.99Å; V309-A377 WeakPolarHBondContact CA-O 3.44Å; V309-A377 HydrophobicContact CG1-CB 4.26Å; V309-V379 HydrophobicContact CG1-CG2 3.86Å
310	V	95.3	Very high	84.4	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	133.6	-178.9	-178.5	0	0	0	0	111.2	L333 V335 L370 V375 A377 V378 V379	V310-L333 WeakPolarHBondContact CA-O 3.45Å; V310-L333 HydrophobicContact CG2-CB 4.21Å; V310-L333 HydrophobicContact CG2-CD2 4.37Å; V310-V335 HydrophobicContact CG1-CG2 4.49Å; V310-L370 HydrophobicContact CG1-CD1 4.31Å; V310-L370 HydrophobicContact CG2-CD1 3.96Å; V310-V375 HydrophobicContact CG2-CB 4.08Å; V310-V375 HydrophobicContact CG2-CG1 3.51Å; V310-A377 PolarHBondContact N-O 2.91Å; V310-V378 CarbonylContact O-C 3.55Å; V310-V378 VanDerWaalsContact O-CA 3.31Å; V310-V378 WeakPolarHBondContact O-CA 3.26Å; V310-V379 PolarHBondContact O-N 2.79Å
311	D	94.8	Very high	85.9	Confident	1 Å²	1	29.1 Å²	29.1	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	105.4	162	-174.9	-12.9	0	0	0	108.3	M313 C314 L320 L333 V335 V379	D311-M313 PolarHBondContact O-N 3.36Å; D311-M313 PolarHBondContact OD1-N 3.38Å; D311-M313 VanDerWaalsContact OD1-N 3.16Å; D311-C314 HydrophobicContact CB-CB 3.94Å; D311-C314 VanDerWaalsContact CG-CA 3.5Å; D311-C314 PolarHBondContact OD1-N 3.05Å; D311-C314 WeakPolarHBondContact OD2-CA 3.41Å; D311-L320 HydrophobicContact CB-CD1 4.09Å; D311-L320 HydrophobicContact CB-CD2 3.7Å; D311-L320 HydrophobicContact CB-CG 3.92Å; D311-L333 PolarHBondContact N-O 3.02Å; D311-V335 PolarHBondContact O-N 2.86Å; D311-V379 VanDerWaalsContact CA-O 3.23Å; D311-V379 WeakPolarHBondContact CA-O 3.38Å; D311-V379 WeakPolarHBondContact CB-O 3.35Å
312	P	95.6	Very high	87.3	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.006	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-3.5	-172.3	32.6	-35.9	0	0	0	113.8	V335 L368 V378 C380 M405	P312-V335 CarbonylContact C-O 3.54Å; P312-V335 VanDerWaalsContact O-O 3.1Å; P312-L368 HydrophobicContact CB-CD1 4.1Å; P312-L368 HydrophobicContact CB-CD2 3.86Å; P312-V378 HydrophobicContact CG-CG1 4.2Å; P312-C380 HydrophobicContact CG-CB 4.24Å; P312-M405 HydrophobicContact CG-CE 3.31Å; P312-M405 HydrophobicContact CG-CG 4.21Å
313	M	93.8	Very high	88.6	Confident	41 Å²	41	22.5 Å²	22.5	20%	0.202	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-141	55.4	177.2	-56.2	-177.7	71.9	0	0	109.2	D311 G315 V335 L382 P383 M394 I401	D311-M313 PolarHBondContact O-N 3.36Å; D311-M313 PolarHBondContact OD1-N 3.38Å; D311-M313 VanDerWaalsContact OD1-N 3.16Å; M313-G315 PolarHBondContact O-N 2.67Å; M313-G315 VanDerWaalsContact O-N 3.14Å; M313-V335 CarbonylContact C-O 3.55Å; M313-V335 WeakPolarHBondContact CA-O 3.29Å; M313-V335 PolarHBondContact N-O 2.83Å; M313-L382 HydrophobicContact SD-CG 4.38Å; M313-P383 HydrophobicContact CE-CG 3.63Å; M313-M394 HydrophobicContact CE-CE 4.22Å; M313-M394 HydrophobicContact CE-SD 4.35Å; M313-M394 HydrophobicContact SD-CE 4.4Å; M313-I401 HydrophobicContact SD-CD1 4.44Å
314	C	92.9	Very high	89.6	Confident	9 Å²	9	21.3 Å²	21.3	6%	0.061	14%	0.137	C	C	.	.			trans	-69.9	-14.2	-161	70.8	0	0	0	0	115.4	D311 V316 G317 L320 V335 D336	D311-C314 HydrophobicContact CB-CB 3.94Å; D311-C314 VanDerWaalsContact CG-CA 3.5Å; D311-C314 PolarHBondContact OD1-N 3.05Å; D311-C314 WeakPolarHBondContact OD2-CA 3.41Å; C314-V316 PolarHBondContact O-N 3.03Å; C314-G317 WeakPolarHBondContact O-CA 3.18Å; C314-G317 PolarHBondContact O-N 2.99Å; C314-L320 HydrophobicContact CB-CD1 4.31Å; C314-V335 PolarHBondContact N-O 3.44Å; C314-V335 PolarHBondContact SG-O 2.75Å; C314-D336 PolarHBondContact N-OD2 3.5Å
315	G	93.1	Very high	90.4	Very high	15 Å²	15	18.8 Å²	18.8	16%	0.155	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	-125	-176.6	0	0	0	0	0	111.1	M313 G317 D336 Q341	M313-G315 PolarHBondContact O-N 2.67Å; M313-G315 VanDerWaalsContact O-N 3.14Å; G315-G317 PolarHBondContact O-N 2.62Å; G315-D336 WeakPolarHBondContact CA-OD2 3.35Å; G315-D336 PolarHBondContact N-OD2 3.33Å; G315-Q341 CarbonylContact O-C 3.39Å
316	V	93.6	Very high	90.6	Very high	16 Å²	16	16.1 Å²	16.1	10%	0.097	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	15.1	176.3	-53.9	0	0	0	0	114.2	T286 G288 C314 T318 K344 A345 N348	T286-V316 HydrophobicContact CG2-CG1 4.27Å; G288-V316 VanDerWaalsContact CA-CG2 3.49Å; C314-V316 PolarHBondContact O-N 3.03Å; V316-T318 VanDerWaalsContact C-N 3.32Å; V316-T318 WeakPolarHBondContact CG2-OG1 3.18Å; V316-T318 PolarHBondContact O-N 3.45Å; V316-K344 HydrophobicContact CB-CB 4.22Å; V316-K344 HydrophobicContact CG1-CB 3.75Å; V316-K344 HydrophobicContact CG1-CD 4Å; V316-A345 WeakPolarHBondContact O-CA 3.35Å; V316-N348 PolarHBondContact O-ND2 3.07Å
317	G	92.3	Very high	90.8	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.08	C	C	.	.	S	Bend	trans	73.8	12.6	171.9	0	0	0	0	0	115.9	C314 G315 I319 L320 I321	C314-G317 WeakPolarHBondContact O-CA 3.18Å; C314-G317 PolarHBondContact O-N 2.99Å; G315-G317 PolarHBondContact O-N 2.62Å; G317-I319 VanDerWaalsContact C-N 3.29Å; G317-I319 PolarHBondContact O-N 3.18Å; G317-L320 PolarHBondContact O-N 2.91Å; G317-I321 WeakPolarHBondContact O-CG1 3.34Å; G317-I321 PolarHBondContact O-N 3.42Å
318	T	90.2	Very high	90.6	Very high	14 Å²	14	22.8 Å²	22.8	9%	0.086	12%	0.115	C	C	.	.	H	α-helix	trans	-58.8	-39.2	-174	-59.3	0	0	0	0	112.2	L284 G288 T292 V316 E322	L284-T318 HydrophobicContact CD1-CG2 3.94Å; G288-T318 WeakPolarHBondContact CA-OG1 3.24Å; G288-T318 PolarHBondContact N-OG1 3.06Å; T292-T318 HydrophobicContact CG2-CG2 4.04Å; V316-T318 VanDerWaalsContact C-N 3.32Å; V316-T318 WeakPolarHBondContact CG2-OG1 3.18Å; V316-T318 PolarHBondContact O-N 3.45Å; T318-E322 WeakPolarHBondContact O-CB 3.48Å; T318-E322 WeakPolarHBondContact O-CG 3.35Å; T318-E322 PolarHBondContact O-N 3.26Å
319	I	88.7	Confident	90.3	Very high	7 Å²	7	23.6 Å²	23.6	4%	0.036	12%	0.124	C	C	.	.	H	α-helix	trans	-60.9	-50.2	178.5	-61.9	178.2	0	0	0	112.3	T292 V296 G317 E322 A323 V379 D381	T292-I319 HydrophobicContact CG2-CB 4Å; T292-I319 HydrophobicContact CG2-CG1 3.63Å; T292-I319 WeakPolarHBondContact OG1-CG1 3.39Å; V296-I319 HydrophobicContact CG2-CG2 3.88Å; V296-I319 WeakPolarHBondContact CG2-O 3.42Å; G317-I319 VanDerWaalsContact C-N 3.29Å; G317-I319 PolarHBondContact O-N 3.18Å; I319-E322 PolarHBondContact O-N 3.47Å; I319-A323 WeakPolarHBondContact O-CB 3.4Å; I319-A323 PolarHBondContact O-N 3.44Å; I319-V379 HydrophobicContact CG2-CB 4.3Å; I319-V379 HydrophobicContact CG2-CG1 3.52Å; I319-D381 HydrophobicContact CD1-CB 3.68Å
320	L	90.7	Very high	90.1	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.005	12%	0.124	C	C	.	.	H	α-helix	trans	-68.6	-37.8	-177.8	-59.2	-178.4	0	0	0	112.1	D311 C314 G317 A323 A324 F332 L333 V358	D311-L320 HydrophobicContact CB-CD1 4.09Å; D311-L320 HydrophobicContact CB-CD2 3.7Å; D311-L320 HydrophobicContact CB-CG 3.92Å; C314-L320 HydrophobicContact CB-CD1 4.31Å; G317-L320 PolarHBondContact O-N 2.91Å; L320-A323 PolarHBondContact O-N 3.21Å; L320-A324 WeakPolarHBondContact O-CB 3.07Å; L320-A324 PolarHBondContact O-N 3.37Å; L320-F332 HydrophobicContact CB-CB 4.19Å; L320-F332 HydrophobicContact CD2-CB 4.15Å; L320-F332 HydrophobicContact CD2-CD1 4.01Å; L320-L333 VanDerWaalsContact CD1-C 3.43Å; L320-V358 HydrophobicContact CB-CG1 3.97Å; L320-V358 HydrophobicContact CD1-CG1 4.32Å
321	I	91.4	Very high	90	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-65.5	-44.4	177.8	-69.3	166.9	0	0	0	111.1	Y283 L284 G317 A323 A324 K325 N348 V349 A352 L354	Y283-I321 HydrophobicContact CD2-CG2 4.12Å; Y283-I321 HydrophobicContact CE2-CG2 4.27Å; L284-I321 HydrophobicContact CD2-CB 4.17Å; L284-I321 HydrophobicContact CD2-CD1 3.81Å; L284-I321 HydrophobicContact CD2-CG2 3.68Å; G317-I321 WeakPolarHBondContact O-CG1 3.34Å; G317-I321 PolarHBondContact O-N 3.42Å; I321-A323 VanDerWaalsContact C-N 3.34Å; I321-A323 PolarHBondContact O-N 3.21Å; I321-A324 PolarHBondContact O-N 2.73Å; I321-K325 WeakPolarHBondContact O-CG 3.43Å; I321-K325 PolarHBondContact O-N 2.82Å; I321-N348 HydrophobicContact CD1-CB 3.39Å; I321-V349 HydrophobicContact CD1-CG2 4.04Å; I321-V349 HydrophobicContact CG1-CG2 4.03Å; I321-A352 HydrophobicContact CG2-CB 3.88Å; I321-L354 HydrophobicContact CB-CD1 4.2Å; I321-L354 HydrophobicContact CG1-CD1 4.21Å; I321-L354 HydrophobicContact CG2-CD1 3.82Å
322	E	88.1	Confident	90	Very high	4 Å²	4	26.3 Å²	26.3	2%	0.019	14%	0.143	C	C	.	.	H	α-helix	trans	-62.2	-42.8	176.1	-79.6	-65.2	151.6	0	0	112.3	K65 R281 Y283 T292 L293 V296 T318 I319 K325 E326	K65-E322 WeakPolarHBondContact CE-OE2 3.15Å; K65-E322 PolarHBondContact NZ-O 3.36Å; K65-E322 VanDerWaalsContact NZ-O 3.09Å; K65-E322 IonicContact NZ-OE2 2.79Å; K65-E322 PolarHBondContact NZ-OE2 3.1Å; R281-E322 WeakPolarHBondContact CG-OE1 3.49Å; R281-E322 IonicContact NE-OE1 3.25Å; Y283-E322 VanDerWaalsContact CE2-OE1 3.24Å; Y283-E322 WeakPolarHBondContact CE2-OE1 3.45Å; Y283-E322 VanDerWaalsContact CZ-OE1 3.28Å; Y283-E322 VanDerWaalsContact OH-CD 3.25Å; Y283-E322 PolarHBondContact OH-OE1 3.4Å; Y283-E322 PolarHBondContact OH-OE2 3.07Å; T292-E322 HydrophobicContact CG2-CB 3.79Å; T292-E322 HydrophobicContact CG2-CG 3.78Å; L293-E322 HydrophobicContact CD2-CB 4.08Å; L293-E322 HydrophobicContact CD2-CG 3.51Å; L293-E322 WeakPolarHBondContact CD2-OE2 3.37Å; V296-E322 HydrophobicContact CG2-CB 4.39Å; T318-E322 WeakPolarHBondContact O-CB 3.48Å; T318-E322 WeakPolarHBondContact O-CG 3.35Å; T318-E322 PolarHBondContact O-N 3.26Å; I319-E322 PolarHBondContact O-N 3.47Å; E322-K325 PolarHBondContact O-N 3.26Å; E322-E326 PolarHBondContact O-N 2.95Å
323	A	86.4	Confident	90.1	Very high	3 Å²	3	27.5 Å²	27.5	3%	0.025	15%	0.149	C	C	.	.	H	α-helix	trans	-63.2	-46	175.3	0	0	0	0	0	111.8	V296 I319 L320 I321 K325 E326 H327 F332	V296-A323 HydrophobicContact CB-CB 4.35Å; V296-A323 VanDerWaalsContact CG1-CA 3.43Å; V296-A323 HydrophobicContact CG1-CB 3.63Å; V296-A323 HydrophobicContact CG2-CB 3.78Å; I319-A323 WeakPolarHBondContact O-CB 3.4Å; I319-A323 PolarHBondContact O-N 3.44Å; L320-A323 PolarHBondContact O-N 3.21Å; I321-A323 VanDerWaalsContact C-N 3.34Å; I321-A323 PolarHBondContact O-N 3.21Å; A323-K325 VanDerWaalsContact C-N 3.31Å; A323-K325 PolarHBondContact O-N 3.34Å; A323-E326 PolarHBondContact O-N 3.43Å; A323-E326 VanDerWaalsContact O-N 3.08Å; A323-H327 WeakPolarHBondContact O-CB 3.17Å; A323-H327 PolarHBondContact O-CD2 3.16Å; A323-H327 PolarHBondContact O-N 3.3Å; A323-F332 HydrophobicContact CB-CD1 3.97Å; A323-F332 HydrophobicContact CB-CE1 3.29Å; A323-F332 HydrophobicContact CB-CZ 3.79Å
324	A	89.2	Confident	90.2	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-63.6	-35.6	178.9	0	0	0	0	0	112.5	L320 I321 E326 F332 L354 R357 V358	L320-A324 WeakPolarHBondContact O-CB 3.07Å; L320-A324 PolarHBondContact O-N 3.37Å; I321-A324 PolarHBondContact O-N 2.73Å; A324-E326 VanDerWaalsContact C-N 3.31Å; A324-E326 PolarHBondContact O-N 2.91Å; A324-F332 HydrophobicContact CB-CD2 3.68Å; A324-F332 HydrophobicContact CB-CE2 3.6Å; A324-F332 HydrophobicContact CB-CG 4.44Å; A324-F332 HydrophobicContact CB-CZ 4.3Å; A324-L354 HydrophobicContact CB-CD1 3.78Å; A324-L354 HydrophobicContact CB-CD2 4.04Å; A324-L354 HydrophobicContact CB-CG 4.47Å; A324-R357 PolarHBondContact O-NH1 3.14Å; A324-R357 VanDerWaalsContact O-NH1 3.12Å; A324-R357 PolarHBondContact O-NH2 2.94Å; A324-V358 HydrophobicContact CB-CG2 3.65Å
325	K	87.1	Confident	90.4	Very high	78 Å²	78	25.1 Å²	25.1	34%	0.339	14%	0.137	S	C	.	.	H	α-helix	trans	-67.4	-30.3	174.3	-72.1	-68.4	-179.3	-172.3	0	112.7	Y283 I321 E322 A323 A352 L354	Y283-K325 HydrophobicContact CD2-CG 4.39Å; Y283-K325 HydrophobicContact CE2-CG 4.19Å; I321-K325 WeakPolarHBondContact O-CG 3.43Å; I321-K325 PolarHBondContact O-N 2.82Å; E322-K325 PolarHBondContact O-N 3.26Å; A323-K325 VanDerWaalsContact C-N 3.31Å; A323-K325 PolarHBondContact O-N 3.34Å; K325-A352 WeakPolarHBondContact CE-O 3.01Å; K325-A352 PolarHBondContact NZ-O 2.91Å; K325-L354 HydrophobicContact CG-CD1 4.41Å
326	E	82.5	Confident	90.6	Very high	47 Å²	47	25.4 Å²	25.4	22%	0.22	14%	0.135	C	C	.	.	H	α-helix	trans	-87.3	-35.6	179.5	-163.5	152.4	172.7	0	0	112.7	K65 R297 E322 A323 A324	K65-E326 WeakPolarHBondContact CD-OE2 3.37Å; K65-E326 IonicContact NZ-OE2 3.34Å; K65-E326 PolarHBondContact NZ-OE2 2.75Å; R297-E326 IonicContact NH1-OE1 2.75Å; R297-E326 PolarHBondContact NH1-OE1 2.93Å; E322-E326 PolarHBondContact O-N 2.95Å; A323-E326 PolarHBondContact O-N 3.43Å; A323-E326 VanDerWaalsContact O-N 3.08Å; A324-E326 VanDerWaalsContact C-N 3.31Å; A324-E326 PolarHBondContact O-N 2.91Å
327	H	85.3	Confident	90.6	Very high	29 Å²	29	29.6 Å²	29.6	13%	0.134	16%	0.155	C	C	.	.			trans	-118.6	88.1	-174.2	-58.7	-74.9	0	0	0	109.9	A300 F303 A323 A329 A330 F332 R357	A300-H327 WeakPolarHBondContact CA-NE2 2.97Å; A300-H327 VanDerWaalsContact CB-CE1 3.46Å; A300-H327 WeakPolarHBondContact CB-CE1 3.08Å; A300-H327 VanDerWaalsContact CB-NE2 3.3Å; A300-H327 WeakPolarHBondContact CB-NE2 3.42Å; A300-H327 PolarHBondContact O-CE1 3.26Å; F303-H327 HydrophobicContact CB-CB 4.38Å; F303-H327 HydrophobicContact CD2-CB 4.01Å; F303-H327 AromaticContact CD2-CD2 3.27Å; F303-H327 WeakPolarHBondContact CD2-CD2 3.31Å; F303-H327 AromaticContact CD2-CE1 3.59Å; F303-H327 AromaticContact CD2-CG 3.29Å; F303-H327 AromaticContact CD2-ND1 3.51Å; F303-H327 AromaticContact CD2-NE2 3.47Å; F303-H327 WeakPolarHBondContact CD2-NE2 3.49Å; F303-H327 AromaticContact CE2-CD2 3.45Å; F303-H327 VanDerWaalsContact CE2-CD2 3.45Å; F303-H327 WeakPolarHBondContact CE2-CD2 3.14Å; F303-H327 AromaticContact CE2-CG 3.95Å; F303-H327 AromaticContact CE2-NE2 3.7Å; F303-H327 HydrophobicContact CG-CB 4.48Å; A323-H327 WeakPolarHBondContact O-CB 3.17Å; A323-H327 PolarHBondContact O-CD2 3.16Å; A323-H327 PolarHBondContact O-N 3.3Å; H327-A329 PolarHBondContact O-N 3.02Å; H327-A330 HydrophobicContact CB-CB 4.26Å; H327-A330 PolarHBondContact O-N 3.14Å; H327-F332 HydrophobicContact CB-CZ 4.28Å; H327-R357 PolarHBondContact O-NH1 2.87Å
328	K	85.2	Confident	90.7	Very high	171 Å²	171	33.3 Å²	33.3	74%	0.743	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-23.8	-175.5	-63.9	-173.9	179.7	-177.6	0	113.7	R357	K328-R357 WeakPolarHBondContact O-CD 3.33Å
329	A	86	Confident	91	Very high	57 Å²	57	37.2 Å²	37.2	47%	0.471	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	0.7	-174.3	0	0	0	0	0	114	P305 G306 H327	P305-A329 HydrophobicContact CB-CB 3.82Å; P305-A329 HydrophobicContact CG-CB 4.14Å; G306-A329 PolarHBondContact N-O 3.04Å; H327-A329 PolarHBondContact O-N 3.02Å
330	A	89.2	Confident	91.3	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.008	21%	0.206	C	C	.	.			trans	-100.3	155.9	177.4	0	0	0	0	0	111.7	F303 S307 H327 F332 R357	F303-A330 HydrophobicContact CB-CB 4.38Å; S307-A330 WeakPolarHBondContact O-CA 3.49Å; S307-A330 WeakPolarHBondContact O-CB 3.16Å; H327-A330 HydrophobicContact CB-CB 4.26Å; H327-A330 PolarHBondContact O-N 3.14Å; A330-F332 HydrophobicContact CB-CE1 4.45Å; A330-F332 HydrophobicContact CB-CE2 3.83Å; A330-F332 HydrophobicContact CB-CZ 3.65Å; A330-F332 VanDerWaalsContact O-CE2 3.24Å; A330-F332 WeakPolarHBondContact O-CE2 3.38Å; A330-R357 PolarHBondContact O-NH1 3.47Å
331	C	93.6	Very high	91.5	Very high	56 Å²	56	40 Å²	40	38%	0.378	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	145.7	173	-65.3	0	0	0	0	110	S307 V309	S307-C331 PolarHBondContact O-N 3.34Å; V309-C331 PolarHBondContact N-O 2.83Å
332	F	94.6	Very high	91.7	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.009	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	136.7	-169.6	-60.1	-86.2	0	0	0	110.1	V309 L320 A323 A324 H327 A330 R357 V358 H359	V309-F332 HydrophobicContact CB-CD1 3.65Å; V309-F332 HydrophobicContact CB-CE1 3.85Å; V309-F332 HydrophobicContact CG1-CD1 4.12Å; V309-F332 HydrophobicContact CG1-CE1 4.23Å; V309-F332 HydrophobicContact CG2-CD1 4.05Å; V309-F332 HydrophobicContact CG2-CE1 3.76Å; V309-F332 CarbonylContact O-C 3.57Å; V309-F332 WeakPolarHBondContact O-CA 3.48Å; L320-F332 HydrophobicContact CB-CB 4.19Å; L320-F332 HydrophobicContact CD2-CB 4.15Å; L320-F332 HydrophobicContact CD2-CD1 4.01Å; A323-F332 HydrophobicContact CB-CD1 3.97Å; A323-F332 HydrophobicContact CB-CE1 3.29Å; A323-F332 HydrophobicContact CB-CZ 3.79Å; A324-F332 HydrophobicContact CB-CD2 3.68Å; A324-F332 HydrophobicContact CB-CE2 3.6Å; A324-F332 HydrophobicContact CB-CG 4.44Å; A324-F332 HydrophobicContact CB-CZ 4.3Å; H327-F332 HydrophobicContact CB-CZ 4.28Å; A330-F332 HydrophobicContact CB-CE1 4.45Å; A330-F332 HydrophobicContact CB-CE2 3.83Å; A330-F332 HydrophobicContact CB-CZ 3.65Å; A330-F332 VanDerWaalsContact O-CE2 3.24Å; A330-F332 WeakPolarHBondContact O-CE2 3.38Å; F332-R357 PolarHBondContact N-O 2.85Å; F332-V358 HydrophobicContact CB-CB 4.42Å; F332-V358 HydrophobicContact CB-CG1 4.35Å; F332-V358 HydrophobicContact CB-CG2 4.05Å; F332-V358 HydrophobicContact CD2-CG2 4.24Å; F332-V358 HydrophobicContact CG-CG2 4.41Å; F332-V358 WeakPolarHBondContact O-CA 3.45Å; F332-H359 PolarHBondContact O-N 2.85Å
333	L	97.4	Very high	92.2	Very high	26 Å²	26	46.7 Å²	46.7	14%	0.136	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	120	174.4	175	65.7	0	0	0	109.8	V309 V310 D311 L320 V335 H359 L361 L370	V309-L333 PolarHBondContact O-N 2.99Å; V310-L333 WeakPolarHBondContact CA-O 3.45Å; V310-L333 HydrophobicContact CG2-CB 4.21Å; V310-L333 HydrophobicContact CG2-CD2 4.37Å; D311-L333 PolarHBondContact N-O 3.02Å; L320-L333 VanDerWaalsContact CD1-C 3.43Å; L333-V335 HydrophobicContact CD2-CG2 4.36Å; L333-V335 HydrophobicContact CG-CG2 4.18Å; L333-H359 CarbonylContact C-O 3.53Å; L333-H359 WeakPolarHBondContact CA-O 3.37Å; L333-H359 HydrophobicContact CD1-CB 4.17Å; L333-L361 HydrophobicContact CD1-CB 3.97Å; L333-L370 HydrophobicContact CD2-CD1 4.03Å; L333-L370 HydrophobicContact CD2-CD2 3.8Å; L333-L370 HydrophobicContact CD2-CG 4.39Å
334	G	97.3	Very high	92.7	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	128.5	171	0	0	0	0	0	110.2	H359 L360 L361	G334-H359 PolarHBondContact N-O 2.91Å; G334-L360 CarbonylContact O-C 3.59Å; G334-L360 VanDerWaalsContact O-CA 3.32Å; G334-L360 WeakPolarHBondContact O-CA 3.36Å; G334-L361 PolarHBondContact O-N 2.85Å
335	V	97.6	Very high	93	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.006	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	136.9	171.2	-173.6	0	0	0	0	108.5	V310 D311 P312 M313 C314 L333 L361 A363 L368	V310-V335 HydrophobicContact CG1-CG2 4.49Å; D311-V335 PolarHBondContact O-N 2.86Å; P312-V335 CarbonylContact C-O 3.54Å; P312-V335 VanDerWaalsContact O-O 3.1Å; M313-V335 CarbonylContact C-O 3.55Å; M313-V335 WeakPolarHBondContact CA-O 3.29Å; M313-V335 PolarHBondContact N-O 2.83Å; C314-V335 PolarHBondContact N-O 3.44Å; C314-V335 PolarHBondContact SG-O 2.75Å; L333-V335 HydrophobicContact CD2-CG2 4.36Å; L333-V335 HydrophobicContact CG-CG2 4.18Å; V335-L361 VanDerWaalsContact CA-O 3.25Å; V335-L361 WeakPolarHBondContact CA-O 3.44Å; V335-L361 HydrophobicContact CG2-CB 4.42Å; V335-A363 HydrophobicContact CG1-CB 3.67Å; V335-L368 HydrophobicContact CB-CD2 4.35Å; V335-L368 HydrophobicContact CG1-CD2 4.15Å; V335-L368 HydrophobicContact CG2-CD2 4.28Å
336	D	96.3	Very high	93.5	Very high	21 Å²	21	51.3 Å²	51.3	11%	0.112	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	156.2	168.6	-151.5	-66.8	0	0	0	109.4	C314 G315 D338 L342 L361 K362 A363	C314-D336 PolarHBondContact N-OD2 3.5Å; G315-D336 WeakPolarHBondContact CA-OD2 3.35Å; G315-D336 PolarHBondContact N-OD2 3.33Å; D336-D338 PolarHBondContact OD1-N 2.82Å; D336-L342 HydrophobicContact CB-CD2 3.69Å; D336-L342 HydrophobicContact CB-CG 3.93Å; D336-L361 PolarHBondContact N-O 3.27Å; D336-K362 WeakPolarHBondContact O-CA 3.3Å; D336-A363 CarbonylContact C-O 3.55Å; D336-A363 PolarHBondContact O-N 2.66Å
337	I	94.4	Very high	94.2	Very high	103 Å²	103	52.1 Å²	52.1	53%	0.528	27%	0.274	S	S	.	.	S	Bend	trans	-86.4	-24.2	177.9	-163.2	168.4	0	0	0	111.5	K362	I337-K362 WeakPolarHBondContact O-CE 3.41Å
338	D	93.8	Very high	94.7	Very high	79 Å²	79	50.7 Å²	50.7	42%	0.422	27%	0.268	S	S	.	.			trans	-91.1	115.7	-174.6	-173.4	-65.5	0	0	0	111.5	D336 G340 Q341 L342	D336-D338 PolarHBondContact OD1-N 2.82Å; D338-G340 VanDerWaalsContact C-N 3.25Å; D338-G340 PolarHBondContact O-N 2.76Å; D338-G340 WeakPolarHBondContact OD1-CA 3.43Å; D338-G340 PolarHBondContact OD1-N 3.44Å; D338-Q341 HydrophobicContact CB-CB 4.1Å; D338-Q341 HydrophobicContact CB-CG 3.79Å; D338-Q341 PolarHBondContact O-N 3.43Å; D338-Q341 PolarHBondContact OD1-N 2.98Å; D338-L342 PolarHBondContact O-N 3.07Å; D338-L342 VanDerWaalsContact O-N 3.11Å
339	D	95.9	Very high	95.3	Very high	95 Å²	95	42.7 Å²	42.7	51%	0.508	23%	0.233	S	C	.	.	H	α-helix	trans	-59.6	-35.4	178.2	-65.5	-63.1	0	0	0	112.7	L342 Q343 K362	D339-L342 PolarHBondContact O-N 2.91Å; D339-Q343 WeakPolarHBondContact O-CB 3.33Å; D339-Q343 PolarHBondContact O-N 3.37Å; D339-K362 VanDerWaalsContact OD1-CD 3.22Å; D339-K362 WeakPolarHBondContact OD1-CD 3.49Å; D339-K362 WeakPolarHBondContact OD1-CE 3.42Å; D339-K362 IonicContact OD1-NZ 3.32Å; D339-K362 PolarHBondContact OD1-NZ 2.81Å; D339-K362 WeakPolarHBondContact OD2-CE 3.44Å; D339-K362 IonicContact OD2-NZ 2.79Å; D339-K362 PolarHBondContact OD2-NZ 3.29Å
340	G	95.5	Very high	95.8	Very high	26 Å²	26	44.5 Å²	44.5	27%	0.268	23%	0.234	S	C	.	.	H	α-helix	trans	-71.4	-30.2	-178.9	0	0	0	0	0	112.9	D338 K344	D338-G340 VanDerWaalsContact C-N 3.25Å; D338-G340 PolarHBondContact O-N 2.76Å; D338-G340 WeakPolarHBondContact OD1-CA 3.43Å; D338-G340 PolarHBondContact OD1-N 3.44Å; G340-K344 WeakPolarHBondContact O-CD 3.45Å; G340-K344 WeakPolarHBondContact O-CG 3.46Å; G340-K344 PolarHBondContact O-N 3.27Å
341	Q	94.3	Very high	96.1	Very high	40 Å²	40	49 Å²	49	19%	0.187	25%	0.254	C	S	.	.	H	α-helix	trans	-70.1	-47.8	169.4	-65.5	-62.2	-28	0	0	110.8	G315 D338 Q343 K344 A345	G315-Q341 CarbonylContact O-C 3.39Å; D338-Q341 HydrophobicContact CB-CB 4.1Å; D338-Q341 HydrophobicContact CB-CG 3.79Å; D338-Q341 PolarHBondContact O-N 3.43Å; D338-Q341 PolarHBondContact OD1-N 2.98Å; Q341-Q343 VanDerWaalsContact C-N 3.33Å; Q341-Q343 PolarHBondContact O-N 3.19Å; Q341-K344 PolarHBondContact O-N 3.26Å; Q341-K344 VanDerWaalsContact O-N 3.16Å; Q341-A345 PolarHBondContact O-N 2.86Å
342	L	97.2	Very high	96.1	Very high	19 Å²	19	46.4 Å²	46.4	10%	0.099	24%	0.237	C	C	.	.	H	α-helix	trans	-62.1	-38.2	178.7	-69.4	179.2	0	0	0	112.8	D336 D338 D339 K344 A345 D346 L360 K362	D336-L342 HydrophobicContact CB-CD2 3.69Å; D336-L342 HydrophobicContact CB-CG 3.93Å; D338-L342 PolarHBondContact O-N 3.07Å; D338-L342 VanDerWaalsContact O-N 3.11Å; D339-L342 PolarHBondContact O-N 2.91Å; L342-K344 VanDerWaalsContact C-N 3.35Å; L342-K344 PolarHBondContact O-N 3.25Å; L342-A345 WeakPolarHBondContact O-CB 3.43Å; L342-A345 PolarHBondContact O-N 3.06Å; L342-D346 WeakPolarHBondContact O-CB 3.18Å; L342-D346 PolarHBondContact O-N 3.44Å; L342-L360 HydrophobicContact CD2-CB 4.37Å; L342-L360 HydrophobicContact CD2-CD2 4.49Å; L342-K362 HydrophobicContact CD1-CB 3.66Å; L342-K362 HydrophobicContact CD1-CG 4.1Å
343	Q	97.6	Very high	96.2	Very high	127 Å²	127	54.1 Å²	54.1	59%	0.593	27%	0.272	S	S	*	.	H	α-helix	trans	-60.6	-45	174.6	-174.4	179.2	11.9	0	0	111.4	D339 Q341 A345 D346 E347	D339-Q343 WeakPolarHBondContact O-CB 3.33Å; D339-Q343 PolarHBondContact O-N 3.37Å; Q341-Q343 VanDerWaalsContact C-N 3.33Å; Q341-Q343 PolarHBondContact O-N 3.19Å; Q343-A345 VanDerWaalsContact C-N 3.33Å; Q343-A345 PolarHBondContact O-N 2.86Å; Q343-D346 PolarHBondContact O-N 2.95Å; Q343-E347 WeakPolarHBondContact O-CG 3.23Å; Q343-E347 PolarHBondContact O-N 2.96Å
344	K	96.3	Very high	96.1	Very high	90 Å²	90	53 Å²	53	39%	0.391	27%	0.267	S	S	.	.	H	α-helix	trans	-67.5	-34.7	176	-69.2	166	-172.7	164.9	0	112	T286 V316 G340 Q341 L342 N348	T286-K344 HydrophobicContact CG2-CD 4.37Å; V316-K344 HydrophobicContact CB-CB 4.22Å; V316-K344 HydrophobicContact CG1-CB 3.75Å; V316-K344 HydrophobicContact CG1-CD 4Å; G340-K344 WeakPolarHBondContact O-CD 3.45Å; G340-K344 WeakPolarHBondContact O-CG 3.46Å; G340-K344 PolarHBondContact O-N 3.27Å; Q341-K344 PolarHBondContact O-N 3.26Å; Q341-K344 VanDerWaalsContact O-N 3.16Å; L342-K344 VanDerWaalsContact C-N 3.35Å; L342-K344 PolarHBondContact O-N 3.25Å; K344-N348 WeakPolarHBondContact O-CB 3.39Å; K344-N348 PolarHBondContact O-N 3.33Å; K344-N348 PolarHBondContact O-ND2 3.04Å
345	A	96.4	Very high	96.1	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-64.1	-44.3	174	0	0	0	0	0	111.1	V316 Q341 L342 Q343 N348 V349 L360	V316-A345 WeakPolarHBondContact O-CA 3.35Å; Q341-A345 PolarHBondContact O-N 2.86Å; L342-A345 WeakPolarHBondContact O-CB 3.43Å; L342-A345 PolarHBondContact O-N 3.06Å; Q343-A345 VanDerWaalsContact C-N 3.33Å; Q343-A345 PolarHBondContact O-N 2.86Å; A345-N348 WeakPolarHBondContact O-CB 3.41Å; A345-N348 PolarHBondContact O-N 2.93Å; A345-N348 VanDerWaalsContact O-N 3.16Å; A345-V349 WeakPolarHBondContact O-CB 3.49Å; A345-V349 VanDerWaalsContact O-CG2 3.29Å; A345-V349 WeakPolarHBondContact O-CG2 3.42Å; A345-V349 PolarHBondContact O-N 2.97Å; A345-L360 HydrophobicContact CB-CD1 3.67Å; A345-L360 HydrophobicContact CB-CD2 4.05Å
346	D	97.8	Very high	96	Very high	88 Å²	88	62.5 Å²	62.5	47%	0.471	32%	0.322	S	S	.	.	H	α-helix	trans	-61.5	-46.7	177.4	-174.5	64.8	0	0	0	111.2	L342 Q343 N348 V349 L350 L360	L342-D346 WeakPolarHBondContact O-CB 3.18Å; L342-D346 PolarHBondContact O-N 3.44Å; Q343-D346 PolarHBondContact O-N 2.95Å; D346-N348 VanDerWaalsContact C-N 3.27Å; D346-N348 PolarHBondContact O-N 3.28Å; D346-V349 PolarHBondContact O-N 3.41Å; D346-V349 VanDerWaalsContact O-N 3.14Å; D346-L350 WeakPolarHBondContact O-CB 3.13Å; D346-L350 PolarHBondContact O-N 2.82Å; D346-L360 HydrophobicContact CB-CD1 3.86Å; D346-L360 VanDerWaalsContact N-CD1 3.29Å
347	E	97.3	Very high	95.9	Very high	63 Å²	63	63.6 Å²	63.6	29%	0.294	32%	0.324	S	S	.	.	H	α-helix	trans	-57.5	-40.5	173.5	-73.5	-175.8	-152.5	0	0	112.6	K285 Q343 F351	K285-E347 HydrophobicContact CD-CB 4.35Å; K285-E347 WeakPolarHBondContact CE-OE2 3.34Å; K285-E347 IonicContact NZ-OE2 2.72Å; K285-E347 PolarHBondContact NZ-OE2 3.46Å; Q343-E347 WeakPolarHBondContact O-CG 3.23Å; Q343-E347 PolarHBondContact O-N 2.96Å; E347-F351 WeakPolarHBondContact O-CB 3.22Å; E347-F351 PolarHBondContact O-N 3.32Å
348	N	95.8	Very high	96	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-68.2	-41.3	176.5	-81.8	-26.4	0	0	0	112.2	L284 K285 T286 V316 I321 K344 A345 D346 F351 A352	L284-N348 HydrophobicContact CD2-CB 4.5Å; K285-N348 WeakPolarHBondContact CB-OD1 3.09Å; K285-N348 PolarHBondContact N-OD1 2.78Å; T286-N348 PolarHBondContact N-OD1 2.93Å; T286-N348 PolarHBondContact O-ND2 2.99Å; V316-N348 PolarHBondContact O-ND2 3.07Å; I321-N348 HydrophobicContact CD1-CB 3.39Å; K344-N348 WeakPolarHBondContact O-CB 3.39Å; K344-N348 PolarHBondContact O-N 3.33Å; K344-N348 PolarHBondContact O-ND2 3.04Å; A345-N348 WeakPolarHBondContact O-CB 3.41Å; A345-N348 PolarHBondContact O-N 2.93Å; A345-N348 VanDerWaalsContact O-N 3.16Å; D346-N348 VanDerWaalsContact C-N 3.27Å; D346-N348 PolarHBondContact O-N 3.28Å; N348-F351 PolarHBondContact O-N 3.36Å; N348-A352 WeakPolarHBondContact O-CB 3.4Å; N348-A352 PolarHBondContact O-N 2.86Å
349	V	97	Very high	96.2	Very high	2 Å²	2	59.8 Å²	59.8	1%	0.012	30%	0.302	C	S	.	.	H	α-helix	trans	-64.9	-43.3	178.3	168.1	0	0	0	0	110.6	I321 A345 D346 A352 E353 L354 Q355 V358	I321-V349 HydrophobicContact CD1-CG2 4.04Å; I321-V349 HydrophobicContact CG1-CG2 4.03Å; A345-V349 WeakPolarHBondContact O-CB 3.49Å; A345-V349 VanDerWaalsContact O-CG2 3.29Å; A345-V349 WeakPolarHBondContact O-CG2 3.42Å; A345-V349 PolarHBondContact O-N 2.97Å; D346-V349 PolarHBondContact O-N 3.41Å; D346-V349 VanDerWaalsContact O-N 3.14Å; V349-A352 PolarHBondContact O-N 3.45Å; V349-E353 PolarHBondContact O-N 2.91Å; V349-E353 VanDerWaalsContact O-N 3.14Å; V349-L354 HydrophobicContact CG1-CB 4.16Å; V349-L354 PolarHBondContact O-N 3.02Å; V349-Q355 HydrophobicContact CG1-CG 4.11Å; V349-V358 HydrophobicContact CG1-CB 4.02Å; V349-V358 HydrophobicContact CG1-CG1 4.49Å; V349-V358 HydrophobicContact CG2-CB 3.95Å; V349-V358 HydrophobicContact CG2-CG1 3.57Å
350	L	96.9	Very high	96.3	Very high	95 Å²	95	57.4 Å²	57.4	50%	0.497	29%	0.289	S	S	.	.	H	α-helix	trans	-61.3	-51.4	173.1	175	64.5	0	0	0	111.1	D346 A352 E353	D346-L350 WeakPolarHBondContact O-CB 3.13Å; D346-L350 PolarHBondContact O-N 2.82Å; L350-A352 PolarHBondContact O-N 2.76Å; L350-E353 PolarHBondContact O-N 2.85Å
351	F	95.5	Very high	96.4	Very high	97 Å²	97	59.4 Å²	59.4	43%	0.425	29%	0.293	S	S	.	.	H	α-helix	trans	-63.5	-28.8	-179.8	-174.7	-106.1	0	0	0	112.9	S282 Y283 K285 E347 N348 E353	S282-F351 WeakPolarHBondContact O-CE1 3.31Å; Y283-F351 WeakPolarHBondContact O-CD1 3.32Å; K285-F351 HydrophobicContact CB-CB 4.22Å; K285-F351 HydrophobicContact CB-CD1 3.95Å; K285-F351 HydrophobicContact CB-CE1 4.49Å; K285-F351 HydrophobicContact CB-CG 4.03Å; E347-F351 WeakPolarHBondContact O-CB 3.22Å; E347-F351 PolarHBondContact O-N 3.32Å; N348-F351 PolarHBondContact O-N 3.36Å; F351-E353 VanDerWaalsContact C-N 3.34Å
352	A	93.8	Very high	96.6	Very high	1 Å²	1	62.7 Å²	62.7	1%	0.008	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-5.6	174.6	0	0	0	0	0	113.7	Y283 I321 K325 N348 V349 L350 L354	Y283-A352 WeakPolarHBondContact O-CB 3.01Å; I321-A352 HydrophobicContact CG2-CB 3.88Å; K325-A352 WeakPolarHBondContact CE-O 3.01Å; K325-A352 PolarHBondContact NZ-O 2.91Å; N348-A352 WeakPolarHBondContact O-CB 3.4Å; N348-A352 PolarHBondContact O-N 2.86Å; V349-A352 PolarHBondContact O-N 3.45Å; L350-A352 PolarHBondContact O-N 2.76Å; A352-L354 HydrophobicContact CB-CD1 3.73Å; A352-L354 HydrophobicContact CB-CG 3.97Å
353	E	96.4	Very high	96.5	Very high	163 Å²	163	62.7 Å²	62.7	76%	0.762	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	51	-175.6	-57.3	170.8	-178.4	0	0	112.6	V349 L350 F351	V349-E353 PolarHBondContact O-N 2.91Å; V349-E353 VanDerWaalsContact O-N 3.14Å; L350-E353 PolarHBondContact O-N 2.85Å; F351-E353 VanDerWaalsContact C-N 3.34Å
354	L	95.9	Very high	96.4	Very high	4 Å²	4	58.5 Å²	58.5	2%	0.021	30%	0.295	C	S	.	.			trans	-122.8	10.9	-172.9	-69.5	176.2	0	0	0	114.8	I321 A324 K325 V349 A352 S356 R357 V358	I321-L354 HydrophobicContact CB-CD1 4.2Å; I321-L354 HydrophobicContact CG1-CD1 4.21Å; I321-L354 HydrophobicContact CG2-CD1 3.82Å; A324-L354 HydrophobicContact CB-CD1 3.78Å; A324-L354 HydrophobicContact CB-CD2 4.04Å; A324-L354 HydrophobicContact CB-CG 4.47Å; K325-L354 HydrophobicContact CG-CD1 4.41Å; V349-L354 HydrophobicContact CG1-CB 4.16Å; V349-L354 PolarHBondContact O-N 3.02Å; A352-L354 HydrophobicContact CB-CD1 3.73Å; A352-L354 HydrophobicContact CB-CG 3.97Å; L354-S356 PolarHBondContact O-N 2.88Å; L354-S356 VanDerWaalsContact O-N 3.08Å; L354-R357 PolarHBondContact O-N 2.81Å; L354-V358 HydrophobicContact CB-CB 4.43Å; L354-V358 HydrophobicContact CB-CG2 3.94Å; L354-V358 HydrophobicContact CD1-CG2 4.29Å; L354-V358 PolarHBondContact O-N 3.39Å
355	Q	95.8	Very high	96.2	Very high	101 Å²	101	54.9 Å²	54.9	47%	0.472	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-23.8	-172.6	-56.1	123	-75	0	0	114.1	V349 R357	V349-Q355 HydrophobicContact CG1-CG 4.11Å; Q355-R357 VanDerWaalsContact C-N 3.27Å; Q355-R357 PolarHBondContact O-N 2.83Å
356	S	95.1	Very high	96.1	Very high	98 Å²	98	57.2 Å²	57.2	69%	0.685	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-9.5	177.8	63.6	0	0	0	0	114.2	L354	L354-S356 PolarHBondContact O-N 2.88Å; L354-S356 VanDerWaalsContact O-N 3.08Å
357	R	94.3	Very high	96	Very high	44 Å²	44	55.9 Å²	55.9	17%	0.166	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.2	-23.1	-174.2	-62.9	-170.6	-59.1	119.4	-6.7	114.5	A324 H327 K328 A330 F332 L354 Q355	A324-R357 PolarHBondContact O-NH1 3.14Å; A324-R357 VanDerWaalsContact O-NH1 3.12Å; A324-R357 PolarHBondContact O-NH2 2.94Å; H327-R357 PolarHBondContact O-NH1 2.87Å; K328-R357 WeakPolarHBondContact O-CD 3.33Å; A330-R357 PolarHBondContact O-NH1 3.47Å; F332-R357 PolarHBondContact N-O 2.85Å; L354-R357 PolarHBondContact O-N 2.81Å; Q355-R357 VanDerWaalsContact C-N 3.27Å; Q355-R357 PolarHBondContact O-N 2.83Å
358	V	96.6	Very high	95.9	Very high	4 Å²	4	53.2 Å²	53.2	2%	0.024	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	110.9	176.2	-174.6	0	0	0	0	107.7	L320 A324 F332 V349 L354	L320-V358 HydrophobicContact CB-CG1 3.97Å; L320-V358 HydrophobicContact CD1-CG1 4.32Å; A324-V358 HydrophobicContact CB-CG2 3.65Å; F332-V358 HydrophobicContact CB-CB 4.42Å; F332-V358 HydrophobicContact CB-CG1 4.35Å; F332-V358 HydrophobicContact CB-CG2 4.05Å; F332-V358 HydrophobicContact CD2-CG2 4.24Å; F332-V358 HydrophobicContact CG-CG2 4.41Å; F332-V358 WeakPolarHBondContact O-CA 3.45Å; V349-V358 HydrophobicContact CG1-CB 4.02Å; V349-V358 HydrophobicContact CG1-CG1 4.49Å; V349-V358 HydrophobicContact CG2-CB 3.95Å; V349-V358 HydrophobicContact CG2-CG1 3.57Å; L354-V358 HydrophobicContact CB-CB 4.43Å; L354-V358 HydrophobicContact CB-CG2 3.94Å; L354-V358 HydrophobicContact CD1-CG2 4.29Å; L354-V358 PolarHBondContact O-N 3.39Å
359	H	97.9	Very high	96	Very high	98 Å²	98	56.9 Å²	56.9	45%	0.454	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	152.5	177.5	-56	-67.7	0	0	0	109.8	F332 L333 G334	F332-H359 PolarHBondContact O-N 2.85Å; L333-H359 CarbonylContact C-O 3.53Å; L333-H359 WeakPolarHBondContact CA-O 3.37Å; L333-H359 HydrophobicContact CD1-CB 4.17Å; G334-H359 PolarHBondContact N-O 2.91Å
360	L	98.4	Very high	96	Very high	46 Å²	46	58.4 Å²	58.4	24%	0.241	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	140.4	-177.7	-61.8	174.6	0	0	0	109.6	G334 L342 A345 D346	G334-L360 CarbonylContact O-C 3.59Å; G334-L360 VanDerWaalsContact O-CA 3.32Å; G334-L360 WeakPolarHBondContact O-CA 3.36Å; L342-L360 HydrophobicContact CD2-CB 4.37Å; L342-L360 HydrophobicContact CD2-CD2 4.49Å; A345-L360 HydrophobicContact CB-CD1 3.67Å; A345-L360 HydrophobicContact CB-CD2 4.05Å; D346-L360 HydrophobicContact CB-CD1 3.86Å; D346-L360 VanDerWaalsContact N-CD1 3.29Å
361	L	97.7	Very high	96	Very high	67 Å²	67	58.3 Å²	58.3	35%	0.351	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	132.9	-179.1	-179.8	63.3	0	0	0	110.5	L333 G334 V335 D336 A363 P369	L333-L361 HydrophobicContact CD1-CB 3.97Å; G334-L361 PolarHBondContact O-N 2.85Å; V335-L361 VanDerWaalsContact CA-O 3.25Å; V335-L361 WeakPolarHBondContact CA-O 3.44Å; V335-L361 HydrophobicContact CG2-CB 4.42Å; D336-L361 PolarHBondContact N-O 3.27Å; L361-A363 PolarHBondContact O-N 3.25Å; L361-P369 HydrophobicContact CD2-CG 3.41Å; L361-P369 VanDerWaalsContact CD2-CG 3.41Å; L361-P369 HydrophobicContact CG-CG 4.41Å
362	K	97.8	Very high	96.1	Very high	109 Å²	109	57.3 Å²	57.3	47%	0.474	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	114.6	171.5	-171.2	-170.2	-172	168.7	0	110.5	D336 I337 D339 L342	D336-K362 WeakPolarHBondContact O-CA 3.3Å; I337-K362 WeakPolarHBondContact O-CE 3.41Å; D339-K362 VanDerWaalsContact OD1-CD 3.22Å; D339-K362 WeakPolarHBondContact OD1-CD 3.49Å; D339-K362 WeakPolarHBondContact OD1-CE 3.42Å; D339-K362 IonicContact OD1-NZ 3.32Å; D339-K362 PolarHBondContact OD1-NZ 2.81Å; D339-K362 WeakPolarHBondContact OD2-CE 3.44Å; D339-K362 IonicContact OD2-NZ 2.79Å; D339-K362 PolarHBondContact OD2-NZ 3.29Å; L342-K362 HydrophobicContact CD1-CB 3.66Å; L342-K362 HydrophobicContact CD1-CG 4.1Å
363	A	96.6	Very high	96.2	Very high	20 Å²	20	59.7 Å²	59.7	17%	0.165	35%	0.346	C	S	.	.			trans	-161.9	171.3	172.4	0	0	0	0	0	111.4	V335 D336 L361 P369	V335-A363 HydrophobicContact CG1-CB 3.67Å; D336-A363 CarbonylContact C-O 3.55Å; D336-A363 PolarHBondContact O-N 2.66Å; L361-A363 PolarHBondContact O-N 3.25Å; A363-P369 HydrophobicContact CB-CG 3.82Å
364	S	94.3	Very high	96.2	Very high	39 Å²	39	53.9 Å²	53.9	27%	0.273	32%	0.323	S	S	.	.			trans	-83.4	139.5	172.9	-173.6	0	0	0	0	111	T366 A367	S364-T366 PolarHBondContact O-N 2.84Å; S364-T366 PolarHBondContact OG-N 2.85Å; S364-T366 PolarHBondContact OG-OG1 3.5Å; S364-A367 CarbonylContact O-C 3.31Å; S364-A367 VanDerWaalsContact O-C 3.31Å; S364-A367 PolarHBondContact O-N 3.4Å
365	S	93.6	Very high	96.1	Very high	14 Å²	14	53.7 Å²	53.7	10%	0.098	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-13.9	170.9	58	0	0	0	0	113.5
366	T	93.4	Very high	96	Very high	48 Å²	48	50.3 Å²	50.3	29%	0.294	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-5.9	175	64.7	0	0	0	0	113.8	S364 V400 I401 E404	S364-T366 PolarHBondContact O-N 2.84Å; S364-T366 PolarHBondContact OG-N 2.85Å; S364-T366 PolarHBondContact OG-OG1 3.5Å; T366-V400 HydrophobicContact CG2-CG1 4.2Å; T366-I401 HydrophobicContact CG2-CG1 3.87Å; T366-E404 VanDerWaalsContact C-CG 3.48Å; T366-E404 VanDerWaalsContact O-CG 3.3Å; T366-E404 WeakPolarHBondContact O-CG 3.18Å
367	A	94.9	Very high	95.9	Very high	61 Å²	61	45.7 Å²	45.7	50%	0.504	28%	0.275	S	S	.	.	S	Bend	trans	-156.5	78.8	176.1	0	0	0	0	0	108.9	S364 E404	S364-A367 CarbonylContact O-C 3.31Å; S364-A367 VanDerWaalsContact O-C 3.31Å; S364-A367 PolarHBondContact O-N 3.4Å; A367-E404 WeakPolarHBondContact CA-OE2 3.37Å
368	L	96.5	Very high	95.9	Very high	7 Å²	7	43.6 Å²	43.6	4%	0.037	27%	0.267	C	S	.	.			trans	-72	128.6	-176.1	-69.4	173.5	0	0	0	109.8	P312 V335 L370 E404 R407 V408	P312-L368 HydrophobicContact CB-CD1 4.1Å; P312-L368 HydrophobicContact CB-CD2 3.86Å; V335-L368 HydrophobicContact CB-CD2 4.35Å; V335-L368 HydrophobicContact CG1-CD2 4.15Å; V335-L368 HydrophobicContact CG2-CD2 4.28Å; L368-L370 PolarHBondContact O-N 3.47Å; L368-E404 HydrophobicContact CD1-CB 4.46Å; L368-E404 PolarHBondContact N-OE2 3.43Å; L368-R407 PolarHBondContact O-NH2 3.25Å; L368-V408 HydrophobicContact CB-CG1 4.09Å; L368-V408 HydrophobicContact CD1-CG1 4.06Å; L368-V408 HydrophobicContact CD1-CG2 4.07Å
369	P	96.8	Very high	95.6	Very high	77 Å²	77	43.5 Å²	43.5	50%	0.5	27%	0.266	S	S	.	.	S	Bend	trans	-77.6	50.2	179.4	35.1	-39	0	0	0	111.4	L361 A363	L361-P369 HydrophobicContact CD2-CG 3.41Å; L361-P369 VanDerWaalsContact CD2-CG 3.41Å; L361-P369 HydrophobicContact CG-CG 4.41Å; A363-P369 HydrophobicContact CB-CG 3.82Å
370	L	97.3	Very high	95.3	Very high	34 Å²	34	38.9 Å²	38.9	18%	0.178	25%	0.245	C	C	.	.	S	Bend	trans	-127.8	142.1	-178.9	-64	175.2	0	0	0	109.5	V310 L333 L368 V375 R407 V408	V310-L370 HydrophobicContact CG1-CD1 4.31Å; V310-L370 HydrophobicContact CG2-CD1 3.96Å; L333-L370 HydrophobicContact CD2-CD1 4.03Å; L333-L370 HydrophobicContact CD2-CD2 3.8Å; L333-L370 HydrophobicContact CD2-CG 4.39Å; L368-L370 PolarHBondContact O-N 3.47Å; L370-V375 HydrophobicContact CD1-CG1 4.14Å; L370-R407 PolarHBondContact O-NH1 3.16Å; L370-R407 PolarHBondContact O-NH2 2.94Å; L370-V408 HydrophobicContact CB-CG1 3.87Å; L370-V408 HydrophobicContact CD1-CG1 4.49Å
371	P	97.6	Very high	94.8	Very high	92 Å²	92	37.9 Å²	37.9	60%	0.597	24%	0.24	S	C	*	.			trans	-60	152.3	173	-20.3	31.8	0	0	0	111.6	S374	P371-S374 WeakPolarHBondContact O-CB 3.3Å; P371-S374 PolarHBondContact O-OG 3.14Å
372	S	96.8	Very high	94.4	Very high	76 Å²	76	34.7 Å²	34.7	53%	0.531	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	145.7	171.4	-55.1	0	0	0	0	110.6	S374 R407	S372-S374 PolarHBondContact O-N 2.82Å; S372-R407 CarbonylContact C-O 3.53Å; S372-R407 VanDerWaalsContact CA-O 3.29Å; S372-R407 WeakPolarHBondContact CA-O 3.25Å; S372-R407 VanDerWaalsContact OG-CG 3.25Å; S372-R407 WeakPolarHBondContact OG-CG 3.46Å; S372-R407 PolarHBondContact OG-NH1 2.84Å
373	A	96	Very high	93.5	Very high	52 Å²	52	30.8 Å²	30.8	43%	0.43	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	31.3	179.2	0	0	0	0	0	115.5	R407 V408 R410	A373-R407 PolarHBondContact N-O 3.21Å; A373-V408 CarbonylContact C-O 3.06Å; A373-V408 VanDerWaalsContact CA-O 3.29Å; A373-V408 WeakPolarHBondContact CA-O 3.5Å; A373-V408 PolarHBondContact N-O 2.84Å; A373-R410 HydrophobicContact CB-CB 4.25Å; A373-R410 WeakPolarHBondContact O-CB 3.49Å
374	S	96.1	Very high	92.3	Very high	40 Å²	40	31.4 Å²	31.4	28%	0.28	21%	0.208	S	C	.	.			trans	-91.9	-21.3	-177.7	57.7	0	0	0	0	114.5	P371 S372 V408 R410	P371-S374 WeakPolarHBondContact O-CB 3.3Å; P371-S374 PolarHBondContact O-OG 3.14Å; S372-S374 PolarHBondContact O-N 2.82Å; S374-V408 PolarHBondContact N-O 2.95Å; S374-R410 PolarHBondContact O-NH2 2.83Å
375	V	95	Very high	90.5	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.006	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	148	-171.1	-46.4	0	0	0	0	112.4	V310 L370 V378 V408 L409 R410	V310-V375 HydrophobicContact CG2-CB 4.08Å; V310-V375 HydrophobicContact CG2-CG1 3.51Å; L370-V375 HydrophobicContact CD1-CG1 4.14Å; V375-V378 HydrophobicContact CG2-CG2 3.83Å; V375-V408 HydrophobicContact CG1-CB 4.48Å; V375-V408 HydrophobicContact CG2-CB 4.28Å; V375-V408 HydrophobicContact CG2-CG2 3.86Å; V375-V408 WeakPolarHBondContact CG2-O 3.17Å; V375-V408 PolarHBondContact N-O 3.26Å; V375-L409 HydrophobicContact CG2-CD1 3.99Å; V375-R410 WeakPolarHBondContact O-CG 3.22Å; V375-R410 PolarHBondContact O-N 3.47Å
376	D	93.6	Very high	88.5	Confident	29 Å²	29	39.6 Å²	39.6	16%	0.155	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	-38.7	177.7	-64.5	-107.1	0	0	0	111.8	S307 C308 R410 G413 T414	S307-D376 WeakPolarHBondContact CA-OD2 3.49Å; S307-D376 PolarHBondContact OG-OD1 3.47Å; C308-D376 PolarHBondContact N-OD2 3.47Å; C308-D376 WeakPolarHBondContact O-CB 3.47Å; C308-D376 PolarHBondContact O-N 2.79Å; D376-R410 IonicContact OD1-CZ 3.71Å; D376-R410 VanDerWaalsContact OD1-CZ 3.3Å; D376-R410 IonicContact OD1-NH1 3.53Å; D376-R410 PolarHBondContact OD1-NH1 2.94Å; D376-R410 IonicContact OD1-NH2 3.47Å; D376-R410 IonicContact OD2-CZ 2.66Å; D376-R410 VanDerWaalsContact OD2-CZ 3.26Å; D376-R410 IonicContact OD2-NH1 2.75Å; D376-R410 PolarHBondContact OD2-NH1 2.86Å; D376-R410 IonicContact OD2-NH2 3.75Å; D376-R410 PolarHBondContact OD2-NH2 3.1Å; D376-G413 CarbonylContact O-C 3.54Å; D376-G413 WeakPolarHBondContact O-CA 3.38Å; D376-T414 PolarHBondContact O-N 3.24Å; D376-T414 VanDerWaalsContact O-N 3.07Å
377	A	92.9	Very high	86.3	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.008	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	144.5	-175.2	0	0	0	0	0	112.1	F303 C308 V309 V310 T414	F303-A377 HydrophobicContact CE1-CB 4.04Å; C308-A377 PolarHBondContact O-N 2.92Å; V309-A377 WeakPolarHBondContact CA-O 3.44Å; V309-A377 HydrophobicContact CG1-CB 4.26Å; V310-A377 PolarHBondContact N-O 2.91Å; A377-T414 CarbonylContact C-O 3.55Å; A377-T414 WeakPolarHBondContact CA-O 3.48Å
378	V	93.7	Very high	84	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.006	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	129.1	167.9	174.8	0	0	0	0	108.4	V310 P312 V375 M405 V408 L409 T414 L415 V416	V310-V378 CarbonylContact O-C 3.55Å; V310-V378 VanDerWaalsContact O-CA 3.31Å; V310-V378 WeakPolarHBondContact O-CA 3.26Å; P312-V378 HydrophobicContact CG-CG1 4.2Å; V375-V378 HydrophobicContact CG2-CG2 3.83Å; V378-M405 HydrophobicContact CG1-CB 4.24Å; V378-M405 HydrophobicContact CG1-CG 3.9Å; V378-M405 HydrophobicContact CG1-SD 4.18Å; V378-V408 HydrophobicContact CG2-CG2 4.09Å; V378-L409 HydrophobicContact CG2-CD1 4.32Å; V378-T414 PolarHBondContact N-O 2.66Å; V378-L415 HydrophobicContact CB-CD1 3.67Å; V378-L415 HydrophobicContact CG1-CD1 3.57Å; V378-V416 PolarHBondContact O-N 3.32Å
379	V	91.7	Very high	81.2	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.012	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	114.2	-177.2	-174.6	0	0	0	0	107.8	T295 V299 V309 V310 D311 I319 V416	T295-V379 HydrophobicContact CG2-CG1 3.31Å; V299-V379 HydrophobicContact CG1-CG2 4.08Å; V299-V379 HydrophobicContact CG2-CG2 3.85Å; V309-V379 HydrophobicContact CG1-CG2 3.86Å; V310-V379 PolarHBondContact O-N 2.79Å; D311-V379 VanDerWaalsContact CA-O 3.23Å; D311-V379 WeakPolarHBondContact CA-O 3.38Å; D311-V379 WeakPolarHBondContact CB-O 3.35Å; I319-V379 HydrophobicContact CG2-CB 4.3Å; I319-V379 HydrophobicContact CG2-CG1 3.52Å; V379-V416 VanDerWaalsContact CA-O 3.32Å; V379-V416 WeakPolarHBondContact CA-O 3.29Å
380	C	90.8	Very high	78.9	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	133.4	-171.7	-166.3	0	0	0	0	112.1	P312 L382 M405 V416 V417 L418	P312-C380 HydrophobicContact CG-CB 4.24Å; C380-L382 HydrophobicContact CB-CD1 3.93Å; C380-M405 HydrophobicContact CB-CE 3.73Å; C380-V416 PolarHBondContact N-O 2.8Å; C380-V417 HydrophobicContact CB-CG1 4.37Å; C380-V417 WeakPolarHBondContact O-CA 3.32Å; C380-L418 PolarHBondContact O-N 2.9Å
381	D	88.5	Confident	76.6	Confident	26 Å²	26	64.3 Å²	64.3	14%	0.139	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	97.7	164.1	179.4	7.4	0	0	0	109	L289 I319 L418	L289-D381 WeakPolarHBondContact CD2-OD2 3.44Å; I319-D381 HydrophobicContact CD1-CB 3.68Å; D381-L418 HydrophobicContact CB-CD2 4.32Å; D381-L418 WeakPolarHBondContact OD1-CD2 3.25Å
382	L	87.9	Confident	74.8	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	33%	0.333	C	S	.	.			trans	-75.5	139.2	-176.7	-74.4	84.4	0	0	0	110.1	M313 C380 F384 M394 L398 M405 V417 L418 L419	M313-L382 HydrophobicContact SD-CG 4.38Å; C380-L382 HydrophobicContact CB-CD1 3.93Å; L382-F384 PolarHBondContact O-N 3.34Å; L382-M394 HydrophobicContact CB-CE 4.3Å; L382-M394 HydrophobicContact CD2-CE 3.97Å; L382-L398 HydrophobicContact CD2-CD1 3.46Å; L382-L398 VanDerWaalsContact CD2-CD1 3.46Å; L382-M405 HydrophobicContact CD1-CE 4.4Å; L382-V417 HydrophobicContact CD1-CB 3.78Å; L382-V417 HydrophobicContact CD1-CG1 3.83Å; L382-L418 PolarHBondContact N-O 3.16Å; L382-L418 VanDerWaalsContact N-O 3.13Å; L382-L419 HydrophobicContact CB-CD2 3.88Å; L382-L419 HydrophobicContact CD1-CD2 3.8Å; L382-L419 HydrophobicContact CD2-CD2 3.84Å; L382-L419 HydrophobicContact CG-CD2 4.05Å
383	P	80	Confident	73.7	Confident	27 Å²	27	63.8 Å²	63.8	18%	0.175	33%	0.327	C	S	.	.			trans	-61.6	129.9	-176.8	24.1	-33.9	0	0	0	111.8	M313 G385 M394	M313-P383 HydrophobicContact CE-CG 3.63Å; P383-G385 PolarHBondContact O-N 3.17Å; P383-G385 VanDerWaalsContact O-N 3.17Å; P383-M394 HydrophobicContact CG-CE 3.67Å; P383-M394 HydrophobicContact CG-CG 3.94Å; P383-M394 HydrophobicContact CG-SD 3.58Å; P383-M394 VanDerWaalsContact CG-SD 3.58Å
384	F	70.9	Confident	73	Confident	33 Å²	33	62 Å²	62	15%	0.145	31%	0.31	C	S	.	.			trans	-76.6	6	179.9	-54.7	-49.7	0	0	0	114.9	L289 L382 R386 L418 S420 L489 I492	L289-F384 HydrophobicContact CD2-CD2 4.41Å; L289-F384 HydrophobicContact CD2-CE2 3.73Å; L382-F384 PolarHBondContact O-N 3.34Å; F384-R386 PolarHBondContact O-N 2.83Å; F384-R386 VanDerWaalsContact O-N 3.16Å; F384-L418 HydrophobicContact CE1-CG 4.32Å; F384-L418 HydrophobicContact CZ-CD2 3.95Å; F384-L418 HydrophobicContact CZ-CG 3.87Å; F384-S420 VanDerWaalsContact CD1-N 3.28Å; F384-L489 HydrophobicContact CD2-CD1 4.46Å; F384-L489 HydrophobicContact CE2-CD1 3.3Å; F384-L489 HydrophobicContact CZ-CD1 3.39Å; F384-I492 HydrophobicContact CD2-CD1 3.46Å; F384-I492 VanDerWaalsContact CD2-CD1 3.46Å; F384-I492 HydrophobicContact CE2-CD1 3.81Å; F384-I492 HydrophobicContact CG-CD1 4.29Å
385	G	56	Low	72.1	Confident	49 Å²	49	62.2 Å²	62.2	51%	0.505	31%	0.314	S	S	.	.	S	Bend	trans	66.6	10.3	177.3	0	0	0	0	0	116.4	P383	P383-G385 PolarHBondContact O-N 3.17Å; P383-G385 VanDerWaalsContact O-N 3.17Å
386	R	53.2	Low	71.6	Confident	176 Å²	176	68.5 Å²	68.5	66%	0.664	34%	0.343	S	S	*	.	S	Bend	trans	-112.1	-31.4	-174.5	-67.4	-174.1	-175.5	-166.6	-0.6	116.3	F384	F384-R386 PolarHBondContact O-N 2.83Å; F384-R386 VanDerWaalsContact O-N 3.16Å
387	K	46.4	Very low	71.2	Confident	177 Å²	177	69.3 Å²	69.3	77%	0.77	35%	0.347	S	S	*	.	S	Bend	trans	-108	-24.1	-176.9	-81.9	-171.9	174.2	-176.6	0	114.1
388	F	46.4	Very low	71.1	Confident	135 Å²	135	69.2 Å²	69.2	59%	0.592	35%	0.347	S	S	*	.	S	Bend	trans	-118.5	107.4	170.9	-59.2	-78.2	0	0	0	104.7	T390	F388-T390 PolarHBondContact O-N 2.84Å
389	S	37.1	Very low	70.9	Confident	119 Å²	119	70.5 Å²	70.5	83%	0.832	36%	0.355	S	S	*	.			trans	-67.2	73.5	168.1	-65.3	0	0	0	0	107.7	R391	S389-R391 PolarHBondContact O-N 3.3Å
390	T	48.6	Very low	70.9	Confident	57 Å²	57	73 Å²	73	35%	0.35	37%	0.371	S	S	.	.			trans	-59.5	124.5	162.4	46.5	0	0	0	0	105.3	F388 I392	F388-T390 PolarHBondContact O-N 2.84Å; T390-I392 PolarHBondContact O-N 3.46Å
391	R	50.5	Low	71	Confident	258 Å²	258	73.2 Å²	73.2	97%	0.974	37%	0.372	S	S	*	.	S	Bend	trans	-61.2	8.5	172.6	-62	-176.5	-175.6	-169.3	1.5	113	S389	S389-R391 PolarHBondContact O-N 3.3Å
392	I	58.3	Low	71.3	Confident	81 Å²	81	72.1 Å²	72.1	42%	0.415	37%	0.365	S	S	.	.	S	Bend	trans	-110.3	122.7	-169.4	-57.8	176.4	0	0	0	106.7	T390 M394 N397	T390-I392 PolarHBondContact O-N 3.46Å; I392-M394 PolarHBondContact O-N 2.89Å; I392-N397 HydrophobicContact CG2-CB 4.3Å; I392-N397 WeakPolarHBondContact CG2-ND2 3.39Å
393	N	73.3	Confident	71.5	Confident	75 Å²	75	74 Å²	74	40%	0.401	38%	0.379	S	S	.	.			trans	-70.6	99.1	170.8	-171.7	-15.5	0	0	0	108.6	A395 E396 N397	N393-A395 PolarHBondContact O-N 3.26Å; N393-A395 WeakPolarHBondContact OD1-CB 3.34Å; N393-A395 PolarHBondContact OD1-N 2.8Å; N393-A395 VanDerWaalsContact OD1-N 3.13Å; N393-E396 HydrophobicContact CB-CB 4.11Å; N393-E396 HydrophobicContact CB-CG 4.05Å; N393-E396 WeakPolarHBondContact CB-OE2 3.32Å; N393-E396 WeakPolarHBondContact ND2-CG 3.33Å; N393-E396 PolarHBondContact ND2-OE1 3.13Å; N393-E396 PolarHBondContact O-N 3.3Å; N393-E396 VanDerWaalsContact O-N 3.09Å; N393-N397 PolarHBondContact O-N 3.03Å; N393-N397 VanDerWaalsContact O-N 3.14Å; N393-N397 PolarHBondContact O-ND2 2.86Å
394	M	81.3	Confident	72.3	Confident	16 Å²	16	74 Å²	74	8%	0.079	38%	0.377	C	S	.	.	H	α-helix	trans	-59.1	-28.9	-179.8	-76.5	-59.8	-61.2	0	0	112.7	M313 L382 P383 I392 L398 I401 L423	M313-M394 HydrophobicContact CE-CE 4.22Å; M313-M394 HydrophobicContact CE-SD 4.35Å; M313-M394 HydrophobicContact SD-CE 4.4Å; L382-M394 HydrophobicContact CB-CE 4.3Å; L382-M394 HydrophobicContact CD2-CE 3.97Å; P383-M394 HydrophobicContact CG-CE 3.67Å; P383-M394 HydrophobicContact CG-CG 3.94Å; P383-M394 HydrophobicContact CG-SD 3.58Å; P383-M394 VanDerWaalsContact CG-SD 3.58Å; I392-M394 PolarHBondContact O-N 2.89Å; M394-L398 VanDerWaalsContact O-CB 3.29Å; M394-L398 WeakPolarHBondContact O-CB 3.31Å; M394-L398 PolarHBondContact O-N 2.87Å; M394-I401 HydrophobicContact CE-CD1 4.08Å; M394-L423 HydrophobicContact CB-CD2 4.29Å
395	A	79	Confident	73.5	Confident	44 Å²	44	72.5 Å²	72.5	36%	0.364	37%	0.37	S	S	.	.	H	α-helix	trans	-67.7	-39.2	176.7	0	0	0	0	0	111.6	N393 L426	N393-A395 PolarHBondContact O-N 3.26Å; N393-A395 WeakPolarHBondContact OD1-CB 3.34Å; N393-A395 PolarHBondContact OD1-N 2.8Å; N393-A395 VanDerWaalsContact OD1-N 3.13Å; A395-L426 HydrophobicContact CB-CD2 3.81Å; A395-L426 VanDerWaalsContact O-CD2 3.24Å; A395-L426 WeakPolarHBondContact O-CD2 3.46Å
396	E	83.3	Confident	75.3	Confident	133 Å²	133	70.9 Å²	70.9	62%	0.621	35%	0.349	S	S	*	.	H	α-helix	trans	-72.3	-34.3	178	-71.4	167.8	-165.2	0	0	112.5	N393 P399	N393-E396 HydrophobicContact CB-CB 4.11Å; N393-E396 HydrophobicContact CB-CG 4.05Å; N393-E396 WeakPolarHBondContact CB-OE2 3.32Å; N393-E396 WeakPolarHBondContact ND2-CG 3.33Å; N393-E396 PolarHBondContact ND2-OE1 3.13Å; N393-E396 PolarHBondContact O-N 3.3Å; N393-E396 VanDerWaalsContact O-N 3.09Å; E396-P399 WeakPolarHBondContact O-CD 3.49Å
397	N	86.3	Confident	77.4	Confident	45 Å²	45	65.7 Å²	65.7	24%	0.241	33%	0.33	C	S	.	.	H	α-helix	trans	-88.3	-15.4	-177	-69.9	-83	0	0	0	113.4	I392 N393 P399 V400 I401	I392-N397 HydrophobicContact CG2-CB 4.3Å; I392-N397 WeakPolarHBondContact CG2-ND2 3.39Å; N393-N397 PolarHBondContact O-N 3.03Å; N393-N397 VanDerWaalsContact O-N 3.14Å; N393-N397 PolarHBondContact O-ND2 2.86Å; N397-P399 VanDerWaalsContact C-CD 3.47Å; N397-V400 PolarHBondContact O-N 2.7Å; N397-V400 VanDerWaalsContact O-N 3.16Å; N397-I401 HydrophobicContact CB-CD1 4.03Å; N397-I401 VanDerWaalsContact O-CG1 3.3Å; N397-I401 WeakPolarHBondContact O-CG1 3.39Å; N397-I401 PolarHBondContact O-N 3.23Å
398	L	89.4	Confident	79.8	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-53.9	-44.5	-178.6	-174.4	65.5	0	0	0	113.1	L382 M394 I401 L402 L419 L423 L426 L427 L430	L382-L398 HydrophobicContact CD2-CD1 3.46Å; L382-L398 VanDerWaalsContact CD2-CD1 3.46Å; M394-L398 VanDerWaalsContact O-CB 3.29Å; M394-L398 WeakPolarHBondContact O-CB 3.31Å; M394-L398 PolarHBondContact O-N 2.87Å; L398-I401 PolarHBondContact O-N 3.4Å; L398-L402 HydrophobicContact CD1-CD1 3.98Å; L398-L402 HydrophobicContact CD1-CG 4.02Å; L398-L402 HydrophobicContact CD2-CD1 4.37Å; L398-L402 HydrophobicContact CG-CD1 3.71Å; L398-L402 HydrophobicContact CG-CG 4.21Å; L398-L402 WeakPolarHBondContact O-CB 3.43Å; L398-L402 WeakPolarHBondContact O-CD1 3.39Å; L398-L402 WeakPolarHBondContact O-CG 3.33Å; L398-L402 PolarHBondContact O-N 3.13Å; L398-L419 HydrophobicContact CD1-CD2 4.49Å; L398-L423 HydrophobicContact CD2-CD2 4.38Å; L398-L426 HydrophobicContact CB-CD2 4.22Å; L398-L426 HydrophobicContact CD2-CB 4.24Å; L398-L426 HydrophobicContact CD2-CD2 3.8Å; L398-L426 HydrophobicContact CD2-CG 4Å; L398-L427 HydrophobicContact CD2-CB 4.45Å; L398-L430 HydrophobicContact CD2-CD1 4.43Å
399	P	90.4	Very high	82.1	Confident	28 Å²	28	50.9 Å²	50.9	18%	0.182	27%	0.265	C	S	.	.	H	α-helix	trans	-58	-49.8	175.8	-21.4	31.9	0	0	0	112.7	E396 N397 I401 L402 S403 L430 F476	E396-P399 WeakPolarHBondContact O-CD 3.49Å; N397-P399 VanDerWaalsContact C-CD 3.47Å; P399-I401 PolarHBondContact O-N 3.41Å; P399-L402 PolarHBondContact O-N 2.95Å; P399-S403 WeakPolarHBondContact O-CB 3.48Å; P399-S403 PolarHBondContact O-N 3.37Å; P399-L430 HydrophobicContact CB-CD1 4.32Å; P399-L430 HydrophobicContact CG-CD1 3.79Å; P399-L430 HydrophobicContact CG-CD2 3.97Å; P399-F476 HydrophobicContact CB-CE2 4.23Å; P399-F476 HydrophobicContact CB-CZ 3.85Å; P399-F476 VanDerWaalsContact O-CE1 3.25Å; P399-F476 WeakPolarHBondContact O-CE1 3.36Å; P399-F476 WeakPolarHBondContact O-CZ 3.29Å
400	V	91.8	Very high	84.8	Confident	55 Å²	55	49.4 Å²	49.4	33%	0.333	24%	0.241	S	C	.	.	H	α-helix	trans	-63.7	-43.5	-177.6	-174.4	0	0	0	0	111	T366 N397 L402 S403 E404	T366-V400 HydrophobicContact CG2-CG1 4.2Å; N397-V400 PolarHBondContact O-N 2.7Å; N397-V400 VanDerWaalsContact O-N 3.16Å; V400-L402 PolarHBondContact O-N 2.8Å; V400-S403 PolarHBondContact O-N 2.77Å; V400-E404 PolarHBondContact O-N 3.46Å
401	I	93.2	Very high	87	Confident	4 Å²	4	50.2 Å²	50.2	2%	0.021	25%	0.246	C	C	.	.	H	α-helix	trans	-60.8	-46.9	176.7	-66.9	169.1	0	0	0	110.7	M313 T366 M394 N397 L398 P399 S403 E404 M405	M313-I401 HydrophobicContact SD-CD1 4.44Å; T366-I401 HydrophobicContact CG2-CG1 3.87Å; M394-I401 HydrophobicContact CE-CD1 4.08Å; N397-I401 HydrophobicContact CB-CD1 4.03Å; N397-I401 VanDerWaalsContact O-CG1 3.3Å; N397-I401 WeakPolarHBondContact O-CG1 3.39Å; N397-I401 PolarHBondContact O-N 3.23Å; L398-I401 PolarHBondContact O-N 3.4Å; P399-I401 PolarHBondContact O-N 3.41Å; I401-S403 PolarHBondContact O-N 2.82Å; I401-E404 PolarHBondContact O-N 3.41Å; I401-M405 HydrophobicContact CG2-CE 3.49Å; I401-M405 VanDerWaalsContact CG2-CE 3.49Å; I401-M405 HydrophobicContact CG2-CG 4.42Å; I401-M405 HydrophobicContact CG2-SD 4.06Å; I401-M405 VanDerWaalsContact O-CG 3.25Å; I401-M405 WeakPolarHBondContact O-CG 3.44Å; I401-M405 PolarHBondContact O-N 3.24Å
402	L	93.1	Very high	88.9	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.01	22%	0.224	C	C	.	.	H	α-helix	trans	-63.4	-34	178.2	-71.7	169	0	0	0	111.9	L398 P399 V400 M405 E406 L415 L427 L430 F476	L398-L402 HydrophobicContact CD1-CD1 3.98Å; L398-L402 HydrophobicContact CD1-CG 4.02Å; L398-L402 HydrophobicContact CD2-CD1 4.37Å; L398-L402 HydrophobicContact CG-CD1 3.71Å; L398-L402 HydrophobicContact CG-CG 4.21Å; L398-L402 WeakPolarHBondContact O-CB 3.43Å; L398-L402 WeakPolarHBondContact O-CD1 3.39Å; L398-L402 WeakPolarHBondContact O-CG 3.33Å; L398-L402 PolarHBondContact O-N 3.13Å; P399-L402 PolarHBondContact O-N 2.95Å; V400-L402 PolarHBondContact O-N 2.8Å; L402-M405 HydrophobicContact CD2-SD 4.27Å; L402-M405 PolarHBondContact O-N 3.3Å; L402-E406 WeakPolarHBondContact O-CB 3.35Å; L402-E406 PolarHBondContact O-N 2.84Å; L402-L415 HydrophobicContact CD2-CD2 4.31Å; L402-L427 HydrophobicContact CD1-CD1 3.41Å; L402-L427 VanDerWaalsContact CD1-CD1 3.41Å; L402-L427 HydrophobicContact CD2-CD1 4.22Å; L402-L427 HydrophobicContact CG-CD1 4.48Å; L402-L430 HydrophobicContact CD1-CD1 4.32Å; L402-F476 HydrophobicContact CB-CD1 4.15Å; L402-F476 HydrophobicContact CB-CE1 3.66Å; L402-F476 HydrophobicContact CB-CZ 4.19Å
403	S	93.6	Very high	90.5	Very high	40 Å²	40	36.7 Å²	36.7	28%	0.28	21%	0.206	S	C	.	.	H	α-helix	trans	-69.1	-42	-179	-171	0	0	0	0	109.9	P399 V400 I401 E406 R407	P399-S403 WeakPolarHBondContact O-CB 3.48Å; P399-S403 PolarHBondContact O-N 3.37Å; V400-S403 PolarHBondContact O-N 2.77Å; I401-S403 PolarHBondContact O-N 2.82Å; S403-E406 PolarHBondContact O-N 2.8Å; S403-R407 VanDerWaalsContact O-CB 3.27Å; S403-R407 WeakPolarHBondContact O-CB 3.5Å; S403-R407 PolarHBondContact O-N 3.22Å
404	E	96.1	Very high	91.4	Very high	28 Å²	28	33.2 Å²	33.2	13%	0.131	19%	0.188	C	C	.	.	H	α-helix	trans	-65.5	-42.1	173.4	-79.5	-63.9	103.1	0	0	112.8	T366 A367 L368 V400 I401 E406 R407 V408	T366-E404 VanDerWaalsContact C-CG 3.48Å; T366-E404 VanDerWaalsContact O-CG 3.3Å; T366-E404 WeakPolarHBondContact O-CG 3.18Å; A367-E404 WeakPolarHBondContact CA-OE2 3.37Å; L368-E404 HydrophobicContact CD1-CB 4.46Å; L368-E404 PolarHBondContact N-OE2 3.43Å; V400-E404 PolarHBondContact O-N 3.46Å; I401-E404 PolarHBondContact O-N 3.41Å; E404-E406 VanDerWaalsContact C-N 3.33Å; E404-E406 PolarHBondContact O-N 3.33Å; E404-R407 PolarHBondContact O-N 3.11Å; E404-R407 WeakPolarHBondContact OE1-CD 3.35Å; E404-R407 IonicContact OE1-CZ 3.78Å; E404-R407 IonicContact OE1-NE 2.79Å; E404-R407 PolarHBondContact OE1-NE 3.18Å; E404-R407 IonicContact OE1-NH2 3.64Å; E404-R407 IonicContact OE2-CZ 3.6Å; E404-R407 IonicContact OE2-NE 3.52Å; E404-R407 PolarHBondContact OE2-NE 3.04Å; E404-R407 IonicContact OE2-NH2 3.8Å; E404-R407 PolarHBondContact OE2-NH2 2.75Å; E404-V408 WeakPolarHBondContact O-CG2 3.42Å; E404-V408 PolarHBondContact O-N 2.85Å
405	M	95.5	Very high	91.9	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-59.8	-44	174.2	-69.9	175.2	174.3	0	0	111.4	P312 V378 C380 L382 I401 L402 V408 L409 L415 V417	P312-M405 HydrophobicContact CG-CE 3.31Å; P312-M405 HydrophobicContact CG-CG 4.21Å; V378-M405 HydrophobicContact CG1-CB 4.24Å; V378-M405 HydrophobicContact CG1-CG 3.9Å; V378-M405 HydrophobicContact CG1-SD 4.18Å; C380-M405 HydrophobicContact CB-CE 3.73Å; L382-M405 HydrophobicContact CD1-CE 4.4Å; I401-M405 HydrophobicContact CG2-CE 3.49Å; I401-M405 VanDerWaalsContact CG2-CE 3.49Å; I401-M405 HydrophobicContact CG2-CG 4.42Å; I401-M405 HydrophobicContact CG2-SD 4.06Å; I401-M405 VanDerWaalsContact O-CG 3.25Å; I401-M405 WeakPolarHBondContact O-CG 3.44Å; I401-M405 PolarHBondContact O-N 3.24Å; L402-M405 HydrophobicContact CD2-SD 4.27Å; L402-M405 PolarHBondContact O-N 3.3Å; M405-V408 WeakPolarHBondContact O-CG2 3.42Å; M405-L409 WeakPolarHBondContact O-CB 3.49Å; M405-L409 PolarHBondContact O-N 3.47Å; M405-L415 HydrophobicContact CB-CD1 4.12Å; M405-L415 HydrophobicContact CG-CD1 4.46Å; M405-L415 HydrophobicContact SD-CD1 3.88Å; M405-V417 HydrophobicContact SD-CG1 4.12Å
406	E	95.3	Very high	92.5	Very high	14 Å²	14	30.4 Å²	30.4	7%	0.065	17%	0.167	C	C	.	.	H	α-helix	trans	-65.1	-43.6	175.5	-178.7	172.5	-151.1	0	0	111.5	L402 S403 E404 V408 L409 F476 S478 L479 K501	L402-E406 WeakPolarHBondContact O-CB 3.35Å; L402-E406 PolarHBondContact O-N 2.84Å; S403-E406 PolarHBondContact O-N 2.8Å; E404-E406 VanDerWaalsContact C-N 3.33Å; E404-E406 PolarHBondContact O-N 3.33Å; E406-V408 PolarHBondContact O-N 2.77Å; E406-L409 PolarHBondContact O-N 3.07Å; E406-F476 WeakPolarHBondContact OE2-CA 3.19Å; E406-F476 WeakPolarHBondContact OE2-CD1 3.22Å; E406-S478 WeakPolarHBondContact OE1-CA 3.47Å; E406-S478 WeakPolarHBondContact OE1-CB 3.49Å; E406-S478 PolarHBondContact OE1-N 3.5Å; E406-S478 VanDerWaalsContact OE1-N 3.11Å; E406-S478 PolarHBondContact OE1-OG 3.16Å; E406-L479 HydrophobicContact CB-CD1 4.12Å; E406-L479 HydrophobicContact CB-CG 4.33Å; E406-L479 HydrophobicContact CG-CD1 4.33Å; E406-L479 HydrophobicContact CG-CD2 4.4Å; E406-L479 HydrophobicContact CG-CG 4.02Å; E406-L479 PolarHBondContact OE1-N 2.92Å; E406-K501 HydrophobicContact CG-CD 4.43Å; E406-K501 PolarHBondContact O-NZ 3.42Å
407	R	96	Very high	92.9	Very high	68 Å²	68	24 Å²	24	26%	0.257	14%	0.137	S	C	.	.	H	α-helix	trans	-58.2	-49.3	-179.2	-176.3	-173.2	65.1	73.1	-1.1	111.7	L368 L370 S372 A373 S403 E404 L409	L368-R407 PolarHBondContact O-NH2 3.25Å; L370-R407 PolarHBondContact O-NH1 3.16Å; L370-R407 PolarHBondContact O-NH2 2.94Å; S372-R407 CarbonylContact C-O 3.53Å; S372-R407 VanDerWaalsContact CA-O 3.29Å; S372-R407 WeakPolarHBondContact CA-O 3.25Å; S372-R407 VanDerWaalsContact OG-CG 3.25Å; S372-R407 WeakPolarHBondContact OG-CG 3.46Å; S372-R407 PolarHBondContact OG-NH1 2.84Å; A373-R407 PolarHBondContact N-O 3.21Å; S403-R407 VanDerWaalsContact O-CB 3.27Å; S403-R407 WeakPolarHBondContact O-CB 3.5Å; S403-R407 PolarHBondContact O-N 3.22Å; E404-R407 PolarHBondContact O-N 3.11Å; E404-R407 WeakPolarHBondContact OE1-CD 3.35Å; E404-R407 IonicContact OE1-CZ 3.78Å; E404-R407 IonicContact OE1-NE 2.79Å; E404-R407 PolarHBondContact OE1-NE 3.18Å; E404-R407 IonicContact OE1-NH2 3.64Å; E404-R407 IonicContact OE2-CZ 3.6Å; E404-R407 IonicContact OE2-NE 3.52Å; E404-R407 PolarHBondContact OE2-NE 3.04Å; E404-R407 IonicContact OE2-NH2 3.8Å; E404-R407 PolarHBondContact OE2-NH2 2.75Å; R407-L409 VanDerWaalsContact C-N 3.29Å; R407-L409 PolarHBondContact O-N 3.37Å
408	V	97	Very high	93	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-71.4	-26	-178.2	-59.7	0	0	0	0	112.5	L368 L370 A373 S374 V375 V378 E404 M405 E406	L368-V408 HydrophobicContact CB-CG1 4.09Å; L368-V408 HydrophobicContact CD1-CG1 4.06Å; L368-V408 HydrophobicContact CD1-CG2 4.07Å; L370-V408 HydrophobicContact CB-CG1 3.87Å; L370-V408 HydrophobicContact CD1-CG1 4.49Å; A373-V408 CarbonylContact C-O 3.06Å; A373-V408 VanDerWaalsContact CA-O 3.29Å; A373-V408 WeakPolarHBondContact CA-O 3.5Å; A373-V408 PolarHBondContact N-O 2.84Å; S374-V408 PolarHBondContact N-O 2.95Å; V375-V408 HydrophobicContact CG1-CB 4.48Å; V375-V408 HydrophobicContact CG2-CB 4.28Å; V375-V408 HydrophobicContact CG2-CG2 3.86Å; V375-V408 WeakPolarHBondContact CG2-O 3.17Å; V375-V408 PolarHBondContact N-O 3.26Å; V378-V408 HydrophobicContact CG2-CG2 4.09Å; E404-V408 WeakPolarHBondContact O-CG2 3.42Å; E404-V408 PolarHBondContact O-N 2.85Å; M405-V408 WeakPolarHBondContact O-CG2 3.42Å; E406-V408 PolarHBondContact O-N 2.77Å
409	L	95	Very high	92.9	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	132.8	-178.7	-164.5	62.9	0	0	0	110.9	V375 V378 M405 E406 R407 L415 L479 K501	V375-L409 HydrophobicContact CG2-CD1 3.99Å; V378-L409 HydrophobicContact CG2-CD1 4.32Å; M405-L409 WeakPolarHBondContact O-CB 3.49Å; M405-L409 PolarHBondContact O-N 3.47Å; E406-L409 PolarHBondContact O-N 3.07Å; R407-L409 VanDerWaalsContact C-N 3.29Å; R407-L409 PolarHBondContact O-N 3.37Å; L409-L415 HydrophobicContact CD2-CB 4.05Å; L409-L479 HydrophobicContact CD2-CD2 4.34Å; L409-K501 HydrophobicContact CB-CD 4.14Å; L409-K501 HydrophobicContact CD2-CB 3.97Å; L409-K501 HydrophobicContact CG-CB 4.31Å; L409-K501 HydrophobicContact CG-CD 4.46Å; L409-K501 WeakPolarHBondContact O-CD 3.48Å; L409-K501 WeakPolarHBondContact O-CE 3.48Å; L409-K501 PolarHBondContact O-NZ 3.31Å
410	R	94.3	Very high	92.8	Very high	89 Å²	89	21 Å²	21	34%	0.336	12%	0.12	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	160.8	172.8	73.3	177.8	68.5	139.9	11.1	111.6	A373 S374 V375 D376 G412 G413	A373-R410 HydrophobicContact CB-CB 4.25Å; A373-R410 WeakPolarHBondContact O-CB 3.49Å; S374-R410 PolarHBondContact O-NH2 2.83Å; V375-R410 WeakPolarHBondContact O-CG 3.22Å; V375-R410 PolarHBondContact O-N 3.47Å; D376-R410 IonicContact OD1-CZ 3.71Å; D376-R410 VanDerWaalsContact OD1-CZ 3.3Å; D376-R410 IonicContact OD1-NH1 3.53Å; D376-R410 PolarHBondContact OD1-NH1 2.94Å; D376-R410 IonicContact OD1-NH2 3.47Å; D376-R410 IonicContact OD2-CZ 2.66Å; D376-R410 VanDerWaalsContact OD2-CZ 3.26Å; D376-R410 IonicContact OD2-NH1 2.75Å; D376-R410 PolarHBondContact OD2-NH1 2.86Å; D376-R410 IonicContact OD2-NH2 3.75Å; D376-R410 PolarHBondContact OD2-NH2 3.1Å; R410-G412 PolarHBondContact O-N 3.28Å; R410-G413 WeakPolarHBondContact O-CA 3.43Å; R410-G413 PolarHBondContact O-N 3.37Å
411	V	94.2	Very high	92.7	Very high	74 Å²	74	21.3 Å²	21.3	45%	0.448	12%	0.123	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	134.8	169	174.7	0	0	0	0	109.4	G413 L503	V411-G413 PolarHBondContact O-N 3.47Å; V411-L503 HydrophobicContact CB-CD2 4.42Å; V411-L503 HydrophobicContact CG1-CD2 3.96Å; V411-L503 HydrophobicContact CG1-CG 3.81Å; V411-L503 HydrophobicContact CG2-CD2 3.74Å; V411-L503 HydrophobicContact CG2-CG 4.41Å
412	G	91.1	Very high	92.4	Very high	50 Å²	50	26.4 Å²	26.4	52%	0.515	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	79.5	-10.1	-170	0	0	0	0	0	113.9	R410 K501	R410-G412 PolarHBondContact O-N 3.28Å; G412-K501 WeakPolarHBondContact CA-O 3.28Å; G412-K501 PolarHBondContact N-O 3.35Å
413	G	91.8	Very high	92.2	Very high	4 Å²	4	26.9 Å²	26.9	4%	0.041	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	157.1	174.7	0	0	0	0	0	111.9	D376 R410 V411 I500 K501	D376-G413 CarbonylContact O-C 3.54Å; D376-G413 WeakPolarHBondContact O-CA 3.38Å; R410-G413 WeakPolarHBondContact O-CA 3.43Å; R410-G413 PolarHBondContact O-N 3.37Å; V411-G413 PolarHBondContact O-N 3.47Å; G413-I500 WeakPolarHBondContact O-CA 3.3Å; G413-K501 PolarHBondContact O-N 3.17Å
414	T	91.6	Very high	92.1	Very high	3 Å²	3	25.1 Å²	25.1	2%	0.018	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	134.3	-176.3	-63.3	0	0	0	0	112.6	V299 L302 D376 A377 V378 V416 K498 Y499	V299-T414 HydrophobicContact CG1-CG2 4.17Å; L302-T414 HydrophobicContact CD1-CG2 3.51Å; L302-T414 WeakPolarHBondContact CD1-OG1 3.22Å; D376-T414 PolarHBondContact O-N 3.24Å; D376-T414 VanDerWaalsContact O-N 3.07Å; A377-T414 CarbonylContact C-O 3.55Å; A377-T414 WeakPolarHBondContact CA-O 3.48Å; V378-T414 PolarHBondContact N-O 2.66Å; T414-V416 HydrophobicContact CG2-CG2 3.84Å; T414-K498 HydrophobicContact CG2-CD 4.47Å; T414-K498 HydrophobicContact CG2-CG 3.98Å; T414-Y499 WeakPolarHBondContact CA-O 3.37Å; T414-Y499 WeakPolarHBondContact CG2-O 3.25Å
415	L	92.5	Very high	91.8	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	126.7	169.1	174.9	65.5	0	0	0	109.2	V378 L402 M405 L409 V417 L479 K498 Y499	V378-L415 HydrophobicContact CB-CD1 3.67Å; V378-L415 HydrophobicContact CG1-CD1 3.57Å; L402-L415 HydrophobicContact CD2-CD2 4.31Å; M405-L415 HydrophobicContact CB-CD1 4.12Å; M405-L415 HydrophobicContact CG-CD1 4.46Å; M405-L415 HydrophobicContact SD-CD1 3.88Å; L409-L415 HydrophobicContact CD2-CB 4.05Å; L415-V417 HydrophobicContact CD1-CG1 3.66Å; L415-V417 HydrophobicContact CD2-CG1 4.4Å; L415-V417 HydrophobicContact CG-CG1 3.99Å; L415-L479 HydrophobicContact CB-CD2 4.4Å; L415-L479 HydrophobicContact CD2-CD1 3.71Å; L415-L479 HydrophobicContact CD2-CD2 4.36Å; L415-K498 WeakPolarHBondContact O-CA 3.32Å; L415-Y499 HydrophobicContact CD2-CD2 4.36Å; L415-Y499 PolarHBondContact N-O 3.3Å; L415-Y499 PolarHBondContact O-N 3.16Å
416	V	91.5	Very high	91.5	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	119.1	168.8	-174.8	0	0	0	0	110.5	T295 V299 V378 V379 C380 T414 I496 H497 K498	T295-V416 HydrophobicContact CG2-CB 4.07Å; T295-V416 HydrophobicContact CG2-CG1 3.4Å; V299-V416 HydrophobicContact CG1-CB 3.82Å; V299-V416 HydrophobicContact CG1-CG2 3.14Å; V378-V416 PolarHBondContact O-N 3.32Å; V379-V416 VanDerWaalsContact CA-O 3.32Å; V379-V416 WeakPolarHBondContact CA-O 3.29Å; C380-V416 PolarHBondContact N-O 2.8Å; T414-V416 HydrophobicContact CG2-CG2 3.84Å; V416-I496 HydrophobicContact CG1-CG2 3.45Å; V416-I496 VanDerWaalsContact CG1-CG2 3.45Å; V416-H497 VanDerWaalsContact CA-O 3.3Å; V416-H497 WeakPolarHBondContact CA-O 3.25Å; V416-K498 HydrophobicContact CG2-CB 4.15Å; V416-K498 HydrophobicContact CG2-CD 4.49Å; V416-K498 HydrophobicContact CG2-CG 3.95Å
417	V	90.6	Very high	91.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	133.1	-177.9	-67.2	0	0	0	0	110.4	C380 L382 M405 L415 L419 L427 I496 H497	C380-V417 HydrophobicContact CB-CG1 4.37Å; C380-V417 WeakPolarHBondContact O-CA 3.32Å; L382-V417 HydrophobicContact CD1-CB 3.78Å; L382-V417 HydrophobicContact CD1-CG1 3.83Å; M405-V417 HydrophobicContact SD-CG1 4.12Å; L415-V417 HydrophobicContact CD1-CG1 3.66Å; L415-V417 HydrophobicContact CD2-CG1 4.4Å; L415-V417 HydrophobicContact CG-CG1 3.99Å; V417-L419 HydrophobicContact CB-CG 4.46Å; V417-L419 HydrophobicContact CG2-CD1 4.11Å; V417-L419 HydrophobicContact CG2-CG 4.2Å; V417-L427 HydrophobicContact CG2-CD2 4.3Å; V417-I496 CarbonylContact O-C 3.42Å; V417-I496 WeakPolarHBondContact O-CA 3.25Å; V417-H497 HydrophobicContact CG2-CB 4.02Å; V417-H497 PolarHBondContact N-O 3.09Å; V417-H497 PolarHBondContact O-N 3.36Å
418	L	88.6	Confident	90.8	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	126.4	168.7	174.7	69.6	0	0	0	109.2	S291 C380 D381 L382 F384 V487 L489 L495 I496	S291-L418 WeakPolarHBondContact OG-CD2 3.27Å; C380-L418 PolarHBondContact O-N 2.9Å; D381-L418 HydrophobicContact CB-CD2 4.32Å; D381-L418 WeakPolarHBondContact OD1-CD2 3.25Å; L382-L418 PolarHBondContact N-O 3.16Å; L382-L418 VanDerWaalsContact N-O 3.13Å; F384-L418 HydrophobicContact CE1-CG 4.32Å; F384-L418 HydrophobicContact CZ-CD2 3.95Å; F384-L418 HydrophobicContact CZ-CG 3.87Å; L418-V487 HydrophobicContact CD1-CG2 3.91Å; L418-L489 HydrophobicContact CD2-CD1 4.08Å; L418-L495 WeakPolarHBondContact CA-O 3.09Å; L418-I496 HydrophobicContact CB-CG1 4.31Å; L418-I496 HydrophobicContact CD1-CD1 4.43Å; L418-I496 HydrophobicContact CD1-CG1 3.54Å; L418-I496 HydrophobicContact CG-CG1 4.49Å
419	L	88.6	Confident	90.3	Very high	1 Å²	1	36 Å²	36	1%	0.005	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	152.3	-173.4	-63.3	178.3	0	0	0	111.7	L382 L398 V417 L423 L427 G494 L495	L382-L419 HydrophobicContact CB-CD2 3.88Å; L382-L419 HydrophobicContact CD1-CD2 3.8Å; L382-L419 HydrophobicContact CD2-CD2 3.84Å; L382-L419 HydrophobicContact CG-CD2 4.05Å; L398-L419 HydrophobicContact CD1-CD2 4.49Å; V417-L419 HydrophobicContact CB-CG 4.46Å; V417-L419 HydrophobicContact CG2-CD1 4.11Å; V417-L419 HydrophobicContact CG2-CG 4.2Å; L419-L423 HydrophobicContact CB-CB 4.1Å; L419-L423 HydrophobicContact CD2-CB 4Å; L419-L423 HydrophobicContact CD2-CD1 4.31Å; L419-L423 HydrophobicContact CG-CB 4.47Å; L419-L427 HydrophobicContact CD1-CB 3.98Å; L419-L427 HydrophobicContact CD1-CD2 3.48Å; L419-L427 VanDerWaalsContact CD1-CD2 3.48Å; L419-L427 HydrophobicContact CD1-CG 4.36Å; L419-G494 CarbonylContact O-C 3.53Å; L419-G494 WeakPolarHBondContact O-CA 3.35Å; L419-L495 PolarHBondContact N-O 3.24Å; L419-L495 PolarHBondContact O-N 2.79Å
420	S	87.9	Confident	89.9	Confident	8 Å²	8	37.1 Å²	37.1	6%	0.056	20%	0.201	C	C	.	.			trans	-67.7	162.1	166	62.4	0	0	0	0	109.9	F384 Q422 L423 S424	F384-S420 VanDerWaalsContact CD1-N 3.28Å; S420-Q422 PolarHBondContact O-N 2.85Å; S420-Q422 PolarHBondContact OG-OE1 2.93Å; S420-L423 PolarHBondContact O-N 3.49Å; S420-L423 WeakPolarHBondContact OG-CG 3.18Å; S420-L423 PolarHBondContact OG-N 3.27Å; S420-S424 VanDerWaalsContact O-CB 3.3Å; S420-S424 WeakPolarHBondContact O-CB 3.36Å; S420-S424 PolarHBondContact O-N 3.19Å
421	P	88.4	Confident	89.2	Confident	61 Å²	61	34 Å²	34	40%	0.396	19%	0.191	S	C	.	.	H	α-helix	trans	-52.6	-37.5	172.1	-28.5	36.5	0	0	0	113.4	C425 D493 L495	P421-C425 PolarHBondContact O-N 2.6Å; P421-C425 VanDerWaalsContact O-N 3.11Å; P421-D493 WeakPolarHBondContact CD-O 3.48Å; P421-D493 HydrophobicContact CG-CB 4.41Å; P421-L495 HydrophobicContact CB-CD1 4.14Å; P421-L495 HydrophobicContact CG-CD1 3.95Å
422	Q	88.3	Confident	88.4	Confident	111 Å²	111	36 Å²	36	52%	0.519	20%	0.198	S	C	.	.	H	α-helix	trans	-66.2	-52.1	177.6	-63.7	81.8	-0	0	0	111.8	S420 S424 C425 L426	S420-Q422 PolarHBondContact O-N 2.85Å; S420-Q422 PolarHBondContact OG-OE1 2.93Å; Q422-S424 VanDerWaalsContact C-N 3.3Å; Q422-S424 PolarHBondContact O-N 3.26Å; Q422-C425 WeakPolarHBondContact O-CB 3.49Å; Q422-C425 PolarHBondContact O-N 3.11Å; Q422-C425 VanDerWaalsContact O-N 3.15Å; Q422-L426 PolarHBondContact O-N 3.15Å; Q422-L426 VanDerWaalsContact O-N 3.16Å
423	L	89.4	Confident	87.2	Confident	12 Å²	12	40.3 Å²	40.3	6%	0.063	21%	0.205	C	C	.	.	H	α-helix	trans	-66.8	-33.5	179.5	-66.7	176.3	0	0	0	111.7	M394 L398 L419 S420 C425 L426 L427	M394-L423 HydrophobicContact CB-CD2 4.29Å; L398-L423 HydrophobicContact CD2-CD2 4.38Å; L419-L423 HydrophobicContact CB-CB 4.1Å; L419-L423 HydrophobicContact CD2-CB 4Å; L419-L423 HydrophobicContact CD2-CD1 4.31Å; L419-L423 HydrophobicContact CG-CB 4.47Å; S420-L423 PolarHBondContact O-N 3.49Å; S420-L423 WeakPolarHBondContact OG-CG 3.18Å; S420-L423 PolarHBondContact OG-N 3.27Å; L423-C425 VanDerWaalsContact C-N 3.3Å; L423-C425 PolarHBondContact O-N 3.34Å; L423-L426 PolarHBondContact O-N 2.88Å; L423-L427 PolarHBondContact O-N 3.15Å
424	S	90.8	Very high	85.5	Confident	4 Å²	4	41.5 Å²	41.5	3%	0.028	21%	0.212	C	C	.	.	H	α-helix	trans	-61.7	-37.3	172.6	174.5	0	0	0	0	112.6	S420 Q422 K428 H497	S420-S424 VanDerWaalsContact O-CB 3.3Å; S420-S424 WeakPolarHBondContact O-CB 3.36Å; S420-S424 PolarHBondContact O-N 3.19Å; Q422-S424 VanDerWaalsContact C-N 3.3Å; Q422-S424 PolarHBondContact O-N 3.26Å; S424-K428 WeakPolarHBondContact O-CG 3.44Å; S424-K428 PolarHBondContact O-N 3.42Å; S424-H497 WeakPolarHBondContact CB-NE2 3.41Å; S424-H497 PolarHBondContact OG-CE1 2.76Å; S424-H497 PolarHBondContact OG-NE2 3Å
425	C	89.9	Confident	83.6	Confident	64 Å²	64	47.6 Å²	47.6	43%	0.432	24%	0.244	S	C	.	.	H	α-helix	trans	-67.6	-42.2	176.3	-174.6	0	0	0	0	110.5	P421 Q422 L423 K428 K429	P421-C425 PolarHBondContact O-N 2.6Å; P421-C425 VanDerWaalsContact O-N 3.11Å; Q422-C425 WeakPolarHBondContact O-CB 3.49Å; Q422-C425 PolarHBondContact O-N 3.11Å; Q422-C425 VanDerWaalsContact O-N 3.15Å; L423-C425 VanDerWaalsContact C-N 3.3Å; L423-C425 PolarHBondContact O-N 3.34Å; C425-K428 PolarHBondContact O-N 3.25Å; C425-K429 WeakPolarHBondContact O-CG 3.43Å; C425-K429 PolarHBondContact O-N 3.42Å; C425-K429 VanDerWaalsContact O-N 3.13Å
426	L	89	Confident	81.1	Confident	45 Å²	45	52.3 Å²	52.3	24%	0.236	28%	0.276	C	S	.	.	H	α-helix	trans	-61.9	-48.5	176.2	-179.4	61.2	0	0	0	112.1	A395 L398 Q422 L423 K428 K429 L430	A395-L426 HydrophobicContact CB-CD2 3.81Å; A395-L426 VanDerWaalsContact O-CD2 3.24Å; A395-L426 WeakPolarHBondContact O-CD2 3.46Å; L398-L426 HydrophobicContact CB-CD2 4.22Å; L398-L426 HydrophobicContact CD2-CB 4.24Å; L398-L426 HydrophobicContact CD2-CD2 3.8Å; L398-L426 HydrophobicContact CD2-CG 4Å; Q422-L426 PolarHBondContact O-N 3.15Å; Q422-L426 VanDerWaalsContact O-N 3.16Å; L423-L426 PolarHBondContact O-N 2.88Å; L426-K428 VanDerWaalsContact C-N 3.28Å; L426-K428 PolarHBondContact O-N 3.25Å; L426-K429 WeakPolarHBondContact O-CB 3.46Å; L426-K429 PolarHBondContact O-N 3.16Å; L426-L430 HydrophobicContact CD1-CD1 4.5Å; L426-L430 HydrophobicContact CD1-CG 4.33Å; L426-L430 HydrophobicContact CG-CD1 4.14Å; L426-L430 HydrophobicContact CG-CG 4.43Å; L426-L430 WeakPolarHBondContact O-CG 3.4Å; L426-L430 PolarHBondContact O-N 3.43Å
427	L	89.6	Confident	78.6	Confident	4 Å²	4	54.9 Å²	54.9	2%	0.021	30%	0.303	C	S	.	.	H	α-helix	trans	-53.2	-46	176.1	173.2	64	0	0	0	111.8	L398 L402 V417 L419 L423 K429 L430 L431 H497 Y499	L398-L427 HydrophobicContact CD2-CB 4.45Å; L402-L427 HydrophobicContact CD1-CD1 3.41Å; L402-L427 VanDerWaalsContact CD1-CD1 3.41Å; L402-L427 HydrophobicContact CD2-CD1 4.22Å; L402-L427 HydrophobicContact CG-CD1 4.48Å; V417-L427 HydrophobicContact CG2-CD2 4.3Å; L419-L427 HydrophobicContact CD1-CB 3.98Å; L419-L427 HydrophobicContact CD1-CD2 3.48Å; L419-L427 VanDerWaalsContact CD1-CD2 3.48Å; L419-L427 HydrophobicContact CD1-CG 4.36Å; L423-L427 PolarHBondContact O-N 3.15Å; L427-K429 VanDerWaalsContact C-N 3.32Å; L427-K429 PolarHBondContact O-N 2.82Å; L427-L430 PolarHBondContact O-N 3.11Å; L427-L431 HydrophobicContact CD1-CD1 3.78Å; L427-L431 HydrophobicContact CD1-CG 4.12Å; L427-L431 HydrophobicContact CG-CD1 3.96Å; L427-L431 WeakPolarHBondContact O-CG 3.45Å; L427-L431 PolarHBondContact O-N 3.19Å; L427-H497 HydrophobicContact CD2-CB 4.27Å; L427-Y499 HydrophobicContact CD2-CE2 3.84Å; L427-Y499 VanDerWaalsContact CD2-OH 3.28Å; L427-Y499 WeakPolarHBondContact CD2-OH 3.34Å
428	K	87.4	Confident	76.1	Confident	102 Å²	102	61 Å²	61	44%	0.443	34%	0.343	S	S	.	.	H	α-helix	trans	-61.8	-39	177.7	-73.3	177.8	179.4	-175.5	0	112.3	S424 C425 L426 L432	S424-K428 WeakPolarHBondContact O-CG 3.44Å; S424-K428 PolarHBondContact O-N 3.42Å; C425-K428 PolarHBondContact O-N 3.25Å; L426-K428 VanDerWaalsContact C-N 3.28Å; L426-K428 PolarHBondContact O-N 3.25Å; K428-L432 WeakPolarHBondContact O-CB 3.39Å; K428-L432 WeakPolarHBondContact O-CD1 3.43Å; K428-L432 WeakPolarHBondContact O-CG 3.42Å; K428-L432 PolarHBondContact O-N 3.47Å
429	K	86.9	Confident	73.5	Confident	123 Å²	123	70.4 Å²	70.4	54%	0.535	38%	0.383	S	S	.	.	H	α-helix	trans	-65.6	-45.2	176.4	-70.6	176.9	-179.9	-177	0	111.5	C425 L426 L427 L431 L432 Q433	C425-K429 WeakPolarHBondContact O-CG 3.43Å; C425-K429 PolarHBondContact O-N 3.42Å; C425-K429 VanDerWaalsContact O-N 3.13Å; L426-K429 WeakPolarHBondContact O-CB 3.46Å; L426-K429 PolarHBondContact O-N 3.16Å; L427-K429 VanDerWaalsContact C-N 3.32Å; L427-K429 PolarHBondContact O-N 2.82Å; K429-L431 VanDerWaalsContact C-N 3.32Å; K429-L431 PolarHBondContact O-N 2.69Å; K429-L432 PolarHBondContact O-N 3.17Å; K429-Q433 WeakPolarHBondContact O-CG 3.19Å; K429-Q433 PolarHBondContact O-N 3.22Å
430	L	85	Confident	70.8	Confident	25 Å²	25	81.8 Å²	81.8	13%	0.131	43%	0.426	C	S	.	.	H	α-helix	trans	-58.5	-44.6	178	-66.2	171.6	0	0	0	111.1	L398 P399 L402 L426 L427 L432 T434 F476	L398-L430 HydrophobicContact CD2-CD1 4.43Å; P399-L430 HydrophobicContact CB-CD1 4.32Å; P399-L430 HydrophobicContact CG-CD1 3.79Å; P399-L430 HydrophobicContact CG-CD2 3.97Å; L402-L430 HydrophobicContact CD1-CD1 4.32Å; L426-L430 HydrophobicContact CD1-CD1 4.5Å; L426-L430 HydrophobicContact CD1-CG 4.33Å; L426-L430 HydrophobicContact CG-CD1 4.14Å; L426-L430 HydrophobicContact CG-CG 4.43Å; L426-L430 WeakPolarHBondContact O-CG 3.4Å; L426-L430 PolarHBondContact O-N 3.43Å; L427-L430 PolarHBondContact O-N 3.11Å; L430-L432 PolarHBondContact O-N 3.06Å; L430-T434 WeakPolarHBondContact O-CG2 3.43Å; L430-F476 HydrophobicContact CB-CD2 4.3Å; L430-F476 HydrophobicContact CB-CE2 4.21Å
431	L	80.7	Confident	68.2	Low	23 Å²	23	89.3 Å²	89.3	12%	0.12	47%	0.466	C	S	.	.	H	α-helix	trans	-74.7	-18.4	178.5	-66.5	169.7	0	0	0	114.7	L427 K429 T434 N435 F476 Y499	L427-L431 HydrophobicContact CD1-CD1 3.78Å; L427-L431 HydrophobicContact CD1-CG 4.12Å; L427-L431 HydrophobicContact CG-CD1 3.96Å; L427-L431 WeakPolarHBondContact O-CG 3.45Å; L427-L431 PolarHBondContact O-N 3.19Å; K429-L431 VanDerWaalsContact C-N 3.32Å; K429-L431 PolarHBondContact O-N 2.69Å; L431-T434 PolarHBondContact O-OG1 3.42Å; L431-N435 PolarHBondContact O-ND2 2.89Å; L431-F476 HydrophobicContact CD2-CB 3.84Å; L431-Y499 HydrophobicContact CD1-CD1 4.35Å; L431-Y499 HydrophobicContact CD1-CE1 3.33Å; L431-Y499 WeakPolarHBondContact CD1-OH 3.39Å
432	L	77.3	Confident	65.5	Low	116 Å²	116	91 Å²	91	61%	0.607	49%	0.485	S	S	*	.	H	α-helix	trans	-84.4	-33.4	174.8	-75.8	168.8	0	0	0	111.6	K428 K429 L430 T434 N435	K428-L432 WeakPolarHBondContact O-CB 3.39Å; K428-L432 WeakPolarHBondContact O-CD1 3.43Å; K428-L432 WeakPolarHBondContact O-CG 3.42Å; K428-L432 PolarHBondContact O-N 3.47Å; K429-L432 PolarHBondContact O-N 3.17Å; L430-L432 PolarHBondContact O-N 3.06Å; L432-T434 PolarHBondContact O-N 2.89Å; L432-N435 PolarHBondContact O-N 3.03Å
433	Q	66.5	Low	62.8	Low	141 Å²	141	94.9 Å²	94.9	66%	0.659	50%	0.503	S	S	*	.	H	α-helix	trans	-67.3	-24.2	176.4	-73.3	175.5	-16.3	0	0	112.6	K429	K429-Q433 WeakPolarHBondContact O-CG 3.19Å; K429-Q433 PolarHBondContact O-N 3.22Å
434	T	56.1	Low	60.1	Low	29 Å²	29	98.9 Å²	98.9	18%	0.178	54%	0.537	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-26.7	176.8	57	0	0	0	0	113.2	L430 L431 L432 T475 F476	L430-T434 WeakPolarHBondContact O-CG2 3.43Å; L431-T434 PolarHBondContact O-OG1 3.42Å; L432-T434 PolarHBondContact O-N 2.89Å; T434-T475 HydrophobicContact CG2-CG2 3.69Å; T434-F476 HydrophobicContact CG2-CB 4.22Å; T434-F476 HydrophobicContact CG2-CD2 4.28Å; T434-F476 VanDerWaalsContact CG2-N 3.26Å
435	N	51.6	Low	57.1	Low	130 Å²	130	107.6 Å²	107.6	70%	0.695	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	-12.8	-179.9	-74.3	-53.5	0	0	0	113.9	L431 L432	L431-N435 PolarHBondContact O-ND2 2.89Å; L432-N435 PolarHBondContact O-N 3.03Å
436	C	39.9	Very low	54.1	Low	100 Å²	100	109.5 Å²	109.5	68%	0.676	59%	0.592	S	S	*	*	S	Bend	trans	-104.9	91.6	171.9	-74.4	0	0	0	0	108
437	G	37.5	Very low	51.3	Low	54 Å²	54	115.9 Å²	115.9	56%	0.557	62%	0.621	S	S	*	*			trans	-52.4	160.2	173.7	0	0	0	0	0	112.4	K439	G437-K439 PolarHBondContact O-N 3.13Å
438	P	38.3	Very low	48.2	Very low	129 Å²	129	122.6 Å²	122.6	84%	0.838	66%	0.662	S	S	*	*			trans	-58.6	113.9	-175	23	-30.7	0	0	0	109.2	R440	P438-R440 PolarHBondContact O-N 3.42Å
439	K	34.2	Very low	45.2	Very low	197 Å²	197	121.8 Å²	121.8	86%	0.857	68%	0.682	S	S	*	*			trans	-58.9	110.7	167.9	-74.2	-174.1	176.9	-177	0	106.3	G437 N441	G437-K439 PolarHBondContact O-N 3.13Å; K439-N441 PolarHBondContact O-N 3.38Å; K439-N441 VanDerWaalsContact O-N 3.1Å
440	R	31.7	Very low	42.3	Very low	239 Å²	239	124.1 Å²	124.1	90%	0.902	70%	0.697	S	S	*	*			trans	-51.6	119.5	165.6	-80.7	178.9	168	175.6	-4.1	106.6	P438 A442	P438-R440 PolarHBondContact O-N 3.42Å; R440-A442 PolarHBondContact O-N 3.3Å
441	N	33.6	Very low	39.5	Very low	166 Å²	166	131.4 Å²	131.4	89%	0.888	73%	0.728	S	S	*	*			trans	-59.7	102.6	169.8	-73.4	-24.3	0	0	0	107.2	K439	K439-N441 PolarHBondContact O-N 3.38Å; K439-N441 VanDerWaalsContact O-N 3.1Å
442	A	32.2	Very low	36.9	Very low	96 Å²	96	135.3 Å²	135.3	79%	0.793	76%	0.757	S	S	*	*			trans	-93.1	109.2	160.7	0	0	0	0	0	106.5	R440	R440-A442 PolarHBondContact O-N 3.3Å
443	E	31.6	Very low	34.3	Very low	194 Å²	194	134.8 Å²	134.8	91%	0.907	76%	0.762	S	S	*	*			trans	0.9	145.8	157.8	-69.7	164.2	166.7	0	0	120.2
444	A	32.7	Very low	32.3	Very low	95 Å²	95	136 Å²	136	79%	0.785	77%	0.772	S	S	*	*			trans	-56.9	148.9	177.4	0	0	0	0	0	113.9
445	E	27.6	Very low	30.7	Very low	187 Å²	187	140.8 Å²	140.8	87%	0.874	80%	0.801	S	S	*	*			trans	-159	126.4	132.6	-111.6	169.4	-164.2	0	0	113.8
446	S	27.1	Very low	29.5	Very low	104 Å²	104	140.5 Å²	140.5	73%	0.727	81%	0.809	S	S	*	*			trans	39.6	110.3	150.7	61.3	0	0	0	0	123.7
447	Q	29.5	Very low	28.8	Very low	180 Å²	180	140.6 Å²	140.6	84%	0.841	81%	0.811	S	S	*	*				19.3	128.5	125.5	-56.6	-171.9	0.7	0	0	120.4
448	T	25.2	Very low	28.3	Very low	145 Å²	145	143.4 Å²	143.4	89%	0.89	82%	0.822	S	S	*	*				172.5	141.2	104.5	30	0	0	0	0	111.1
449	G	24.5	Very low	27.6	Very low	84 Å²	84	145.9 Å²	145.9	87%	0.866	82%	0.823	S	S	*	*			trans	149.7	98.3	167.1	0	0	0	0	0	115.3
450	M	25.2	Very low	27.2	Very low	173 Å²	173	145.6 Å²	145.6	85%	0.852	82%	0.824	S	S	*	*			trans	-91.8	146.8	-166.9	-136.7	150.4	67.7	0	0	113.5
451	K	27	Very low	26.9	Very low	177 Å²	177	143 Å²	143	77%	0.77	82%	0.822	S	S	*	*			trans	128.9	107.4	137.9	-76.2	177.8	175.5	178.8	0	118.8
452	S	25.1	Very low	26.5	Very low	105 Å²	105	142.3 Å²	142.3	73%	0.734	82%	0.818	S	S	*	*				70.2	137.9	121.5	92	0	0	0	0	118.6
453	C	22.8	Very low	26.2	Very low	105 Å²	105	145.5 Å²	145.5	71%	0.709	82%	0.821	S	S	*	*			cis	-170.3	153.9	40.4	-120.8	0	0	0	0	111.5
454	L	24.2	Very low	25.8	Very low	166 Å²	166	144.8 Å²	144.8	87%	0.869	82%	0.818	S	S	*	*			trans	81.5	127	143.3	-69.4	158.8	0	0	0	121.9
455	V	23.8	Very low	25.5	Very low	130 Å²	130	147.7 Å²	147.7	79%	0.788	82%	0.819	S	S	*	*			trans	-92.2	139.3	-176	171.5	0	0	0	0	109.4
456	S	26.2	Very low	25.4	Very low	124 Å²	124	144.9 Å²	144.9	87%	0.867	81%	0.814	S	S	*	*				-163.5	136.4	126.8	48.8	0	0	0	0	111
457	S	25	Very low	25.6	Very low	102 Å²	102	145.4 Å²	145.4	71%	0.713	82%	0.818	S	S	*	*			trans	-102.5	145.9	-161.9	36.9	0	0	0	0	111.7
458	S	25.8	Very low	25.6	Very low	114 Å²	114	142.1 Å²	142.1	80%	0.797	82%	0.815	S	S	*	*			trans	-165.7	108.1	133.3	8.8	0	0	0	0	111.6
459	E	24.5	Very low	25.7	Very low	181 Å²	181	140.2 Å²	140.2	85%	0.846	81%	0.808	S	S	*	*			trans	65.3	79.4	139.8	-56.1	-170.8	158.7	0	0	119.4
460	Q	26.1	Very low	26.2	Very low	190 Å²	190	142.4 Å²	142.4	89%	0.888	81%	0.809	S	S	*	*			trans	-100.5	117.6	146.2	-73.4	-178.3	-13.9	0	0	108.4	N462	Q460-N462 PolarHBondContact O-N 2.6Å
461	H	25.8	Very low	26.5	Very low	186 Å²	186	142 Å²	142	86%	0.861	81%	0.805	S	S	*	*			trans	-63.2	105.4	170.3	-91.9	-86.8	0	0	0	109.5	L463	H461-L463 PolarHBondContact O-N 2.78Å
462	N	23.9	Very low	26.9	Very low	150 Å²	150	142.9 Å²	142.9	80%	0.802	81%	0.812	S	S	*	*			trans	-74	112.7	172.6	-118.6	-13.3	0	0	0	108.9	Q460 Q464	Q460-N462 PolarHBondContact O-N 2.6Å; N462-Q464 PolarHBondContact O-N 2.87Å
463	L	26.2	Very low	27.6	Very low	163 Å²	163	142.1 Å²	142.1	85%	0.853	81%	0.812	S	S	*	*			trans	-86.1	97.3	161.9	-81.4	162.9	0	0	0	107.7	H461 I465	H461-L463 PolarHBondContact O-N 2.78Å; L463-I465 PolarHBondContact O-N 3.2Å
464	Q	23.5	Very low	28.8	Very low	179 Å²	179	139.1 Å²	139.1	84%	0.836	79%	0.792	S	S	*	*			trans	-66.1	112.3	165.1	-97.3	171.9	-40.1	0	0	108.8	N462	N462-Q464 PolarHBondContact O-N 2.87Å
465	I	27.5	Very low	30.3	Very low	157 Å²	157	135.5 Å²	135.5	81%	0.805	78%	0.778	S	S	*	*			trans	-86.9	107.3	165.8	-62.6	174.6	0	0	0	106.7	L463 S467	L463-I465 PolarHBondContact O-N 3.2Å; I465-S467 PolarHBondContact O-N 3.26Å
466	T	24.7	Very low	32.3	Very low	127 Å²	127	129.7 Å²	129.7	78%	0.779	74%	0.742	S	S	*	*			trans	-71.2	116.5	167.6	40.9	0	0	0	0	108.9	S468	T466-S468 PolarHBondContact O-N 3.23Å
467	S	31.5	Very low	34.3	Very low	116 Å²	116	126.9 Å²	126.9	81%	0.811	72%	0.722	S	S	*	*			trans	-73.7	113.4	177.2	54.1	0	0	0	0	110.9	I465	I465-S467 PolarHBondContact O-N 3.26Å
468	S	28.5	Very low	37.2	Very low	110 Å²	110	122.5 Å²	122.5	77%	0.769	69%	0.691	S	S	*	*			trans	-153.8	93.6	157.2	55.5	0	0	0	0	111.1	T466	T466-S468 PolarHBondContact O-N 3.23Å
469	S	28.5	Very low	40.3	Very low	106 Å²	106	117.9 Å²	117.9	74%	0.741	66%	0.658	S	S	*	*			trans	165.5	123.7	139.9	49.2	0	0	0	0	107.7	Q471	S469-Q471 PolarHBondContact O-N 2.76Å
470	S	34	Very low	43.5	Very low	129 Å²	129	116.6 Å²	116.6	90%	0.902	65%	0.645	S	S	*	*			trans	-62.9	93.1	174.5	42.4	0	0	0	0	110.3
471	Q	32.1	Very low	46.6	Very low	164 Å²	164	111.9 Å²	111.9	77%	0.766	62%	0.623	S	S	*	*			trans	-98	120.3	153.9	-76.5	-173.6	-17.9	0	0	106.9	S469 A473	S469-Q471 PolarHBondContact O-N 2.76Å; Q471-A473 PolarHBondContact O-N 2.76Å
472	E	36	Very low	49.6	Very low	196 Å²	196	107.7 Å²	107.7	92%	0.916	60%	0.604	S	S	*	*			trans	-48.7	124.9	171.6	-71	176.8	155.1	0	0	109	S474	E472-S474 PolarHBondContact O-N 3.32Å
473	A	38.8	Very low	52.7	Low	89 Å²	89	102.2 Å²	102.2	74%	0.736	58%	0.579	S	S	*	*			trans	-63.6	102	178.1	0	0	0	0	0	108.5	Q471 T475	Q471-A473 PolarHBondContact O-N 2.76Å; A473-T475 PolarHBondContact O-N 3.04Å; A473-T475 PolarHBondContact O-OG1 2.79Å
474	S	47.5	Very low	55.6	Low	42 Å²	42	96.9 Å²	96.9	29%	0.294	55%	0.553	S	S	.	*			trans	-54.8	109.2	175.4	56.6	0	0	0	0	108.8	E472 F476	E472-S474 PolarHBondContact O-N 3.32Å; S474-F476 WeakPolarHBondContact O-CE2 3.47Å; S474-F476 WeakPolarHBondContact OG-CZ 3.47Å
475	T	57.2	Low	58.6	Low	91 Å²	91	91.1 Å²	91.1	56%	0.558	53%	0.528	S	S	*	.			trans	-93.8	113.7	-174.8	-53.1	0	0	0	0	108.2	T434 A473 S477	T434-T475 HydrophobicContact CG2-CG2 3.69Å; A473-T475 PolarHBondContact O-N 3.04Å; A473-T475 PolarHBondContact O-OG1 2.79Å; T475-S477 VanDerWaalsContact C-N 3.34Å; T475-S477 PolarHBondContact O-N 3.21Å; T475-S477 VanDerWaalsContact O-N 3.15Å
476	F	65.5	Low	61.3	Low	7 Å²	7	91.4 Å²	91.4	3%	0.031	52%	0.519	C	S	.	.			trans	-84.5	63	-178.7	-48.7	-77.4	0	0	0	112.2	P399 L402 E406 L430 L431 T434 S474	P399-F476 HydrophobicContact CB-CE2 4.23Å; P399-F476 HydrophobicContact CB-CZ 3.85Å; P399-F476 VanDerWaalsContact O-CE1 3.25Å; P399-F476 WeakPolarHBondContact O-CE1 3.36Å; P399-F476 WeakPolarHBondContact O-CZ 3.29Å; L402-F476 HydrophobicContact CB-CD1 4.15Å; L402-F476 HydrophobicContact CB-CE1 3.66Å; L402-F476 HydrophobicContact CB-CZ 4.19Å; E406-F476 WeakPolarHBondContact OE2-CA 3.19Å; E406-F476 WeakPolarHBondContact OE2-CD1 3.22Å; L430-F476 HydrophobicContact CB-CD2 4.3Å; L430-F476 HydrophobicContact CB-CE2 4.21Å; L431-F476 HydrophobicContact CD2-CB 3.84Å; T434-F476 HydrophobicContact CG2-CB 4.22Å; T434-F476 HydrophobicContact CG2-CD2 4.28Å; T434-F476 VanDerWaalsContact CG2-N 3.26Å; S474-F476 WeakPolarHBondContact O-CE2 3.47Å; S474-F476 WeakPolarHBondContact OG-CZ 3.47Å
477	S	67.6	Low	64	Low	65 Å²	65	85.4 Å²	85.4	46%	0.455	48%	0.482	S	S	.	.			trans	-77.6	-27	-174.6	50.3	0	0	0	0	113.9	T475 D504	T475-S477 VanDerWaalsContact C-N 3.34Å; T475-S477 PolarHBondContact O-N 3.21Å; T475-S477 VanDerWaalsContact O-N 3.15Å; S477-D504 WeakPolarHBondContact CB-OD1 3.39Å; S477-D504 PolarHBondContact OG-OD1 3.44Å
478	S	86.7	Confident	66.1	Low	10 Å²	10	81 Å²	81	7%	0.07	45%	0.452	C	S	.	.	S	Bend	trans	-88.6	-12.2	-168.9	-35.9	0	0	0	0	113.8	E406 R480 K501 T502 D504	E406-S478 WeakPolarHBondContact OE1-CA 3.47Å; E406-S478 WeakPolarHBondContact OE1-CB 3.49Å; E406-S478 PolarHBondContact OE1-N 3.5Å; E406-S478 VanDerWaalsContact OE1-N 3.11Å; E406-S478 PolarHBondContact OE1-OG 3.16Å; S478-R480 PolarHBondContact O-N 3.43Å; S478-K501 CarbonylContact O-C 3.58Å; S478-K501 WeakPolarHBondContact O-CA 3.17Å; S478-T502 WeakPolarHBondContact CB-O 3.24Å; S478-T502 PolarHBondContact O-N 3.42Å; S478-T502 PolarHBondContact O-OG1 3.48Å; S478-D504 WeakPolarHBondContact CA-OD1 3.49Å; S478-D504 WeakPolarHBondContact CB-OD1 3.3Å; S478-D504 PolarHBondContact N-OD1 2.95Å; S478-D504 PolarHBondContact OG-OD1 3.02Å; S478-D504 PolarHBondContact OG-OD2 3.02Å
479	L	91.1	Very high	68.1	Low	17 Å²	17	77.4 Å²	77.4	9%	0.089	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	103.5	-178.5	-70.3	177.1	0	0	0	112.8	E406 L409 L415 Y499 K501	E406-L479 HydrophobicContact CB-CD1 4.12Å; E406-L479 HydrophobicContact CB-CG 4.33Å; E406-L479 HydrophobicContact CG-CD1 4.33Å; E406-L479 HydrophobicContact CG-CD2 4.4Å; E406-L479 HydrophobicContact CG-CG 4.02Å; E406-L479 PolarHBondContact OE1-N 2.92Å; L409-L479 HydrophobicContact CD2-CD2 4.34Å; L415-L479 HydrophobicContact CB-CD2 4.4Å; L415-L479 HydrophobicContact CD2-CD1 3.71Å; L415-L479 HydrophobicContact CD2-CD2 4.36Å; L479-Y499 HydrophobicContact CB-CD1 4.2Å; L479-Y499 HydrophobicContact CB-CG 4.44Å; L479-K501 HydrophobicContact CD2-CB 4.24Å
480	R	90.7	Very high	70.1	Confident	155 Å²	155	75 Å²	75	59%	0.585	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.4	121.5	174.5	-172	177.7	-67.1	-176.1	-0.1	111.6	S478 Y499 I500 T502	S478-R480 PolarHBondContact O-N 3.43Å; R480-Y499 CarbonylContact O-C 3.33Å; R480-Y499 VanDerWaalsContact O-CA 3.25Å; R480-Y499 WeakPolarHBondContact O-CA 3.3Å; R480-I500 PolarHBondContact N-O 2.93Å; R480-I500 PolarHBondContact O-N 3.1Å; R480-T502 HydrophobicContact CB-CG2 4Å
481	H	91.3	Very high	71.5	Confident	91 Å²	91	76.1 Å²	76.1	42%	0.421	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	137.1	174.6	-178.9	-101.3	0	0	0	111.7	A483 T484 Y499	H481-A483 VanDerWaalsContact NE2-C 3.26Å; H481-A483 PolarHBondContact NE2-O 2.98Å; H481-T484 PolarHBondContact NE2-OG1 3.13Å; H481-Y499 VanDerWaalsContact CA-CD1 3.44Å; H481-Y499 HydrophobicContact CB-CD1 4Å; H481-Y499 HydrophobicContact CB-CE1 3.69Å; H481-Y499 AromaticContact CD2-CE1 3.8Å; H481-Y499 AromaticContact CD2-CZ 3.87Å
482	Q	89.4	Confident	73.3	Confident	98 Å²	98	70.9 Å²	70.9	46%	0.458	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	-47	176.7	-68.3	-65.5	-52.6	0	0	112.1	K498 I500	Q482-K498 HydrophobicContact CB-CB 4.35Å; Q482-K498 HydrophobicContact CB-CD 4.42Å; Q482-K498 HydrophobicContact CB-CG 4.08Å; Q482-K498 WeakPolarHBondContact CB-O 3.44Å; Q482-K498 PolarHBondContact N-O 2.96Å; Q482-I500 HydrophobicContact CG-CB 4.35Å; Q482-I500 HydrophobicContact CG-CD1 3.67Å; Q482-I500 HydrophobicContact CG-CG1 3.72Å
483	A	88.1	Confident	75.3	Confident	35 Å²	35	64 Å²	64	29%	0.289	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	150	-175.8	0	0	0	0	0	111.5	H481 H497 K498	H481-A483 VanDerWaalsContact NE2-C 3.26Å; H481-A483 PolarHBondContact NE2-O 2.98Å; A483-H497 WeakPolarHBondContact O-CA 3.33Å; A483-K498 HydrophobicContact CB-CB 4.45Å; A483-K498 PolarHBondContact N-O 2.96Å; A483-K498 PolarHBondContact O-N 3.21Å
484	T	88.4	Confident	77.4	Confident	50 Å²	50	59.8 Å²	59.8	31%	0.307	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	125.9	165	-60.6	0	0	0	0	108.7	H481 L495 I496 H497	H481-T484 PolarHBondContact NE2-OG1 3.13Å; T484-L495 HydrophobicContact CG2-CB 4.25Å; T484-L495 HydrophobicContact CG2-CD2 3.76Å; T484-I496 CarbonylContact C-O 3.54Å; T484-I496 VanDerWaalsContact CA-O 3.3Å; T484-I496 WeakPolarHBondContact CA-O 3.29Å; T484-H497 VanDerWaalsContact CG2-CE1 3.49Å; T484-H497 WeakPolarHBondContact CG2-CE1 3.39Å; T484-H497 PolarHBondContact OG1-CE1 2.89Å; T484-H497 PolarHBondContact OG1-ND1 3.2Å
485	L	85.2	Confident	79.4	Confident	58 Å²	58	59 Å²	59	30%	0.304	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	123.2	-178.8	-66.7	146	0	0	0	108.7	F29 L495 I496	F29-L485 HydrophobicContact CE2-CD2 4.08Å; F29-L485 HydrophobicContact CZ-CD1 3.75Å; F29-L485 HydrophobicContact CZ-CD2 3.84Å; F29-L485 HydrophobicContact CZ-CG 4.33Å; L485-L495 CarbonylContact O-C 3.53Å; L485-L495 WeakPolarHBondContact O-CA 3.38Å; L485-I496 HydrophobicContact CB-CB 4.34Å; L485-I496 PolarHBondContact N-O 3.14Å; L485-I496 PolarHBondContact O-N 2.92Å
486	R	85.5	Confident	80.8	Confident	164 Å²	164	54.7 Å²	54.7	62%	0.619	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	130.6	173	-172.3	178.4	-174.9	172.1	2.1	109	D493	R486-D493 IonicContact CZ-OD2 2.6Å; R486-D493 IonicContact NE-OD2 2.95Å; R486-D493 PolarHBondContact NE-OD2 2.96Å; R486-D493 IonicContact NH2-OD2 2.78Å; R486-D493 PolarHBondContact NH2-OD2 3.39Å
487	V	79.8	Confident	82	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.006	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	140.3	-174.1	-58.3	0	0	0	0	109.5	N24 I294 L418 L489 G494 I496	N24-V487 CarbonylContact O-C 3.57Å; N24-V487 WeakPolarHBondContact O-CA 3.41Å; I294-V487 HydrophobicContact CD1-CB 3.69Å; I294-V487 HydrophobicContact CD1-CG1 3.45Å; I294-V487 VanDerWaalsContact CD1-CG1 3.45Å; I294-V487 HydrophobicContact CD1-CG2 4.07Å; L418-V487 HydrophobicContact CD1-CG2 3.91Å; V487-L489 HydrophobicContact CG2-CD2 3.89Å; V487-G494 PolarHBondContact N-O 3.34Å; V487-G494 PolarHBondContact O-N 3.04Å; V487-I496 HydrophobicContact CG1-CD1 3.96Å; V487-I496 HydrophobicContact CG1-CG1 4.42Å; V487-I496 HydrophobicContact CG2-CD1 4.12Å; V487-I496 HydrophobicContact CG2-CG1 4.13Å
488	S	77.4	Confident	83	Confident	24 Å²	24	53 Å²	53	17%	0.168	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	130.7	173	175.2	0	0	0	0	110.6	N24 G490	N24-S488 PolarHBondContact O-N 2.92Å; S488-G490 PolarHBondContact OG-N 2.96Å; S488-G490 PolarHBondContact OG-O 3.02Å; S488-G490 VanDerWaalsContact OG-O 3.14Å
489	L	70.4	Confident	83.3	Confident	33 Å²	33	52.9 Å²	52.9	17%	0.173	28%	0.276	C	S	.	.			trans	-105.4	30.8	174.9	-45.1	-176.2	0	0	0	110.7	L289 S291 F384 L418 V487 I492	L289-L489 HydrophobicContact CD2-CD1 4.38Å; S291-L489 WeakPolarHBondContact OG-CD2 3.34Å; F384-L489 HydrophobicContact CD2-CD1 4.46Å; F384-L489 HydrophobicContact CE2-CD1 3.3Å; F384-L489 HydrophobicContact CZ-CD1 3.39Å; L418-L489 HydrophobicContact CD2-CD1 4.08Å; V487-L489 HydrophobicContact CG2-CD2 3.89Å; L489-I492 HydrophobicContact CB-CD1 4.49Å; L489-I492 HydrophobicContact CB-CG1 3.84Å; L489-I492 HydrophobicContact CD1-CD1 4.33Å; L489-I492 HydrophobicContact CD1-CG1 4.3Å; L489-I492 HydrophobicContact CG-CG1 4.43Å; L489-I492 PolarHBondContact N-O 3.29Å
490	G	69.6	Low	83.3	Confident	57 Å²	57	54.2 Å²	54.2	59%	0.588	28%	0.283	S	S	*	.	S	Bend	trans	91.6	-109.7	-167.3	0	0	0	0	0	110.9	S488 I492	S488-G490 PolarHBondContact OG-N 2.96Å; S488-G490 PolarHBondContact OG-O 3.02Å; S488-G490 VanDerWaalsContact OG-O 3.14Å; G490-I492 VanDerWaalsContact C-N 3.33Å
491	V	63.1	Low	83.4	Confident	151 Å²	151	48.1 Å²	48.1	92%	0.915	26%	0.261	S	S	*	.	S	Bend	trans	-77.4	-21.1	-174.7	-171.5	0	0	0	0	112.7
492	I	69.2	Low	83.4	Confident	55 Å²	55	45.5 Å²	45.5	28%	0.282	25%	0.251	S	S	.	.	S	Bend	trans	-113.6	145.4	-178.7	64.7	-179.1	0	0	0	110.5	F384 L489 G490	F384-I492 HydrophobicContact CD2-CD1 3.46Å; F384-I492 VanDerWaalsContact CD2-CD1 3.46Å; F384-I492 HydrophobicContact CE2-CD1 3.81Å; F384-I492 HydrophobicContact CG-CD1 4.29Å; L489-I492 HydrophobicContact CB-CD1 4.49Å; L489-I492 HydrophobicContact CB-CG1 3.84Å; L489-I492 HydrophobicContact CD1-CD1 4.33Å; L489-I492 HydrophobicContact CD1-CG1 4.3Å; L489-I492 HydrophobicContact CG-CG1 4.43Å; L489-I492 PolarHBondContact N-O 3.29Å; G490-I492 VanDerWaalsContact C-N 3.33Å
493	D	78.3	Confident	83.2	Confident	51 Å²	51	47.3 Å²	47.3	27%	0.273	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	143.5	166.5	-69	-34.7	0	0	0	110.1	P421 R486	P421-D493 WeakPolarHBondContact CD-O 3.48Å; P421-D493 HydrophobicContact CG-CB 4.41Å; R486-D493 IonicContact CZ-OD2 2.6Å; R486-D493 IonicContact NE-OD2 2.95Å; R486-D493 PolarHBondContact NE-OD2 2.96Å; R486-D493 IonicContact NH2-OD2 2.78Å; R486-D493 PolarHBondContact NH2-OD2 3.39Å
494	G	84.5	Confident	82.1	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	158.2	167.2	0	0	0	0	0	110.7	L419 V487	L419-G494 CarbonylContact O-C 3.53Å; L419-G494 WeakPolarHBondContact O-CA 3.35Å; V487-G494 PolarHBondContact N-O 3.34Å; V487-G494 PolarHBondContact O-N 3.04Å
495	L	87.8	Confident	81.8	Confident	26 Å²	26	54 Å²	54	14%	0.136	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	121.8	171.4	-65.1	97.5	0	0	0	109.1	L418 L419 P421 T484 L485	L418-L495 WeakPolarHBondContact CA-O 3.09Å; L419-L495 PolarHBondContact N-O 3.24Å; L419-L495 PolarHBondContact O-N 2.79Å; P421-L495 HydrophobicContact CB-CD1 4.14Å; P421-L495 HydrophobicContact CG-CD1 3.95Å; T484-L495 HydrophobicContact CG2-CB 4.25Å; T484-L495 HydrophobicContact CG2-CD2 3.76Å; L485-L495 CarbonylContact O-C 3.53Å; L485-L495 WeakPolarHBondContact O-CA 3.38Å
496	I	87.9	Confident	81.6	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	121.2	171.7	-61.7	174.7	0	0	0	107.2	I294 V416 V417 L418 T484 L485 V487	I294-I496 HydrophobicContact CB-CD1 3.42Å; I294-I496 VanDerWaalsContact CB-CD1 3.42Å; I294-I496 HydrophobicContact CD1-CD1 3.88Å; I294-I496 HydrophobicContact CG1-CD1 4.28Å; I294-I496 HydrophobicContact CG2-CD1 3.3Å; V416-I496 HydrophobicContact CG1-CG2 3.45Å; V416-I496 VanDerWaalsContact CG1-CG2 3.45Å; V417-I496 CarbonylContact O-C 3.42Å; V417-I496 WeakPolarHBondContact O-CA 3.25Å; L418-I496 HydrophobicContact CB-CG1 4.31Å; L418-I496 HydrophobicContact CD1-CD1 4.43Å; L418-I496 HydrophobicContact CD1-CG1 3.54Å; L418-I496 HydrophobicContact CG-CG1 4.49Å; T484-I496 CarbonylContact C-O 3.54Å; T484-I496 VanDerWaalsContact CA-O 3.3Å; T484-I496 WeakPolarHBondContact CA-O 3.29Å; L485-I496 HydrophobicContact CB-CB 4.34Å; L485-I496 PolarHBondContact N-O 3.14Å; L485-I496 PolarHBondContact O-N 2.92Å; V487-I496 HydrophobicContact CG1-CD1 3.96Å; V487-I496 HydrophobicContact CG1-CG1 4.42Å; V487-I496 HydrophobicContact CG2-CD1 4.12Å; V487-I496 HydrophobicContact CG2-CG1 4.13Å
497	H	89.4	Confident	81.4	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	135.9	172.6	-61.7	-96.8	0	0	0	109.7	V416 V417 S424 L427 A483 T484 Y499	V416-H497 VanDerWaalsContact CA-O 3.3Å; V416-H497 WeakPolarHBondContact CA-O 3.25Å; V417-H497 HydrophobicContact CG2-CB 4.02Å; V417-H497 PolarHBondContact N-O 3.09Å; V417-H497 PolarHBondContact O-N 3.36Å; S424-H497 WeakPolarHBondContact CB-NE2 3.41Å; S424-H497 PolarHBondContact OG-CE1 2.76Å; S424-H497 PolarHBondContact OG-NE2 3Å; L427-H497 HydrophobicContact CD2-CB 4.27Å; A483-H497 WeakPolarHBondContact O-CA 3.33Å; T484-H497 VanDerWaalsContact CG2-CE1 3.49Å; T484-H497 WeakPolarHBondContact CG2-CE1 3.39Å; T484-H497 PolarHBondContact OG1-CE1 2.89Å; T484-H497 PolarHBondContact OG1-ND1 3.2Å; H497-Y499 HydrophobicContact CB-CD2 4.2Å; H497-Y499 HydrophobicContact CB-CE2 3.39Å
498	K	89.9	Confident	81.5	Confident	38 Å²	38	50.4 Å²	50.4	17%	0.165	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	129.4	174.6	-179.1	174.3	178.3	169.8	0	109.4	S298 T414 L415 V416 Q482 A483	S298-K498 PolarHBondContact O-NZ 2.98Å; T414-K498 HydrophobicContact CG2-CD 4.47Å; T414-K498 HydrophobicContact CG2-CG 3.98Å; L415-K498 WeakPolarHBondContact O-CA 3.32Å; V416-K498 HydrophobicContact CG2-CB 4.15Å; V416-K498 HydrophobicContact CG2-CD 4.49Å; V416-K498 HydrophobicContact CG2-CG 3.95Å; Q482-K498 HydrophobicContact CB-CB 4.35Å; Q482-K498 HydrophobicContact CB-CD 4.42Å; Q482-K498 HydrophobicContact CB-CG 4.08Å; Q482-K498 WeakPolarHBondContact CB-O 3.44Å; Q482-K498 PolarHBondContact N-O 2.96Å; A483-K498 HydrophobicContact CB-CB 4.45Å; A483-K498 PolarHBondContact N-O 2.96Å; A483-K498 PolarHBondContact O-N 3.21Å
499	Y	91.4	Very high	81.7	Confident	6 Å²	6	52.1 Å²	52.1	2%	0.024	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	152.3	175.1	-59.7	-95.3	0	0	0	110.3	T414 L415 L427 L431 L479 R480 H481 H497	T414-Y499 WeakPolarHBondContact CA-O 3.37Å; T414-Y499 WeakPolarHBondContact CG2-O 3.25Å; L415-Y499 HydrophobicContact CD2-CD2 4.36Å; L415-Y499 PolarHBondContact N-O 3.3Å; L415-Y499 PolarHBondContact O-N 3.16Å; L427-Y499 HydrophobicContact CD2-CE2 3.84Å; L427-Y499 VanDerWaalsContact CD2-OH 3.28Å; L427-Y499 WeakPolarHBondContact CD2-OH 3.34Å; L431-Y499 HydrophobicContact CD1-CD1 4.35Å; L431-Y499 HydrophobicContact CD1-CE1 3.33Å; L431-Y499 WeakPolarHBondContact CD1-OH 3.39Å; L479-Y499 HydrophobicContact CB-CD1 4.2Å; L479-Y499 HydrophobicContact CB-CG 4.44Å; R480-Y499 CarbonylContact O-C 3.33Å; R480-Y499 VanDerWaalsContact O-CA 3.25Å; R480-Y499 WeakPolarHBondContact O-CA 3.3Å; H481-Y499 VanDerWaalsContact CA-CD1 3.44Å; H481-Y499 HydrophobicContact CB-CD1 4Å; H481-Y499 HydrophobicContact CB-CE1 3.69Å; H481-Y499 AromaticContact CD2-CE1 3.8Å; H481-Y499 AromaticContact CD2-CZ 3.87Å; H497-Y499 HydrophobicContact CB-CD2 4.2Å; H497-Y499 HydrophobicContact CB-CE2 3.39Å
500	I	92	Very high	82.5	Confident	45 Å²	45	53.3 Å²	53.3	23%	0.231	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	133.3	168.3	-67.4	171	0	0	0	107.4	G413 R480 Q482 T502	G413-I500 WeakPolarHBondContact O-CA 3.3Å; R480-I500 PolarHBondContact N-O 2.93Å; R480-I500 PolarHBondContact O-N 3.1Å; Q482-I500 HydrophobicContact CG-CB 4.35Å; Q482-I500 HydrophobicContact CG-CD1 3.67Å; Q482-I500 HydrophobicContact CG-CG1 3.72Å; I500-T502 PolarHBondContact O-N 3.4Å
501	K	92.9	Very high	83.4	Confident	27 Å²	27	53.1 Å²	53.1	12%	0.117	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	122.3	172.4	-173.3	171	179.5	176.8	0	109.7	E406 L409 G412 G413 S478 L479	E406-K501 HydrophobicContact CG-CD 4.43Å; E406-K501 PolarHBondContact O-NZ 3.42Å; L409-K501 HydrophobicContact CB-CD 4.14Å; L409-K501 HydrophobicContact CD2-CB 3.97Å; L409-K501 HydrophobicContact CG-CB 4.31Å; L409-K501 HydrophobicContact CG-CD 4.46Å; L409-K501 WeakPolarHBondContact O-CD 3.48Å; L409-K501 WeakPolarHBondContact O-CE 3.48Å; L409-K501 PolarHBondContact O-NZ 3.31Å; G412-K501 WeakPolarHBondContact CA-O 3.28Å; G412-K501 PolarHBondContact N-O 3.35Å; G413-K501 PolarHBondContact O-N 3.17Å; S478-K501 CarbonylContact O-C 3.58Å; S478-K501 WeakPolarHBondContact O-CA 3.17Å; L479-K501 HydrophobicContact CD2-CB 4.24Å
502	T	91.6	Very high	85	Confident	36 Å²	36	45.5 Å²	45.5	22%	0.221	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-101.5	171.2	174.3	57.3	0	0	0	0	110.5	S478 R480 I500	S478-T502 WeakPolarHBondContact CB-O 3.24Å; S478-T502 PolarHBondContact O-N 3.42Å; S478-T502 PolarHBondContact O-OG1 3.48Å; R480-T502 HydrophobicContact CB-CG2 4Å; I500-T502 PolarHBondContact O-N 3.4Å
503	L	84.6	Confident	86.3	Confident	137 Å²	137	44.8 Å²	44.8	72%	0.717	23%	0.233	S	C	*	.	P	Polyproline II helix	trans	-67.5	141.5	159.8	-65.8	165.7	0	0	0	107.3	V411	V411-L503 HydrophobicContact CB-CD2 4.42Å; V411-L503 HydrophobicContact CG1-CD2 3.96Å; V411-L503 HydrophobicContact CG1-CG 3.81Å; V411-L503 HydrophobicContact CG2-CD2 3.74Å; V411-L503 HydrophobicContact CG2-CG 4.41Å
504	D	65.4	Low	87	Confident	171 Å²	171	44.2 Å²	44.2	91%	0.914	23%	0.23	S	C	*	.			trans	-61.5	0	171.4	-72.5	-42.3	0	0	0	111.9	S477 S478	S477-D504 WeakPolarHBondContact CB-OD1 3.39Å; S477-D504 PolarHBondContact OG-OD1 3.44Å; S478-D504 WeakPolarHBondContact CA-OD1 3.49Å; S478-D504 WeakPolarHBondContact CB-OD1 3.3Å; S478-D504 PolarHBondContact N-OD1 2.95Å; S478-D504 PolarHBondContact OG-OD1 3.02Å; S478-D504 PolarHBondContact OG-OD2 3.02Å

Retrieved 504 of 504 residues in 992.9 ms (Link to these results)

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