A0A087XP06_POEFO Loading...

Glycogen synthase kinase-3 beta

AlphaFold DB , UniProt , Accession A0A087XP06, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 421 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	28.3	Very low	41.1	Very low	240 Å²	240	102.8 Å²	102.8	100%	1.182	57%	0.571	S	S	*	*				0	124.1	0	-76.5	-175.1	176.5	0	0	109.1
2	S	28.3	Very low	40.8	Very low	117 Å²	117	108.3 Å²	108.3	82%	0.818	59%	0.589	S	S	*	*			trans	33.2	91.6	177.8	58	0	0	0	0	119	R4	S2-R4 VanDerWaalsContact C-N 3.3Å; S2-R4 PolarHBondContact O-N 3.13Å
3	G	29.1	Very low	40.5	Very low	86 Å²	86	109.5 Å²	109.5	89%	0.887	61%	0.61	S	S	*	*			trans	-75.8	64.3	171.6	0	0	0	0	0	114.4
4	R	32.3	Very low	40	Very low	222 Å²	222	109.2 Å²	109.2	84%	0.838	62%	0.617	S	S	*	*			trans	-76	128.9	157.3	-84.4	-172.1	178.8	-176.7	0.7	108.3	S2 R6	S2-R4 VanDerWaalsContact C-N 3.3Å; S2-R4 PolarHBondContact O-N 3.13Å; R4-R6 PolarHBondContact O-N 3.22Å
5	P	36.7	Very low	39.6	Very low	82 Å²	82	115 Å²	115	53%	0.532	63%	0.633	S	S	.	*			trans	-58.4	132.4	173.4	20.7	-27.7	0	0	0	108.8	T7	P5-T7 HydrophobicContact CB-CG2 3.92Å; P5-T7 HydrophobicContact CG-CG2 3.91Å; P5-T7 PolarHBondContact O-N 3.12Å
6	R	53.6	Low	39.2	Very low	83 Å²	83	115.5 Å²	115.5	31%	0.313	64%	0.643	S	S	.	*			trans	-70.8	83.5	170.1	-62.9	178.1	-161.2	-166.5	1.3	106.5	R4 T8 F67 D181 S219	R4-R6 PolarHBondContact O-N 3.22Å; R6-T8 PolarHBondContact O-N 2.87Å; R6-F67 HydrophobicContact CB-CE1 4.45Å; R6-F67 HydrophobicContact CB-CZ 3.88Å; R6-F67 WeakPolarHBondContact O-CE1 3.45Å; R6-D181 IonicContact NH1-OD1 2.99Å; R6-D181 PolarHBondContact NH1-OD1 3.39Å; R6-D181 IonicContact NH1-OD2 3.15Å; R6-S219 PolarHBondContact NH1-OG 3.44Å
7	T	49.2	Very low	39.3	Very low	46 Å²	46	115.6 Å²	115.6	28%	0.282	65%	0.648	S	S	.	*			trans	-77.6	126.9	-171	46.8	0	0	0	0	110.2	P5 F93	P5-T7 HydrophobicContact CB-CG2 3.92Å; P5-T7 HydrophobicContact CG-CG2 3.91Å; P5-T7 PolarHBondContact O-N 3.12Å; T7-F93 HydrophobicContact CG2-CD1 4.18Å; T7-F93 HydrophobicContact CG2-CE1 3.34Å; T7-F93 HydrophobicContact CG2-CE2 4.22Å; T7-F93 HydrophobicContact CG2-CZ 3.37Å
8	T	55	Low	39.2	Very low	20 Å²	20	115.6 Å²	115.6	12%	0.123	65%	0.653	C	S	.	*			trans	-61.6	133.7	157.1	53.8	0	0	0	0	107.6	R6 F93 G202	R6-T8 PolarHBondContact O-N 2.87Å; T8-F93 WeakPolarHBondContact O-CD1 3.22Å; T8-G202 WeakPolarHBondContact CG2-O 3.38Å
9	S	50.3	Low	39.4	Very low	29 Å²	29	116.6 Å²	116.6	20%	0.203	65%	0.652	C	S	.	*			trans	-18.7	134.1	175.6	-12.8	0	0	0	0	115.1
10	F	48.2	Very low	39.9	Very low	156 Å²	156	114.8 Å²	114.8	68%	0.684	65%	0.645	S	S	*	*			trans	-52.9	146.4	174.8	-73.6	-82	0	0	0	111.5	E12 F93	F10-E12 PolarHBondContact O-N 2.93Å; F10-F93 HydrophobicContact CD1-CE1 4.38Å; F10-F93 HydrophobicContact CE1-CE1 4.29Å; F10-F93 HydrophobicContact CE1-CZ 4.41Å
11	A	41.5	Very low	39.9	Very low	50 Å²	50	115.6 Å²	115.6	41%	0.413	66%	0.658	S	S	.	*			trans	-66.9	103	178.2	0	0	0	0	0	110.7	K94	A11-K94 HydrophobicContact CB-CG 4.21Å
12	E	37.5	Very low	40.7	Very low	169 Å²	169	108 Å²	108	79%	0.79	63%	0.634	S	S	*	*			trans	-67.9	145.7	163	-79.1	177.4	171.9	0	0	110.8	F10 C14 K94	F10-E12 PolarHBondContact O-N 2.93Å; E12-C14 PolarHBondContact O-N 3.04Å; E12-K94 PolarHBondContact O-NZ 3.19Å
13	S	35.9	Very low	42	Very low	123 Å²	123	107.5 Å²	107.5	86%	0.86	62%	0.617	S	S	*	*	S	Bend	trans	-54.7	93.8	-173.1	41.1	0	0	0	0	112.6
14	C	34	Very low	43.3	Very low	106 Å²	106	105.1 Å²	105.1	72%	0.716	59%	0.592	S	S	*	*			trans	-144.6	145.4	163.4	-94.2	0	0	0	0	109	E12	E12-C14 PolarHBondContact O-N 3.04Å
15	K	34	Very low	45.1	Very low	196 Å²	196	98.4 Å²	98.4	85%	0.852	58%	0.58	S	S	*	*			trans	-41.5	140.8	-163.1	-67.3	179.6	178.1	178.7	0	114.5	V17	K15-V17 PolarHBondContact O-N 2.8Å
16	P	33.7	Very low	47.3	Very low	123 Å²	123	98.6 Å²	98.6	80%	0.799	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-57.7	133	178.7	22.9	-31.5	0	0	0	110.8
17	V	41.1	Very low	48.9	Very low	118 Å²	118	100.6 Å²	100.6	72%	0.715	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-63.1	129	167.9	-179.6	0	0	0	0	107.1	K15 Q19	K15-V17 PolarHBondContact O-N 2.8Å; V17-Q19 PolarHBondContact O-N 3.11Å
18	P	36.2	Very low	50.8	Low	114 Å²	114	102.6 Å²	102.6	74%	0.74	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-56.7	129.7	177.1	-19.5	29.6	0	0	0	109.8
19	Q	44.5	Very low	52.5	Low	136 Å²	136	104.4 Å²	104.4	64%	0.636	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-63.6	137.4	168.9	-74.6	-171.5	-24.5	0	0	108.8	V17 S21	V17-Q19 PolarHBondContact O-N 3.11Å; Q19-S21 PolarHBondContact O-N 3.35Å
20	P	49.2	Very low	54.2	Low	80 Å²	80	112.7 Å²	112.7	52%	0.519	64%	0.638	S	S	.	*	P	Polyproline II helix	trans	-56.8	127.7	168	-18	29.3	0	0	0	109	A22 Y117	P20-A22 PolarHBondContact O-N 3.42Å; P20-Y117 HydrophobicContact CG-CD2 4.43Å; P20-Y117 HydrophobicContact CG-CE2 4.29Å
21	S	40	Very low	55.8	Low	132 Å²	132	108.2 Å²	108.2	92%	0.923	62%	0.621	S	S	*	*	S	Bend	trans	-74.4	11	-170.4	46.6	0	0	0	0	115.3	Q19	Q19-S21 PolarHBondContact O-N 3.35Å
22	A	43.9	Very low	57.4	Low	80 Å²	80	116.1 Å²	116.1	66%	0.661	65%	0.646	S	S	*	*	S	Bend	trans	-156.6	118.6	170.6	0	0	0	0	0	109.5	P20 G24	P20-A22 PolarHBondContact O-N 3.42Å; A22-G24 PolarHBondContact O-N 3.32Å; A22-G24 VanDerWaalsContact O-N 3.17Å
23	F	56.8	Low	59.3	Low	106 Å²	106	115.1 Å²	115.1	47%	0.465	65%	0.646	S	S	.	*			trans	-66.7	112.6	163.4	-65.5	-78.1	0	0	0	107.1	S25 V126	F23-S25 PolarHBondContact O-N 3.42Å; F23-S25 VanDerWaalsContact O-N 3.15Å; F23-V126 HydrophobicContact CE1-CB 4.49Å; F23-V126 HydrophobicContact CE1-CG1 3.93Å; F23-V126 HydrophobicContact CE1-CG2 3.7Å; F23-V126 HydrophobicContact CZ-CG2 3.77Å
24	G	56.2	Low	61.3	Low	36 Å²	36	111 Å²	111	37%	0.371	62%	0.622	S	S	.	*	P	Polyproline II helix	trans	-55.3	121.6	170.6	0	0	0	0	0	108.8	A22 M26	A22-G24 PolarHBondContact O-N 3.32Å; A22-G24 VanDerWaalsContact O-N 3.17Å; G24-M26 PolarHBondContact O-N 3.28Å
25	S	68.6	Low	63.8	Low	82 Å²	82	108.1 Å²	108.1	57%	0.573	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-67.3	119.7	-179.5	48.9	0	0	0	0	109.4	F23 K27	F23-S25 PolarHBondContact O-N 3.42Å; F23-S25 VanDerWaalsContact O-N 3.15Å; S25-K27 PolarHBondContact O-N 3.49Å
26	M	83.1	Confident	66.5	Low	86 Å²	86	105.3 Å²	105.3	42%	0.424	59%	0.591	S	S	.	*	P	Polyproline II helix	trans	-69	118.2	169.2	-179.6	179.5	-72.8	0	0	107.9	G24 T38 V40 F116	G24-M26 PolarHBondContact O-N 3.28Å; M26-T38 HydrophobicContact CE-CG2 4.26Å; M26-T38 HydrophobicContact CG-CG2 3.6Å; M26-T38 HydrophobicContact SD-CG2 3.74Å; M26-V40 HydrophobicContact CB-CG1 4.22Å; M26-V40 HydrophobicContact CE-CG1 3.85Å; M26-V40 HydrophobicContact CG-CG1 3.95Å; M26-F116 HydrophobicContact CE-CE2 3.9Å
27	K	88.9	Confident	69.5	Low	125 Å²	125	100.1 Å²	100.1	54%	0.543	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.8	135.7	176.7	-65.8	177.4	-174.6	169.1	0	109	S25 T39	S25-K27 PolarHBondContact O-N 3.49Å; K27-T39 PolarHBondContact N-O 3.25Å; K27-T39 PolarHBondContact O-N 2.87Å
28	V	88	Confident	72.1	Confident	88 Å²	88	95 Å²	95	53%	0.533	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	124.6	174.7	177.8	0	0	0	0	108	K36 V37	V28-K36 HydrophobicContact CG1-CD 4.16Å; V28-K36 HydrophobicContact CG1-CG 3.73Å; V28-V37 WeakPolarHBondContact CA-O 3.39Å
29	S	90.6	Very high	75	Confident	58 Å²	58	90.7 Å²	90.7	41%	0.406	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	-179.4	175.5	61.4	0	0	0	0	110.4	V37	S29-V37 PolarHBondContact N-O 2.86Å; S29-V37 PolarHBondContact O-N 3.21Å
30	R	86.8	Confident	77.4	Confident	203 Å²	203	84.5 Å²	84.5	77%	0.766	47%	0.469	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.6	139.7	169.8	-65.4	-172.5	-177.1	-141.3	5.5	109	S35	R30-S35 VanDerWaalsContact CA-O 3.29Å; R30-S35 WeakPolarHBondContact CA-O 3.47Å
31	D	81.8	Confident	79.7	Confident	61 Å²	61	83.8 Å²	83.8	33%	0.326	46%	0.464	S	S	.	.			trans	-79	-176.4	170.3	68.3	14.2	0	0	0	111.7	D33 G34 S35 V37	D31-D33 PolarHBondContact O-N 2.88Å; D31-D33 PolarHBondContact OD1-N 3.03Å; D31-G34 PolarHBondContact O-N 2.65Å; D31-G34 PolarHBondContact OD1-N 3.39Å; D31-S35 PolarHBondContact N-O 2.91Å; D31-S35 WeakPolarHBondContact OD1-CA 3.48Å; D31-S35 WeakPolarHBondContact OD1-CB 3.5Å; D31-S35 PolarHBondContact OD1-N 3.13Å; D31-S35 WeakPolarHBondContact OD2-CB 3.47Å; D31-V37 HydrophobicContact CB-CG2 3.78Å
32	K	74.3	Confident	82.4	Confident	217 Å²	217	77.5 Å²	77.5	94%	0.943	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-25.9	-177.8	-64.6	-177.4	-179.3	178.4	0	113.2	G34	K32-G34 VanDerWaalsContact C-N 3.33Å
33	D	77.4	Confident	84.9	Confident	147 Å²	147	74.8 Å²	74.8	79%	0.786	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	3.9	179.5	-59	-37.3	0	0	0	111.8	D31 S35	D31-D33 PolarHBondContact O-N 2.88Å; D31-D33 PolarHBondContact OD1-N 3.03Å; D33-S35 VanDerWaalsContact C-N 3.31Å
34	G	78.9	Confident	86.8	Confident	36 Å²	36	70.9 Å²	70.9	37%	0.371	38%	0.38	S	S	.	.			trans	81.9	5.1	179.5	0	0	0	0	0	114.4	D31 K32	D31-G34 PolarHBondContact O-N 2.65Å; D31-G34 PolarHBondContact OD1-N 3.39Å; K32-G34 VanDerWaalsContact C-N 3.33Å
35	S	85	Confident	88.6	Confident	46 Å²	46	69.1 Å²	69.1	32%	0.322	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-71.7	140.5	178.4	-55.6	0	0	0	0	110.7	R30 D31 D33 V37	R30-S35 VanDerWaalsContact CA-O 3.29Å; R30-S35 WeakPolarHBondContact CA-O 3.47Å; D31-S35 PolarHBondContact N-O 2.91Å; D31-S35 WeakPolarHBondContact OD1-CA 3.48Å; D31-S35 WeakPolarHBondContact OD1-CB 3.5Å; D31-S35 PolarHBondContact OD1-N 3.13Å; D31-S35 WeakPolarHBondContact OD2-CB 3.47Å; D33-S35 VanDerWaalsContact C-N 3.31Å; S35-V37 PolarHBondContact O-N 2.87Å
36	K	92.6	Very high	89.8	Confident	137 Å²	137	67 Å²	67	60%	0.596	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.9	117.2	-179.5	-174.8	-174.1	179.9	-175.8	0	110.1	V28	V28-K36 HydrophobicContact CG1-CD 4.16Å; V28-K36 HydrophobicContact CG1-CG 3.73Å
37	V	95.6	Very high	90.1	Very high	14 Å²	14	65.4 Å²	65.4	9%	0.085	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	131.9	174.4	-177.3	0	0	0	0	109.1	V28 S29 D31 S35 T57	V28-V37 WeakPolarHBondContact CA-O 3.39Å; S29-V37 PolarHBondContact N-O 2.86Å; S29-V37 PolarHBondContact O-N 3.21Å; D31-V37 HydrophobicContact CB-CG2 3.78Å; S35-V37 PolarHBondContact O-N 2.87Å; V37-T57 HydrophobicContact CB-CG2 4.33Å; V37-T57 HydrophobicContact CG2-CG2 3.77Å
38	T	96	Very high	90.2	Very high	11 Å²	11	63.5 Å²	63.5	7%	0.067	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	122.5	172.7	-53.9	0	0	0	0	108.9	M26 V40 S55 Y56	M26-T38 HydrophobicContact CE-CG2 4.26Å; M26-T38 HydrophobicContact CG-CG2 3.6Å; M26-T38 HydrophobicContact SD-CG2 3.74Å; T38-V40 HydrophobicContact CG2-CG1 4.39Å; T38-S55 CarbonylContact O-C 3.56Å; T38-S55 WeakPolarHBondContact O-CA 3.49Å; T38-Y56 HydrophobicContact CG2-CE1 4.14Å; T38-Y56 HydrophobicContact CG2-CE2 4.03Å; T38-Y56 WeakPolarHBondContact CG2-OH 3.21Å; T38-Y56 PolarHBondContact N-O 3.07Å; T38-Y56 PolarHBondContact O-N 3.16Å
39	T	96.5	Very high	90.4	Very high	23 Å²	23	64.1 Å²	64.1	14%	0.141	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	131	177.9	-55.5	0	0	0	0	109.7	K27 E53 V54 S55	K27-T39 PolarHBondContact N-O 3.25Å; K27-T39 PolarHBondContact O-N 2.87Å; T39-E53 HydrophobicContact CG2-CB 4.44Å; T39-V54 WeakPolarHBondContact CA-O 3.26Å; T39-S55 WeakPolarHBondContact CG2-OG 3.49Å; T39-S55 PolarHBondContact OG1-OG 3.37Å
40	V	96.3	Very high	90.5	Very high	6 Å²	6	70.5 Å²	70.5	4%	0.036	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	154.1	179.3	-63.8	0	0	0	0	110.4	M26 T38 A42 E53 V54 Y56 F116	M26-V40 HydrophobicContact CB-CG1 4.22Å; M26-V40 HydrophobicContact CE-CG1 3.85Å; M26-V40 HydrophobicContact CG-CG1 3.95Å; T38-V40 HydrophobicContact CG2-CG1 4.39Å; V40-A42 HydrophobicContact CG2-CB 4.28Å; V40-E53 CarbonylContact O-C 3.53Å; V40-E53 WeakPolarHBondContact O-CA 3.34Å; V40-V54 HydrophobicContact CG2-CB 4.25Å; V40-V54 PolarHBondContact N-O 3.42Å; V40-V54 PolarHBondContact O-N 3.48Å; V40-Y56 HydrophobicContact CG1-CE1 4.38Å; V40-Y56 HydrophobicContact CG2-CE1 4.12Å; V40-F116 HydrophobicContact CB-CD2 4.19Å; V40-F116 HydrophobicContact CB-CE2 4.35Å; V40-F116 HydrophobicContact CB-CG 4.32Å; V40-F116 HydrophobicContact CG1-CD2 4.1Å; V40-F116 HydrophobicContact CG1-CE2 3.83Å; V40-F116 HydrophobicContact CG1-CZ 4.17Å; V40-F116 HydrophobicContact CG2-CD1 3.9Å; V40-F116 HydrophobicContact CG2-CD2 4.33Å; V40-F116 HydrophobicContact CG2-CE1 3.95Å; V40-F116 HydrophobicContact CG2-CE2 4.39Å; V40-F116 HydrophobicContact CG2-CG 4.09Å; V40-F116 HydrophobicContact CG2-CZ 4.2Å
41	V	96.3	Very high	90.9	Very high	65 Å²	65	64.7 Å²	64.7	39%	0.394	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	113.4	165	-179.8	0	0	0	0	107.5	P51 Q52	V41-P51 HydrophobicContact CG1-CB 3.58Å; V41-Q52 WeakPolarHBondContact CA-O 3.4Å
42	A	96.4	Very high	91.5	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	150.4	-175.9	0	0	0	0	0	111.8	V40 P51 Q52 V54 F116	V40-A42 HydrophobicContact CG2-CB 4.28Å; A42-P51 WeakPolarHBondContact O-CA 3.36Å; A42-Q52 PolarHBondContact N-O 3.47Å; A42-Q52 PolarHBondContact O-N 3.29Å; A42-V54 HydrophobicContact CB-CB 4.4Å; A42-V54 HydrophobicContact CB-CG2 3.93Å; A42-F116 HydrophobicContact CB-CB 3.93Å; A42-F116 HydrophobicContact CB-CD1 4.09Å; A42-F116 HydrophobicContact CB-CG 4.41Å
43	T	96.7	Very high	92.6	Very high	24 Å²	24	61.7 Å²	61.7	15%	0.147	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	135.9	177.8	-55.4	0	0	0	0	109.7	D49 Y114 F115	T43-D49 HydrophobicContact CG2-CB 4.38Å; T43-D49 WeakPolarHBondContact CG2-OD1 3.43Å; T43-Y114 CarbonylContact O-C 3.59Å; T43-Y114 WeakPolarHBondContact O-CA 3.33Å; T43-F115 HydrophobicContact CG2-CE1 3.58Å; T43-F115 HydrophobicContact CG2-CZ 3.63Å; T43-F115 PolarHBondContact N-O 3.17Å; T43-F115 WeakPolarHBondContact O-CD1 3.33Å; T43-F115 PolarHBondContact O-N 3.11Å
44	P	97.2	Very high	93.5	Very high	23 Å²	23	55.1 Å²	55.1	15%	0.149	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52	138.4	171.5	-27.8	36.2	0	0	0	112.9	Q46 R50	P44-Q46 WeakPolarHBondContact CB-O 3.41Å; P44-R50 WeakPolarHBondContact CD-O 3.12Å
45	G	94.4	Very high	94.4	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.297	C	S	.	.	S	Bend	trans	-65.6	-42.1	178.5	0	0	0	0	0	112.5	R102 R113	G45-R102 WeakPolarHBondContact O-CA 3.42Å; G45-R102 WeakPolarHBondContact O-CB 3.37Å; G45-R102 VanDerWaalsContact O-CG 3.26Å; G45-R102 WeakPolarHBondContact O-CG 3.49Å; G45-R102 PolarHBondContact O-NE 3.29Å; G45-R113 PolarHBondContact N-O 3.04Å
46	Q	92.1	Very high	95	Very high	37 Å²	37	53.2 Å²	53.2	17%	0.173	29%	0.285	C	S	.	.	S	Bend	trans	-117	157.4	172.7	-57.6	81	17.6	0	0	110.4	P44 L104 L112	P44-Q46 WeakPolarHBondContact CB-O 3.41Å; Q46-L104 PolarHBondContact NE2-O 3.32Å; Q46-L112 PolarHBondContact NE2-O 3.01Å; Q46-L112 VanDerWaalsContact NE2-O 3.16Å; Q46-L112 PolarHBondContact OE1-O 2.95Å
47	G	90.5	Very high	95.2	Very high	53 Å²	53	47.4 Å²	47.4	55%	0.546	26%	0.26	S	S	.	.	S	Bend	trans	87.7	-164.1	-179	0	0	0	0	0	113.4
48	P	90.1	Very high	95	Very high	85 Å²	85	51.2 Å²	51.2	55%	0.552	28%	0.28	S	S	*	.	S	Bend	trans	-68.2	148.3	-173.7	28.9	-34.9	0	0	0	112.1	R50	P48-R50 HydrophobicContact CB-CG 4.3Å; P48-R50 HydrophobicContact CG-CG 4.46Å; P48-R50 PolarHBondContact O-N 3.32Å
49	D	92.5	Very high	94.9	Very high	100 Å²	100	53.8 Å²	53.8	54%	0.535	30%	0.296	S	S	.	.			trans	-73.7	65.7	175.3	-78.8	-27.8	0	0	0	111.4	T43 P51 R102	T43-D49 HydrophobicContact CG2-CB 4.38Å; T43-D49 WeakPolarHBondContact CG2-OD1 3.43Å; D49-P51 WeakPolarHBondContact O-CD 3.38Å; D49-R102 IonicContact OD1-CZ 3.1Å; D49-R102 IonicContact OD1-NH1 2.91Å; D49-R102 PolarHBondContact OD1-NH1 2.76Å; D49-R102 IonicContact OD1-NH2 2.65Å; D49-R102 PolarHBondContact OD1-NH2 3.31Å; D49-R102 IonicContact OD2-CZ 3.94Å; D49-R102 IonicContact OD2-NH1 3.21Å; D49-R102 PolarHBondContact OD2-NH1 3.25Å; D49-R102 IonicContact OD2-NH2 3.69Å
50	R	93.9	Very high	94.9	Very high	192 Å²	192	58 Å²	58	73%	0.725	31%	0.313	S	S	*	.			trans	-108.6	101.7	174.3	-69.2	-177.1	-178	-179.6	0.8	108.9	P44 P48	P44-R50 WeakPolarHBondContact CD-O 3.12Å; P48-R50 HydrophobicContact CB-CG 4.3Å; P48-R50 HydrophobicContact CG-CG 4.46Å; P48-R50 PolarHBondContact O-N 3.32Å
51	P	94.4	Very high	94.9	Very high	82 Å²	82	61.4 Å²	61.4	53%	0.532	33%	0.333	S	S	.	.			trans	-62.1	144.8	177.6	-20.1	32.1	0	0	0	111.5	V41 A42 D49	V41-P51 HydrophobicContact CG1-CB 3.58Å; A42-P51 WeakPolarHBondContact O-CA 3.36Å; D49-P51 WeakPolarHBondContact O-CD 3.38Å
52	Q	95.1	Very high	94.8	Very high	85 Å²	85	62 Å²	62	40%	0.397	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	157.2	177.3	63.1	-177.3	4.5	0	0	111	V41 A42 V54 Y114	V41-Q52 WeakPolarHBondContact CA-O 3.4Å; A42-Q52 PolarHBondContact N-O 3.47Å; A42-Q52 PolarHBondContact O-N 3.29Å; Q52-V54 HydrophobicContact CG-CG2 4.3Å; Q52-Y114 PolarHBondContact NE2-OH 3.07Å
53	E	96.3	Very high	94.5	Very high	130 Å²	130	63.3 Å²	63.3	61%	0.607	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.2	133.7	173.1	-68.7	-167.3	158.6	0	0	110.2	T39 V40	T39-E53 HydrophobicContact CG2-CB 4.44Å; V40-E53 CarbonylContact O-C 3.53Å; V40-E53 WeakPolarHBondContact O-CA 3.34Å
54	V	96.9	Very high	93.9	Very high	8 Å²	8	68.1 Å²	68.1	5%	0.048	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	122.4	175.3	179.3	0	0	0	0	107.7	T39 V40 A42 Q52 L75 Y114	T39-V54 WeakPolarHBondContact CA-O 3.26Å; V40-V54 HydrophobicContact CG2-CB 4.25Å; V40-V54 PolarHBondContact N-O 3.42Å; V40-V54 PolarHBondContact O-N 3.48Å; A42-V54 HydrophobicContact CB-CB 4.4Å; A42-V54 HydrophobicContact CB-CG2 3.93Å; Q52-V54 HydrophobicContact CG-CG2 4.3Å; V54-L75 HydrophobicContact CG1-CD2 3.87Å; V54-Y114 HydrophobicContact CG1-CD2 4.32Å; V54-Y114 HydrophobicContact CG1-CE2 4.45Å; V54-Y114 HydrophobicContact CG2-CD1 4.35Å; V54-Y114 HydrophobicContact CG2-CD2 4.14Å; V54-Y114 HydrophobicContact CG2-CE2 4.24Å; V54-Y114 HydrophobicContact CG2-CG 4.19Å
55	S	97.1	Very high	92.7	Very high	25 Å²	25	69.5 Å²	69.5	18%	0.175	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	136.9	177.8	-62.6	0	0	0	0	110.9	T38 T39 C76	T38-S55 CarbonylContact O-C 3.56Å; T38-S55 WeakPolarHBondContact O-CA 3.49Å; T39-S55 WeakPolarHBondContact CG2-OG 3.49Å; T39-S55 PolarHBondContact OG1-OG 3.37Å; S55-C76 PolarHBondContact O-N 3.48Å; S55-C76 PolarHBondContact O-SG 2.85Å
56	Y	97.1	Very high	91.4	Very high	18 Å²	18	73.5 Å²	73.5	7%	0.071	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	154.8	178.4	61.6	-94.2	0	0	0	113.4	T38 V40 A73 K74 I84 F116	T38-Y56 HydrophobicContact CG2-CE1 4.14Å; T38-Y56 HydrophobicContact CG2-CE2 4.03Å; T38-Y56 WeakPolarHBondContact CG2-OH 3.21Å; T38-Y56 PolarHBondContact N-O 3.07Å; T38-Y56 PolarHBondContact O-N 3.16Å; V40-Y56 HydrophobicContact CG1-CE1 4.38Å; V40-Y56 HydrophobicContact CG2-CE1 4.12Å; Y56-A73 HydrophobicContact CD2-CB 3.74Å; Y56-A73 HydrophobicContact CE2-CB 4.48Å; Y56-A73 HydrophobicContact CG-CB 4.25Å; Y56-K74 CarbonylContact C-O 3.59Å; Y56-K74 WeakPolarHBondContact CA-O 3.21Å; Y56-K74 VanDerWaalsContact CB-O 3.26Å; Y56-K74 WeakPolarHBondContact CB-O 3.45Å; Y56-I84 HydrophobicContact CD1-CD1 4.31Å; Y56-I84 HydrophobicContact CD2-CD1 4Å; Y56-I84 HydrophobicContact CE1-CD1 4.08Å; Y56-I84 HydrophobicContact CE2-CD1 3.75Å; Y56-I84 HydrophobicContact CG-CD1 4.27Å; Y56-F116 HydrophobicContact CE1-CZ 4.4Å
57	T	97	Very high	90.6	Very high	14 Å²	14	74.5 Å²	74.5	9%	0.086	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	-174.8	-179.2	61.4	0	0	0	0	111.7	V37 T59 A73 K74	V37-T57 HydrophobicContact CB-CG2 4.33Å; V37-T57 HydrophobicContact CG2-CG2 3.77Å; T57-T59 VanDerWaalsContact C-N 3.25Å; T57-T59 PolarHBondContact O-N 3.22Å; T57-T59 VanDerWaalsContact O-N 3.1Å; T57-A73 WeakPolarHBondContact O-CA 3.42Å; T57-K74 PolarHBondContact N-O 2.92Å; T57-K74 PolarHBondContact O-N 3.44Å
58	D	92.3	Very high	90.3	Very high	94 Å²	94	73.1 Å²	73.1	50%	0.503	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	54.5	37.5	166.9	-53.7	-31.8	0	0	0	114.6	K60 K74	D58-K60 PolarHBondContact O-N 3.17Å; D58-K74 HydrophobicContact CB-CB 4.44Å
59	T	94.4	Very high	90.5	Very high	66 Å²	66	70.8 Å²	70.8	41%	0.405	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	119	-175.7	-53.3	0	0	0	0	110.9	T57 Y71 Q72	T57-T59 VanDerWaalsContact C-N 3.25Å; T57-T59 PolarHBondContact O-N 3.22Å; T57-T59 VanDerWaalsContact O-N 3.1Å; T59-Y71 HydrophobicContact CG2-CD1 3.66Å; T59-Y71 HydrophobicContact CG2-CG 3.93Å; T59-Q72 CarbonylContact C-O 3.16Å; T59-Q72 VanDerWaalsContact CA-O 3.26Å; T59-Q72 WeakPolarHBondContact CA-O 3.29Å
60	K	96.1	Very high	90.7	Very high	111 Å²	111	68 Å²	68	48%	0.483	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	143.8	175.6	65.2	179.8	179.8	-176.9	0	111.5	D58 I62 Y71 Q72	D58-K60 PolarHBondContact O-N 3.17Å; K60-I62 HydrophobicContact CG-CG2 4.26Å; K60-I62 PolarHBondContact O-N 3.24Å; K60-Y71 CarbonylContact O-C 3.57Å; K60-Y71 WeakPolarHBondContact O-CA 3.42Å; K60-Q72 HydrophobicContact CG-CB 3.94Å; K60-Q72 PolarHBondContact N-O 2.99Å; K60-Q72 VanDerWaalsContact NZ-OE1 3.17Å; K60-Q72 PolarHBondContact O-N 3.03Å
61	V	96.3	Very high	90.9	Very high	77 Å²	77	61.7 Å²	61.7	47%	0.467	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	128	176.4	178.8	0	0	0	0	109.5	V69 Y71	V61-V69 HydrophobicContact CG1-CG1 3.87Å; V61-V69 HydrophobicContact CG2-CG1 4.02Å; V61-Y71 HydrophobicContact CG2-CD1 3.75Å; V61-Y71 HydrophobicContact CG2-CE1 3.51Å
62	I	94	Very high	91	Very high	79 Å²	79	58.6 Å²	58.6	41%	0.405	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	-11.6	176.8	60.2	168.2	0	0	0	113.2	K60 V70 Q72 Y134	K60-I62 HydrophobicContact CG-CG2 4.26Å; K60-I62 PolarHBondContact O-N 3.24Å; I62-V70 HydrophobicContact CD1-CG1 3.98Å; I62-V70 HydrophobicContact CG1-CB 4.27Å; I62-V70 HydrophobicContact CG1-CG1 3.9Å; I62-V70 WeakPolarHBondContact CG1-O 3.49Å; I62-V70 PolarHBondContact N-O 3.16Å; I62-Q72 HydrophobicContact CD1-CB 4.15Å; I62-Q72 HydrophobicContact CG1-CB 4.49Å; I62-Q72 HydrophobicContact CG2-CB 3.64Å; I62-Y134 HydrophobicContact CD1-CD2 4.27Å; I62-Y134 HydrophobicContact CD1-CE2 3.92Å
63	G	89.1	Confident	91.2	Very high	26 Å²	26	54.5 Å²	54.5	27%	0.268	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161	144.8	176.4	0	0	0	0	0	112.5	V70	G63-V70 PolarHBondContact N-O 2.87Å; G63-V70 PolarHBondContact O-N 3.07Å
64	N	84.8	Confident	91.3	Very high	125 Å²	125	52.3 Å²	52.3	67%	0.668	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.4	131.3	173.1	-78.1	-41.5	0	0	0	108.5	V69	N64-V69 WeakPolarHBondContact OD1-CG1 3.42Å; N64-V69 WeakPolarHBondContact OD1-CG2 3.35Å
65	G	71.6	Confident	91.3	Very high	52 Å²	52	52.4 Å²	52.4	54%	0.536	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	175.8	178.8	0	0	0	0	0	112.3	F67 G68	G65-F67 PolarHBondContact O-N 2.76Å; G65-F67 VanDerWaalsContact O-N 3.07Å; G65-G68 PolarHBondContact N-O 3.32Å; G65-G68 PolarHBondContact O-N 2.68Å
66	S	68.5	Low	91.2	Very high	84 Å²	84	53.8 Å²	53.8	59%	0.587	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-20.3	178.6	50.6	0	0	0	0	114
67	F	74.1	Confident	91.1	Very high	59 Å²	59	59.7 Å²	59.7	26%	0.259	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-10.1	-176.2	-54.8	-71.5	0	0	0	113.5	R6 G65 V87	R6-F67 HydrophobicContact CB-CE1 4.45Å; R6-F67 HydrophobicContact CB-CZ 3.88Å; R6-F67 WeakPolarHBondContact O-CE1 3.45Å; G65-F67 PolarHBondContact O-N 2.76Å; G65-F67 VanDerWaalsContact O-N 3.07Å; F67-V87 WeakPolarHBondContact O-CG1 3.42Å
68	G	85.3	Confident	91.1	Very high	24 Å²	24	62.1 Å²	62.1	25%	0.247	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	146.9	-161	-178.1	0	0	0	0	0	114.2	G65 K86	G65-G68 PolarHBondContact N-O 3.32Å; G65-G68 PolarHBondContact O-N 2.68Å; G68-K86 WeakPolarHBondContact CA-O 3.11Å
69	V	93.6	Very high	91.3	Very high	36 Å²	36	59.2 Å²	59.2	22%	0.218	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	138.9	-174.2	-175.3	0	0	0	0	109.3	V61 N64 Y71 K86	V61-V69 HydrophobicContact CG1-CG1 3.87Å; V61-V69 HydrophobicContact CG2-CG1 4.02Å; N64-V69 WeakPolarHBondContact OD1-CG1 3.42Å; N64-V69 WeakPolarHBondContact OD1-CG2 3.35Å; V69-Y71 HydrophobicContact CB-CE2 3.79Å; V69-Y71 HydrophobicContact CG1-CD1 4.42Å; V69-Y71 HydrophobicContact CG1-CD2 4.14Å; V69-Y71 HydrophobicContact CG1-CE1 3.91Å; V69-Y71 HydrophobicContact CG1-CE2 3.57Å; V69-Y71 VanDerWaalsContact CG1-CZ 3.44Å; V69-K86 PolarHBondContact N-O 3Å; V69-K86 VanDerWaalsContact N-O 3.1Å; V69-K86 PolarHBondContact O-N 3.19Å
70	V	96.4	Very high	91.4	Very high	41 Å²	41	60 Å²	60	25%	0.248	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	124.9	172.9	-172.3	0	0	0	0	108.8	I62 G63 A83 I84 K85	I62-V70 HydrophobicContact CD1-CG1 3.98Å; I62-V70 HydrophobicContact CG1-CB 4.27Å; I62-V70 HydrophobicContact CG1-CG1 3.9Å; I62-V70 WeakPolarHBondContact CG1-O 3.49Å; I62-V70 PolarHBondContact N-O 3.16Å; G63-V70 PolarHBondContact N-O 2.87Å; G63-V70 PolarHBondContact O-N 3.07Å; V70-A83 HydrophobicContact CG1-CB 4.27Å; V70-I84 WeakPolarHBondContact CA-O 3.49Å; V70-K85 HydrophobicContact CG2-CB 4.3Å; V70-K85 HydrophobicContact CG2-CG 4.11Å
71	Y	97.4	Very high	91.5	Very high	59 Å²	59	58 Å²	58	23%	0.231	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	146.8	176	-54.9	-93.7	0	0	0	110.2	T59 K60 V61 V69 A83 I84 K86	T59-Y71 HydrophobicContact CG2-CD1 3.66Å; T59-Y71 HydrophobicContact CG2-CG 3.93Å; K60-Y71 CarbonylContact O-C 3.57Å; K60-Y71 WeakPolarHBondContact O-CA 3.42Å; V61-Y71 HydrophobicContact CG2-CD1 3.75Å; V61-Y71 HydrophobicContact CG2-CE1 3.51Å; V69-Y71 HydrophobicContact CB-CE2 3.79Å; V69-Y71 HydrophobicContact CG1-CD1 4.42Å; V69-Y71 HydrophobicContact CG1-CD2 4.14Å; V69-Y71 HydrophobicContact CG1-CE1 3.91Å; V69-Y71 HydrophobicContact CG1-CE2 3.57Å; V69-Y71 VanDerWaalsContact CG1-CZ 3.44Å; Y71-A83 CarbonylContact O-C 3.58Å; Y71-A83 VanDerWaalsContact O-CA 3.24Å; Y71-A83 WeakPolarHBondContact O-CA 3.24Å; Y71-I84 PolarHBondContact N-O 2.83Å; Y71-I84 PolarHBondContact O-N 2.83Å; Y71-K86 HydrophobicContact CD2-CB 4.45Å; Y71-K86 HydrophobicContact CE2-CB 3.93Å; Y71-K86 HydrophobicContact CE2-CD 4.19Å
72	Q	98.1	Very high	91.6	Very high	17 Å²	17	54.3 Å²	54.3	8%	0.079	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	141.1	155.6	179.3	-177.6	-30.3	0	0	107.8	T59 K60 I62 L81 V82 Y134	T59-Q72 CarbonylContact C-O 3.16Å; T59-Q72 VanDerWaalsContact CA-O 3.26Å; T59-Q72 WeakPolarHBondContact CA-O 3.29Å; K60-Q72 HydrophobicContact CG-CB 3.94Å; K60-Q72 PolarHBondContact N-O 2.99Å; K60-Q72 VanDerWaalsContact NZ-OE1 3.17Å; K60-Q72 PolarHBondContact O-N 3.03Å; I62-Q72 HydrophobicContact CD1-CB 4.15Å; I62-Q72 HydrophobicContact CG1-CB 4.49Å; I62-Q72 HydrophobicContact CG2-CB 3.64Å; Q72-L81 HydrophobicContact CG-CD2 4.38Å; Q72-V82 CarbonylContact C-O 3.47Å; Q72-V82 WeakPolarHBondContact CA-O 3.49Å; Q72-Y134 HydrophobicContact CB-CD2 4.43Å; Q72-Y134 HydrophobicContact CB-CE2 4.25Å; Q72-Y134 HydrophobicContact CG-CD2 4.02Å; Q72-Y134 HydrophobicContact CG-CE2 3.96Å; Q72-Y134 PolarHBondContact OE1-OH 2.9Å
73	A	98.1	Very high	91.9	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	169.4	170.4	0	0	0	0	0	109.9	Y56 T57 L81 V82 I84	Y56-A73 HydrophobicContact CD2-CB 3.74Å; Y56-A73 HydrophobicContact CE2-CB 4.48Å; Y56-A73 HydrophobicContact CG-CB 4.25Å; T57-A73 WeakPolarHBondContact O-CA 3.42Å; A73-L81 WeakPolarHBondContact O-CA 3.41Å; A73-V82 HydrophobicContact CB-CG2 4.08Å; A73-V82 PolarHBondContact N-O 2.94Å; A73-V82 PolarHBondContact O-N 3.17Å; A73-I84 HydrophobicContact CB-CD1 3.82Å; A73-I84 HydrophobicContact CB-CG1 4.41Å
74	K	98.1	Very high	92.3	Very high	83 Å²	83	50.1 Å²	50.1	36%	0.361	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	126.8	175.6	-173.4	-179.9	177.5	-175.5	0	109.6	Y56 T57 D58 G79 E80 L81	Y56-K74 CarbonylContact C-O 3.59Å; Y56-K74 WeakPolarHBondContact CA-O 3.21Å; Y56-K74 VanDerWaalsContact CB-O 3.26Å; Y56-K74 WeakPolarHBondContact CB-O 3.45Å; T57-K74 PolarHBondContact N-O 2.92Å; T57-K74 PolarHBondContact O-N 3.44Å; D58-K74 HydrophobicContact CB-CB 4.44Å; K74-G79 VanDerWaalsContact CE-O 3.25Å; K74-G79 WeakPolarHBondContact CE-O 3.49Å; K74-G79 WeakPolarHBondContact CG-O 3.39Å; K74-E80 WeakPolarHBondContact CA-O 3.43Å; K74-L81 HydrophobicContact CB-CD2 4.09Å; K74-L81 HydrophobicContact CG-CD2 4.36Å
75	L	97.7	Very high	92.9	Very high	11 Å²	11	45 Å²	45	6%	0.058	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	135	175.2	-65	179.7	0	0	0	110	V54 G79 E80 V82	V54-L75 HydrophobicContact CG1-CD2 3.87Å; L75-G79 WeakPolarHBondContact O-CA 3.5Å; L75-G79 PolarHBondContact O-N 3.45Å; L75-E80 PolarHBondContact N-O 2.9Å; L75-V82 HydrophobicContact CD1-CG1 3.81Å; L75-V82 HydrophobicContact CD2-CG1 4.23Å; L75-V82 HydrophobicContact CD2-CG2 4.13Å; L75-V82 HydrophobicContact CG-CG1 3.79Å; L75-V82 HydrophobicContact CG-CG2 4.25Å
76	C	96.2	Very high	94	Very high	54 Å²	54	45 Å²	45	37%	0.365	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-41	-179.2	-63.8	0	0	0	0	112.1	S55	S55-C76 PolarHBondContact O-N 3.48Å; S55-C76 PolarHBondContact O-SG 2.85Å
77	D	94.8	Very high	95.1	Very high	142 Å²	142	41.6 Å²	41.6	76%	0.759	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-43.6	-170.8	-55	-27.6	0	0	0	112.6
78	S	96.2	Very high	95.9	Very high	64 Å²	64	42.3 Å²	42.3	45%	0.448	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	-16.1	-176.6	65.6	0	0	0	0	114	E80	S78-E80 WeakPolarHBondContact CB-OE2 3.25Å; S78-E80 PolarHBondContact O-N 3.19Å; S78-E80 WeakPolarHBondContact OG-CB 3.49Å; S78-E80 WeakPolarHBondContact OG-CG 3.29Å; S78-E80 PolarHBondContact OG-N 3.43Å; S78-E80 PolarHBondContact OG-OE2 3.36Å
79	G	96.1	Very high	96.1	Very high	33 Å²	33	43.5 Å²	43.5	34%	0.34	24%	0.237	S	C	.	.			trans	70.1	2.7	-170.6	0	0	0	0	0	114.5	K74 L75	K74-G79 VanDerWaalsContact CE-O 3.25Å; K74-G79 WeakPolarHBondContact CE-O 3.49Å; K74-G79 WeakPolarHBondContact CG-O 3.39Å; L75-G79 WeakPolarHBondContact O-CA 3.5Å; L75-G79 PolarHBondContact O-N 3.45Å
80	E	97.6	Very high	95.5	Very high	82 Å²	82	44 Å²	44	38%	0.383	24%	0.238	S	C	.	.			trans	-70.3	144.6	-179.7	-68.3	170.3	109.4	0	0	111.7	K74 L75 S78 R113	K74-E80 WeakPolarHBondContact CA-O 3.43Å; L75-E80 PolarHBondContact N-O 2.9Å; S78-E80 WeakPolarHBondContact CB-OE2 3.25Å; S78-E80 PolarHBondContact O-N 3.19Å; S78-E80 WeakPolarHBondContact OG-CB 3.49Å; S78-E80 WeakPolarHBondContact OG-CG 3.29Å; S78-E80 PolarHBondContact OG-N 3.43Å; S78-E80 PolarHBondContact OG-OE2 3.36Å; E80-R113 VanDerWaalsContact CD-NH1 3.27Å; E80-R113 IonicContact OE1-CZ 3.85Å; E80-R113 IonicContact OE1-NH1 2.7Å; E80-R113 PolarHBondContact OE1-NH1 3.16Å; E80-R113 IonicContact OE1-NH2 3.64Å; E80-R113 PolarHBondContact OE1-NH2 3.3Å; E80-R113 IonicContact OE2-CZ 2.69Å; E80-R113 IonicContact OE2-NH1 3.89Å; E80-R113 PolarHBondContact OE2-NH1 2.83Å; E80-R113 IonicContact OE2-NH2 3.89Å
81	L	98.3	Very high	94.5	Very high	70 Å²	70	49.9 Å²	49.9	37%	0.366	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	139.2	171.7	-65.4	178.6	0	0	0	110.8	Q72 A73 K74 Y134	Q72-L81 HydrophobicContact CG-CD2 4.38Å; A73-L81 WeakPolarHBondContact O-CA 3.41Å; K74-L81 HydrophobicContact CB-CD2 4.09Å; K74-L81 HydrophobicContact CG-CD2 4.36Å; L81-Y134 HydrophobicContact CB-CD1 3.84Å; L81-Y134 HydrophobicContact CB-CG 3.96Å; L81-Y134 HydrophobicContact CD1-CD1 3.96Å; L81-Y134 HydrophobicContact CD1-CE1 4.07Å; L81-Y134 VanDerWaalsContact O-CB 3.29Å; L81-Y134 WeakPolarHBondContact O-CB 3.49Å
82	V	98.6	Very high	93.4	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	154.9	175.8	-67.1	0	0	0	0	110.9	Q72 A73 L75 I84 V131 L132	Q72-V82 CarbonylContact C-O 3.47Å; Q72-V82 WeakPolarHBondContact CA-O 3.49Å; A73-V82 HydrophobicContact CB-CG2 4.08Å; A73-V82 PolarHBondContact N-O 2.94Å; A73-V82 PolarHBondContact O-N 3.17Å; L75-V82 HydrophobicContact CD1-CG1 3.81Å; L75-V82 HydrophobicContact CD2-CG1 4.23Å; L75-V82 HydrophobicContact CD2-CG2 4.13Å; L75-V82 HydrophobicContact CG-CG1 3.79Å; L75-V82 HydrophobicContact CG-CG2 4.25Å; V82-I84 HydrophobicContact CG2-CG1 4.38Å; V82-V131 HydrophobicContact CB-CG1 3.89Å; V82-V131 HydrophobicContact CG1-CG1 4.09Å; V82-V131 HydrophobicContact CG2-CG1 3.97Å; V82-L132 CarbonylContact C-O 3.59Å; V82-L132 WeakPolarHBondContact CA-O 3.42Å; V82-L132 WeakPolarHBondContact CB-O 3.18Å
83	A	98.5	Very high	92	Very high	12 Å²	12	56.7 Å²	56.7	10%	0.099	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	129	167.8	0	0	0	0	0	109.7	V70 Y71 L132	V70-A83 HydrophobicContact CG1-CB 4.27Å; Y71-A83 CarbonylContact O-C 3.58Å; Y71-A83 VanDerWaalsContact O-CA 3.24Å; Y71-A83 WeakPolarHBondContact O-CA 3.24Å; A83-L132 HydrophobicContact CB-CB 4.32Å; A83-L132 PolarHBondContact N-O 3.25Å; A83-L132 WeakPolarHBondContact O-CB 3.27Å; A83-L132 PolarHBondContact O-N 3.4Å
84	I	98.2	Very high	90.3	Very high	4 Å²	4	60.9 Å²	60.9	2%	0.021	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	105.4	177.1	-52.8	178.5	0	0	0	108.3	Y56 V70 Y71 A73 V82 N129 L130 V131	Y56-I84 HydrophobicContact CD1-CD1 4.31Å; Y56-I84 HydrophobicContact CD2-CD1 4Å; Y56-I84 HydrophobicContact CE1-CD1 4.08Å; Y56-I84 HydrophobicContact CE2-CD1 3.75Å; Y56-I84 HydrophobicContact CG-CD1 4.27Å; V70-I84 WeakPolarHBondContact CA-O 3.49Å; Y71-I84 PolarHBondContact N-O 2.83Å; Y71-I84 PolarHBondContact O-N 2.83Å; A73-I84 HydrophobicContact CB-CD1 3.82Å; A73-I84 HydrophobicContact CB-CG1 4.41Å; V82-I84 HydrophobicContact CG2-CG1 4.38Å; I84-N129 HydrophobicContact CG2-CB 4.04Å; I84-L130 CarbonylContact C-O 3.56Å; I84-L130 WeakPolarHBondContact CA-O 3.37Å; I84-V131 HydrophobicContact CG1-CG2 4.38Å
85	K	97	Very high	89.1	Confident	19 Å²	19	58.9 Å²	58.9	8%	0.083	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	109.7	174.4	-176.5	178.8	177.7	-172.1	0	109.1	V70 V87 E97 N129 L130 L132 D200	V70-K85 HydrophobicContact CG2-CB 4.3Å; V70-K85 HydrophobicContact CG2-CG 4.11Å; K85-V87 HydrophobicContact CD-CG2 4.29Å; K85-V87 HydrophobicContact CG-CG2 3.88Å; K85-E97 IonicContact NZ-OE1 3.15Å; K85-E97 PolarHBondContact NZ-OE1 3.09Å; K85-E97 IonicContact NZ-OE2 3.16Å; K85-E97 PolarHBondContact NZ-OE2 2.94Å; K85-N129 WeakPolarHBondContact O-CA 3.26Å; K85-L130 HydrophobicContact CB-CB 4.34Å; K85-L130 PolarHBondContact N-O 3.39Å; K85-L130 PolarHBondContact O-N 2.61Å; K85-L132 HydrophobicContact CB-CD1 3.85Å; K85-D200 IonicContact NZ-OD1 3.72Å; K85-D200 PolarHBondContact NZ-OD1 3.16Å
86	K	95	Very high	88.7	Confident	52 Å²	52	61.1 Å²	61.1	23%	0.226	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	115.4	179.5	-176.5	172	-175.8	-177.9	0	110.1	G68 V69 Y71 Y127 L128 N129	G68-K86 WeakPolarHBondContact CA-O 3.11Å; V69-K86 PolarHBondContact N-O 3Å; V69-K86 VanDerWaalsContact N-O 3.1Å; V69-K86 PolarHBondContact O-N 3.19Å; Y71-K86 HydrophobicContact CD2-CB 4.45Å; Y71-K86 HydrophobicContact CE2-CB 3.93Å; Y71-K86 HydrophobicContact CE2-CD 4.19Å; K86-Y127 HydrophobicContact CD-CD1 4.22Å; K86-Y127 HydrophobicContact CD-CG 4.38Å; K86-Y127 VanDerWaalsContact CE-CG 3.41Å; K86-Y127 HydrophobicContact CG-CD1 3.71Å; K86-Y127 HydrophobicContact CG-CG 4.07Å; K86-L128 WeakPolarHBondContact CA-O 3.45Å; K86-N129 VanDerWaalsContact CG-OD1 3.27Å; K86-N129 WeakPolarHBondContact CG-OD1 3.43Å
87	V	92.4	Very high	88.5	Confident	12 Å²	12	58.9 Å²	58.9	7%	0.073	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	127.9	-173.8	179.2	0	0	0	0	109.9	F67 K85 Q89 Y127 L128	F67-V87 WeakPolarHBondContact O-CG1 3.42Å; K85-V87 HydrophobicContact CD-CG2 4.29Å; K85-V87 HydrophobicContact CG-CG2 3.88Å; V87-Q89 PolarHBondContact O-N 2.87Å; V87-Y127 CarbonylContact O-C 3.56Å; V87-Y127 WeakPolarHBondContact O-CA 3.38Å; V87-L128 PolarHBondContact N-O 3.27Å; V87-L128 PolarHBondContact O-N 3.06Å
88	L	90.4	Very high	88.5	Confident	74 Å²	74	53 Å²	53	39%	0.387	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	129.2	174.1	-178.9	67	0	0	0	110	D90 E125 Y127	L88-D90 PolarHBondContact O-N 3.03Å; L88-E125 HydrophobicContact CD1-CB 4.18Å; L88-E125 HydrophobicContact CD1-CG 4.11Å; L88-Y127 HydrophobicContact CB-CD1 4.13Å; L88-Y127 HydrophobicContact CB-CE1 3.81Å; L88-Y127 HydrophobicContact CD1-CD1 4.39Å; L88-Y127 HydrophobicContact CD1-CD2 4.4Å; L88-Y127 HydrophobicContact CD1-CE1 3.95Å; L88-Y127 HydrophobicContact CD1-CE2 3.92Å; L88-Y127 HydrophobicContact CG-CE1 4.47Å
89	Q	88.9	Confident	88.5	Confident	49 Å²	49	55.7 Å²	55.7	23%	0.229	26%	0.264	C	S	.	.			trans	-86.4	87	173.6	-63.6	-62.4	-73.3	0	0	109.5	V87 K91 N95 Y117 V126 L128	V87-Q89 PolarHBondContact O-N 2.87Å; Q89-K91 PolarHBondContact O-N 3.15Å; Q89-N95 PolarHBondContact NE2-ND2 3.32Å; Q89-N95 VanDerWaalsContact NE2-ND2 3.11Å; Q89-Y117 HydrophobicContact CG-CD1 4.5Å; Q89-Y117 HydrophobicContact CG-CE1 4.17Å; Q89-V126 HydrophobicContact CB-CB 4.47Å; Q89-V126 WeakPolarHBondContact CB-O 3.5Å; Q89-V126 HydrophobicContact CG-CG1 4.48Å; Q89-V126 PolarHBondContact N-O 2.8Å; Q89-L128 HydrophobicContact CG-CB 3.86Å
90	D	80.8	Confident	88.5	Confident	45 Å²	45	54.8 Å²	54.8	24%	0.241	25%	0.251	C	S	.	.			trans	-75.5	117.5	170.8	-173.8	-24.5	0	0	0	109.4	L88 R92 F93	L88-D90 PolarHBondContact O-N 3.03Å; D90-R92 PolarHBondContact O-N 3.31Å; D90-R92 VanDerWaalsContact OD1-CB 3.27Å; D90-R92 WeakPolarHBondContact OD1-CB 3.43Å; D90-R92 WeakPolarHBondContact OD1-CG 3.46Å; D90-R92 IonicContact OD1-CZ 2.86Å; D90-R92 PolarHBondContact OD1-N 3.39Å; D90-R92 IonicContact OD1-NE 3.14Å; D90-R92 PolarHBondContact OD1-NE 2.91Å; D90-R92 IonicContact OD1-NH2 2.65Å; D90-R92 IonicContact OD2-CZ 2.67Å; D90-R92 IonicContact OD2-NE 3.63Å; D90-R92 PolarHBondContact OD2-NE 2.85Å; D90-R92 VanDerWaalsContact OD2-NE 3.15Å; D90-R92 IonicContact OD2-NH2 3.38Å; D90-R92 PolarHBondContact OD2-NH2 3.24Å; D90-F93 HydrophobicContact CB-CD2 3.88Å; D90-F93 PolarHBondContact O-N 2.95Å
91	K	75.8	Confident	88.5	Confident	166 Å²	166	51.1 Å²	51.1	72%	0.722	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-21	-179.4	-63.6	179.2	-177.4	174.7	0	113.3	Q89 F93	Q89-K91 PolarHBondContact O-N 3.15Å; K91-F93 VanDerWaalsContact C-N 3.34Å
92	R	74.2	Confident	88.4	Confident	166 Å²	166	51.3 Å²	51.3	63%	0.626	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-18.9	178.5	-60	174.1	-67.7	-175.9	1.3	113.1	D90	D90-R92 PolarHBondContact O-N 3.31Å; D90-R92 VanDerWaalsContact OD1-CB 3.27Å; D90-R92 WeakPolarHBondContact OD1-CB 3.43Å; D90-R92 WeakPolarHBondContact OD1-CG 3.46Å; D90-R92 IonicContact OD1-CZ 2.86Å; D90-R92 PolarHBondContact OD1-N 3.39Å; D90-R92 IonicContact OD1-NE 3.14Å; D90-R92 PolarHBondContact OD1-NE 2.91Å; D90-R92 IonicContact OD1-NH2 2.65Å; D90-R92 IonicContact OD2-CZ 2.67Å; D90-R92 IonicContact OD2-NE 3.63Å; D90-R92 PolarHBondContact OD2-NE 2.85Å; D90-R92 VanDerWaalsContact OD2-NE 3.15Å; D90-R92 IonicContact OD2-NH2 3.38Å; D90-R92 PolarHBondContact OD2-NH2 3.24Å
93	F	68.6	Low	88.3	Confident	52 Å²	52	57.3 Å²	57.3	23%	0.228	26%	0.256	C	S	.	.	S	Bend	trans	-119.9	132.6	-175.8	-60.5	-72.2	0	0	0	111.1	T7 T8 F10 D90 K91 N95	T7-F93 HydrophobicContact CG2-CD1 4.18Å; T7-F93 HydrophobicContact CG2-CE1 3.34Å; T7-F93 HydrophobicContact CG2-CE2 4.22Å; T7-F93 HydrophobicContact CG2-CZ 3.37Å; T8-F93 WeakPolarHBondContact O-CD1 3.22Å; F10-F93 HydrophobicContact CD1-CE1 4.38Å; F10-F93 HydrophobicContact CE1-CE1 4.29Å; F10-F93 HydrophobicContact CE1-CZ 4.41Å; D90-F93 HydrophobicContact CB-CD2 3.88Å; D90-F93 PolarHBondContact O-N 2.95Å; K91-F93 VanDerWaalsContact C-N 3.34Å; F93-N95 PolarHBondContact O-N 3.23Å
94	K	62.2	Low	88.3	Confident	88 Å²	88	57.1 Å²	57.1	38%	0.383	25%	0.253	S	S	.	.			trans	-79	110.9	173.1	-66.9	-176.5	-177.9	173.8	0	108.7	A11 E12 R96	A11-K94 HydrophobicContact CB-CG 4.21Å; E12-K94 PolarHBondContact O-NZ 3.19Å; K94-R96 PolarHBondContact O-N 3.35Å; K94-R96 VanDerWaalsContact O-N 3.07Å
95	N	73.6	Confident	88.3	Confident	41 Å²	41	61.9 Å²	61.9	22%	0.219	28%	0.278	C	S	.	.			trans	-75	97.4	171.2	-168.8	-38.2	0	0	0	109.6	Q89 F93 E97	Q89-N95 PolarHBondContact NE2-ND2 3.32Å; Q89-N95 VanDerWaalsContact NE2-ND2 3.11Å; F93-N95 PolarHBondContact O-N 3.23Å; N95-E97 VanDerWaalsContact C-N 3.32Å; N95-E97 WeakPolarHBondContact OD1-CB 3.42Å; N95-E97 PolarHBondContact OD1-N 3.17Å
96	R	88.9	Confident	88.4	Confident	59 Å²	59	61.8 Å²	61.8	22%	0.223	28%	0.278	C	S	.	.			trans	-81.7	-12.5	177.9	-64.3	175.7	-178.2	147.6	-0.2	112.8	K94 L98 Q99 I100	K94-R96 PolarHBondContact O-N 3.35Å; K94-R96 VanDerWaalsContact O-N 3.07Å; R96-L98 PolarHBondContact O-N 2.98Å; R96-Q99 PolarHBondContact O-N 3.06Å; R96-I100 HydrophobicContact CB-CD1 4.25Å; R96-I100 WeakPolarHBondContact O-CG1 3.44Å; R96-I100 PolarHBondContact O-N 2.8Å
97	E	93.4	Very high	88.5	Confident	7 Å²	7	61.4 Å²	61.4	3%	0.033	28%	0.282	C	S	.	.	H	α-helix	trans	-58.3	-50.1	-173.5	-172.9	168.7	-163.5	0	0	110.9	K85 N95 Q99 I100 M101 L130 F201 G202	K85-E97 IonicContact NZ-OE1 3.15Å; K85-E97 PolarHBondContact NZ-OE1 3.09Å; K85-E97 IonicContact NZ-OE2 3.16Å; K85-E97 PolarHBondContact NZ-OE2 2.94Å; N95-E97 VanDerWaalsContact C-N 3.32Å; N95-E97 WeakPolarHBondContact OD1-CB 3.42Å; N95-E97 PolarHBondContact OD1-N 3.17Å; E97-Q99 PolarHBondContact O-N 2.9Å; E97-I100 PolarHBondContact O-N 3.29Å; E97-M101 HydrophobicContact CG-CG 4.33Å; E97-M101 HydrophobicContact CG-SD 4.1Å; E97-M101 WeakPolarHBondContact O-CB 3.28Å; E97-M101 VanDerWaalsContact O-CG 3.28Å; E97-M101 WeakPolarHBondContact O-CG 3.29Å; E97-M101 PolarHBondContact O-N 3.21Å; E97-L130 HydrophobicContact CG-CD1 3.91Å; E97-F201 HydrophobicContact CG-CB 4Å; E97-F201 PolarHBondContact OE1-N 2.9Å; E97-G202 PolarHBondContact OE1-N 3.46Å
98	L	94.4	Very high	88.8	Confident	18 Å²	18	61 Å²	61	9%	0.094	28%	0.279	C	S	.	.	H	α-helix	trans	-58.1	-50.7	176.7	177.5	61.3	0	0	0	111.7	R96 I100 M101 R102 L112 F115 L128 L130	R96-L98 PolarHBondContact O-N 2.98Å; L98-I100 VanDerWaalsContact C-N 3.25Å; L98-I100 PolarHBondContact O-N 3.11Å; L98-M101 PolarHBondContact O-N 3.16Å; L98-R102 HydrophobicContact CD1-CG 3.87Å; L98-R102 HydrophobicContact CG-CG 4.36Å; L98-R102 VanDerWaalsContact O-CG 3.29Å; L98-R102 WeakPolarHBondContact O-CG 3.46Å; L98-R102 PolarHBondContact O-N 2.92Å; L98-L112 HydrophobicContact CD1-CD2 3.82Å; L98-F115 HydrophobicContact CD1-CB 3.86Å; L98-F115 HydrophobicContact CD1-CD1 3.69Å; L98-F115 HydrophobicContact CD1-CD2 3.98Å; L98-F115 HydrophobicContact CD1-CE1 4.2Å; L98-F115 HydrophobicContact CD1-CE2 4.47Å; L98-F115 HydrophobicContact CD1-CG 3.56Å; L98-F115 HydrophobicContact CD2-CD2 3.71Å; L98-F115 HydrophobicContact CD2-CE2 3.83Å; L98-F115 HydrophobicContact CD2-CG 4.19Å; L98-F115 HydrophobicContact CD2-CZ 4.38Å; L98-L128 HydrophobicContact CB-CD2 4.06Å; L98-L128 HydrophobicContact CD2-CD1 4.09Å; L98-L128 HydrophobicContact CD2-CD2 4.5Å; L98-L130 HydrophobicContact CB-CD2 4.38Å; L98-L130 HydrophobicContact CD1-CD2 3.84Å
99	Q	94.7	Very high	89.2	Confident	121 Å²	121	57.7 Å²	57.7	57%	0.565	26%	0.262	S	S	*	.	H	α-helix	trans	-60.1	-36.6	-177.6	-67.5	-178.8	-20	0	0	112.7	R96 E97	R96-Q99 PolarHBondContact O-N 3.06Å; E97-Q99 PolarHBondContact O-N 2.9Å
100	I	97.3	Very high	89.7	Confident	13 Å²	13	55.7 Å²	55.7	7%	0.067	25%	0.253	C	S	.	.	H	α-helix	trans	-70.3	-55.4	175.2	-74.2	170.5	0	0	0	109.5	R96 E97 L98 R102 K103 L104 I177 F201 A204	R96-I100 HydrophobicContact CB-CD1 4.25Å; R96-I100 WeakPolarHBondContact O-CG1 3.44Å; R96-I100 PolarHBondContact O-N 2.8Å; E97-I100 PolarHBondContact O-N 3.29Å; L98-I100 VanDerWaalsContact C-N 3.25Å; L98-I100 PolarHBondContact O-N 3.11Å; I100-R102 VanDerWaalsContact C-N 3.26Å; I100-R102 PolarHBondContact O-N 2.95Å; I100-K103 WeakPolarHBondContact O-CB 3.28Å; I100-K103 PolarHBondContact O-N 3Å; I100-L104 HydrophobicContact CG2-CD1 3.87Å; I100-L104 HydrophobicContact CG2-CG 4.36Å; I100-L104 WeakPolarHBondContact O-CG 3.43Å; I100-I177 HydrophobicContact CD1-CG2 4.35Å; I100-I177 HydrophobicContact CG2-CD1 4.18Å; I100-I177 HydrophobicContact CG2-CG2 4.19Å; I100-F201 HydrophobicContact CG2-CB 4.32Å; I100-F201 HydrophobicContact CG2-CD1 3.74Å; I100-F201 HydrophobicContact CG2-CE1 4.45Å; I100-F201 HydrophobicContact CG2-CG 4.24Å; I100-A204 HydrophobicContact CD1-CB 3.67Å
101	M	97.8	Very high	90.6	Very high	5 Å²	5	58.9 Å²	58.9	3%	0.025	26%	0.262	C	S	.	.	H	α-helix	trans	-61	-31.8	-173.7	-69.5	-163.6	77.7	0	0	113.9	E97 L98 K103 L104 V110 L112 L130 L132 F201	E97-M101 HydrophobicContact CG-CG 4.33Å; E97-M101 HydrophobicContact CG-SD 4.1Å; E97-M101 WeakPolarHBondContact O-CB 3.28Å; E97-M101 VanDerWaalsContact O-CG 3.28Å; E97-M101 WeakPolarHBondContact O-CG 3.29Å; E97-M101 PolarHBondContact O-N 3.21Å; L98-M101 PolarHBondContact O-N 3.16Å; M101-K103 PolarHBondContact O-N 3.31Å; M101-L104 PolarHBondContact O-N 2.64Å; M101-V110 HydrophobicContact CE-CG1 3.94Å; M101-L112 HydrophobicContact CB-CB 4.26Å; M101-L112 HydrophobicContact CB-CD2 4.04Å; M101-L112 HydrophobicContact CE-CB 4.24Å; M101-L130 HydrophobicContact SD-CD1 4.26Å; M101-L132 HydrophobicContact CE-CD2 3.32Å; M101-L132 HydrophobicContact SD-CD2 4.03Å; M101-F201 HydrophobicContact CE-CD2 4.27Å; M101-F201 HydrophobicContact CG-CB 4.07Å; M101-F201 HydrophobicContact CG-CD2 4.02Å; M101-F201 HydrophobicContact CG-CG 4.19Å; M101-F201 HydrophobicContact SD-CD2 4.27Å
102	R	96.6	Very high	91.6	Very high	75 Å²	75	51 Å²	51	28%	0.283	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-22.1	174.7	-70.1	-166	67.9	-172.1	0.1	113.9	G45 D49 L98 I100 L112	G45-R102 WeakPolarHBondContact O-CA 3.42Å; G45-R102 WeakPolarHBondContact O-CB 3.37Å; G45-R102 VanDerWaalsContact O-CG 3.26Å; G45-R102 WeakPolarHBondContact O-CG 3.49Å; G45-R102 PolarHBondContact O-NE 3.29Å; D49-R102 IonicContact OD1-CZ 3.1Å; D49-R102 IonicContact OD1-NH1 2.91Å; D49-R102 PolarHBondContact OD1-NH1 2.76Å; D49-R102 IonicContact OD1-NH2 2.65Å; D49-R102 PolarHBondContact OD1-NH2 3.31Å; D49-R102 IonicContact OD2-CZ 3.94Å; D49-R102 IonicContact OD2-NH1 3.21Å; D49-R102 PolarHBondContact OD2-NH1 3.25Å; D49-R102 IonicContact OD2-NH2 3.69Å; L98-R102 HydrophobicContact CD1-CG 3.87Å; L98-R102 HydrophobicContact CG-CG 4.36Å; L98-R102 VanDerWaalsContact O-CG 3.29Å; L98-R102 WeakPolarHBondContact O-CG 3.46Å; L98-R102 PolarHBondContact O-N 2.92Å; I100-R102 VanDerWaalsContact C-N 3.26Å; I100-R102 PolarHBondContact O-N 2.95Å; R102-L112 HydrophobicContact CG-CD2 3.96Å
103	K	96.3	Very high	92.8	Very high	126 Å²	126	45.7 Å²	45.7	55%	0.548	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-11.8	178.2	-61.1	178	-178.1	-175.4	0	113.2	I100 M101	I100-K103 WeakPolarHBondContact O-CB 3.28Å; I100-K103 PolarHBondContact O-N 3Å; M101-K103 PolarHBondContact O-N 3.31Å
104	L	97.9	Very high	94.2	Very high	8 Å²	8	45.6 Å²	45.6	4%	0.042	21%	0.206	C	C	.	.			trans	-98.3	127.8	-171.9	-54.2	-178.7	0	0	0	110.7	Q46 I100 M101 I109 Y171 I172 I177 F201	Q46-L104 PolarHBondContact NE2-O 3.32Å; I100-L104 HydrophobicContact CG2-CD1 3.87Å; I100-L104 HydrophobicContact CG2-CG 4.36Å; I100-L104 WeakPolarHBondContact O-CG 3.43Å; M101-L104 PolarHBondContact O-N 2.64Å; L104-I109 HydrophobicContact CB-CG2 4.46Å; L104-I109 HydrophobicContact CD1-CD1 4.34Å; L104-I109 HydrophobicContact CD1-CG2 4.25Å; L104-Y171 HydrophobicContact CB-CE1 4.27Å; L104-Y171 HydrophobicContact CD2-CD1 4.41Å; L104-Y171 HydrophobicContact CD2-CE1 3.87Å; L104-I172 HydrophobicContact CD1-CG2 4.15Å; L104-I172 HydrophobicContact CD2-CG2 4.05Å; L104-I177 HydrophobicContact CD2-CD1 4.14Å; L104-F201 HydrophobicContact CD1-CD1 3.94Å; L104-F201 HydrophobicContact CD1-CE1 3.42Å; L104-F201 VanDerWaalsContact CD1-CE1 3.42Å; L104-F201 HydrophobicContact CD1-CE2 4.08Å; L104-F201 HydrophobicContact CD1-CG 4.46Å; L104-F201 HydrophobicContact CD1-CZ 3.5Å
105	D	97.9	Very high	95.8	Very high	103 Å²	103	42.2 Å²	42.2	55%	0.551	19%	0.191	S	C	*	.			trans	-143.6	97.9	171.2	-170.5	20.2	0	0	0	109.2	R111 Y171	D105-R111 IonicContact OD1-NH1 3.88Å; D105-Y171 PolarHBondContact N-OH 2.69Å; D105-Y171 PolarHBondContact O-OH 3.47Å
106	H	98.6	Very high	96.9	Very high	18 Å²	18	40.6 Å²	40.6	8%	0.083	18%	0.182	C	C	.	.			trans	-152.4	142.8	-175.1	-174.9	-96.2	0	0	0	111	N108 I109 Y171 E366	H106-N108 PolarHBondContact CE1-OD1 2.81Å; H106-N108 PolarHBondContact ND1-N 3.39Å; H106-N108 PolarHBondContact O-N 3.16Å; H106-I109 HydrophobicContact CB-CB 4.29Å; H106-I109 HydrophobicContact CB-CD1 3.95Å; H106-I109 HydrophobicContact CB-CG1 4.08Å; H106-I109 PolarHBondContact O-N 3.23Å; H106-I109 VanDerWaalsContact O-N 3.07Å; H106-Y171 HydrophobicContact CB-CD1 3.78Å; H106-Y171 HydrophobicContact CB-CD2 4.18Å; H106-Y171 HydrophobicContact CB-CE1 3.83Å; H106-Y171 HydrophobicContact CB-CE2 4.23Å; H106-Y171 HydrophobicContact CB-CG 3.94Å; H106-Y171 AromaticContact CD2-CD2 3.73Å; H106-Y171 AromaticContact CD2-CG 3.83Å; H106-Y171 AromaticContact CG-CG 3.91Å; H106-E366 IonicContact CD2-OE1 2.92Å; H106-E366 IonicContact CD2-OE2 3.25Å; H106-E366 IonicContact NE2-OE1 2.65Å; H106-E366 PolarHBondContact NE2-OE1 3.41Å; H106-E366 VanDerWaalsContact NE2-OE1 3.16Å; H106-E366 IonicContact NE2-OE2 3.38Å
107	C	98.6	Very high	97.1	Very high	44 Å²	44	41.1 Å²	41.1	30%	0.297	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-30.3	-175	56.2	0	0	0	0	113.6	K197	C107-K197 PolarHBondContact O-NZ 3.22Å
108	N	98.9	Very high	97.1	Very high	3 Å²	3	41.2 Å²	41.2	2%	0.016	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	20.2	177.7	-55	116.5	0	0	0	114.7	H106 Q164 S168 L196 K197 L198	H106-N108 PolarHBondContact CE1-OD1 2.81Å; H106-N108 PolarHBondContact ND1-N 3.39Å; H106-N108 PolarHBondContact O-N 3.16Å; N108-Q164 HydrophobicContact CB-CB 4.44Å; N108-Q164 WeakPolarHBondContact ND2-CB 3.42Å; N108-Q164 WeakPolarHBondContact ND2-CG 3.38Å; N108-Q164 PolarHBondContact ND2-OE1 2.89Å; N108-S168 WeakPolarHBondContact O-CB 3.32Å; N108-L196 VanDerWaalsContact CA-O 3.28Å; N108-L196 WeakPolarHBondContact CA-O 3.24Å; N108-L196 WeakPolarHBondContact CB-O 3.49Å; N108-L196 PolarHBondContact ND2-O 3.31Å; N108-K197 WeakPolarHBondContact O-CA 3.29Å; N108-L198 PolarHBondContact O-N 3.38Å
109	I	98.9	Very high	96.9	Very high	5 Å²	5	44.1 Å²	44.1	3%	0.026	21%	0.208	C	C	.	.	B	Isolated β-bridge	trans	-122.9	141.8	171.1	-61.7	177.9	0	0	0	108	L104 H106 R111 Y171 I172 F201	L104-I109 HydrophobicContact CB-CG2 4.46Å; L104-I109 HydrophobicContact CD1-CD1 4.34Å; L104-I109 HydrophobicContact CD1-CG2 4.25Å; H106-I109 HydrophobicContact CB-CB 4.29Å; H106-I109 HydrophobicContact CB-CD1 3.95Å; H106-I109 HydrophobicContact CB-CG1 4.08Å; H106-I109 PolarHBondContact O-N 3.23Å; H106-I109 VanDerWaalsContact O-N 3.07Å; I109-R111 PolarHBondContact O-N 2.94Å; I109-Y171 HydrophobicContact CD1-CD1 3.54Å; I109-Y171 HydrophobicContact CD1-CE1 4.06Å; I109-Y171 HydrophobicContact CD1-CG 4.5Å; I109-I172 HydrophobicContact CD1-CG2 3.54Å; I109-F201 HydrophobicContact CD1-CZ 4.42Å; I109-F201 HydrophobicContact CG2-CE2 3.69Å; I109-F201 HydrophobicContact CG2-CZ 3.72Å
110	V	98.6	Very high	96.4	Very high	7 Å²	7	39.3 Å²	39.3	4%	0.042	19%	0.191	C	C	.	.			trans	-65.6	127.7	176.1	70	0	0	0	0	109.8	M101 L132 D133 L188 K197 L198 C199	M101-V110 HydrophobicContact CE-CG1 3.94Å; V110-L132 HydrophobicContact CG1-CD2 4.03Å; V110-L132 HydrophobicContact CG2-CB 4.14Å; V110-L132 HydrophobicContact CG2-CD2 4.45Å; V110-D133 HydrophobicContact CG2-CB 4.15Å; V110-D133 WeakPolarHBondContact CG2-O 3.26Å; V110-L188 HydrophobicContact CB-CD1 4.29Å; V110-L188 HydrophobicContact CG2-CD1 4.18Å; V110-K197 HydrophobicContact CB-CB 4.49Å; V110-L198 PolarHBondContact N-O 3.21Å; V110-C199 HydrophobicContact CB-CB 4.25Å; V110-C199 HydrophobicContact CG1-CB 3.64Å
111	R	98.6	Very high	95.7	Very high	111 Å²	111	47 Å²	47	42%	0.419	23%	0.232	S	C	.	.			trans	-75.9	130.7	-177.7	-171.7	-178.9	172.5	110	-3.3	110	D105 I109 R113 L132 D133	D105-R111 IonicContact OD1-NH1 3.88Å; I109-R111 PolarHBondContact O-N 2.94Å; R111-R113 PolarHBondContact O-N 3.16Å; R111-L132 VanDerWaalsContact O-CA 3.28Å; R111-L132 WeakPolarHBondContact O-CA 3.34Å; R111-D133 VanDerWaalsContact CB-OD2 3.24Å; R111-D133 WeakPolarHBondContact CB-OD2 3.36Å; R111-D133 PolarHBondContact O-N 3.42Å
112	L	98.5	Very high	95.1	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	108.6	162	179.1	67.2	0	0	0	108.5	Q46 L98 M101 R102 Y114 L130 L132	Q46-L112 PolarHBondContact NE2-O 3.01Å; Q46-L112 VanDerWaalsContact NE2-O 3.16Å; Q46-L112 PolarHBondContact OE1-O 2.95Å; L98-L112 HydrophobicContact CD1-CD2 3.82Å; M101-L112 HydrophobicContact CB-CB 4.26Å; M101-L112 HydrophobicContact CB-CD2 4.04Å; M101-L112 HydrophobicContact CE-CB 4.24Å; R102-L112 HydrophobicContact CG-CD2 3.96Å; L112-Y114 VanDerWaalsContact CD1-O 3.24Å; L112-Y114 WeakPolarHBondContact CD1-O 3.49Å; L112-L130 HydrophobicContact CD1-CB 3.88Å; L112-L130 HydrophobicContact CD1-CD2 3.96Å; L112-L130 HydrophobicContact CD1-CG 4.47Å; L112-L132 HydrophobicContact CD1-CD2 4.44Å
113	R	98.1	Very high	94.1	Very high	54 Å²	54	59 Å²	59	20%	0.204	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	-51.6	175.2	-66.3	-164.4	176.3	-145.9	1.8	111.4	G45 E80 R111 V131 D133	G45-R113 PolarHBondContact N-O 3.04Å; E80-R113 VanDerWaalsContact CD-NH1 3.27Å; E80-R113 IonicContact OE1-CZ 3.85Å; E80-R113 IonicContact OE1-NH1 2.7Å; E80-R113 PolarHBondContact OE1-NH1 3.16Å; E80-R113 IonicContact OE1-NH2 3.64Å; E80-R113 PolarHBondContact OE1-NH2 3.3Å; E80-R113 IonicContact OE2-CZ 2.69Å; E80-R113 IonicContact OE2-NH1 3.89Å; E80-R113 PolarHBondContact OE2-NH1 2.83Å; E80-R113 IonicContact OE2-NH2 3.89Å; R111-R113 PolarHBondContact O-N 3.16Å; R113-V131 WeakPolarHBondContact CA-O 3.35Å; R113-V131 PolarHBondContact N-O 3.06Å; R113-D133 IonicContact CZ-OD1 2.9Å; R113-D133 VanDerWaalsContact CZ-OD1 3.27Å; R113-D133 IonicContact NE-OD1 3.35Å; R113-D133 PolarHBondContact NE-OD1 2.76Å; R113-D133 IonicContact NH2-OD1 3.8Å; R113-D133 PolarHBondContact NH2-OD1 3.23Å
114	Y	97.9	Very high	93.5	Very high	51 Å²	51	59 Å²	59	20%	0.2	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	163.7	-176.7	-49.9	-69.1	0	0	0	111.4	T43 Q52 V54 L112 V131	T43-Y114 CarbonylContact O-C 3.59Å; T43-Y114 WeakPolarHBondContact O-CA 3.33Å; Q52-Y114 PolarHBondContact NE2-OH 3.07Å; V54-Y114 HydrophobicContact CG1-CD2 4.32Å; V54-Y114 HydrophobicContact CG1-CE2 4.45Å; V54-Y114 HydrophobicContact CG2-CD1 4.35Å; V54-Y114 HydrophobicContact CG2-CD2 4.14Å; V54-Y114 HydrophobicContact CG2-CE2 4.24Å; V54-Y114 HydrophobicContact CG2-CG 4.19Å; L112-Y114 VanDerWaalsContact CD1-O 3.24Å; L112-Y114 WeakPolarHBondContact CD1-O 3.49Å; Y114-V131 HydrophobicContact CD2-CB 4.27Å; Y114-V131 HydrophobicContact CD2-CG1 4.14Å; Y114-V131 PolarHBondContact N-O 2.96Å; Y114-V131 VanDerWaalsContact N-O 3.17Å; Y114-V131 PolarHBondContact O-N 3.24Å
115	F	97.3	Very high	93.1	Very high	17 Å²	17	60.4 Å²	60.4	8%	0.075	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	150.4	163.7	69	-82	0	0	0	111.2	T43 L98 Y117 L128 N129 L130	T43-F115 HydrophobicContact CG2-CE1 3.58Å; T43-F115 HydrophobicContact CG2-CZ 3.63Å; T43-F115 PolarHBondContact N-O 3.17Å; T43-F115 WeakPolarHBondContact O-CD1 3.33Å; T43-F115 PolarHBondContact O-N 3.11Å; L98-F115 HydrophobicContact CD1-CB 3.86Å; L98-F115 HydrophobicContact CD1-CD1 3.69Å; L98-F115 HydrophobicContact CD1-CD2 3.98Å; L98-F115 HydrophobicContact CD1-CE1 4.2Å; L98-F115 HydrophobicContact CD1-CE2 4.47Å; L98-F115 HydrophobicContact CD1-CG 3.56Å; L98-F115 HydrophobicContact CD2-CD2 3.71Å; L98-F115 HydrophobicContact CD2-CE2 3.83Å; L98-F115 HydrophobicContact CD2-CG 4.19Å; L98-F115 HydrophobicContact CD2-CZ 4.38Å; F115-Y117 HydrophobicContact CD2-CE2 4.39Å; F115-Y117 HydrophobicContact CE2-CE2 4.37Å; F115-L128 HydrophobicContact CB-CD1 4.33Å; F115-L128 HydrophobicContact CD2-CD1 4.32Å; F115-N129 WeakPolarHBondContact CA-O 3.36Å; F115-L130 HydrophobicContact CB-CD2 4.01Å
116	F	95.9	Very high	92.7	Very high	6 Å²	6	56.8 Å²	56.8	3%	0.026	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	160.4	175	64.2	-87	0	0	0	111.1	M26 V40 A42 Y56 N129 V131	M26-F116 HydrophobicContact CE-CE2 3.9Å; V40-F116 HydrophobicContact CB-CD2 4.19Å; V40-F116 HydrophobicContact CB-CE2 4.35Å; V40-F116 HydrophobicContact CB-CG 4.32Å; V40-F116 HydrophobicContact CG1-CD2 4.1Å; V40-F116 HydrophobicContact CG1-CE2 3.83Å; V40-F116 HydrophobicContact CG1-CZ 4.17Å; V40-F116 HydrophobicContact CG2-CD1 3.9Å; V40-F116 HydrophobicContact CG2-CD2 4.33Å; V40-F116 HydrophobicContact CG2-CE1 3.95Å; V40-F116 HydrophobicContact CG2-CE2 4.39Å; V40-F116 HydrophobicContact CG2-CG 4.09Å; V40-F116 HydrophobicContact CG2-CZ 4.2Å; A42-F116 HydrophobicContact CB-CB 3.93Å; A42-F116 HydrophobicContact CB-CD1 4.09Å; A42-F116 HydrophobicContact CB-CG 4.41Å; Y56-F116 HydrophobicContact CE1-CZ 4.4Å; F116-N129 HydrophobicContact CD1-CB 3.89Å; F116-N129 HydrophobicContact CD2-CB 3.93Å; F116-N129 HydrophobicContact CE1-CB 3.54Å; F116-N129 HydrophobicContact CE2-CB 3.57Å; F116-N129 VanDerWaalsContact CE2-CG 3.42Å; F116-N129 VanDerWaalsContact CE2-ND2 3.29Å; F116-N129 WeakPolarHBondContact CE2-ND2 3.19Å; F116-N129 HydrophobicContact CG-CB 4.08Å; F116-N129 HydrophobicContact CZ-CB 3.37Å; F116-N129 PolarHBondContact N-O 2.71Å; F116-N129 WeakPolarHBondContact O-CB 3.26Å; F116-N129 PolarHBondContact O-N 2.89Å; F116-N129 PolarHBondContact O-ND2 3.23Å; F116-V131 HydrophobicContact CD1-CG2 4.07Å; F116-V131 HydrophobicContact CE1-CG2 3.71Å
117	Y	93.6	Very high	92.4	Very high	70 Å²	70	58.3 Å²	58.3	28%	0.275	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	144.8	175.8	-66.6	-89.1	0	0	0	110.6	P20 Q89 F115 V126 Y127 L128	P20-Y117 HydrophobicContact CG-CD2 4.43Å; P20-Y117 HydrophobicContact CG-CE2 4.29Å; Q89-Y117 HydrophobicContact CG-CD1 4.5Å; Q89-Y117 HydrophobicContact CG-CE1 4.17Å; F115-Y117 HydrophobicContact CD2-CE2 4.39Å; F115-Y117 HydrophobicContact CE2-CE2 4.37Å; Y117-V126 HydrophobicContact CD1-CG1 3.8Å; Y117-Y127 CarbonylContact C-O 3.58Å; Y117-Y127 VanDerWaalsContact CA-O 3.26Å; Y117-Y127 WeakPolarHBondContact CA-O 3.28Å; Y117-L128 HydrophobicContact CD1-CB 4.4Å; Y117-L128 HydrophobicContact CD1-CD1 4.45Å; Y117-L128 HydrophobicContact CE1-CB 4.14Å; Y117-L128 HydrophobicContact CE1-CD1 3.98Å; Y117-L128 HydrophobicContact CE2-CD1 4.42Å
118	S	92.5	Very high	92.2	Very high	10 Å²	10	56.3 Å²	56.3	7%	0.07	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	144.5	176.2	64.6	0	0	0	0	110.8	Y127 N129	S118-Y127 PolarHBondContact N-O 3.28Å; S118-Y127 PolarHBondContact O-N 3.07Å; S118-N129 PolarHBondContact OG-ND2 3.11Å
119	S	90.4	Very high	92.1	Very high	79 Å²	79	56.4 Å²	56.4	55%	0.552	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.5	149.6	173.4	-52.8	0	0	0	0	112	E125	S119-E125 CarbonylContact C-O 3.44Å; S119-E125 WeakPolarHBondContact CA-O 3.27Å
120	G	85.1	Confident	92	Very high	19 Å²	19	56.1 Å²	56.1	20%	0.196	27%	0.271	C	S	.	.			trans	-85.4	-179.2	170	0	0	0	0	0	113.8	K122 E125 Y127	G120-K122 VanDerWaalsContact C-N 3.3Å; G120-E125 PolarHBondContact N-O 3.07Å; G120-Y127 VanDerWaalsContact CA-CE2 3.47Å
121	D	82.4	Confident	92	Very high	175 Å²	175	56 Å²	56	94%	0.936	27%	0.27	S	S	*	.	S	Bend	trans	-70.8	-30	174.4	-59.5	-35.4	0	0	0	111.6
122	K	83.6	Confident	92	Very high	142 Å²	142	51.4 Å²	51.4	62%	0.617	25%	0.254	S	S	*	.	S	Bend	trans	-90.7	146.6	175.5	-55.6	-169.8	-155.6	124.2	0	111.2	G120 D124 E125	G120-K122 VanDerWaalsContact C-N 3.3Å; K122-D124 PolarHBondContact O-N 3.37Å; K122-E125 HydrophobicContact CB-CG 3.93Å; K122-E125 VanDerWaalsContact CD-OE1 3.24Å; K122-E125 WeakPolarHBondContact CD-OE1 3.38Å; K122-E125 WeakPolarHBondContact CE-OE1 3.28Å; K122-E125 IonicContact NZ-OE1 2.69Å; K122-E125 PolarHBondContact NZ-OE1 2.88Å; K122-E125 PolarHBondContact O-N 2.69Å; K122-E125 VanDerWaalsContact O-N 3.15Å
123	K	76.9	Confident	92	Very high	189 Å²	189	52.7 Å²	52.7	82%	0.822	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	133.7	170.7	-163.8	174.4	179.5	-179.6	0	109.4	E125	K123-E125 VanDerWaalsContact C-N 3.27Å; K123-E125 PolarHBondContact O-N 3.07Å
124	D	83.4	Confident	92	Very high	128 Å²	128	53.2 Å²	53.2	68%	0.684	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.8	-0.2	-178.7	-48	-47	0	0	0	117.3	K122 V126	K122-D124 PolarHBondContact O-N 3.37Å; D124-V126 PolarHBondContact O-N 2.86Å
125	E	88.4	Confident	92	Very high	37 Å²	37	51.7 Å²	51.7	17%	0.173	26%	0.259	C	S	.	.			trans	-74.5	122.1	170.1	-77.9	-174.3	-169	0	0	110.2	L88 S119 G120 K122 K123 Y127	L88-E125 HydrophobicContact CD1-CB 4.18Å; L88-E125 HydrophobicContact CD1-CG 4.11Å; S119-E125 CarbonylContact C-O 3.44Å; S119-E125 WeakPolarHBondContact CA-O 3.27Å; G120-E125 PolarHBondContact N-O 3.07Å; K122-E125 HydrophobicContact CB-CG 3.93Å; K122-E125 VanDerWaalsContact CD-OE1 3.24Å; K122-E125 WeakPolarHBondContact CD-OE1 3.38Å; K122-E125 WeakPolarHBondContact CE-OE1 3.28Å; K122-E125 IonicContact NZ-OE1 2.69Å; K122-E125 PolarHBondContact NZ-OE1 2.88Å; K122-E125 PolarHBondContact O-N 2.69Å; K122-E125 VanDerWaalsContact O-N 3.15Å; K123-E125 VanDerWaalsContact C-N 3.27Å; K123-E125 PolarHBondContact O-N 3.07Å; E125-Y127 HydrophobicContact CB-CE2 4.06Å; E125-Y127 PolarHBondContact OE2-OH 3.04Å
126	V	90.4	Very high	92	Very high	26 Å²	26	53.3 Å²	53.3	16%	0.158	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	131.9	175.4	178.6	0	0	0	0	108.5	F23 Q89 Y117 D124	F23-V126 HydrophobicContact CE1-CB 4.49Å; F23-V126 HydrophobicContact CE1-CG1 3.93Å; F23-V126 HydrophobicContact CE1-CG2 3.7Å; F23-V126 HydrophobicContact CZ-CG2 3.77Å; Q89-V126 HydrophobicContact CB-CB 4.47Å; Q89-V126 WeakPolarHBondContact CB-O 3.5Å; Q89-V126 HydrophobicContact CG-CG1 4.48Å; Q89-V126 PolarHBondContact N-O 2.8Å; Y117-V126 HydrophobicContact CD1-CG1 3.8Å; D124-V126 PolarHBondContact O-N 2.86Å
127	Y	92.3	Very high	92.1	Very high	51 Å²	51	55.1 Å²	55.1	20%	0.2	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	138	174.8	-67.4	-98.3	0	0	0	109.9	K86 V87 L88 Y117 S118 G120 E125	K86-Y127 HydrophobicContact CD-CD1 4.22Å; K86-Y127 HydrophobicContact CD-CG 4.38Å; K86-Y127 VanDerWaalsContact CE-CG 3.41Å; K86-Y127 HydrophobicContact CG-CD1 3.71Å; K86-Y127 HydrophobicContact CG-CG 4.07Å; V87-Y127 CarbonylContact O-C 3.56Å; V87-Y127 WeakPolarHBondContact O-CA 3.38Å; L88-Y127 HydrophobicContact CB-CD1 4.13Å; L88-Y127 HydrophobicContact CB-CE1 3.81Å; L88-Y127 HydrophobicContact CD1-CD1 4.39Å; L88-Y127 HydrophobicContact CD1-CD2 4.4Å; L88-Y127 HydrophobicContact CD1-CE1 3.95Å; L88-Y127 HydrophobicContact CD1-CE2 3.92Å; L88-Y127 HydrophobicContact CG-CE1 4.47Å; Y117-Y127 CarbonylContact C-O 3.58Å; Y117-Y127 VanDerWaalsContact CA-O 3.26Å; Y117-Y127 WeakPolarHBondContact CA-O 3.28Å; S118-Y127 PolarHBondContact N-O 3.28Å; S118-Y127 PolarHBondContact O-N 3.07Å; G120-Y127 VanDerWaalsContact CA-CE2 3.47Å; E125-Y127 HydrophobicContact CB-CE2 4.06Å; E125-Y127 PolarHBondContact OE2-OH 3.04Å
128	L	93.9	Very high	92.3	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	130.3	164.6	171.8	64.3	0	0	0	108.1	K86 V87 Q89 L98 F115 Y117 L130	K86-L128 WeakPolarHBondContact CA-O 3.45Å; V87-L128 PolarHBondContact N-O 3.27Å; V87-L128 PolarHBondContact O-N 3.06Å; Q89-L128 HydrophobicContact CG-CB 3.86Å; L98-L128 HydrophobicContact CB-CD2 4.06Å; L98-L128 HydrophobicContact CD2-CD1 4.09Å; L98-L128 HydrophobicContact CD2-CD2 4.5Å; F115-L128 HydrophobicContact CB-CD1 4.33Å; F115-L128 HydrophobicContact CD2-CD1 4.32Å; Y117-L128 HydrophobicContact CD1-CB 4.4Å; Y117-L128 HydrophobicContact CD1-CD1 4.45Å; Y117-L128 HydrophobicContact CE1-CB 4.14Å; Y117-L128 HydrophobicContact CE1-CD1 3.98Å; Y117-L128 HydrophobicContact CE2-CD1 4.42Å; L128-L130 HydrophobicContact CD1-CD2 4.06Å; L128-L130 HydrophobicContact CD2-CD2 4.02Å; L128-L130 HydrophobicContact CD2-CG 4.43Å; L128-L130 HydrophobicContact CG-CD2 3.96Å; L128-L130 HydrophobicContact CG-CG 4.3Å
129	N	96.4	Very high	92.6	Very high	5 Å²	5	52.5 Å²	52.5	3%	0.027	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	118.8	176.4	-56.2	-89.2	0	0	0	108.1	I84 K85 K86 F115 F116 S118	I84-N129 HydrophobicContact CG2-CB 4.04Å; K85-N129 WeakPolarHBondContact O-CA 3.26Å; K86-N129 VanDerWaalsContact CG-OD1 3.27Å; K86-N129 WeakPolarHBondContact CG-OD1 3.43Å; F115-N129 WeakPolarHBondContact CA-O 3.36Å; F116-N129 HydrophobicContact CD1-CB 3.89Å; F116-N129 HydrophobicContact CD2-CB 3.93Å; F116-N129 HydrophobicContact CE1-CB 3.54Å; F116-N129 HydrophobicContact CE2-CB 3.57Å; F116-N129 VanDerWaalsContact CE2-CG 3.42Å; F116-N129 VanDerWaalsContact CE2-ND2 3.29Å; F116-N129 WeakPolarHBondContact CE2-ND2 3.19Å; F116-N129 HydrophobicContact CG-CB 4.08Å; F116-N129 HydrophobicContact CZ-CB 3.37Å; F116-N129 PolarHBondContact N-O 2.71Å; F116-N129 WeakPolarHBondContact O-CB 3.26Å; F116-N129 PolarHBondContact O-N 2.89Å; F116-N129 PolarHBondContact O-ND2 3.23Å; S118-N129 PolarHBondContact OG-ND2 3.11Å
130	L	97.4	Very high	92.9	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	115	175.3	-56.5	177.4	0	0	0	108.4	I84 K85 E97 L98 M101 L112 F115 L128 L132	I84-L130 CarbonylContact C-O 3.56Å; I84-L130 WeakPolarHBondContact CA-O 3.37Å; K85-L130 HydrophobicContact CB-CB 4.34Å; K85-L130 PolarHBondContact N-O 3.39Å; K85-L130 PolarHBondContact O-N 2.61Å; E97-L130 HydrophobicContact CG-CD1 3.91Å; L98-L130 HydrophobicContact CB-CD2 4.38Å; L98-L130 HydrophobicContact CD1-CD2 3.84Å; M101-L130 HydrophobicContact SD-CD1 4.26Å; L112-L130 HydrophobicContact CD1-CB 3.88Å; L112-L130 HydrophobicContact CD1-CD2 3.96Å; L112-L130 HydrophobicContact CD1-CG 4.47Å; F115-L130 HydrophobicContact CB-CD2 4.01Å; L128-L130 HydrophobicContact CD1-CD2 4.06Å; L128-L130 HydrophobicContact CD2-CD2 4.02Å; L128-L130 HydrophobicContact CD2-CG 4.43Å; L128-L130 HydrophobicContact CG-CD2 3.96Å; L128-L130 HydrophobicContact CG-CG 4.3Å; L130-L132 HydrophobicContact CB-CD1 4.19Å; L130-L132 HydrophobicContact CB-CG 4.33Å; L130-L132 WeakPolarHBondContact O-CD1 3.34Å
131	V	98.3	Very high	93.5	Very high	3 Å²	3	58 Å²	58	2%	0.018	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	115.5	175.9	-172.4	0	0	0	0	108.3	V82 I84 R113 Y114 F116	V82-V131 HydrophobicContact CB-CG1 3.89Å; V82-V131 HydrophobicContact CG1-CG1 4.09Å; V82-V131 HydrophobicContact CG2-CG1 3.97Å; I84-V131 HydrophobicContact CG1-CG2 4.38Å; R113-V131 WeakPolarHBondContact CA-O 3.35Å; R113-V131 PolarHBondContact N-O 3.06Å; Y114-V131 HydrophobicContact CD2-CB 4.27Å; Y114-V131 HydrophobicContact CD2-CG1 4.14Å; Y114-V131 PolarHBondContact N-O 2.96Å; Y114-V131 VanDerWaalsContact N-O 3.17Å; Y114-V131 PolarHBondContact O-N 3.24Å; F116-V131 HydrophobicContact CD1-CG2 4.07Å; F116-V131 HydrophobicContact CE1-CG2 3.71Å
132	L	98.6	Very high	94.2	Very high	16 Å²	16	50.8 Å²	50.8	8%	0.084	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	156.9	-168.2	-57.5	137.5	0	0	0	109.9	V82 A83 K85 M101 V110 R111 L112 L130 Y134	V82-L132 CarbonylContact C-O 3.59Å; V82-L132 WeakPolarHBondContact CA-O 3.42Å; V82-L132 WeakPolarHBondContact CB-O 3.18Å; A83-L132 HydrophobicContact CB-CB 4.32Å; A83-L132 PolarHBondContact N-O 3.25Å; A83-L132 WeakPolarHBondContact O-CB 3.27Å; A83-L132 PolarHBondContact O-N 3.4Å; K85-L132 HydrophobicContact CB-CD1 3.85Å; M101-L132 HydrophobicContact CE-CD2 3.32Å; M101-L132 HydrophobicContact SD-CD2 4.03Å; V110-L132 HydrophobicContact CG1-CD2 4.03Å; V110-L132 HydrophobicContact CG2-CB 4.14Å; V110-L132 HydrophobicContact CG2-CD2 4.45Å; R111-L132 VanDerWaalsContact O-CA 3.28Å; R111-L132 WeakPolarHBondContact O-CA 3.34Å; L112-L132 HydrophobicContact CD1-CD2 4.44Å; L130-L132 HydrophobicContact CB-CD1 4.19Å; L130-L132 HydrophobicContact CB-CG 4.33Å; L130-L132 WeakPolarHBondContact O-CD1 3.34Å; L132-Y134 PolarHBondContact O-N 2.76Å
133	D	98.4	Very high	94.9	Very high	28 Å²	28	44.9 Å²	44.9	15%	0.15	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.4	133.3	164.3	-77	-18.1	0	0	0	110.4	V110 R111 R113	V110-D133 HydrophobicContact CG2-CB 4.15Å; V110-D133 WeakPolarHBondContact CG2-O 3.26Å; R111-D133 VanDerWaalsContact CB-OD2 3.24Å; R111-D133 WeakPolarHBondContact CB-OD2 3.36Å; R111-D133 PolarHBondContact O-N 3.42Å; R113-D133 IonicContact CZ-OD1 2.9Å; R113-D133 VanDerWaalsContact CZ-OD1 3.27Å; R113-D133 IonicContact NE-OD1 3.35Å; R113-D133 PolarHBondContact NE-OD1 2.76Å; R113-D133 IonicContact NH2-OD1 3.8Å; R113-D133 PolarHBondContact NH2-OD1 3.23Å
134	Y	98.4	Very high	95.8	Very high	64 Å²	64	41.3 Å²	41.3	25%	0.251	20%	0.195	S	C	.	.			trans	-80.5	134.7	171.2	178.8	-101.2	0	0	0	110.6	I62 Q72 L81 L132 P136	I62-Y134 HydrophobicContact CD1-CD2 4.27Å; I62-Y134 HydrophobicContact CD1-CE2 3.92Å; Q72-Y134 HydrophobicContact CB-CD2 4.43Å; Q72-Y134 HydrophobicContact CB-CE2 4.25Å; Q72-Y134 HydrophobicContact CG-CD2 4.02Å; Q72-Y134 HydrophobicContact CG-CE2 3.96Å; Q72-Y134 PolarHBondContact OE1-OH 2.9Å; L81-Y134 HydrophobicContact CB-CD1 3.84Å; L81-Y134 HydrophobicContact CB-CG 3.96Å; L81-Y134 HydrophobicContact CD1-CD1 3.96Å; L81-Y134 HydrophobicContact CD1-CE1 4.07Å; L81-Y134 VanDerWaalsContact O-CB 3.29Å; L81-Y134 WeakPolarHBondContact O-CB 3.49Å; L132-Y134 PolarHBondContact O-N 2.76Å; Y134-P136 HydrophobicContact CE1-CB 3.99Å
135	V	98.1	Very high	96.4	Very high	20 Å²	20	41.2 Å²	41.2	12%	0.121	19%	0.19	C	C	.	.			trans	-132.9	127.9	174.6	-175.9	0	0	0	0	107.6	L188 L189 K197	V135-L188 HydrophobicContact CB-CB 3.69Å; V135-L188 HydrophobicContact CB-CD1 3.94Å; V135-L188 HydrophobicContact CB-CG 4.38Å; V135-L188 HydrophobicContact CG1-CB 3.56Å; V135-L188 HydrophobicContact CG2-CB 4.16Å; V135-L188 HydrophobicContact CG2-CD1 4Å; V135-L189 WeakPolarHBondContact CG1-O 3.45Å; V135-K197 HydrophobicContact CG2-CD 3.91Å
136	P	96.8	Very high	96.8	Very high	50 Å²	50	41.9 Å²	41.9	33%	0.325	19%	0.191	S	C	.	.			trans	-77.9	-29.3	-159.9	27.7	-35.7	0	0	0	115.2	Y134 R141	Y134-P136 HydrophobicContact CE1-CB 3.99Å; P136-R141 PolarHBondContact O-NH1 2.89Å
137	E	97.9	Very high	97	Very high	44 Å²	44	43.4 Å²	43.4	21%	0.206	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	170.8	-174.6	-77.6	-63.2	163.2	0	0	112.6	R141 V142 L188 L189 P191	E137-R141 VanDerWaalsContact CD-CZ 3.45Å; E137-R141 IonicContact OE1-CZ 3.24Å; E137-R141 IonicContact OE1-NE 2.7Å; E137-R141 IonicContact OE1-NH1 3.67Å; E137-R141 IonicContact OE1-NH2 3.65Å; E137-R141 PolarHBondContact OE1-NH2 3.29Å; E137-R141 WeakPolarHBondContact OE2-CB 3.48Å; E137-R141 VanDerWaalsContact OE2-CD 3.31Å; E137-R141 WeakPolarHBondContact OE2-CD 3.42Å; E137-R141 IonicContact OE2-CZ 3.67Å; E137-R141 IonicContact OE2-NE 3.51Å; E137-R141 PolarHBondContact OE2-NE 2.88Å; E137-R141 IonicContact OE2-NH1 2.75Å; E137-R141 IonicContact OE2-NH2 3.83Å; E137-V142 HydrophobicContact CB-CG2 4.32Å; E137-L188 CarbonylContact O-C 3.51Å; E137-L188 WeakPolarHBondContact O-CA 3.43Å; E137-L189 HydrophobicContact CB-CB 4.21Å; E137-L189 WeakPolarHBondContact CB-O 3Å; E137-L189 PolarHBondContact N-O 2.93Å; E137-L189 VanDerWaalsContact N-O 3.08Å; E137-L189 PolarHBondContact O-N 2.67Å; E137-P191 HydrophobicContact CB-CG 3.83Å; E137-P191 HydrophobicContact CG-CG 3.56Å
138	T	98.4	Very high	97.2	Very high	23 Å²	23	49.5 Å²	49.5	14%	0.141	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	154.6	170.5	67	0	0	0	0	110.5	Y140 R141 V142 L187 L188	T138-Y140 PolarHBondContact O-N 2.98Å; T138-R141 PolarHBondContact O-N 3.31Å; T138-R141 PolarHBondContact OG1-N 3.25Å; T138-V142 PolarHBondContact O-N 2.94Å; T138-L187 CarbonylContact C-O 3.6Å; T138-L187 WeakPolarHBondContact CA-O 3.07Å; T138-L188 HydrophobicContact CG2-CD2 3.85Å
139	V	98.5	Very high	97.3	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.012	24%	0.244	C	C	.	.	H	α-helix	trans	-53.4	-38.7	173.2	175.9	0	0	0	0	110.3	R141 V142 A143 P184 L187 L189 L196 L250	V139-R141 PolarHBondContact O-N 2.88Å; V139-V142 PolarHBondContact O-N 3.46Å; V139-A143 WeakPolarHBondContact O-CB 3.42Å; V139-A143 PolarHBondContact O-N 2.81Å; V139-P184 HydrophobicContact CB-CB 4.22Å; V139-P184 HydrophobicContact CG1-CB 4.09Å; V139-P184 PolarHBondContact N-O 3.08Å; V139-L187 HydrophobicContact CB-CB 3.92Å; V139-L187 HydrophobicContact CB-CD1 4.29Å; V139-L187 HydrophobicContact CG2-CB 3.41Å; V139-L187 VanDerWaalsContact CG2-CB 3.41Å; V139-L187 HydrophobicContact CG2-CD1 3.96Å; V139-L187 HydrophobicContact CG2-CG 4.33Å; V139-L187 PolarHBondContact N-O 3.25Å; V139-L189 HydrophobicContact CB-CD1 4.27Å; V139-L189 HydrophobicContact CG2-CD1 3.7Å; V139-L189 HydrophobicContact CG2-CD2 3.94Å; V139-L189 HydrophobicContact CG2-CG 3.77Å; V139-L196 HydrophobicContact CG2-CD1 3.9Å; V139-L250 HydrophobicContact CG1-CD1 4.33Å; V139-L250 HydrophobicContact CG1-CD2 3.77Å; V139-L250 HydrophobicContact CG1-CG 4.46Å
140	Y	97.9	Very high	97.2	Very high	83 Å²	83	60.5 Å²	60.5	33%	0.325	28%	0.282	S	S	.	.	H	α-helix	trans	-57.1	-50.2	175.3	176.8	-107.6	0	0	0	113.1	T138 R144 P184 Q185	T138-Y140 PolarHBondContact O-N 2.98Å; Y140-R144 VanDerWaalsContact O-CB 3.23Å; Y140-R144 WeakPolarHBondContact O-CB 3.5Å; Y140-R144 PolarHBondContact O-N 2.91Å; Y140-P184 PolarHBondContact N-O 3.4Å; Y140-Q185 HydrophobicContact CD1-CG 4.15Å; Y140-Q185 HydrophobicContact CD2-CG 4.24Å; Y140-Q185 VanDerWaalsContact CD2-NE2 3.3Å; Y140-Q185 HydrophobicContact CG-CG 3.83Å
141	R	97.4	Very high	97	Very high	131 Å²	131	65.9 Å²	65.9	49%	0.494	31%	0.307	S	S	.	.	H	α-helix	trans	-65.9	-42.5	-178.2	-74.3	176.3	64.5	-170.1	-7.7	111.3	P136 E137 T138 V139 R144 H145	P136-R141 PolarHBondContact O-NH1 2.89Å; E137-R141 VanDerWaalsContact CD-CZ 3.45Å; E137-R141 IonicContact OE1-CZ 3.24Å; E137-R141 IonicContact OE1-NE 2.7Å; E137-R141 IonicContact OE1-NH1 3.67Å; E137-R141 IonicContact OE1-NH2 3.65Å; E137-R141 PolarHBondContact OE1-NH2 3.29Å; E137-R141 WeakPolarHBondContact OE2-CB 3.48Å; E137-R141 VanDerWaalsContact OE2-CD 3.31Å; E137-R141 WeakPolarHBondContact OE2-CD 3.42Å; E137-R141 IonicContact OE2-CZ 3.67Å; E137-R141 IonicContact OE2-NE 3.51Å; E137-R141 PolarHBondContact OE2-NE 2.88Å; E137-R141 IonicContact OE2-NH1 2.75Å; E137-R141 IonicContact OE2-NH2 3.83Å; T138-R141 PolarHBondContact O-N 3.31Å; T138-R141 PolarHBondContact OG1-N 3.25Å; V139-R141 PolarHBondContact O-N 2.88Å; R141-R144 PolarHBondContact O-N 3.28Å; R141-H145 PolarHBondContact O-N 3.33Å
142	V	97.3	Very high	96.7	Very high	24 Å²	24	68.7 Å²	68.7	15%	0.145	33%	0.325	C	S	.	.	H	α-helix	trans	-63.5	-51.4	176.9	174.3	0	0	0	0	110.8	E137 T138 V139 R144 H145 Y146 L153 L189	E137-V142 HydrophobicContact CB-CG2 4.32Å; T138-V142 PolarHBondContact O-N 2.94Å; V139-V142 PolarHBondContact O-N 3.46Å; V142-R144 VanDerWaalsContact C-N 3.29Å; V142-R144 PolarHBondContact O-N 3.22Å; V142-H145 WeakPolarHBondContact O-CB 3.28Å; V142-H145 PolarHBondContact O-N 3.07Å; V142-H145 VanDerWaalsContact O-N 3.1Å; V142-Y146 HydrophobicContact CG1-CD2 4.21Å; V142-Y146 HydrophobicContact CG1-CE2 4.1Å; V142-Y146 WeakPolarHBondContact O-CD2 3.41Å; V142-Y146 PolarHBondContact O-N 2.92Å; V142-L153 HydrophobicContact CG1-CD1 3.84Å; V142-L189 HydrophobicContact CB-CD1 4.18Å; V142-L189 HydrophobicContact CG2-CD1 3.81Å
143	A	96.8	Very high	96.5	Very high	17 Å²	17	68.4 Å²	68.4	14%	0.14	32%	0.323	C	S	.	.	H	α-helix	trans	-59	-40.9	178.2	0	0	0	0	0	112	V139 H145 Y146 S147 L250	V139-A143 WeakPolarHBondContact O-CB 3.42Å; V139-A143 PolarHBondContact O-N 2.81Å; A143-H145 VanDerWaalsContact C-N 3.34Å; A143-H145 PolarHBondContact O-N 2.82Å; A143-Y146 PolarHBondContact O-N 2.81Å; A143-S147 WeakPolarHBondContact O-CB 3.42Å; A143-S147 PolarHBondContact O-N 2.9Å; A143-L250 HydrophobicContact CB-CD2 3.93Å
144	R	96.1	Very high	96.4	Very high	115 Å²	115	69.5 Å²	69.5	43%	0.434	33%	0.332	S	S	.	.	H	α-helix	trans	-63.8	-36	176.4	-172.1	-179.4	-175.1	-168.7	7.4	112.7	Y140 R141 V142 R148	Y140-R144 VanDerWaalsContact O-CB 3.23Å; Y140-R144 WeakPolarHBondContact O-CB 3.5Å; Y140-R144 PolarHBondContact O-N 2.91Å; R141-R144 PolarHBondContact O-N 3.28Å; V142-R144 VanDerWaalsContact C-N 3.29Å; V142-R144 PolarHBondContact O-N 3.22Å; R144-R148 VanDerWaalsContact CZ-NH2 3.34Å; R144-R148 WeakPolarHBondContact O-CB 3.31Å; R144-R148 WeakPolarHBondContact O-CG 3.43Å; R144-R148 PolarHBondContact O-N 3.43Å
145	H	96.9	Very high	96.3	Very high	126 Å²	126	69 Å²	69	58%	0.583	33%	0.332	S	S	*	.	H	α-helix	trans	-60.6	-51.7	175.4	174.8	82.5	0	0	0	111.1	R141 V142 A143 S147 R148 A149	R141-H145 PolarHBondContact O-N 3.33Å; V142-H145 WeakPolarHBondContact O-CB 3.28Å; V142-H145 PolarHBondContact O-N 3.07Å; V142-H145 VanDerWaalsContact O-N 3.1Å; A143-H145 VanDerWaalsContact C-N 3.34Å; A143-H145 PolarHBondContact O-N 2.82Å; H145-S147 PolarHBondContact O-N 2.85Å; H145-R148 PolarHBondContact O-N 2.94Å; H145-A149 PolarHBondContact O-N 3.28Å; H145-A149 VanDerWaalsContact O-N 3.11Å
146	Y	96.2	Very high	96.3	Very high	51 Å²	51	69 Å²	69	20%	0.2	33%	0.333	C	S	.	.	H	α-helix	trans	-62.1	-44.6	177	-79.3	-87.7	0	0	0	112.3	V142 A143 R148 A149 K150 Q151 T152 L153 P154	V142-Y146 HydrophobicContact CG1-CD2 4.21Å; V142-Y146 HydrophobicContact CG1-CE2 4.1Å; V142-Y146 WeakPolarHBondContact O-CD2 3.41Å; V142-Y146 PolarHBondContact O-N 2.92Å; A143-Y146 PolarHBondContact O-N 2.81Å; Y146-R148 PolarHBondContact O-N 3.37Å; Y146-A149 CarbonylContact O-C 3.43Å; Y146-A149 WeakPolarHBondContact O-CA 3.44Å; Y146-A149 PolarHBondContact O-N 3.41Å; Y146-A149 VanDerWaalsContact O-N 3.08Å; Y146-K150 PolarHBondContact O-N 3.07Å; Y146-K150 VanDerWaalsContact O-N 3.14Å; Y146-Q151 CarbonylContact C-O 3.56Å; Y146-Q151 VanDerWaalsContact C-O 3.25Å; Y146-Q151 HydrophobicContact CD1-CB 3.89Å; Y146-Q151 PolarHBondContact O-N 3.32Å; Y146-T152 WeakPolarHBondContact CD1-O 3.29Å; Y146-L153 HydrophobicContact CD2-CD1 3.68Å; Y146-L153 HydrophobicContact CE2-CD1 3.41Å; Y146-L153 VanDerWaalsContact CE2-CD1 3.41Å; Y146-L153 HydrophobicContact CG-CD1 4.43Å; Y146-P154 VanDerWaalsContact CE1-CD 3.47Å; Y146-P154 HydrophobicContact CE1-CG 4.23Å
147	S	94.8	Very high	96.4	Very high	57 Å²	57	68 Å²	68	40%	0.399	32%	0.323	S	S	.	.	H	α-helix	trans	-58.5	-44.7	178.4	-175.4	0	0	0	0	112.1	A143 H145 A149 K150 G253	A143-S147 WeakPolarHBondContact O-CB 3.42Å; A143-S147 PolarHBondContact O-N 2.9Å; H145-S147 PolarHBondContact O-N 2.85Å; S147-A149 VanDerWaalsContact C-N 3.31Å; S147-A149 PolarHBondContact O-N 3.21Å; S147-K150 WeakPolarHBondContact O-CA 3.34Å; S147-K150 PolarHBondContact O-N 2.98Å; S147-G253 WeakPolarHBondContact CB-O 3.41Å; S147-G253 PolarHBondContact OG-O 2.73Å
148	R	95.6	Very high	96.4	Very high	179 Å²	179	66 Å²	66	68%	0.675	31%	0.313	S	S	*	.	H	α-helix	trans	-63.5	-34.9	174.7	-77.9	174.4	164.6	-178.7	-10.8	113.2	R144 H145 Y146 K150	R144-R148 VanDerWaalsContact CZ-NH2 3.34Å; R144-R148 WeakPolarHBondContact O-CB 3.31Å; R144-R148 WeakPolarHBondContact O-CG 3.43Å; R144-R148 PolarHBondContact O-N 3.43Å; H145-R148 PolarHBondContact O-N 2.94Å; Y146-R148 PolarHBondContact O-N 3.37Å; R148-K150 PolarHBondContact O-N 2.88Å
149	A	96.5	Very high	96.4	Very high	48 Å²	48	66.2 Å²	66.2	40%	0.397	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	2.7	173.6	0	0	0	0	0	113.3	H145 Y146 S147 Q151	H145-A149 PolarHBondContact O-N 3.28Å; H145-A149 VanDerWaalsContact O-N 3.11Å; Y146-A149 CarbonylContact O-C 3.43Å; Y146-A149 WeakPolarHBondContact O-CA 3.44Å; Y146-A149 PolarHBondContact O-N 3.41Å; Y146-A149 VanDerWaalsContact O-N 3.08Å; S147-A149 VanDerWaalsContact C-N 3.31Å; S147-A149 PolarHBondContact O-N 3.21Å; A149-Q151 HydrophobicContact CB-CB 4.45Å; A149-Q151 HydrophobicContact CB-CG 4.28Å; A149-Q151 PolarHBondContact O-N 3.03Å
150	K	93.9	Very high	96.4	Very high	189 Å²	189	66.2 Å²	66.2	82%	0.822	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	26.2	-172.7	-58.2	-179.4	178.9	179.1	0	113.1	Y146 S147 R148	Y146-K150 PolarHBondContact O-N 3.07Å; Y146-K150 VanDerWaalsContact O-N 3.14Å; S147-K150 WeakPolarHBondContact O-CA 3.34Å; S147-K150 PolarHBondContact O-N 2.98Å; R148-K150 PolarHBondContact O-N 2.88Å
151	Q	94.2	Very high	96.5	Very high	113 Å²	113	62.7 Å²	62.7	53%	0.528	30%	0.298	S	S	.	.			trans	-106.1	159.9	176.7	-68.9	177.5	-6.2	0	0	110.2	Y146 A149	Y146-Q151 CarbonylContact C-O 3.56Å; Y146-Q151 VanDerWaalsContact C-O 3.25Å; Y146-Q151 HydrophobicContact CD1-CB 3.89Å; Y146-Q151 PolarHBondContact O-N 3.32Å; A149-Q151 HydrophobicContact CB-CB 4.45Å; A149-Q151 HydrophobicContact CB-CG 4.28Å; A149-Q151 PolarHBondContact O-N 3.03Å
152	T	91.1	Very high	96.5	Very high	63 Å²	63	56.5 Å²	56.5	39%	0.387	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-99.1	147.7	168.9	51.8	0	0	0	0	109.2	Y146	Y146-T152 WeakPolarHBondContact CD1-O 3.29Å
153	L	95.2	Very high	96.6	Very high	10 Å²	10	55.4 Å²	55.4	5%	0.052	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-58	132.7	172.7	-175.4	68.7	0	0	0	109.2	V142 Y146 M155 Y157 V158 Y161 L250	V142-L153 HydrophobicContact CG1-CD1 3.84Å; Y146-L153 HydrophobicContact CD2-CD1 3.68Å; Y146-L153 HydrophobicContact CE2-CD1 3.41Å; Y146-L153 VanDerWaalsContact CE2-CD1 3.41Å; Y146-L153 HydrophobicContact CG-CD1 4.43Å; L153-M155 PolarHBondContact O-N 3.34Å; L153-Y157 HydrophobicContact CD1-CD2 4.21Å; L153-Y157 HydrophobicContact CD1-CG 4.46Å; L153-V158 HydrophobicContact CB-CG2 4.26Å; L153-V158 HydrophobicContact CD2-CG2 3.99Å; L153-V158 HydrophobicContact CG-CG2 4.26Å; L153-Y161 HydrophobicContact CD2-CD2 4Å; L153-Y161 HydrophobicContact CD2-CE2 3.9Å; L153-L250 HydrophobicContact CD2-CD2 4.06Å
154	P	96.1	Very high	96.7	Very high	50 Å²	50	54.6 Å²	54.6	33%	0.325	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-54.8	138.6	176.3	-28	34.1	0	0	0	111.8	Y146 V156 Y157 V158	Y146-P154 VanDerWaalsContact CE1-CD 3.47Å; Y146-P154 HydrophobicContact CE1-CG 4.23Å; P154-V156 VanDerWaalsContact C-N 3.25Å; P154-V156 HydrophobicContact CB-CG1 4.38Å; P154-V156 PolarHBondContact O-N 2.93Å; P154-Y157 HydrophobicContact CB-CD2 3.87Å; P154-Y157 HydrophobicContact CB-CE2 4.34Å; P154-Y157 HydrophobicContact CG-CD2 4.01Å; P154-Y157 HydrophobicContact CG-CE2 4.24Å; P154-Y157 WeakPolarHBondContact O-CB 3.37Å; P154-Y157 PolarHBondContact O-N 3.43Å; P154-V158 PolarHBondContact O-N 3.18Å
155	M	97.4	Very high	96.9	Very high	54 Å²	54	49.1 Å²	49.1	27%	0.266	24%	0.241	S	C	.	.	H	α-helix	trans	-59.9	-34.6	-169.2	-170.4	56.2	54.1	0	0	113.3	L153 Y157 V158 K159 L251 P310 F339	L153-M155 PolarHBondContact O-N 3.34Å; M155-Y157 PolarHBondContact O-N 2.94Å; M155-V158 WeakPolarHBondContact O-CB 3.48Å; M155-V158 PolarHBondContact O-N 3.06Å; M155-V158 VanDerWaalsContact O-N 3.09Å; M155-V158 HydrophobicContact SD-CB 4.04Å; M155-V158 HydrophobicContact SD-CG1 4.38Å; M155-V158 HydrophobicContact SD-CG2 4.39Å; M155-K159 WeakPolarHBondContact O-CG 3.45Å; M155-K159 PolarHBondContact O-N 3.23Å; M155-L251 HydrophobicContact CE-CD2 3.73Å; M155-L251 HydrophobicContact SD-CD2 4.24Å; M155-P310 VanDerWaalsContact CE-CD 3.46Å; M155-P310 HydrophobicContact CE-CG 3.72Å; M155-P310 HydrophobicContact CG-CG 4.13Å; M155-P310 HydrophobicContact SD-CG 4.07Å; M155-F339 HydrophobicContact CG-CE2 4.43Å; M155-F339 HydrophobicContact SD-CE2 3.61Å; M155-F339 HydrophobicContact SD-CZ 3.68Å
156	V	97.1	Very high	97	Very high	21 Å²	21	43.1 Å²	43.1	13%	0.127	21%	0.213	C	C	.	.	H	α-helix	trans	-56.4	-38.7	175.4	64.9	0	0	0	0	112.2	P154 K159 L160 P351	P154-V156 VanDerWaalsContact C-N 3.25Å; P154-V156 HydrophobicContact CB-CG1 4.38Å; P154-V156 PolarHBondContact O-N 2.93Å; V156-K159 PolarHBondContact O-N 3.49Å; V156-L160 HydrophobicContact CG2-CD1 4.1Å; V156-L160 WeakPolarHBondContact O-CB 3.42Å; V156-L160 VanDerWaalsContact O-CG 3.28Å; V156-L160 WeakPolarHBondContact O-CG 3.21Å; V156-L160 PolarHBondContact O-N 3.38Å; V156-P351 HydrophobicContact CG1-CG 3.59Å
157	Y	98.2	Very high	97.1	Very high	29 Å²	29	40.8 Å²	40.8	11%	0.114	20%	0.204	C	C	.	.	H	α-helix	trans	-73	-37.4	176.2	-66.7	-59.4	0	0	0	112	L153 P154 M155 K159 L160 Y161 A194 P351	L153-Y157 HydrophobicContact CD1-CD2 4.21Å; L153-Y157 HydrophobicContact CD1-CG 4.46Å; P154-Y157 HydrophobicContact CB-CD2 3.87Å; P154-Y157 HydrophobicContact CB-CE2 4.34Å; P154-Y157 HydrophobicContact CG-CD2 4.01Å; P154-Y157 HydrophobicContact CG-CE2 4.24Å; P154-Y157 WeakPolarHBondContact O-CB 3.37Å; P154-Y157 PolarHBondContact O-N 3.43Å; M155-Y157 PolarHBondContact O-N 2.94Å; Y157-K159 VanDerWaalsContact C-N 3.3Å; Y157-K159 PolarHBondContact O-N 2.98Å; Y157-L160 HydrophobicContact CD1-CD1 4.37Å; Y157-L160 PolarHBondContact O-N 3.07Å; Y157-Y161 HydrophobicContact CD1-CE1 4.26Å; Y157-Y161 AromaticContact CD1-CZ 3.85Å; Y157-Y161 WeakPolarHBondContact CD1-OH 3.42Å; Y157-Y161 HydrophobicContact CG-CE2 4.44Å; Y157-Y161 WeakPolarHBondContact O-CB 3.4Å; Y157-Y161 VanDerWaalsContact O-CD2 3.27Å; Y157-Y161 WeakPolarHBondContact O-CD2 3.47Å; Y157-Y161 PolarHBondContact O-N 3.35Å; Y157-A194 HydrophobicContact CD1-CB 4.4Å; Y157-A194 HydrophobicContact CE1-CB 4.27Å; Y157-P351 HydrophobicContact CE2-CG 3.9Å
158	V	98.6	Very high	97.3	Very high	1 Å²	1	38 Å²	38	1%	0.006	19%	0.185	C	C	.	.	H	α-helix	trans	-58.3	-46.8	173.2	-176.4	0	0	0	0	109.9	L153 P154 M155 M162 L247 L250 L251 F339	L153-V158 HydrophobicContact CB-CG2 4.26Å; L153-V158 HydrophobicContact CD2-CG2 3.99Å; L153-V158 HydrophobicContact CG-CG2 4.26Å; P154-V158 PolarHBondContact O-N 3.18Å; M155-V158 WeakPolarHBondContact O-CB 3.48Å; M155-V158 PolarHBondContact O-N 3.06Å; M155-V158 VanDerWaalsContact O-N 3.09Å; M155-V158 HydrophobicContact SD-CB 4.04Å; M155-V158 HydrophobicContact SD-CG1 4.38Å; M155-V158 HydrophobicContact SD-CG2 4.39Å; V158-M162 HydrophobicContact CG1-CG 4.37Å; V158-M162 VanDerWaalsContact O-CB 3.29Å; V158-M162 WeakPolarHBondContact O-CB 3.32Å; V158-M162 VanDerWaalsContact O-CG 3.26Å; V158-M162 WeakPolarHBondContact O-CG 3.24Å; V158-M162 PolarHBondContact O-N 2.81Å; V158-L247 HydrophobicContact CG1-CD1 3.78Å; V158-L250 HydrophobicContact CG1-CB 4.3Å; V158-L250 HydrophobicContact CG1-CD1 4.42Å; V158-L250 HydrophobicContact CG2-CB 4.32Å; V158-L251 HydrophobicContact CG1-CD2 4.21Å; V158-F339 HydrophobicContact CG1-CE1 4.41Å; V158-F339 HydrophobicContact CG1-CZ 4.03Å
159	K	98.8	Very high	97.4	Very high	27 Å²	27	29.5 Å²	29.5	12%	0.117	15%	0.153	C	C	.	.	H	α-helix	trans	-59.8	-52.6	175.6	-69.4	179.6	-179.5	-170.9	0	111.2	M155 V156 Y157 Y161 Y163 F339 F340 E342 L343	M155-K159 WeakPolarHBondContact O-CG 3.45Å; M155-K159 PolarHBondContact O-N 3.23Å; V156-K159 PolarHBondContact O-N 3.49Å; Y157-K159 VanDerWaalsContact C-N 3.3Å; Y157-K159 PolarHBondContact O-N 2.98Å; K159-Y161 PolarHBondContact O-N 3.3Å; K159-Y163 WeakPolarHBondContact O-CB 3.41Å; K159-Y163 PolarHBondContact O-N 3.34Å; K159-F339 HydrophobicContact CB-CE1 4.42Å; K159-F339 HydrophobicContact CB-CZ 4.49Å; K159-F339 HydrophobicContact CD-CE2 4.41Å; K159-F339 VanDerWaalsContact CD-O 3.29Å; K159-F339 WeakPolarHBondContact CD-O 3.26Å; K159-F339 WeakPolarHBondContact CE-O 3.3Å; K159-F339 HydrophobicContact CG-CD1 4.25Å; K159-F339 HydrophobicContact CG-CD2 4.38Å; K159-F339 HydrophobicContact CG-CE1 3.7Å; K159-F339 HydrophobicContact CG-CE2 3.81Å; K159-F339 HydrophobicContact CG-CZ 3.46Å; K159-F339 VanDerWaalsContact CG-CZ 3.46Å; K159-F339 PolarHBondContact NZ-O 3.49Å; K159-F340 HydrophobicContact CB-CD1 4.24Å; K159-F340 VanDerWaalsContact O-CE1 3.24Å; K159-F340 WeakPolarHBondContact O-CE1 3.39Å; K159-E342 HydrophobicContact CD-CB 4.24Å; K159-E342 VanDerWaalsContact CD-OE2 3.29Å; K159-E342 WeakPolarHBondContact CD-OE2 3.22Å; K159-E342 WeakPolarHBondContact CE-OE2 3.38Å; K159-E342 IonicContact NZ-OE2 3.62Å; K159-E342 PolarHBondContact NZ-OE2 2.87Å; K159-L343 HydrophobicContact CB-CD1 4.07Å; K159-L343 HydrophobicContact CB-CD2 3.93Å; K159-L343 HydrophobicContact CB-CG 4.05Å
160	L	98.8	Very high	97.5	Very high	2 Å²	2	27.5 Å²	27.5	1%	0.01	14%	0.136	C	C	.	.	H	α-helix	trans	-58.8	-46.9	-178.7	-77.6	165.1	0	0	0	112.8	V156 Y157 Q164 A194 L343 L350 K356 P357 L359	V156-L160 HydrophobicContact CG2-CD1 4.1Å; V156-L160 WeakPolarHBondContact O-CB 3.42Å; V156-L160 VanDerWaalsContact O-CG 3.28Å; V156-L160 WeakPolarHBondContact O-CG 3.21Å; V156-L160 PolarHBondContact O-N 3.38Å; Y157-L160 HydrophobicContact CD1-CD1 4.37Å; Y157-L160 PolarHBondContact O-N 3.07Å; L160-Q164 WeakPolarHBondContact O-CB 3.5Å; L160-Q164 VanDerWaalsContact O-CG 3.27Å; L160-Q164 WeakPolarHBondContact O-CG 3.37Å; L160-Q164 PolarHBondContact O-N 3.27Å; L160-Q164 VanDerWaalsContact O-N 3.15Å; L160-Q164 PolarHBondContact O-NE2 2.82Å; L160-A194 HydrophobicContact CD1-CB 4.03Å; L160-L343 HydrophobicContact CD2-CD2 3.88Å; L160-L343 HydrophobicContact CG-CD2 3.92Å; L160-L350 HydrophobicContact CD1-CD2 3.36Å; L160-K356 HydrophobicContact CD2-CB 4.48Å; L160-P357 HydrophobicContact CD2-CG 4.36Å; L160-L359 HydrophobicContact CD2-CD1 4.1Å; L160-L359 HydrophobicContact CD2-CD2 4.34Å
161	Y	98.8	Very high	97.8	Very high	10 Å²	10	19.3 Å²	19.3	4%	0.039	10%	0.1	C	C	.	.	H	α-helix	trans	-71.1	-44.5	-176.1	-59.4	-19.2	0	0	0	111.1	L153 Y157 K159 Q164 L165 L189 A194 L196	L153-Y161 HydrophobicContact CD2-CD2 4Å; L153-Y161 HydrophobicContact CD2-CE2 3.9Å; Y157-Y161 HydrophobicContact CD1-CE1 4.26Å; Y157-Y161 AromaticContact CD1-CZ 3.85Å; Y157-Y161 WeakPolarHBondContact CD1-OH 3.42Å; Y157-Y161 HydrophobicContact CG-CE2 4.44Å; Y157-Y161 WeakPolarHBondContact O-CB 3.4Å; Y157-Y161 VanDerWaalsContact O-CD2 3.27Å; Y157-Y161 WeakPolarHBondContact O-CD2 3.47Å; Y157-Y161 PolarHBondContact O-N 3.35Å; K159-Y161 PolarHBondContact O-N 3.3Å; Y161-Q164 PolarHBondContact O-N 2.86Å; Y161-L165 WeakPolarHBondContact O-CB 3.22Å; Y161-L165 PolarHBondContact O-N 2.92Å; Y161-L189 HydrophobicContact CD1-CD2 3.57Å; Y161-L189 HydrophobicContact CD2-CD1 4.14Å; Y161-L189 HydrophobicContact CD2-CD2 4.29Å; Y161-L189 HydrophobicContact CE1-CD1 4.26Å; Y161-L189 HydrophobicContact CE1-CD2 3.54Å; Y161-L189 HydrophobicContact CE2-CD1 3.63Å; Y161-L189 HydrophobicContact CE2-CD2 4.24Å; Y161-L189 HydrophobicContact CG-CD2 3.98Å; Y161-A194 HydrophobicContact CE1-CB 4.3Å; Y161-L196 HydrophobicContact CG-CD1 4.37Å; Y161-L196 WeakPolarHBondContact O-CD1 3.41Å
162	M	98.9	Very high	98	Very high	1 Å²	1	14 Å²	14	1%	0.005	8%	0.075	C	C	.	.	H	α-helix	trans	-67.1	-39.3	179.2	-67.9	-54.8	-48.4	0	0	112.1	V158 L165 F166 A243 V246 L247 L250 F340	V158-M162 HydrophobicContact CG1-CG 4.37Å; V158-M162 VanDerWaalsContact O-CB 3.29Å; V158-M162 WeakPolarHBondContact O-CB 3.32Å; V158-M162 VanDerWaalsContact O-CG 3.26Å; V158-M162 WeakPolarHBondContact O-CG 3.24Å; V158-M162 PolarHBondContact O-N 2.81Å; M162-L165 HydrophobicContact CE-CD2 3.85Å; M162-L165 PolarHBondContact O-N 2.94Å; M162-L165 HydrophobicContact SD-CD2 4.25Å; M162-F166 HydrophobicContact CB-CE2 4.2Å; M162-F166 HydrophobicContact CE-CE2 3.7Å; M162-F166 HydrophobicContact CE-CZ 3.69Å; M162-F166 WeakPolarHBondContact O-CD2 3.17Å; M162-F166 WeakPolarHBondContact O-CG 3.41Å; M162-F166 PolarHBondContact O-N 3.1Å; M162-A243 HydrophobicContact CE-CB 4.19Å; M162-A243 VanDerWaalsContact CE-O 3.28Å; M162-A243 WeakPolarHBondContact CE-O 3.46Å; M162-V246 HydrophobicContact SD-CB 4.34Å; M162-V246 HydrophobicContact SD-CG1 3.83Å; M162-L247 HydrophobicContact CE-CB 3.91Å; M162-L247 HydrophobicContact CG-CB 4.28Å; M162-L247 HydrophobicContact CG-CD1 3.98Å; M162-L247 HydrophobicContact SD-CB 4.05Å; M162-L250 HydrophobicContact CG-CD1 4.4Å; M162-L250 HydrophobicContact SD-CD1 4.2Å; M162-F340 HydrophobicContact CB-CE1 3.99Å; M162-F340 HydrophobicContact CB-CZ 3.93Å
163	Y	98.9	Very high	98.4	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-61	-47.6	176	-175.1	-89.9	0	0	0	112	K159 L165 F166 R167 C335 F340 L343 L359 F362	K159-Y163 WeakPolarHBondContact O-CB 3.41Å; K159-Y163 PolarHBondContact O-N 3.34Å; Y163-L165 VanDerWaalsContact C-N 3.34Å; Y163-L165 PolarHBondContact O-N 3.1Å; Y163-F166 PolarHBondContact O-N 2.92Å; Y163-R167 HydrophobicContact CD1-CG 4.42Å; Y163-R167 HydrophobicContact CE1-CG 4.03Å; Y163-R167 PolarHBondContact O-N 2.87Å; Y163-C335 HydrophobicContact CD2-CB 4.21Å; Y163-C335 HydrophobicContact CE2-CB 3.81Å; Y163-C335 WeakPolarHBondContact CE2-O 3.4Å; Y163-F340 HydrophobicContact CD2-CB 3.89Å; Y163-F340 HydrophobicContact CD2-CD1 4.01Å; Y163-F340 HydrophobicContact CD2-CD2 4.1Å; Y163-F340 AromaticContact CD2-CG 3.73Å; Y163-F340 HydrophobicContact CD2-CG 3.73Å; Y163-F340 HydrophobicContact CE2-CB 4.41Å; Y163-F340 HydrophobicContact CG-CD1 4.38Å; Y163-L343 HydrophobicContact CD2-CD1 4.21Å; Y163-L343 HydrophobicContact CG-CD1 3.9Å; Y163-L359 HydrophobicContact CD1-CB 4.5Å; Y163-L359 HydrophobicContact CD1-CD2 4.01Å; Y163-L359 HydrophobicContact CE1-CB 3.92Å; Y163-L359 HydrophobicContact CE1-CD2 4.25Å; Y163-L359 WeakPolarHBondContact CE1-O 2.79Å; Y163-L359 PolarHBondContact OH-O 3.26Å; Y163-F362 VanDerWaalsContact OH-CE2 3.27Å; Y163-F362 WeakPolarHBondContact OH-CE2 3.46Å; Y163-F362 VanDerWaalsContact OH-CZ 3.26Å; Y163-F362 WeakPolarHBondContact OH-CZ 3.47Å
164	Q	98.9	Very high	98.5	Very high	1 Å²	1	13.7 Å²	13.7	1%	0.005	7%	0.072	C	C	.	.	H	α-helix	trans	-66.6	-35	178.4	-72.9	175.5	89.4	0	0	112.4	N108 L160 Y161 R167 S168 A194 L196 L359	N108-Q164 HydrophobicContact CB-CB 4.44Å; N108-Q164 WeakPolarHBondContact ND2-CB 3.42Å; N108-Q164 WeakPolarHBondContact ND2-CG 3.38Å; N108-Q164 PolarHBondContact ND2-OE1 2.89Å; L160-Q164 WeakPolarHBondContact O-CB 3.5Å; L160-Q164 VanDerWaalsContact O-CG 3.27Å; L160-Q164 WeakPolarHBondContact O-CG 3.37Å; L160-Q164 PolarHBondContact O-N 3.27Å; L160-Q164 VanDerWaalsContact O-N 3.15Å; L160-Q164 PolarHBondContact O-NE2 2.82Å; Y161-Q164 PolarHBondContact O-N 2.86Å; Q164-R167 PolarHBondContact O-N 3.02Å; Q164-S168 PolarHBondContact O-N 3.36Å; Q164-A194 PolarHBondContact NE2-O 2.65Å; Q164-L196 HydrophobicContact CB-CB 3.9Å; Q164-L196 HydrophobicContact CB-CD2 4.34Å; Q164-L359 HydrophobicContact CG-CD2 4.03Å
165	L	98.9	Very high	98.6	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-61.2	-51.1	170.7	172.5	55.9	0	0	0	110.5	Y161 M162 Y163 R167 S168 L169 I182 L187 L196 A243	Y161-L165 WeakPolarHBondContact O-CB 3.22Å; Y161-L165 PolarHBondContact O-N 2.92Å; M162-L165 HydrophobicContact CE-CD2 3.85Å; M162-L165 PolarHBondContact O-N 2.94Å; M162-L165 HydrophobicContact SD-CD2 4.25Å; Y163-L165 VanDerWaalsContact C-N 3.34Å; Y163-L165 PolarHBondContact O-N 3.1Å; L165-R167 VanDerWaalsContact C-N 3.33Å; L165-R167 PolarHBondContact O-N 3.32Å; L165-S168 PolarHBondContact O-N 3.26Å; L165-S168 VanDerWaalsContact O-N 3.1Å; L165-S168 PolarHBondContact O-OG 3.3Å; L165-L169 HydrophobicContact CD1-CD1 4.16Å; L165-L169 HydrophobicContact CD1-CG 4.05Å; L165-L169 HydrophobicContact CG-CD1 4.27Å; L165-L169 WeakPolarHBondContact O-CG 3.38Å; L165-L169 PolarHBondContact O-N 2.75Å; L165-I182 HydrophobicContact CD1-CD1 4.32Å; L165-I182 HydrophobicContact CD1-CG2 4.37Å; L165-I182 HydrophobicContact CD2-CG2 4.27Å; L165-L187 HydrophobicContact CD1-CD2 3.67Å; L165-L187 HydrophobicContact CD2-CD1 3.97Å; L165-L187 HydrophobicContact CD2-CD2 4.38Å; L165-L196 HydrophobicContact CB-CD2 4.41Å; L165-A243 HydrophobicContact CD2-CB 3.91Å; L165-A243 HydrophobicContact CG-CB 4.47Å
166	F	98.9	Very high	98.7	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-61.7	-37.3	178.6	-70.9	-53.9	0	0	0	112.9	M162 Y163 L169 A170 A243 L316 L320 P331 A334 C335 F340	M162-F166 HydrophobicContact CB-CE2 4.2Å; M162-F166 HydrophobicContact CE-CE2 3.7Å; M162-F166 HydrophobicContact CE-CZ 3.69Å; M162-F166 WeakPolarHBondContact O-CD2 3.17Å; M162-F166 WeakPolarHBondContact O-CG 3.41Å; M162-F166 PolarHBondContact O-N 3.1Å; Y163-F166 PolarHBondContact O-N 2.92Å; F166-L169 HydrophobicContact CD1-CD1 4.38Å; F166-L169 PolarHBondContact O-N 2.92Å; F166-A170 WeakPolarHBondContact O-CB 3.27Å; F166-A170 PolarHBondContact O-N 3.1Å; F166-A243 HydrophobicContact CD1-CB 4.43Å; F166-A243 HydrophobicContact CE1-CB 3.62Å; F166-A243 HydrophobicContact CZ-CB 4.06Å; F166-L316 HydrophobicContact CE2-CD2 4.37Å; F166-L320 HydrophobicContact CE1-CD1 4.41Å; F166-L320 HydrophobicContact CE1-CD2 3.95Å; F166-L320 HydrophobicContact CE2-CD1 4.41Å; F166-L320 HydrophobicContact CZ-CD1 3.6Å; F166-L320 HydrophobicContact CZ-CD2 3.89Å; F166-L320 HydrophobicContact CZ-CG 4.42Å; F166-P331 HydrophobicContact CB-CB 4.49Å; F166-P331 HydrophobicContact CD1-CB 4.4Å; F166-P331 VanDerWaalsContact O-CB 3.31Å; F166-P331 WeakPolarHBondContact O-CB 3.27Å; F166-A334 HydrophobicContact CB-CB 4.4Å; F166-A334 HydrophobicContact CD1-CB 3.75Å; F166-A334 HydrophobicContact CD2-CB 3.8Å; F166-A334 HydrophobicContact CE1-CB 3.92Å; F166-A334 HydrophobicContact CE2-CB 3.97Å; F166-A334 HydrophobicContact CG-CB 3.72Å; F166-A334 HydrophobicContact CZ-CB 4.04Å; F166-C335 WeakPolarHBondContact CB-SG 3.39Å; F166-F340 HydrophobicContact CD2-CE2 4.06Å; F166-F340 AromaticContact CD2-CZ 3.88Å; F166-F340 HydrophobicContact CD2-CZ 3.88Å; F166-F340 HydrophobicContact CE2-CE2 4.28Å; F166-F340 AromaticContact CE2-CZ 3.98Å; F166-F340 HydrophobicContact CE2-CZ 3.98Å
167	R	98.9	Very high	98.7	Very high	1 Å²	1	12.2 Å²	12.2	0%	0.004	7%	0.065	C	C	.	.	H	α-helix	trans	-60.4	-46.6	170.5	-83.4	-167.7	77.1	-169.2	8.5	112.3	Y163 Q164 L165 L169 A170 Y171 L359 N361 F362 E366	Y163-R167 HydrophobicContact CD1-CG 4.42Å; Y163-R167 HydrophobicContact CE1-CG 4.03Å; Y163-R167 PolarHBondContact O-N 2.87Å; Q164-R167 PolarHBondContact O-N 3.02Å; L165-R167 VanDerWaalsContact C-N 3.33Å; L165-R167 PolarHBondContact O-N 3.32Å; R167-L169 VanDerWaalsContact C-N 3.27Å; R167-L169 PolarHBondContact O-N 3.26Å; R167-A170 PolarHBondContact O-N 2.89Å; R167-Y171 PolarHBondContact O-N 3Å; R167-L359 VanDerWaalsContact NH1-C 3.27Å; R167-L359 PolarHBondContact NH1-O 3.11Å; R167-N361 PolarHBondContact NH1-OD1 3.44Å; R167-N361 VanDerWaalsContact NH2-C 3.26Å; R167-N361 PolarHBondContact NH2-O 3.39Å; R167-N361 PolarHBondContact NH2-OD1 3.1Å; R167-F362 HydrophobicContact CG-CE1 3.68Å; R167-F362 HydrophobicContact CG-CZ 3.75Å; R167-E366 IonicContact CZ-OE1 2.64Å; R167-E366 VanDerWaalsContact CZ-OE1 3.29Å; R167-E366 IonicContact NE-OE1 3.02Å; R167-E366 PolarHBondContact NE-OE1 3.31Å; R167-E366 IonicContact NH2-OE1 2.67Å; R167-E366 PolarHBondContact NH2-OE1 3.33Å; R167-E366 IonicContact NH2-OE2 3.01Å; R167-E366 PolarHBondContact NH2-OE2 3.25Å
168	S	98.9	Very high	98.8	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-59.9	-39.2	177.5	77.1	0	0	0	0	112.1	N108 Q164 L165 Y171 I172	N108-S168 WeakPolarHBondContact O-CB 3.32Å; Q164-S168 PolarHBondContact O-N 3.36Å; L165-S168 PolarHBondContact O-N 3.26Å; L165-S168 VanDerWaalsContact O-N 3.1Å; L165-S168 PolarHBondContact O-OG 3.3Å; S168-Y171 PolarHBondContact O-N 3.21Å; S168-I172 WeakPolarHBondContact O-CG1 3.35Å; S168-I172 PolarHBondContact O-N 2.86Å; S168-I172 VanDerWaalsContact O-N 3.1Å
169	L	98.9	Very high	98.8	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-68.7	-45	176.5	-68.3	-179.3	0	0	0	111.8	L165 F166 R167 Y171 I172 H173 I182 L198 D239 A243 P331	L165-L169 HydrophobicContact CD1-CD1 4.16Å; L165-L169 HydrophobicContact CD1-CG 4.05Å; L165-L169 HydrophobicContact CG-CD1 4.27Å; L165-L169 WeakPolarHBondContact O-CG 3.38Å; L165-L169 PolarHBondContact O-N 2.75Å; F166-L169 HydrophobicContact CD1-CD1 4.38Å; F166-L169 PolarHBondContact O-N 2.92Å; R167-L169 VanDerWaalsContact C-N 3.27Å; R167-L169 PolarHBondContact O-N 3.26Å; L169-Y171 VanDerWaalsContact C-N 3.25Å; L169-Y171 PolarHBondContact O-N 3.02Å; L169-I172 HydrophobicContact CD2-CD1 4.03Å; L169-I172 HydrophobicContact CD2-CG1 4.46Å; L169-I172 WeakPolarHBondContact O-CG1 3.36Å; L169-I172 PolarHBondContact O-N 2.88Å; L169-H173 WeakPolarHBondContact O-CB 3.3Å; L169-H173 PolarHBondContact O-CD2 3.11Å; L169-H173 PolarHBondContact O-N 2.87Å; L169-I182 HydrophobicContact CD2-CD1 3.76Å; L169-I182 HydrophobicContact CD2-CG1 4.07Å; L169-L198 HydrophobicContact CD2-CD2 4.48Å; L169-D239 HydrophobicContact CD1-CB 4.31Å; L169-D239 HydrophobicContact CD2-CB 3.95Å; L169-A243 HydrophobicContact CD1-CB 4.08Å; L169-P331 HydrophobicContact CB-CB 3.8Å; L169-P331 HydrophobicContact CB-CG 3.75Å
170	A	98.9	Very high	98.7	Very high	5 Å²	5	9.6 Å²	9.6	4%	0.041	5%	0.054	C	C	.	.	H	α-helix	trans	-55.1	-45.4	175.2	0	0	0	0	0	110.8	F166 R167 S174 P331 L332	F166-A170 WeakPolarHBondContact O-CB 3.27Å; F166-A170 PolarHBondContact O-N 3.1Å; R167-A170 PolarHBondContact O-N 2.89Å; A170-S174 PolarHBondContact O-N 2.88Å; A170-P331 HydrophobicContact CB-CB 3.99Å; A170-L332 HydrophobicContact CB-CB 4.39Å; A170-L332 HydrophobicContact CB-CD1 4.32Å
171	Y	98.9	Very high	98.7	Very high	18 Å²	18	9.5 Å²	9.5	7%	0.071	5%	0.053	C	C	.	.	H	α-helix	trans	-59.5	-56	176.6	-177.7	-98.1	0	0	0	112	L104 D105 H106 I109 R167 S168 L169 H173 S174 F175 E366	L104-Y171 HydrophobicContact CB-CE1 4.27Å; L104-Y171 HydrophobicContact CD2-CD1 4.41Å; L104-Y171 HydrophobicContact CD2-CE1 3.87Å; D105-Y171 PolarHBondContact N-OH 2.69Å; D105-Y171 PolarHBondContact O-OH 3.47Å; H106-Y171 HydrophobicContact CB-CD1 3.78Å; H106-Y171 HydrophobicContact CB-CD2 4.18Å; H106-Y171 HydrophobicContact CB-CE1 3.83Å; H106-Y171 HydrophobicContact CB-CE2 4.23Å; H106-Y171 HydrophobicContact CB-CG 3.94Å; H106-Y171 AromaticContact CD2-CD2 3.73Å; H106-Y171 AromaticContact CD2-CG 3.83Å; H106-Y171 AromaticContact CG-CG 3.91Å; I109-Y171 HydrophobicContact CD1-CD1 3.54Å; I109-Y171 HydrophobicContact CD1-CE1 4.06Å; I109-Y171 HydrophobicContact CD1-CG 4.5Å; R167-Y171 PolarHBondContact O-N 3Å; S168-Y171 PolarHBondContact O-N 3.21Å; L169-Y171 VanDerWaalsContact C-N 3.25Å; L169-Y171 PolarHBondContact O-N 3.02Å; Y171-H173 VanDerWaalsContact C-N 3.34Å; Y171-H173 PolarHBondContact O-N 3.4Å; Y171-S174 WeakPolarHBondContact O-CB 3.45Å; Y171-S174 PolarHBondContact O-N 3.08Å; Y171-S174 PolarHBondContact O-OG 3.31Å; Y171-F175 HydrophobicContact CD1-CE2 4.12Å; Y171-F175 HydrophobicContact CD2-CE2 4.21Å; Y171-F175 HydrophobicContact CE1-CD2 4.4Å; Y171-F175 AromaticContact CE1-CE2 3.7Å; Y171-F175 HydrophobicContact CE1-CE2 3.7Å; Y171-F175 AromaticContact CE2-CE2 3.8Å; Y171-F175 HydrophobicContact CE2-CE2 3.8Å; Y171-F175 HydrophobicContact CE2-CZ 4.28Å; Y171-F175 HydrophobicContact CG-CE2 4.37Å; Y171-F175 AromaticContact CZ-CE2 3.54Å; Y171-F175 VanDerWaalsContact O-CD2 3.22Å; Y171-F175 WeakPolarHBondContact O-CD2 3.3Å; Y171-E366 HydrophobicContact CD2-CG 3.85Å
172	I	98.9	Very high	98.7	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-67.4	-34.8	-177	59.3	159.6	0	0	0	112.6	L104 I109 S168 L169 S174 F175 I177 H179 L198 F201	L104-I172 HydrophobicContact CD1-CG2 4.15Å; L104-I172 HydrophobicContact CD2-CG2 4.05Å; I109-I172 HydrophobicContact CD1-CG2 3.54Å; S168-I172 WeakPolarHBondContact O-CG1 3.35Å; S168-I172 PolarHBondContact O-N 2.86Å; S168-I172 VanDerWaalsContact O-N 3.1Å; L169-I172 HydrophobicContact CD2-CD1 4.03Å; L169-I172 HydrophobicContact CD2-CG1 4.46Å; L169-I172 WeakPolarHBondContact O-CG1 3.36Å; L169-I172 PolarHBondContact O-N 2.88Å; I172-S174 VanDerWaalsContact C-N 3.27Å; I172-S174 PolarHBondContact O-N 2.71Å; I172-F175 PolarHBondContact O-N 2.81Å; I172-F175 VanDerWaalsContact O-N 3.11Å; I172-I177 CarbonylContact C-O 3.42Å; I172-I177 HydrophobicContact CB-CB 4.28Å; I172-I177 HydrophobicContact CB-CG2 4.43Å; I172-I177 WeakPolarHBondContact O-CB 3.35Å; I172-I177 PolarHBondContact O-N 2.82Å; I172-H179 HydrophobicContact CD1-CB 3.83Å; I172-L198 HydrophobicContact CD1-CD2 4.38Å; I172-F201 HydrophobicContact CG2-CE1 4.05Å; I172-F201 HydrophobicContact CG2-CZ 4.4Å
173	H	98.8	Very high	98.7	Very high	35 Å²	35	10.2 Å²	10.2	16%	0.162	6%	0.056	C	C	.	.	H	α-helix	trans	-67.8	-28.9	178.7	-68.7	-172.6	0	0	0	111.6	L169 Y171 F175 G176 I177 S236 D239 P331	L169-H173 WeakPolarHBondContact O-CB 3.3Å; L169-H173 PolarHBondContact O-CD2 3.11Å; L169-H173 PolarHBondContact O-N 2.87Å; Y171-H173 VanDerWaalsContact C-N 3.34Å; Y171-H173 PolarHBondContact O-N 3.4Å; H173-F175 PolarHBondContact O-N 3.37Å; H173-G176 WeakPolarHBondContact O-CA 3.43Å; H173-G176 PolarHBondContact O-N 3.04Å; H173-I177 PolarHBondContact CD2-O 2.84Å; H173-I177 VanDerWaalsContact CD2-O 3.26Å; H173-S236 PolarHBondContact CE1-O 3.36Å; H173-D239 IonicContact CD2-OD2 2.68Å; H173-D239 IonicContact CE1-OD2 3.29Å; H173-D239 IonicContact NE2-OD2 2.94Å; H173-D239 PolarHBondContact NE2-OD2 2.97Å; H173-P331 WeakPolarHBondContact ND1-CG 3.32Å
174	S	98.6	Very high	98.7	Very high	32 Å²	32	10.2 Å²	10.2	22%	0.224	6%	0.057	C	C	.	.	H	α-helix	trans	-63.2	-20.9	173.2	79.5	0	0	0	0	113.6	A170 Y171 I172 Q365	A170-S174 PolarHBondContact O-N 2.88Å; Y171-S174 WeakPolarHBondContact O-CB 3.45Å; Y171-S174 PolarHBondContact O-N 3.08Å; Y171-S174 PolarHBondContact O-OG 3.31Å; I172-S174 VanDerWaalsContact C-N 3.27Å; I172-S174 PolarHBondContact O-N 2.71Å; S174-Q365 VanDerWaalsContact CB-NE2 3.33Å; S174-Q365 WeakPolarHBondContact CB-O 3.44Å; S174-Q365 PolarHBondContact O-NE2 2.86Å; S174-Q365 PolarHBondContact OG-NE2 3.06Å
175	F	98.2	Very high	98.6	Very high	68 Å²	68	13.5 Å²	13.5	30%	0.298	7%	0.072	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	6.7	171.7	-62	-80.1	0	0	0	113	Y171 I172 H173 I177 Q365	Y171-F175 HydrophobicContact CD1-CE2 4.12Å; Y171-F175 HydrophobicContact CD2-CE2 4.21Å; Y171-F175 HydrophobicContact CE1-CD2 4.4Å; Y171-F175 AromaticContact CE1-CE2 3.7Å; Y171-F175 HydrophobicContact CE1-CE2 3.7Å; Y171-F175 AromaticContact CE2-CE2 3.8Å; Y171-F175 HydrophobicContact CE2-CE2 3.8Å; Y171-F175 HydrophobicContact CE2-CZ 4.28Å; Y171-F175 HydrophobicContact CG-CE2 4.37Å; Y171-F175 AromaticContact CZ-CE2 3.54Å; Y171-F175 VanDerWaalsContact O-CD2 3.22Å; Y171-F175 WeakPolarHBondContact O-CD2 3.3Å; I172-F175 PolarHBondContact O-N 2.81Å; I172-F175 VanDerWaalsContact O-N 3.11Å; H173-F175 PolarHBondContact O-N 3.37Å; F175-I177 HydrophobicContact CB-CD1 3.79Å; F175-I177 HydrophobicContact CB-CG1 3.99Å; F175-I177 PolarHBondContact O-N 3.23Å; F175-Q365 HydrophobicContact CE1-CG 4.32Å; F175-Q365 HydrophobicContact CE2-CG 4Å; F175-Q365 HydrophobicContact CZ-CG 3.68Å
176	G	98.1	Very high	98.6	Very high	24 Å²	24	14 Å²	14	25%	0.247	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.8	13.2	-171.7	0	0	0	0	0	113.8	H173 Q206 L207	H173-G176 WeakPolarHBondContact O-CA 3.43Å; H173-G176 PolarHBondContact O-N 3.04Å; G176-Q206 CarbonylContact O-C 3.48Å; G176-Q206 VanDerWaalsContact O-CA 3.3Å; G176-Q206 WeakPolarHBondContact O-CA 3.36Å; G176-L207 PolarHBondContact O-N 3.4Å
177	I	98.7	Very high	98.6	Very high	3 Å²	3	14.1 Å²	14.1	2%	0.015	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	122.3	-179.2	-61.6	166.8	0	0	0	108.9	I100 L104 I172 H173 F175 A204 Q206	I100-I177 HydrophobicContact CD1-CG2 4.35Å; I100-I177 HydrophobicContact CG2-CD1 4.18Å; I100-I177 HydrophobicContact CG2-CG2 4.19Å; L104-I177 HydrophobicContact CD2-CD1 4.14Å; I172-I177 CarbonylContact C-O 3.42Å; I172-I177 HydrophobicContact CB-CB 4.28Å; I172-I177 HydrophobicContact CB-CG2 4.43Å; I172-I177 WeakPolarHBondContact O-CB 3.35Å; I172-I177 PolarHBondContact O-N 2.82Å; H173-I177 PolarHBondContact CD2-O 2.84Å; H173-I177 VanDerWaalsContact CD2-O 3.26Å; F175-I177 HydrophobicContact CB-CD1 3.79Å; F175-I177 HydrophobicContact CB-CG1 3.99Å; F175-I177 PolarHBondContact O-N 3.23Å; I177-A204 HydrophobicContact CG2-CB 4.27Å; I177-Q206 HydrophobicContact CG1-CB 4.45Å
178	C	98.7	Very high	98.6	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	135.3	169.5	-177.2	0	0	0	0	109.6	R180 A204 K205 L207 D239	C178-R180 HydrophobicContact CB-CG 4.01Å; C178-R180 WeakPolarHBondContact SG-CG 3.36Å; C178-A204 VanDerWaalsContact O-CA 3.22Å; C178-A204 WeakPolarHBondContact O-CA 3.41Å; C178-A204 WeakPolarHBondContact O-CB 3.37Å; C178-K205 PolarHBondContact N-O 2.82Å; C178-K205 PolarHBondContact O-N 3.02Å; C178-L207 HydrophobicContact CB-CD1 3.5Å; C178-L207 HydrophobicContact CB-CD2 4.38Å; C178-L207 HydrophobicContact CB-CG 3.72Å; C178-D239 VanDerWaalsContact SG-CG 3.51Å; C178-D239 PolarHBondContact SG-OD2 2.7Å
179	H	98.7	Very high	98.5	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.081	C	C	.	.			trans	-73.8	-44.4	-176.9	-172.2	-88.6	0	0	0	112	I172 D181 I182 C199 D200 F201 S203 A204 D239	I172-H179 HydrophobicContact CD1-CB 3.83Å; H179-D181 PolarHBondContact CE1-O 3.01Å; H179-D181 VanDerWaalsContact ND1-C 3.32Å; H179-D181 PolarHBondContact ND1-N 2.98Å; H179-D181 PolarHBondContact O-N 2.93Å; H179-I182 HydrophobicContact CB-CD1 3.75Å; H179-I182 HydrophobicContact CB-CG1 4.02Å; H179-I182 VanDerWaalsContact CG-CD1 3.5Å; H179-I182 WeakPolarHBondContact ND1-CD1 3.4Å; H179-I182 PolarHBondContact ND1-N 3.4Å; H179-C199 PolarHBondContact NE2-O 3.15Å; H179-D200 PolarHBondContact CE1-O 2.95Å; H179-D200 PolarHBondContact NE2-O 3.28Å; H179-F201 AromaticContact CD2-CE1 3.89Å; H179-S203 CarbonylContact O-C 3.59Å; H179-A204 WeakPolarHBondContact O-CA 3.42Å; H179-A204 PolarHBondContact O-N 2.93Å; H179-D239 PolarHBondContact N-OD2 2.9Å
180	R	98.2	Very high	98.5	Very high	1 Å²	1	17.6 Å²	17.6	0%	0.004	9%	0.094	C	C	.	.	S	Bend	trans	63.8	15.6	175.2	-45.8	-168	-64.7	162	3.7	116	C178 S203 I217 C218 Y234 I238 D239	C178-R180 HydrophobicContact CB-CG 4.01Å; C178-R180 WeakPolarHBondContact SG-CG 3.36Å; R180-S203 PolarHBondContact NE-O 3.28Å; R180-S203 PolarHBondContact NH2-O 2.98Å; R180-I217 HydrophobicContact CB-CG1 3.71Å; R180-I217 HydrophobicContact CB-CG2 4.34Å; R180-C218 VanDerWaalsContact C-SG 3.51Å; R180-C218 WeakPolarHBondContact O-CA 3.37Å; R180-C218 PolarHBondContact O-N 3.15Å; R180-C218 VanDerWaalsContact O-N 3.08Å; R180-C218 PolarHBondContact O-SG 2.91Å; R180-Y234 PolarHBondContact NH1-OH 3.32Å; R180-I238 HydrophobicContact CB-CD1 4.37Å; R180-I238 HydrophobicContact CG-CD1 3.97Å; R180-D239 PolarHBondContact N-OD1 3.45Å
181	D	97.6	Very high	98.2	Very high	1 Å²	1	20 Å²	20	1%	0.005	11%	0.109	C	C	.	.			trans	-156.7	44.6	170.6	-158	28.2	0	0	0	112.2	R6 H179 K183 N186 S219	R6-D181 IonicContact NH1-OD1 2.99Å; R6-D181 PolarHBondContact NH1-OD1 3.39Å; R6-D181 IonicContact NH1-OD2 3.15Å; H179-D181 PolarHBondContact CE1-O 3.01Å; H179-D181 VanDerWaalsContact ND1-C 3.32Å; H179-D181 PolarHBondContact ND1-N 2.98Å; H179-D181 PolarHBondContact O-N 2.93Å; D181-K183 PolarHBondContact O-N 3.22Å; D181-K183 IonicContact OD1-NZ 3.27Å; D181-K183 IonicContact OD2-NZ 3.3Å; D181-K183 PolarHBondContact OD2-NZ 3.38Å; D181-N186 PolarHBondContact O-ND2 3.42Å; D181-S219 WeakPolarHBondContact OD1-CB 3.2Å; D181-S219 PolarHBondContact OD1-N 2.95Å; D181-S219 PolarHBondContact OD1-OG 2.82Å
182	I	98.9	Very high	97.9	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.129	C	C	.	.			trans	-68.8	125.2	173.3	-61.6	-62.5	0	0	0	109.1	L165 L169 H179 L198 Y222 D239 V246	L165-I182 HydrophobicContact CD1-CD1 4.32Å; L165-I182 HydrophobicContact CD1-CG2 4.37Å; L165-I182 HydrophobicContact CD2-CG2 4.27Å; L169-I182 HydrophobicContact CD2-CD1 3.76Å; L169-I182 HydrophobicContact CD2-CG1 4.07Å; H179-I182 HydrophobicContact CB-CD1 3.75Å; H179-I182 HydrophobicContact CB-CG1 4.02Å; H179-I182 VanDerWaalsContact CG-CD1 3.5Å; H179-I182 WeakPolarHBondContact ND1-CD1 3.4Å; H179-I182 PolarHBondContact ND1-N 3.4Å; I182-L198 HydrophobicContact CD1-CD1 3.52Å; I182-L198 HydrophobicContact CD1-CD2 4.08Å; I182-L198 HydrophobicContact CD1-CG 4.47Å; I182-Y222 WeakPolarHBondContact O-CB 3.27Å; I182-D239 HydrophobicContact CG1-CB 4.06Å; I182-V246 HydrophobicContact CG2-CG2 4.42Å
183	K	98.6	Very high	97.8	Very high	25 Å²	25	26.4 Å²	26.4	11%	0.109	14%	0.143	C	C	.	.	S	Bend	trans	-167.4	158.4	-179.1	64.2	-166.5	-171.1	-151.2	0	109.8	D181 Q185 N186 L187 S219 Y222	D181-K183 PolarHBondContact O-N 3.22Å; D181-K183 IonicContact OD1-NZ 3.27Å; D181-K183 IonicContact OD2-NZ 3.3Å; D181-K183 PolarHBondContact OD2-NZ 3.38Å; K183-Q185 HydrophobicContact CG-CB 4.34Å; K183-Q185 VanDerWaalsContact CG-OE1 3.23Å; K183-Q185 PolarHBondContact O-N 3.2Å; K183-N186 WeakPolarHBondContact CE-ND2 3.18Å; K183-N186 VanDerWaalsContact CE-OD1 3.31Å; K183-N186 WeakPolarHBondContact CE-OD1 3.44Å; K183-N186 HydrophobicContact CG-CB 4.16Å; K183-N186 PolarHBondContact O-N 2.87Å; K183-L187 WeakPolarHBondContact O-CG 3.45Å; K183-S219 WeakPolarHBondContact CD-OG 3.25Å; K183-S219 PolarHBondContact NZ-OG 3.42Å; K183-Y222 HydrophobicContact CB-CD2 3.51Å; K183-Y222 HydrophobicContact CB-CE2 3.57Å; K183-Y222 HydrophobicContact CB-CG 4.02Å
184	P	98.6	Very high	97.8	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.006	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-56.2	-26.4	-176.5	-27.8	37.7	0	0	0	115.2	V139 Y140 N186 Y222 V246	V139-P184 HydrophobicContact CB-CB 4.22Å; V139-P184 HydrophobicContact CG1-CB 4.09Å; V139-P184 PolarHBondContact N-O 3.08Å; Y140-P184 PolarHBondContact N-O 3.4Å; P184-N186 VanDerWaalsContact C-N 3.33Å; P184-Y222 VanDerWaalsContact CD-CE1 3.43Å; P184-Y222 WeakPolarHBondContact CD-OH 3.39Å; P184-Y222 HydrophobicContact CG-CE1 4.07Å; P184-Y222 WeakPolarHBondContact CG-OH 3.33Å; P184-V246 HydrophobicContact CG-CG1 4.49Å; P184-V246 HydrophobicContact CG-CG2 4.18Å
185	Q	97.6	Very high	97.8	Very high	70 Å²	70	24.8 Å²	24.8	33%	0.327	13%	0.134	S	C	.	.	G	3₁₀ helix	trans	-72.3	-26.3	177.8	-59.5	81.9	0.8	0	0	113.1	Y140 K183 L187	Y140-Q185 HydrophobicContact CD1-CG 4.15Å; Y140-Q185 HydrophobicContact CD2-CG 4.24Å; Y140-Q185 VanDerWaalsContact CD2-NE2 3.3Å; Y140-Q185 HydrophobicContact CG-CG 3.83Å; K183-Q185 HydrophobicContact CG-CB 4.34Å; K183-Q185 VanDerWaalsContact CG-OE1 3.23Å; K183-Q185 PolarHBondContact O-N 3.2Å; Q185-L187 VanDerWaalsContact C-N 3.32Å
186	N	98.4	Very high	97.8	Very high	11 Å²	11	21.6 Å²	21.6	6%	0.059	12%	0.12	C	C	.	.	G	3₁₀ helix	trans	-94.8	9.9	-178.9	-70.6	1.6	0	0	0	112.3	D181 K183 P184 C199 D200	D181-N186 PolarHBondContact O-ND2 3.42Å; K183-N186 WeakPolarHBondContact CE-ND2 3.18Å; K183-N186 VanDerWaalsContact CE-OD1 3.31Å; K183-N186 WeakPolarHBondContact CE-OD1 3.44Å; K183-N186 HydrophobicContact CG-CB 4.16Å; K183-N186 PolarHBondContact O-N 2.87Å; P184-N186 VanDerWaalsContact C-N 3.33Å; N186-C199 PolarHBondContact O-N 3.09Å; N186-C199 PolarHBondContact O-SG 3.07Å; N186-C199 VanDerWaalsContact O-SG 3.38Å; N186-D200 PolarHBondContact ND2-OD2 3.47Å
187	L	98.8	Very high	97.9	Very high	1 Å²	1	22.3 Å²	22.3	1%	0.005	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	97.5	177.6	-55.6	-179.6	0	0	0	108	T138 V139 L165 K183 Q185 L196 L198 V246	T138-L187 CarbonylContact C-O 3.6Å; T138-L187 WeakPolarHBondContact CA-O 3.07Å; V139-L187 HydrophobicContact CB-CB 3.92Å; V139-L187 HydrophobicContact CB-CD1 4.29Å; V139-L187 HydrophobicContact CG2-CB 3.41Å; V139-L187 VanDerWaalsContact CG2-CB 3.41Å; V139-L187 HydrophobicContact CG2-CD1 3.96Å; V139-L187 HydrophobicContact CG2-CG 4.33Å; V139-L187 PolarHBondContact N-O 3.25Å; L165-L187 HydrophobicContact CD1-CD2 3.67Å; L165-L187 HydrophobicContact CD2-CD1 3.97Å; L165-L187 HydrophobicContact CD2-CD2 4.38Å; K183-L187 WeakPolarHBondContact O-CG 3.45Å; Q185-L187 VanDerWaalsContact C-N 3.32Å; L187-L196 HydrophobicContact CB-CD1 4.1Å; L187-L196 HydrophobicContact CB-CG 4.49Å; L187-L196 HydrophobicContact CD1-CD1 4.46Å; L187-L196 HydrophobicContact CD2-CD2 4.45Å; L187-L198 HydrophobicContact CD2-CD1 3.84Å; L187-V246 HydrophobicContact CD1-CG1 3.94Å; L187-V246 HydrophobicContact CD1-CG2 4.47Å
188	L	98.8	Very high	97.9	Very high	26 Å²	26	22.2 Å²	22.2	14%	0.136	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	144.8	179.3	-51.1	179.9	0	0	0	110	V110 V135 E137 T138 L196 K197 C199	V110-L188 HydrophobicContact CB-CD1 4.29Å; V110-L188 HydrophobicContact CG2-CD1 4.18Å; V135-L188 HydrophobicContact CB-CB 3.69Å; V135-L188 HydrophobicContact CB-CD1 3.94Å; V135-L188 HydrophobicContact CB-CG 4.38Å; V135-L188 HydrophobicContact CG1-CB 3.56Å; V135-L188 HydrophobicContact CG2-CB 4.16Å; V135-L188 HydrophobicContact CG2-CD1 4Å; E137-L188 CarbonylContact O-C 3.51Å; E137-L188 WeakPolarHBondContact O-CA 3.43Å; T138-L188 HydrophobicContact CG2-CD2 3.85Å; L188-L196 CarbonylContact O-C 3.55Å; L188-L196 VanDerWaalsContact O-CA 3.31Å; L188-L196 WeakPolarHBondContact O-CA 3.17Å; L188-K197 HydrophobicContact CB-CB 4.43Å; L188-K197 WeakPolarHBondContact CB-O 3.42Å; L188-K197 PolarHBondContact N-O 3.23Å; L188-K197 PolarHBondContact O-N 3.18Å; L188-C199 HydrophobicContact CD1-CB 3.67Å; L188-C199 HydrophobicContact CD2-CB 4.46Å; L188-C199 HydrophobicContact CG-CB 3.85Å
189	L	98.4	Very high	97.8	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	135.6	-178.9	-68.3	-179.8	0	0	0	111.1	V135 E137 V139 V142 Y161 P191 V195 L196	V135-L189 WeakPolarHBondContact CG1-O 3.45Å; E137-L189 HydrophobicContact CB-CB 4.21Å; E137-L189 WeakPolarHBondContact CB-O 3Å; E137-L189 PolarHBondContact N-O 2.93Å; E137-L189 VanDerWaalsContact N-O 3.08Å; E137-L189 PolarHBondContact O-N 2.67Å; V139-L189 HydrophobicContact CB-CD1 4.27Å; V139-L189 HydrophobicContact CG2-CD1 3.7Å; V139-L189 HydrophobicContact CG2-CD2 3.94Å; V139-L189 HydrophobicContact CG2-CG 3.77Å; V142-L189 HydrophobicContact CB-CD1 4.18Å; V142-L189 HydrophobicContact CG2-CD1 3.81Å; Y161-L189 HydrophobicContact CD1-CD2 3.57Å; Y161-L189 HydrophobicContact CD2-CD1 4.14Å; Y161-L189 HydrophobicContact CD2-CD2 4.29Å; Y161-L189 HydrophobicContact CE1-CD1 4.26Å; Y161-L189 HydrophobicContact CE1-CD2 3.54Å; Y161-L189 HydrophobicContact CE2-CD1 3.63Å; Y161-L189 HydrophobicContact CE2-CD2 4.24Å; Y161-L189 HydrophobicContact CG-CD2 3.98Å; L189-P191 WeakPolarHBondContact O-CD 3.31Å; L189-V195 WeakPolarHBondContact CA-O 3.38Å; L189-L196 HydrophobicContact CD2-CB 3.79Å; L189-L196 HydrophobicContact CD2-CD1 3.96Å; L189-L196 HydrophobicContact CD2-CG 4.03Å
190	D	97.7	Very high	97.7	Very high	48 Å²	48	24.5 Å²	24.5	26%	0.257	13%	0.13	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	107.8	155.9	178	-7.4	0	0	0	108.3	E192 T193 A194 V195	D190-E192 PolarHBondContact O-N 3.23Å; D190-E192 WeakPolarHBondContact OD1-CB 3.46Å; D190-E192 PolarHBondContact OD1-N 2.97Å; D190-T193 WeakPolarHBondContact CB-OG1 3.45Å; D190-T193 WeakPolarHBondContact OD2-CG2 3.22Å; D190-T193 PolarHBondContact OD2-OG1 3.12Å; D190-A194 VanDerWaalsContact O-CA 3.25Å; D190-A194 WeakPolarHBondContact O-CA 3.38Å; D190-A194 PolarHBondContact O-N 2.64Å; D190-V195 HydrophobicContact CB-CB 4.47Å; D190-V195 PolarHBondContact N-O 3.02Å
191	P	92.2	Very high	97.6	Very high	57 Å²	57	24.5 Å²	24.5	37%	0.37	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-24.6	-177.3	-21.3	33.4	0	0	0	114	E137 L189	E137-P191 HydrophobicContact CB-CG 3.83Å; E137-P191 HydrophobicContact CG-CG 3.56Å; L189-P191 WeakPolarHBondContact O-CD 3.31Å
192	E	93.6	Very high	97.4	Very high	104 Å²	104	25.2 Å²	25.2	49%	0.486	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-40.6	-174.9	-173.2	179.2	161.6	0	0	111	D190 N352 R354	D190-E192 PolarHBondContact O-N 3.23Å; D190-E192 WeakPolarHBondContact OD1-CB 3.46Å; D190-E192 PolarHBondContact OD1-N 2.97Å; E192-N352 PolarHBondContact O-ND2 3.3Å; E192-N352 VanDerWaalsContact O-ND2 3.12Å; E192-R354 VanDerWaalsContact CD-NH1 3.31Å; E192-R354 VanDerWaalsContact CG-CZ 3.45Å; E192-R354 IonicContact OE1-CZ 3.89Å; E192-R354 IonicContact OE1-NH1 2.81Å; E192-R354 PolarHBondContact OE1-NH1 2.99Å; E192-R354 IonicContact OE1-NH2 4Å; E192-R354 PolarHBondContact OE1-NH2 2.82Å
193	T	97.1	Very high	97.1	Very high	47 Å²	47	25.2 Å²	25.2	29%	0.288	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-7.7	-178.3	63.5	0	0	0	0	113.6	D190 V195	D190-T193 WeakPolarHBondContact CB-OG1 3.45Å; D190-T193 WeakPolarHBondContact OD2-CG2 3.22Å; D190-T193 PolarHBondContact OD2-OG1 3.12Å; T193-V195 PolarHBondContact O-N 2.91Å; T193-V195 VanDerWaalsContact O-N 3.16Å; T193-V195 WeakPolarHBondContact OG1-CG2 3.45Å; T193-V195 PolarHBondContact OG1-N 2.86Å
194	A	97.9	Very high	97	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	20.8	-171.8	0	0	0	0	0	114.2	Y157 L160 Y161 Q164 D190 L350	Y157-A194 HydrophobicContact CD1-CB 4.4Å; Y157-A194 HydrophobicContact CE1-CB 4.27Å; L160-A194 HydrophobicContact CD1-CB 4.03Å; Y161-A194 HydrophobicContact CE1-CB 4.3Å; Q164-A194 PolarHBondContact NE2-O 2.65Å; D190-A194 VanDerWaalsContact O-CA 3.25Å; D190-A194 WeakPolarHBondContact O-CA 3.38Å; D190-A194 PolarHBondContact O-N 2.64Å; A194-L350 HydrophobicContact CB-CD1 3.99Å; A194-L350 HydrophobicContact CB-CD2 3.87Å
195	V	98.7	Very high	96.9	Very high	34 Å²	34	24.8 Å²	24.8	21%	0.206	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	127.2	176	172.1	0	0	0	0	109.6	L189 D190 T193 K197 P357	L189-V195 WeakPolarHBondContact CA-O 3.38Å; D190-V195 HydrophobicContact CB-CB 4.47Å; D190-V195 PolarHBondContact N-O 3.02Å; T193-V195 PolarHBondContact O-N 2.91Å; T193-V195 VanDerWaalsContact O-N 3.16Å; T193-V195 WeakPolarHBondContact OG1-CG2 3.45Å; T193-V195 PolarHBondContact OG1-N 2.86Å; V195-K197 HydrophobicContact CG1-CG 4.18Å; V195-P357 HydrophobicContact CG2-CB 3.64Å; V195-P357 HydrophobicContact CG2-CG 4.44Å
196	L	98.9	Very high	96.9	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	135.6	170.2	-178.5	150.5	0	0	0	110.5	N108 V139 Y161 Q164 L165 L187 L188 L189	N108-L196 VanDerWaalsContact CA-O 3.28Å; N108-L196 WeakPolarHBondContact CA-O 3.24Å; N108-L196 WeakPolarHBondContact CB-O 3.49Å; N108-L196 PolarHBondContact ND2-O 3.31Å; V139-L196 HydrophobicContact CG2-CD1 3.9Å; Y161-L196 HydrophobicContact CG-CD1 4.37Å; Y161-L196 WeakPolarHBondContact O-CD1 3.41Å; Q164-L196 HydrophobicContact CB-CB 3.9Å; Q164-L196 HydrophobicContact CB-CD2 4.34Å; L165-L196 HydrophobicContact CB-CD2 4.41Å; L187-L196 HydrophobicContact CB-CD1 4.1Å; L187-L196 HydrophobicContact CB-CG 4.49Å; L187-L196 HydrophobicContact CD1-CD1 4.46Å; L187-L196 HydrophobicContact CD2-CD2 4.45Å; L188-L196 CarbonylContact O-C 3.55Å; L188-L196 VanDerWaalsContact O-CA 3.31Å; L188-L196 WeakPolarHBondContact O-CA 3.17Å; L189-L196 HydrophobicContact CD2-CB 3.79Å; L189-L196 HydrophobicContact CD2-CD1 3.96Å; L189-L196 HydrophobicContact CD2-CG 4.03Å
197	K	98.9	Very high	96.8	Very high	40 Å²	40	27 Å²	27	17%	0.174	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	122.4	172.2	-70.4	178.9	179.8	-68.4	0	111	C107 N108 V110 V135 L188 V195	C107-K197 PolarHBondContact O-NZ 3.22Å; N108-K197 WeakPolarHBondContact O-CA 3.29Å; V110-K197 HydrophobicContact CB-CB 4.49Å; V135-K197 HydrophobicContact CG2-CD 3.91Å; L188-K197 HydrophobicContact CB-CB 4.43Å; L188-K197 WeakPolarHBondContact CB-O 3.42Å; L188-K197 PolarHBondContact N-O 3.23Å; L188-K197 PolarHBondContact O-N 3.18Å; V195-K197 HydrophobicContact CG1-CG 4.18Å
198	L	98.9	Very high	96.7	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	135.4	170.7	179.5	61.9	0	0	0	110.2	N108 V110 L169 I172 I182 L187 F201	N108-L198 PolarHBondContact O-N 3.38Å; V110-L198 PolarHBondContact N-O 3.21Å; L169-L198 HydrophobicContact CD2-CD2 4.48Å; I172-L198 HydrophobicContact CD1-CD2 4.38Å; I182-L198 HydrophobicContact CD1-CD1 3.52Å; I182-L198 HydrophobicContact CD1-CD2 4.08Å; I182-L198 HydrophobicContact CD1-CG 4.47Å; L187-L198 HydrophobicContact CD2-CD1 3.84Å; L198-F201 HydrophobicContact CD2-CZ 4.1Å; L198-F201 HydrophobicContact CG-CZ 4.23Å
199	C	98.3	Very high	96.4	Very high	18 Å²	18	40.8 Å²	40.8	12%	0.122	20%	0.203	C	C	.	.			trans	-135	177	178.6	76.6	0	0	0	0	112.5	V110 H179 N186 L188	V110-C199 HydrophobicContact CB-CB 4.25Å; V110-C199 HydrophobicContact CG1-CB 3.64Å; H179-C199 PolarHBondContact NE2-O 3.15Å; N186-C199 PolarHBondContact O-N 3.09Å; N186-C199 PolarHBondContact O-SG 3.07Å; N186-C199 VanDerWaalsContact O-SG 3.38Å; L188-C199 HydrophobicContact CD1-CB 3.67Å; L188-C199 HydrophobicContact CD2-CB 4.46Å; L188-C199 HydrophobicContact CG-CB 3.85Å
200	D	95.7	Very high	96.2	Very high	31 Å²	31	44.7 Å²	44.7	17%	0.166	24%	0.244	C	C	.	.			trans	65.2	70.6	176	-167.6	21.8	0	0	0	115.2	K85 H179 N186 G202	K85-D200 IonicContact NZ-OD1 3.72Å; K85-D200 PolarHBondContact NZ-OD1 3.16Å; H179-D200 PolarHBondContact CE1-O 2.95Å; H179-D200 PolarHBondContact NE2-O 3.28Å; N186-D200 PolarHBondContact ND2-OD2 3.47Å; D200-G202 PolarHBondContact O-N 2.75Å
201	F	96.4	Very high	96.1	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-82	14.7	177.1	-70.6	-94.8	0	0	0	113.2	E97 I100 M101 L104 I109 I172 H179 L198 S203 A204	E97-F201 HydrophobicContact CG-CB 4Å; E97-F201 PolarHBondContact OE1-N 2.9Å; I100-F201 HydrophobicContact CG2-CB 4.32Å; I100-F201 HydrophobicContact CG2-CD1 3.74Å; I100-F201 HydrophobicContact CG2-CE1 4.45Å; I100-F201 HydrophobicContact CG2-CG 4.24Å; M101-F201 HydrophobicContact CE-CD2 4.27Å; M101-F201 HydrophobicContact CG-CB 4.07Å; M101-F201 HydrophobicContact CG-CD2 4.02Å; M101-F201 HydrophobicContact CG-CG 4.19Å; M101-F201 HydrophobicContact SD-CD2 4.27Å; L104-F201 HydrophobicContact CD1-CD1 3.94Å; L104-F201 HydrophobicContact CD1-CE1 3.42Å; L104-F201 VanDerWaalsContact CD1-CE1 3.42Å; L104-F201 HydrophobicContact CD1-CE2 4.08Å; L104-F201 HydrophobicContact CD1-CG 4.46Å; L104-F201 HydrophobicContact CD1-CZ 3.5Å; I109-F201 HydrophobicContact CD1-CZ 4.42Å; I109-F201 HydrophobicContact CG2-CE2 3.69Å; I109-F201 HydrophobicContact CG2-CZ 3.72Å; I172-F201 HydrophobicContact CG2-CE1 4.05Å; I172-F201 HydrophobicContact CG2-CZ 4.4Å; H179-F201 AromaticContact CD2-CE1 3.89Å; L198-F201 HydrophobicContact CD2-CZ 4.1Å; L198-F201 HydrophobicContact CG-CZ 4.23Å; F201-S203 PolarHBondContact O-N 2.94Å; F201-A204 HydrophobicContact CB-CB 4.06Å; F201-A204 HydrophobicContact CD1-CB 3.84Å; F201-A204 HydrophobicContact CG-CB 4.44Å; F201-A204 WeakPolarHBondContact O-CB 3.46Å; F201-A204 PolarHBondContact O-N 2.86Å
202	G	93.1	Very high	96.2	Very high	16 Å²	16	49 Å²	49	17%	0.165	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-61.5	-26.5	-179.3	0	0	0	0	0	113.9	T8 E97 D200	T8-G202 WeakPolarHBondContact CG2-O 3.38Å; E97-G202 PolarHBondContact OE1-N 3.46Å; D200-G202 PolarHBondContact O-N 2.75Å
203	S	93.5	Very high	96.2	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.007	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-96.3	-7.9	175	-63.7	0	0	0	0	113.5	H179 R180 F201	H179-S203 CarbonylContact O-C 3.59Å; R180-S203 PolarHBondContact NE-O 3.28Å; R180-S203 PolarHBondContact NH2-O 2.98Å; F201-S203 PolarHBondContact O-N 2.94Å
204	A	96.1	Very high	96.1	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.246	C	C	.	.			trans	-68.8	150.6	-171.4	0	0	0	0	0	112.4	I100 I177 C178 H179 F201	I100-A204 HydrophobicContact CD1-CB 3.67Å; I177-A204 HydrophobicContact CG2-CB 4.27Å; C178-A204 VanDerWaalsContact O-CA 3.22Å; C178-A204 WeakPolarHBondContact O-CA 3.41Å; C178-A204 WeakPolarHBondContact O-CB 3.37Å; H179-A204 WeakPolarHBondContact O-CA 3.42Å; H179-A204 PolarHBondContact O-N 2.93Å; F201-A204 HydrophobicContact CB-CB 4.06Å; F201-A204 HydrophobicContact CD1-CB 3.84Å; F201-A204 HydrophobicContact CG-CB 4.44Å; F201-A204 WeakPolarHBondContact O-CB 3.46Å; F201-A204 PolarHBondContact O-N 2.86Å
205	K	95.8	Very high	95.8	Very high	16 Å²	16	46.3 Å²	46.3	7%	0.07	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	141.7	176.3	-171.2	-170.4	172.3	-168.1	0	109.6	C178 L207 N213	C178-K205 PolarHBondContact N-O 2.82Å; C178-K205 PolarHBondContact O-N 3.02Å; K205-L207 HydrophobicContact CB-CD2 4.39Å; K205-L207 HydrophobicContact CD-CD2 4.32Å; K205-L207 PolarHBondContact O-N 2.99Å; K205-N213 VanDerWaalsContact CD-OD1 3.32Å; K205-N213 WeakPolarHBondContact CD-OD1 3.2Å; K205-N213 WeakPolarHBondContact CE-OD1 3.41Å; K205-N213 PolarHBondContact NZ-OD1 3.28Å
206	Q	97.3	Very high	95.6	Very high	100 Å²	100	51.8 Å²	51.8	47%	0.467	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	115.5	162.8	-172.2	173.6	-5.2	0	0	108.9	G176 I177	G176-Q206 CarbonylContact O-C 3.48Å; G176-Q206 VanDerWaalsContact O-CA 3.3Å; G176-Q206 WeakPolarHBondContact O-CA 3.36Å; I177-Q206 HydrophobicContact CG1-CB 4.45Å
207	L	96.6	Very high	95.3	Very high	29 Å²	29	51.9 Å²	51.9	15%	0.152	28%	0.276	C	S	.	.			trans	-84	127.7	-179.8	-57.6	-175.4	0	0	0	109.1	G176 C178 K205 Y234	G176-L207 PolarHBondContact O-N 3.4Å; C178-L207 HydrophobicContact CB-CD1 3.5Å; C178-L207 HydrophobicContact CB-CD2 4.38Å; C178-L207 HydrophobicContact CB-CG 3.72Å; K205-L207 HydrophobicContact CB-CD2 4.39Å; K205-L207 HydrophobicContact CD-CD2 4.32Å; K205-L207 PolarHBondContact O-N 2.99Å; L207-Y234 HydrophobicContact CD1-CD2 4.2Å; L207-Y234 HydrophobicContact CD1-CE2 4.24Å; L207-Y234 HydrophobicContact CD2-CE2 4.21Å
208	V	96.5	Very high	95	Very high	65 Å²	65	50.1 Å²	50.1	39%	0.394	27%	0.268	S	S	.	.			trans	-115.2	125.8	177.8	-178.9	0	0	0	0	107.4	G210 E211	V208-G210 PolarHBondContact O-N 3.33Å; V208-E211 HydrophobicContact CB-CB 4.31Å; V208-E211 HydrophobicContact CB-CG 3.99Å; V208-E211 HydrophobicContact CG1-CG 4.12Å; V208-E211 PolarHBondContact O-N 2.89Å; V208-E211 VanDerWaalsContact O-N 3.08Å
209	R	93.8	Very high	94.8	Very high	251 Å²	251	50.6 Å²	50.6	95%	0.947	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	131.4	-179.5	-173.1	178.6	-177.8	-177.9	0.8	109.7	E211	R209-E211 VanDerWaalsContact C-N 3.33Å
210	G	93.4	Very high	94.7	Very high	82 Å²	82	54.1 Å²	54.1	85%	0.845	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	90	-14.2	-177.1	0	0	0	0	0	114.4	V208	V208-G210 PolarHBondContact O-N 3.33Å
211	E	95	Very high	94.8	Very high	99 Å²	99	56.3 Å²	56.3	46%	0.463	29%	0.289	S	S	.	.	S	Bend	trans	-90.1	127.5	172.3	-67.8	-174.2	-172.1	0	0	111.2	V208 R209 N213	V208-E211 HydrophobicContact CB-CB 4.31Å; V208-E211 HydrophobicContact CB-CG 3.99Å; V208-E211 HydrophobicContact CG1-CG 4.12Å; V208-E211 PolarHBondContact O-N 2.89Å; V208-E211 VanDerWaalsContact O-N 3.08Å; R209-E211 VanDerWaalsContact C-N 3.33Å; E211-N213 PolarHBondContact O-ND2 3.22Å
212	P	94.4	Very high	94.9	Very high	97 Å²	97	56.8 Å²	56.8	63%	0.63	29%	0.291	S	S	*	.			trans	-69.5	150.6	178	29.1	-34.5	0	0	0	112	T232	P212-T232 CarbonylContact C-O 3.59Å
213	N	94.6	Very high	95.2	Very high	9 Å²	9	56.9 Å²	56.9	5%	0.048	29%	0.286	C	S	.	.			trans	-129.1	149.9	-179.7	-57.3	-80	0	0	0	110.6	K205 E211 S215 T232 Y234	K205-N213 VanDerWaalsContact CD-OD1 3.32Å; K205-N213 WeakPolarHBondContact CD-OD1 3.2Å; K205-N213 WeakPolarHBondContact CE-OD1 3.41Å; K205-N213 PolarHBondContact NZ-OD1 3.28Å; E211-N213 PolarHBondContact O-ND2 3.22Å; N213-S215 PolarHBondContact O-N 3.31Å; N213-T232 WeakPolarHBondContact CB-O 3.5Å; N213-T232 PolarHBondContact N-O 3.01Å; N213-T232 PolarHBondContact ND2-O 3.03Å; N213-T232 VanDerWaalsContact ND2-O 3.14Å; N213-T232 WeakPolarHBondContact O-CA 3.33Å; N213-T232 VanDerWaalsContact O-CB 3.24Å; N213-T232 WeakPolarHBondContact O-CB 3.33Å; N213-T232 WeakPolarHBondContact O-CG2 3.44Å; N213-Y234 HydrophobicContact CB-CD1 4.37Å; N213-Y234 HydrophobicContact CB-CE1 3.53Å; N213-Y234 HydrophobicContact CB-CE2 4.14Å; N213-Y234 WeakPolarHBondContact CB-OH 3.14Å
214	V	93.7	Very high	95.4	Very high	50 Å²	50	56.8 Å²	56.8	30%	0.303	29%	0.286	S	S	.	.			trans	-63.4	124.9	175.2	179.1	0	0	0	0	109.7	Y234	V214-Y234 WeakPolarHBondContact O-CE1 3.45Å; V214-Y234 PolarHBondContact O-OH 3.13Å
215	S	93	Very high	95.5	Very high	34 Å²	34	56.8 Å²	56.8	24%	0.238	29%	0.286	C	S	.	.	S	Bend	trans	-79	-34.5	179.6	58	0	0	0	0	113.1	N213 I217 A231	N213-S215 PolarHBondContact O-N 3.31Å; S215-I217 PolarHBondContact O-N 3.49Å; S215-A231 WeakPolarHBondContact CB-O 3.24Å
216	Y	93.7	Very high	95.6	Very high	149 Å²	149	56.1 Å²	56.1	58%	0.584	28%	0.283	S	S	*	.	S	Bend	trans	-75.7	67.3	176	-163.3	-98.4	0	0	0	111.7
217	I	92.9	Very high	95.6	Very high	3 Å²	3	51.7 Å²	51.7	2%	0.015	26%	0.262	C	S	.	.			trans	-129.6	178.6	178.5	-158.4	56.2	0	0	0	109.5	R180 S215 R223 L227	R180-I217 HydrophobicContact CB-CG1 3.71Å; R180-I217 HydrophobicContact CB-CG2 4.34Å; S215-I217 PolarHBondContact O-N 3.49Å; I217-R223 PolarHBondContact O-NE 2.91Å; I217-R223 PolarHBondContact O-NH2 3.35Å; I217-L227 HydrophobicContact CG2-CD1 3.86Å; I217-L227 HydrophobicContact CG2-CD2 4.17Å
218	C	92.2	Very high	95.6	Very high	2 Å²	2	52 Å²	52	1%	0.014	26%	0.264	C	S	.	.	S	Bend	trans	63	150.4	-169.8	-57.3	0	0	0	0	114.6	R180 R223 L227	R180-C218 VanDerWaalsContact C-SG 3.51Å; R180-C218 WeakPolarHBondContact O-CA 3.37Å; R180-C218 PolarHBondContact O-N 3.15Å; R180-C218 VanDerWaalsContact O-N 3.08Å; R180-C218 PolarHBondContact O-SG 2.91Å; C218-R223 HydrophobicContact CB-CB 4.14Å; C218-R223 HydrophobicContact CB-CG 4.31Å; C218-R223 PolarHBondContact O-NH2 2.86Å; C218-L227 HydrophobicContact CB-CD1 4.41Å
219	S	94.3	Very high	95.5	Very high	11 Å²	11	49.3 Å²	49.3	8%	0.077	25%	0.247	C	C	.	.			trans	-67.5	137.6	165.3	-62.7	0	0	0	0	110.4	R6 D181 K183 Y221 Y222 R223	R6-S219 PolarHBondContact NH1-OG 3.44Å; D181-S219 WeakPolarHBondContact OD1-CB 3.2Å; D181-S219 PolarHBondContact OD1-N 2.95Å; D181-S219 PolarHBondContact OD1-OG 2.82Å; K183-S219 WeakPolarHBondContact CD-OG 3.25Å; K183-S219 PolarHBondContact NZ-OG 3.42Å; S219-Y221 PolarHBondContact O-N 3Å; S219-Y222 PolarHBondContact O-N 2.81Å; S219-R223 PolarHBondContact O-N 2.8Å
220	R	95.9	Very high	95.6	Very high	92 Å²	92	38.8 Å²	38.8	35%	0.347	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-50.6	-51.4	-164	-168.2	-171.3	-67.3	129.1	-5.1	114.8	Y222 R223 G259 D260 Q265	R220-Y222 PolarHBondContact O-N 2.76Å; R220-Y222 VanDerWaalsContact O-N 3.14Å; R220-R223 VanDerWaalsContact O-CB 3.29Å; R220-R223 WeakPolarHBondContact O-CB 3.37Å; R220-R223 PolarHBondContact O-N 2.67Å; R220-R223 VanDerWaalsContact O-N 3.14Å; R220-G259 WeakPolarHBondContact CD-O 3.47Å; R220-D260 PolarHBondContact NE-O 2.89Å; R220-D260 PolarHBondContact NH1-O 2.99Å; R220-D260 PolarHBondContact NH2-O 3.08Å; R220-Q265 HydrophobicContact CG-CB 4.41Å; R220-Q265 HydrophobicContact CG-CG 4.41Å; R220-Q265 VanDerWaalsContact O-CD 3.27Å; R220-Q265 PolarHBondContact O-OE1 3.39Å
221	Y	98.4	Very high	95.7	Very high	77 Å²	77	35 Å²	35	30%	0.302	18%	0.177	S	C	.	.	G	3₁₀ helix	trans	-65.5	-17.9	-176.2	-58.9	-15.9	0	0	0	114.2	S219 P255 P258 G259	S219-Y221 PolarHBondContact O-N 3Å; Y221-P255 HydrophobicContact CD2-CB 3.9Å; Y221-P255 HydrophobicContact CD2-CG 3.86Å; Y221-P255 HydrophobicContact CE2-CB 4.49Å; Y221-P255 HydrophobicContact CE2-CG 4.19Å; Y221-P255 HydrophobicContact CG-CB 4.43Å; Y221-P258 HydrophobicContact CE1-CB 4.32Å; Y221-G259 WeakPolarHBondContact CE1-O 3.44Å
222	Y	98.7	Very high	95.8	Very high	9 Å²	9	33.2 Å²	33.2	4%	0.035	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-109.9	5.6	-177.8	-47.8	-81.7	0	0	0	111.7	I182 K183 P184 S219 R220 S242 C245 V246 E249	I182-Y222 WeakPolarHBondContact O-CB 3.27Å; K183-Y222 HydrophobicContact CB-CD2 3.51Å; K183-Y222 HydrophobicContact CB-CE2 3.57Å; K183-Y222 HydrophobicContact CB-CG 4.02Å; P184-Y222 VanDerWaalsContact CD-CE1 3.43Å; P184-Y222 WeakPolarHBondContact CD-OH 3.39Å; P184-Y222 HydrophobicContact CG-CE1 4.07Å; P184-Y222 WeakPolarHBondContact CG-OH 3.33Å; S219-Y222 PolarHBondContact O-N 2.81Å; R220-Y222 PolarHBondContact O-N 2.76Å; R220-Y222 VanDerWaalsContact O-N 3.14Å; Y222-S242 WeakPolarHBondContact O-CB 3.29Å; Y222-S242 PolarHBondContact O-OG 3.14Å; Y222-C245 HydrophobicContact CD1-CB 3.69Å; Y222-C245 HydrophobicContact CE1-CB 4.39Å; Y222-V246 HydrophobicContact CD1-CG2 4.1Å; Y222-V246 HydrophobicContact CE1-CG2 4.15Å; Y222-E249 VanDerWaalsContact CE1-OE2 3.22Å; Y222-E249 WeakPolarHBondContact CE1-OE2 3.27Å; Y222-E249 VanDerWaalsContact CZ-OE2 3.26Å; Y222-E249 PolarHBondContact OH-OE1 2.94Å; Y222-E249 PolarHBondContact OH-OE2 3.45Å
223	R	98.5	Very high	95.9	Very high	18 Å²	18	33.2 Å²	33.2	7%	0.068	17%	0.168	C	C	.	.			trans	-76.8	128.9	-175.9	-175.2	177.8	-65.5	147	0.8	110.4	I217 C218 S219 R220 L227 I228 W241	I217-R223 PolarHBondContact O-NE 2.91Å; I217-R223 PolarHBondContact O-NH2 3.35Å; C218-R223 HydrophobicContact CB-CB 4.14Å; C218-R223 HydrophobicContact CB-CG 4.31Å; C218-R223 PolarHBondContact O-NH2 2.86Å; S219-R223 PolarHBondContact O-N 2.8Å; R220-R223 VanDerWaalsContact O-CB 3.29Å; R220-R223 WeakPolarHBondContact O-CB 3.37Å; R220-R223 PolarHBondContact O-N 2.67Å; R220-R223 VanDerWaalsContact O-N 3.14Å; R223-L227 HydrophobicContact CG-CB 3.71Å; R223-L227 HydrophobicContact CG-CD1 3.96Å; R223-L227 HydrophobicContact CG-CG 4.48Å; R223-I228 HydrophobicContact CG-CG1 4.06Å; R223-W241 PolarHBondContact O-NE1 2.74Å; R223-W241 VanDerWaalsContact O-NE1 3.14Å
224	A	98.7	Very high	96.1	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.168	C	C	.	.			trans	-65.9	146.5	176.1	0	0	0	0	0	112	E226 L227 I228 I238 W241	A224-E226 VanDerWaalsContact C-N 3.32Å; A224-E226 HydrophobicContact CB-CG 4.38Å; A224-E226 WeakPolarHBondContact CB-OE2 3.39Å; A224-E226 PolarHBondContact O-N 2.92Å; A224-L227 HydrophobicContact CB-CD1 4.45Å; A224-L227 HydrophobicContact CB-CG 4.49Å; A224-L227 WeakPolarHBondContact O-CB 3.34Å; A224-L227 PolarHBondContact O-N 3.21Å; A224-L227 VanDerWaalsContact O-N 3.08Å; A224-I228 PolarHBondContact O-N 3.46Å; A224-I238 HydrophobicContact CB-CB 3.94Å; A224-I238 HydrophobicContact CB-CG2 3.82Å; A224-W241 HydrophobicContact CB-CB 3.85Å; A224-W241 HydrophobicContact CB-CD2 4.39Å; A224-W241 HydrophobicContact CB-CG 3.74Å
225	P	98.2	Very high	96.3	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-62.1	-35.7	-173.7	25.5	-35.5	0	0	0	112.8	L227 I228 F229 W241 I269 M284 Y323	P225-L227 PolarHBondContact O-N 2.78Å; P225-I228 CarbonylContact O-C 3.43Å; P225-I228 WeakPolarHBondContact O-CA 3.37Å; P225-I228 WeakPolarHBondContact O-CB 3.48Å; P225-I228 PolarHBondContact O-N 3.25Å; P225-F229 HydrophobicContact CB-CD2 4.47Å; P225-F229 HydrophobicContact CB-CE2 4.4Å; P225-F229 WeakPolarHBondContact O-CD2 3.41Å; P225-F229 PolarHBondContact O-N 3.27Å; P225-W241 HydrophobicContact CG-CE3 4.24Å; P225-W241 HydrophobicContact CG-CH2 3.99Å; P225-W241 HydrophobicContact CG-CZ2 4.35Å; P225-W241 HydrophobicContact CG-CZ3 3.94Å; P225-I269 HydrophobicContact CB-CD1 4.43Å; P225-M284 HydrophobicContact CB-SD 3.56Å; P225-M284 VanDerWaalsContact CB-SD 3.56Å; P225-M284 HydrophobicContact CG-SD 3.57Å; P225-M284 VanDerWaalsContact CG-SD 3.57Å; P225-Y323 HydrophobicContact CB-CD1 4.1Å; P225-Y323 HydrophobicContact CB-CE1 4.22Å; P225-Y323 HydrophobicContact CG-CD1 3.91Å; P225-Y323 HydrophobicContact CG-CE1 4.4Å
226	E	98.3	Very high	96.6	Very high	2 Å²	2	34 Å²	34	1%	0.009	17%	0.171	C	C	.	.	H	α-helix	trans	-57.7	-34	174.5	61.1	-89.2	-144.6	0	0	113.2	A224 F229 G230 A231 I238 M284 P325 R328	A224-E226 VanDerWaalsContact C-N 3.32Å; A224-E226 HydrophobicContact CB-CG 4.38Å; A224-E226 WeakPolarHBondContact CB-OE2 3.39Å; A224-E226 PolarHBondContact O-N 2.92Å; E226-F229 CarbonylContact O-C 3.42Å; E226-F229 PolarHBondContact O-N 3.21Å; E226-G230 PolarHBondContact O-N 3.06Å; E226-G230 VanDerWaalsContact O-N 3.15Å; E226-A231 HydrophobicContact CB-CB 4.09Å; E226-A231 WeakPolarHBondContact O-CB 3.34Å; E226-A231 PolarHBondContact O-N 3Å; E226-I238 HydrophobicContact CG-CG2 4.08Å; E226-I238 VanDerWaalsContact OE1-CG2 3.31Å; E226-I238 WeakPolarHBondContact OE1-CG2 3.25Å; E226-M284 HydrophobicContact CB-CB 3.86Å; E226-M284 HydrophobicContact CB-CG 4.13Å; E226-M284 WeakPolarHBondContact CB-O 3.41Å; E226-P325 HydrophobicContact CG-CG 4.41Å; E226-R328 IonicContact OE1-CZ 3.94Å; E226-R328 IonicContact OE1-NH1 2.95Å; E226-R328 PolarHBondContact OE1-NH1 2.75Å; E226-R328 IonicContact OE1-NH2 3.45Å; E226-R328 PolarHBondContact OE1-NH2 3.38Å; E226-R328 IonicContact OE2-CZ 3.01Å; E226-R328 IonicContact OE2-NH1 3.58Å; E226-R328 IonicContact OE2-NH2 2.69Å; E226-R328 PolarHBondContact OE2-NH2 3.14Å
227	L	97.7	Very high	96.8	Very high	7 Å²	7	27.7 Å²	27.7	4%	0.037	15%	0.149	C	C	.	.	H	α-helix	trans	-71.9	-33	174.7	-62.3	177.2	0	0	0	111.5	I217 C218 R223 A224 P225 G230 Y234 I238	I217-L227 HydrophobicContact CG2-CD1 3.86Å; I217-L227 HydrophobicContact CG2-CD2 4.17Å; C218-L227 HydrophobicContact CB-CD1 4.41Å; R223-L227 HydrophobicContact CG-CB 3.71Å; R223-L227 HydrophobicContact CG-CD1 3.96Å; R223-L227 HydrophobicContact CG-CG 4.48Å; A224-L227 HydrophobicContact CB-CD1 4.45Å; A224-L227 HydrophobicContact CB-CG 4.49Å; A224-L227 WeakPolarHBondContact O-CB 3.34Å; A224-L227 PolarHBondContact O-N 3.21Å; A224-L227 VanDerWaalsContact O-N 3.08Å; P225-L227 PolarHBondContact O-N 2.78Å; L227-G230 PolarHBondContact O-N 3.06Å; L227-G230 VanDerWaalsContact O-N 3.16Å; L227-Y234 HydrophobicContact CD2-CD1 3.29Å; L227-Y234 HydrophobicContact CD2-CD2 4.22Å; L227-Y234 HydrophobicContact CD2-CE1 3.44Å; L227-Y234 VanDerWaalsContact CD2-CE1 3.44Å; L227-Y234 HydrophobicContact CD2-CE2 4.38Å; L227-Y234 HydrophobicContact CD2-CG 3.69Å; L227-I238 HydrophobicContact CD1-CB 4.28Å; L227-I238 HydrophobicContact CD1-CD1 3.94Å; L227-I238 HydrophobicContact CD1-CG2 4.17Å; L227-I238 HydrophobicContact CD2-CD1 4.47Å; L227-I238 HydrophobicContact CD2-CG2 4.4Å; L227-I238 HydrophobicContact CG-CG2 4.11Å
228	I	95.9	Very high	97.1	Very high	36 Å²	36	27.6 Å²	27.6	19%	0.185	15%	0.148	C	C	.	.	H	α-helix	trans	-69.1	-38.7	174.3	-54.7	172.5	0	0	0	110	R223 A224 P225 G230 G262 Q265 L266 I269	R223-I228 HydrophobicContact CG-CG1 4.06Å; A224-I228 PolarHBondContact O-N 3.46Å; P225-I228 CarbonylContact O-C 3.43Å; P225-I228 WeakPolarHBondContact O-CA 3.37Å; P225-I228 WeakPolarHBondContact O-CB 3.48Å; P225-I228 PolarHBondContact O-N 3.25Å; I228-G230 PolarHBondContact O-N 3.13Å; I228-G262 VanDerWaalsContact CG2-O 3.26Å; I228-G262 WeakPolarHBondContact CG2-O 3.49Å; I228-Q265 HydrophobicContact CD1-CB 4.04Å; I228-Q265 HydrophobicContact CD1-CG 3.54Å; I228-L266 HydrophobicContact CG2-CB 4.22Å; I228-I269 HydrophobicContact CD1-CD1 3.85Å
229	F	94.6	Very high	97.4	Very high	7 Å²	7	27.5 Å²	27.5	3%	0.031	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-2.1	170.6	-73.7	-68.7	0	0	0	113.6	P225 E226 L266 P276 M284 N285 Y288 F293	P225-F229 HydrophobicContact CB-CD2 4.47Å; P225-F229 HydrophobicContact CB-CE2 4.4Å; P225-F229 WeakPolarHBondContact O-CD2 3.41Å; P225-F229 PolarHBondContact O-N 3.27Å; E226-F229 CarbonylContact O-C 3.42Å; E226-F229 PolarHBondContact O-N 3.21Å; F229-L266 HydrophobicContact CE1-CD2 4.06Å; F229-L266 HydrophobicContact CE2-CD1 3.96Å; F229-L266 HydrophobicContact CE2-CD2 4.35Å; F229-L266 HydrophobicContact CZ-CD1 4.03Å; F229-L266 HydrophobicContact CZ-CD2 3.74Å; F229-P276 HydrophobicContact CZ-CG 4.5Å; F229-M284 HydrophobicContact CD2-CB 4.27Å; F229-M284 HydrophobicContact CD2-CE 3.79Å; F229-M284 HydrophobicContact CD2-SD 3.82Å; F229-M284 HydrophobicContact CE2-CE 3.34Å; F229-M284 HydrophobicContact CE2-SD 3.81Å; F229-M284 HydrophobicContact CZ-CE 4.15Å; F229-N285 HydrophobicContact CB-CB 4.02Å; F229-N285 PolarHBondContact O-ND2 3.21Å; F229-Y288 HydrophobicContact CB-CD2 4.39Å; F229-Y288 AromaticContact CD1-CD1 3.55Å; F229-Y288 HydrophobicContact CD1-CD1 3.55Å; F229-Y288 AromaticContact CD1-CD2 3.75Å; F229-Y288 HydrophobicContact CD1-CD2 3.75Å; F229-Y288 AromaticContact CD1-CE1 3.44Å; F229-Y288 HydrophobicContact CD1-CE1 3.44Å; F229-Y288 VanDerWaalsContact CD1-CE1 3.44Å; F229-Y288 AromaticContact CD1-CE2 3.7Å; F229-Y288 HydrophobicContact CD1-CE2 3.7Å; F229-Y288 AromaticContact CD1-CG 3.68Å; F229-Y288 HydrophobicContact CD1-CG 3.68Å; F229-Y288 AromaticContact CD1-CZ 3.54Å; F229-Y288 AromaticContact CE1-CD1 3.75Å; F229-Y288 HydrophobicContact CE1-CD1 3.75Å; F229-Y288 AromaticContact CE1-CE1 3.36Å; F229-Y288 HydrophobicContact CE1-CE1 3.36Å; F229-Y288 HydrophobicContact CE1-CE2 4.37Å; F229-Y288 HydrophobicContact CE1-CG 4.36Å; F229-Y288 AromaticContact CE1-CZ 3.73Å; F229-F293 HydrophobicContact CE1-CE2 4.02Å; F229-F293 AromaticContact CE1-CZ 3.92Å; F229-F293 HydrophobicContact CE1-CZ 3.92Å; F229-F293 HydrophobicContact CZ-CE2 4.16Å; F229-F293 HydrophobicContact CZ-CZ 4.13Å
230	G	95.1	Very high	97.6	Very high	31 Å²	31	27 Å²	27	32%	0.32	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.6	17.2	173.3	0	0	0	0	0	115.1	E226 L227 I228	E226-G230 PolarHBondContact O-N 3.06Å; E226-G230 VanDerWaalsContact O-N 3.15Å; L227-G230 PolarHBondContact O-N 3.06Å; L227-G230 VanDerWaalsContact O-N 3.16Å; I228-G230 PolarHBondContact O-N 3.13Å
231	A	96.3	Very high	97.8	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.008	13%	0.128	C	C	.	.			trans	-57.4	140.1	176.9	0	0	0	0	0	111.7	S215 E226 Y234 M284 N285	S215-A231 WeakPolarHBondContact CB-O 3.24Å; E226-A231 HydrophobicContact CB-CB 4.09Å; E226-A231 WeakPolarHBondContact O-CB 3.34Å; E226-A231 PolarHBondContact O-N 3Å; A231-Y234 WeakPolarHBondContact O-CD1 3.24Å; A231-M284 VanDerWaalsContact CB-O 3.31Å; A231-M284 WeakPolarHBondContact CB-O 3.12Å; A231-N285 HydrophobicContact CB-CB 4.19Å
232	T	96.8	Very high	97.8	Very high	62 Å²	62	19 Å²	19	38%	0.38	11%	0.114	S	C	.	.	S	Bend	trans	-114.5	-11.2	177.9	59.2	0	0	0	0	112.5	P212 N213	P212-T232 CarbonylContact C-O 3.59Å; N213-T232 WeakPolarHBondContact CB-O 3.5Å; N213-T232 PolarHBondContact N-O 3.01Å; N213-T232 PolarHBondContact ND2-O 3.03Å; N213-T232 VanDerWaalsContact ND2-O 3.14Å; N213-T232 WeakPolarHBondContact O-CA 3.33Å; N213-T232 VanDerWaalsContact O-CB 3.24Å; N213-T232 WeakPolarHBondContact O-CB 3.33Å; N213-T232 WeakPolarHBondContact O-CG2 3.44Å
233	D	96.3	Very high	97.8	Very high	97 Å²	97	18.6 Å²	18.6	52%	0.519	11%	0.112	S	C	.	.	S	Bend	trans	-102.8	16.7	179.4	61.4	-27.5	0	0	0	112.9
234	Y	98.1	Very high	97.8	Very high	14 Å²	14	17.7 Å²	17.7	6%	0.055	11%	0.109	C	C	.	.			trans	-57.9	158.2	176.6	61.4	-98.8	0	0	0	112.8	R180 L207 N213 V214 L227 A231 I238	R180-Y234 PolarHBondContact NH1-OH 3.32Å; L207-Y234 HydrophobicContact CD1-CD2 4.2Å; L207-Y234 HydrophobicContact CD1-CE2 4.24Å; L207-Y234 HydrophobicContact CD2-CE2 4.21Å; N213-Y234 HydrophobicContact CB-CD1 4.37Å; N213-Y234 HydrophobicContact CB-CE1 3.53Å; N213-Y234 HydrophobicContact CB-CE2 4.14Å; N213-Y234 WeakPolarHBondContact CB-OH 3.14Å; V214-Y234 WeakPolarHBondContact O-CE1 3.45Å; V214-Y234 PolarHBondContact O-OH 3.13Å; L227-Y234 HydrophobicContact CD2-CD1 3.29Å; L227-Y234 HydrophobicContact CD2-CD2 4.22Å; L227-Y234 HydrophobicContact CD2-CE1 3.44Å; L227-Y234 VanDerWaalsContact CD2-CE1 3.44Å; L227-Y234 HydrophobicContact CD2-CE2 4.38Å; L227-Y234 HydrophobicContact CD2-CG 3.69Å; A231-Y234 WeakPolarHBondContact O-CD1 3.24Å; Y234-I238 HydrophobicContact CD2-CD1 3.6Å; Y234-I238 HydrophobicContact CD2-CG1 4.34Å; Y234-I238 HydrophobicContact CD2-CG2 4.21Å; Y234-I238 HydrophobicContact CE2-CD1 3.57Å; Y234-I238 HydrophobicContact CG-CG2 4.35Å
235	T	98.6	Very high	97.9	Very high	76 Å²	76	17.8 Å²	17.8	47%	0.466	11%	0.109	S	C	.	.			trans	-112	-178.6	-180	79	0	0	0	0	111.6	S237 I238	T235-S237 PolarHBondContact O-N 3.22Å; T235-S237 PolarHBondContact OG1-N 3.36Å; T235-S237 PolarHBondContact OG1-OG 2.84Å; T235-I238 WeakPolarHBondContact O-CG1 3.33Å; T235-I238 PolarHBondContact O-N 2.81Å
236	S	98.7	Very high	97.9	Very high	21 Å²	21	17.8 Å²	17.8	15%	0.147	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-10.8	175.7	-52.7	0	0	0	0	114.1	H173 I238 D239	H173-S236 PolarHBondContact CE1-O 3.36Å; S236-I238 PolarHBondContact O-N 3.45Å; S236-I238 VanDerWaalsContact O-N 3.13Å; S236-D239 WeakPolarHBondContact O-CB 3.33Å; S236-D239 PolarHBondContact O-N 3.34Å
237	S	98.9	Very high	97.9	Very high	16 Å²	16	17.7 Å²	17.7	11%	0.112	11%	0.108	C	C	.	.	H	α-helix	trans	-65.3	-10.1	175.2	68.8	0	0	0	0	114	T235 D239 V240 W241 P325 R328	T235-S237 PolarHBondContact O-N 3.22Å; T235-S237 PolarHBondContact OG1-N 3.36Å; T235-S237 PolarHBondContact OG1-OG 2.84Å; S237-D239 VanDerWaalsContact C-N 3.28Å; S237-D239 PolarHBondContact O-N 3.21Å; S237-V240 WeakPolarHBondContact O-CB 3.29Å; S237-V240 PolarHBondContact O-N 3.42Å; S237-W241 PolarHBondContact O-N 2.76Å; S237-W241 VanDerWaalsContact O-N 3.16Å; S237-P325 WeakPolarHBondContact CB-O 3.48Å; S237-P325 WeakPolarHBondContact OG-CB 3.23Å; S237-P325 PolarHBondContact OG-O 3.21Å; S237-R328 PolarHBondContact O-NH1 3.45Å
238	I	98.9	Very high	98	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-64	-33.7	167.4	64.4	172	0	0	0	111.9	R180 A224 E226 L227 Y234 T235 S236 V240 W241 S242	R180-I238 HydrophobicContact CB-CD1 4.37Å; R180-I238 HydrophobicContact CG-CD1 3.97Å; A224-I238 HydrophobicContact CB-CB 3.94Å; A224-I238 HydrophobicContact CB-CG2 3.82Å; E226-I238 HydrophobicContact CG-CG2 4.08Å; E226-I238 VanDerWaalsContact OE1-CG2 3.31Å; E226-I238 WeakPolarHBondContact OE1-CG2 3.25Å; L227-I238 HydrophobicContact CD1-CB 4.28Å; L227-I238 HydrophobicContact CD1-CD1 3.94Å; L227-I238 HydrophobicContact CD1-CG2 4.17Å; L227-I238 HydrophobicContact CD2-CD1 4.47Å; L227-I238 HydrophobicContact CD2-CG2 4.4Å; L227-I238 HydrophobicContact CG-CG2 4.11Å; Y234-I238 HydrophobicContact CD2-CD1 3.6Å; Y234-I238 HydrophobicContact CD2-CG1 4.34Å; Y234-I238 HydrophobicContact CD2-CG2 4.21Å; Y234-I238 HydrophobicContact CE2-CD1 3.57Å; Y234-I238 HydrophobicContact CG-CG2 4.35Å; T235-I238 WeakPolarHBondContact O-CG1 3.33Å; T235-I238 PolarHBondContact O-N 2.81Å; S236-I238 PolarHBondContact O-N 3.45Å; S236-I238 VanDerWaalsContact O-N 3.13Å; I238-V240 VanDerWaalsContact C-N 3.29Å; I238-V240 PolarHBondContact O-N 2.84Å; I238-W241 WeakPolarHBondContact O-CB 3.34Å; I238-W241 PolarHBondContact O-N 2.99Å; I238-S242 PolarHBondContact O-N 2.79Å; I238-S242 PolarHBondContact O-OG 2.78Å; I238-S242 VanDerWaalsContact O-OG 3.11Å
239	D	98.9	Very high	98.1	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-69.8	-31.9	176.7	-69.2	-30.7	0	0	0	110.8	L169 H173 C178 H179 R180 I182 S236 S237 S242 A243	L169-D239 HydrophobicContact CD1-CB 4.31Å; L169-D239 HydrophobicContact CD2-CB 3.95Å; H173-D239 IonicContact CD2-OD2 2.68Å; H173-D239 IonicContact CE1-OD2 3.29Å; H173-D239 IonicContact NE2-OD2 2.94Å; H173-D239 PolarHBondContact NE2-OD2 2.97Å; C178-D239 VanDerWaalsContact SG-CG 3.51Å; C178-D239 PolarHBondContact SG-OD2 2.7Å; H179-D239 PolarHBondContact N-OD2 2.9Å; R180-D239 PolarHBondContact N-OD1 3.45Å; I182-D239 HydrophobicContact CG1-CB 4.06Å; S236-D239 WeakPolarHBondContact O-CB 3.33Å; S236-D239 PolarHBondContact O-N 3.34Å; S237-D239 VanDerWaalsContact C-N 3.28Å; S237-D239 PolarHBondContact O-N 3.21Å; D239-S242 PolarHBondContact O-N 3.1Å; D239-A243 WeakPolarHBondContact O-CB 3.28Å; D239-A243 PolarHBondContact O-N 3.29Å
240	V	98.9	Very high	98.3	Very high	2 Å²	2	16.4 Å²	16.4	1%	0.012	10%	0.102	C	C	.	.	H	α-helix	trans	-66.1	-44.4	175.5	178.9	0	0	0	0	110.4	S237 I238 S242 A243 G244 L320 R328 L329 P331	S237-V240 WeakPolarHBondContact O-CB 3.29Å; S237-V240 PolarHBondContact O-N 3.42Å; I238-V240 VanDerWaalsContact C-N 3.29Å; I238-V240 PolarHBondContact O-N 2.84Å; V240-S242 PolarHBondContact O-N 3.2Å; V240-A243 PolarHBondContact O-N 3.48Å; V240-G244 PolarHBondContact O-N 3.15Å; V240-L320 HydrophobicContact CG1-CB 4.49Å; V240-L320 HydrophobicContact CG1-CD2 3.43Å; V240-L320 VanDerWaalsContact CG1-CD2 3.43Å; V240-R328 HydrophobicContact CG1-CB 4.03Å; V240-L329 WeakPolarHBondContact CG1-O 3.25Å; V240-P331 HydrophobicContact CG2-CG 4.08Å
241	W	98.9	Very high	98.4	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-57.4	-49.7	172.2	174.3	-81.6	0	0	0	111.1	R223 A224 P225 S237 I238 A243 G244 C245 F257 I269 L273 L321 E322	R223-W241 PolarHBondContact O-NE1 2.74Å; R223-W241 VanDerWaalsContact O-NE1 3.14Å; A224-W241 HydrophobicContact CB-CB 3.85Å; A224-W241 HydrophobicContact CB-CD2 4.39Å; A224-W241 HydrophobicContact CB-CG 3.74Å; P225-W241 HydrophobicContact CG-CE3 4.24Å; P225-W241 HydrophobicContact CG-CH2 3.99Å; P225-W241 HydrophobicContact CG-CZ2 4.35Å; P225-W241 HydrophobicContact CG-CZ3 3.94Å; S237-W241 PolarHBondContact O-N 2.76Å; S237-W241 VanDerWaalsContact O-N 3.16Å; I238-W241 WeakPolarHBondContact O-CB 3.34Å; I238-W241 PolarHBondContact O-N 2.99Å; W241-A243 VanDerWaalsContact C-N 3.29Å; W241-A243 PolarHBondContact O-N 2.88Å; W241-G244 CarbonylContact O-C 3.25Å; W241-G244 WeakPolarHBondContact O-CA 3.43Å; W241-G244 PolarHBondContact O-N 2.86Å; W241-C245 PolarHBondContact O-N 2.84Å; W241-F257 HydrophobicContact CH2-CE2 4.25Å; W241-F257 HydrophobicContact CZ2-CD2 4.14Å; W241-F257 AromaticContact CZ2-CE2 3.67Å; W241-F257 HydrophobicContact CZ2-CE2 3.67Å; W241-F257 HydrophobicContact CZ2-CZ 4.45Å; W241-I269 HydrophobicContact CH2-CD1 4.36Å; W241-I269 HydrophobicContact CH2-CG1 4.45Å; W241-I269 HydrophobicContact CH2-CG2 3.77Å; W241-I269 HydrophobicContact CZ2-CD1 3.72Å; W241-I269 HydrophobicContact CZ2-CG1 3.96Å; W241-I269 HydrophobicContact CZ2-CG2 4.14Å; W241-L273 HydrophobicContact CH2-CD1 3.72Å; W241-L273 HydrophobicContact CZ3-CD1 4Å; W241-L321 HydrophobicContact CD2-CD2 3.74Å; W241-L321 HydrophobicContact CE3-CB 4.49Å; W241-L321 HydrophobicContact CE3-CD2 3.89Å; W241-L321 HydrophobicContact CG-CD2 4.21Å; W241-L321 HydrophobicContact CH2-CD2 4.33Å; W241-L321 HydrophobicContact CZ2-CD2 4.18Å; W241-L321 HydrophobicContact CZ3-CB 4.21Å; W241-L321 HydrophobicContact CZ3-CD2 4.2Å; W241-L321 WeakPolarHBondContact O-CD2 3.38Å; W241-E322 WeakPolarHBondContact CZ3-O 3.43Å
242	S	98.9	Very high	98.5	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-58.5	-40	177.9	-59.5	0	0	0	0	112.3	Y222 I238 D239 V240 C245 V246	Y222-S242 WeakPolarHBondContact O-CB 3.29Å; Y222-S242 PolarHBondContact O-OG 3.14Å; I238-S242 PolarHBondContact O-N 2.79Å; I238-S242 PolarHBondContact O-OG 2.78Å; I238-S242 VanDerWaalsContact O-OG 3.11Å; D239-S242 PolarHBondContact O-N 3.1Å; V240-S242 PolarHBondContact O-N 3.2Å; S242-C245 WeakPolarHBondContact O-CB 3.41Å; S242-C245 PolarHBondContact O-N 3.02Å; S242-V246 WeakPolarHBondContact O-CG2 3.24Å; S242-V246 PolarHBondContact O-N 2.93Å
243	A	98.9	Very high	98.4	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-65.4	-37.2	173.7	0	0	0	0	0	112.2	M162 L165 F166 L169 D239 V240 W241 C245 V246 L247	M162-A243 HydrophobicContact CE-CB 4.19Å; M162-A243 VanDerWaalsContact CE-O 3.28Å; M162-A243 WeakPolarHBondContact CE-O 3.46Å; L165-A243 HydrophobicContact CD2-CB 3.91Å; L165-A243 HydrophobicContact CG-CB 4.47Å; F166-A243 HydrophobicContact CD1-CB 4.43Å; F166-A243 HydrophobicContact CE1-CB 3.62Å; F166-A243 HydrophobicContact CZ-CB 4.06Å; L169-A243 HydrophobicContact CD1-CB 4.08Å; D239-A243 WeakPolarHBondContact O-CB 3.28Å; D239-A243 PolarHBondContact O-N 3.29Å; V240-A243 PolarHBondContact O-N 3.48Å; W241-A243 VanDerWaalsContact C-N 3.29Å; W241-A243 PolarHBondContact O-N 2.88Å; A243-C245 VanDerWaalsContact C-N 3.34Å; A243-V246 PolarHBondContact O-N 2.71Å; A243-L247 PolarHBondContact O-N 2.65Å
244	G	98.9	Very high	98.5	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-58.8	-42.8	170	0	0	0	0	0	112.7	V240 W241 L247 A248	V240-G244 PolarHBondContact O-N 3.15Å; W241-G244 CarbonylContact O-C 3.25Å; W241-G244 WeakPolarHBondContact O-CA 3.43Å; W241-G244 PolarHBondContact O-N 2.86Å; G244-L247 PolarHBondContact O-N 2.92Å; G244-A248 WeakPolarHBondContact O-CB 3.15Å; G244-A248 PolarHBondContact O-N 3.18Å
245	C	98.9	Very high	98.5	Very high	1 Å²	1	17 Å²	17	1%	0.007	10%	0.099	C	C	.	.	H	α-helix	trans	-62.6	-40.9	173.4	-69.6	0	0	0	0	112	Y222 W241 S242 A243 A248 E249	Y222-C245 HydrophobicContact CD1-CB 3.69Å; Y222-C245 HydrophobicContact CE1-CB 4.39Å; W241-C245 PolarHBondContact O-N 2.84Å; S242-C245 WeakPolarHBondContact O-CB 3.41Å; S242-C245 PolarHBondContact O-N 3.02Å; A243-C245 VanDerWaalsContact C-N 3.34Å; C245-A248 PolarHBondContact O-N 3.17Å; C245-E249 VanDerWaalsContact O-CB 3.31Å; C245-E249 WeakPolarHBondContact O-CB 3.14Å; C245-E249 PolarHBondContact O-N 3.48Å
246	V	98.9	Very high	98.5	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-62.8	-46.7	175.4	174.1	0	0	0	0	110.9	M162 I182 P184 L187 Y222 S242 A243 A248 E249 L250	M162-V246 HydrophobicContact SD-CB 4.34Å; M162-V246 HydrophobicContact SD-CG1 3.83Å; I182-V246 HydrophobicContact CG2-CG2 4.42Å; P184-V246 HydrophobicContact CG-CG1 4.49Å; P184-V246 HydrophobicContact CG-CG2 4.18Å; L187-V246 HydrophobicContact CD1-CG1 3.94Å; L187-V246 HydrophobicContact CD1-CG2 4.47Å; Y222-V246 HydrophobicContact CD1-CG2 4.1Å; Y222-V246 HydrophobicContact CE1-CG2 4.15Å; S242-V246 WeakPolarHBondContact O-CG2 3.24Å; S242-V246 PolarHBondContact O-N 2.93Å; A243-V246 PolarHBondContact O-N 2.71Å; V246-A248 PolarHBondContact O-N 3.44Å; V246-E249 PolarHBondContact O-N 3.01Å; V246-L250 HydrophobicContact CG1-CD1 4.23Å; V246-L250 HydrophobicContact CG1-CG 4.48Å; V246-L250 WeakPolarHBondContact O-CG 3.42Å; V246-L250 PolarHBondContact O-N 2.91Å
247	L	98.9	Very high	98.5	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-56.8	-51.5	175.8	171.6	61.4	0	0	0	110.7	V158 M162 A243 G244 E249 L250 L251 L316 C317 L320 F339	V158-L247 HydrophobicContact CG1-CD1 3.78Å; M162-L247 HydrophobicContact CE-CB 3.91Å; M162-L247 HydrophobicContact CG-CB 4.28Å; M162-L247 HydrophobicContact CG-CD1 3.98Å; M162-L247 HydrophobicContact SD-CB 4.05Å; A243-L247 PolarHBondContact O-N 2.65Å; G244-L247 PolarHBondContact O-N 2.92Å; L247-E249 VanDerWaalsContact C-N 3.3Å; L247-E249 PolarHBondContact O-N 3.47Å; L247-L250 PolarHBondContact O-N 3.31Å; L247-L251 HydrophobicContact CD1-CD1 3.97Å; L247-L251 HydrophobicContact CD1-CG 4.15Å; L247-L251 HydrophobicContact CG-CD1 4.1Å; L247-L251 VanDerWaalsContact O-CG 3.31Å; L247-L251 WeakPolarHBondContact O-CG 3.47Å; L247-L251 PolarHBondContact O-N 3Å; L247-L251 VanDerWaalsContact O-N 3.09Å; L247-L316 HydrophobicContact CD2-CB 4.23Å; L247-L316 HydrophobicContact CD2-CD2 3.84Å; L247-L316 HydrophobicContact CD2-CG 3.83Å; L247-C317 HydrophobicContact CD2-CB 4.02Å; L247-L320 HydrophobicContact CD2-CD1 4.01Å; L247-F339 HydrophobicContact CD1-CE1 4.24Å; L247-F339 HydrophobicContact CD1-CZ 4.49Å
248	A	98.8	Very high	98.4	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-58.8	-42.2	179.3	0	0	0	0	0	112.1	G244 C245 V246 L250 L251 L252 I256 F305 L321	G244-A248 WeakPolarHBondContact O-CB 3.15Å; G244-A248 PolarHBondContact O-N 3.18Å; C245-A248 PolarHBondContact O-N 3.17Å; V246-A248 PolarHBondContact O-N 3.44Å; A248-L250 PolarHBondContact O-N 3.03Å; A248-L251 PolarHBondContact O-N 3.29Å; A248-L252 WeakPolarHBondContact O-CB 3.46Å; A248-L252 VanDerWaalsContact O-CG 3.29Å; A248-L252 WeakPolarHBondContact O-CG 3.26Å; A248-L252 PolarHBondContact O-N 2.67Å; A248-I256 HydrophobicContact CB-CB 3.82Å; A248-I256 HydrophobicContact CB-CD1 3.73Å; A248-I256 HydrophobicContact CB-CG1 4.35Å; A248-I256 HydrophobicContact CB-CG2 3.7Å; A248-F305 HydrophobicContact CB-CE1 4.08Å; A248-F305 HydrophobicContact CB-CZ 4.16Å; A248-L321 HydrophobicContact CB-CD1 4.45Å
249	E	98.6	Very high	98.3	Very high	16 Å²	16	15.2 Å²	15.2	8%	0.075	9%	0.087	C	C	.	.	H	α-helix	trans	-62.7	-41.4	177.6	176.5	170.4	165.4	0	0	112.5	Y222 C245 V246 L247 L251 L252 G253 Q254	Y222-E249 VanDerWaalsContact CE1-OE2 3.22Å; Y222-E249 WeakPolarHBondContact CE1-OE2 3.27Å; Y222-E249 VanDerWaalsContact CZ-OE2 3.26Å; Y222-E249 PolarHBondContact OH-OE1 2.94Å; Y222-E249 PolarHBondContact OH-OE2 3.45Å; C245-E249 VanDerWaalsContact O-CB 3.31Å; C245-E249 WeakPolarHBondContact O-CB 3.14Å; C245-E249 PolarHBondContact O-N 3.48Å; V246-E249 PolarHBondContact O-N 3.01Å; L247-E249 VanDerWaalsContact C-N 3.3Å; L247-E249 PolarHBondContact O-N 3.47Å; E249-L251 VanDerWaalsContact C-N 3.3Å; E249-L251 PolarHBondContact O-N 2.97Å; E249-L252 PolarHBondContact O-N 3.22Å; E249-G253 WeakPolarHBondContact O-CA 3.34Å; E249-G253 PolarHBondContact O-N 2.87Å; E249-Q254 WeakPolarHBondContact CA-O 3.29Å; E249-Q254 PolarHBondContact O-N 3.34Å
250	L	98.4	Very high	98	Very high	7 Å²	7	21.2 Å²	21.2	4%	0.037	12%	0.119	C	C	.	.	H	α-helix	trans	-64.6	-34.7	175.8	-68.9	177.6	0	0	0	112.5	V139 A143 L153 V158 M162 V246 L247 A248	V139-L250 HydrophobicContact CG1-CD1 4.33Å; V139-L250 HydrophobicContact CG1-CD2 3.77Å; V139-L250 HydrophobicContact CG1-CG 4.46Å; A143-L250 HydrophobicContact CB-CD2 3.93Å; L153-L250 HydrophobicContact CD2-CD2 4.06Å; V158-L250 HydrophobicContact CG1-CB 4.3Å; V158-L250 HydrophobicContact CG1-CD1 4.42Å; V158-L250 HydrophobicContact CG2-CB 4.32Å; M162-L250 HydrophobicContact CG-CD1 4.4Å; M162-L250 HydrophobicContact SD-CD1 4.2Å; V246-L250 HydrophobicContact CG1-CD1 4.23Å; V246-L250 HydrophobicContact CG1-CG 4.48Å; V246-L250 WeakPolarHBondContact O-CG 3.42Å; V246-L250 PolarHBondContact O-N 2.91Å; L247-L250 PolarHBondContact O-N 3.31Å; A248-L250 PolarHBondContact O-N 3.03Å
251	L	98.2	Very high	97.7	Very high	8 Å²	8	23.2 Å²	23.2	4%	0.042	13%	0.133	C	C	.	.	H	α-helix	trans	-75.8	-35.5	177.6	-63.4	174.8	0	0	0	112.7	M155 V158 L247 A248 E249 F305 T309 A313	M155-L251 HydrophobicContact CE-CD2 3.73Å; M155-L251 HydrophobicContact SD-CD2 4.24Å; V158-L251 HydrophobicContact CG1-CD2 4.21Å; L247-L251 HydrophobicContact CD1-CD1 3.97Å; L247-L251 HydrophobicContact CD1-CG 4.15Å; L247-L251 HydrophobicContact CG-CD1 4.1Å; L247-L251 VanDerWaalsContact O-CG 3.31Å; L247-L251 WeakPolarHBondContact O-CG 3.47Å; L247-L251 PolarHBondContact O-N 3Å; L247-L251 VanDerWaalsContact O-N 3.09Å; A248-L251 PolarHBondContact O-N 3.29Å; E249-L251 VanDerWaalsContact C-N 3.3Å; E249-L251 PolarHBondContact O-N 2.97Å; L251-F305 HydrophobicContact CB-CD1 3.92Å; L251-F305 HydrophobicContact CB-CE1 4.02Å; L251-F305 HydrophobicContact CD1-CD1 4.36Å; L251-F305 HydrophobicContact CD1-CE1 4.09Å; L251-F305 HydrophobicContact CD1-CZ 4.38Å; L251-T309 HydrophobicContact CD1-CG2 4.18Å; L251-T309 HydrophobicContact CD2-CG2 4.25Å; L251-A313 HydrophobicContact CD1-CB 3.93Å; L251-A313 HydrophobicContact CD2-CB 4.19Å
252	L	96.8	Very high	97.3	Very high	24 Å²	24	24.8 Å²	24.8	13%	0.126	15%	0.149	C	C	.	.	H	α-helix	trans	-84.5	-33.4	-178.4	-69.7	169.5	0	0	0	112.8	A248 E249 Q254 I256 V304 F305 R306	A248-L252 WeakPolarHBondContact O-CB 3.46Å; A248-L252 VanDerWaalsContact O-CG 3.29Å; A248-L252 WeakPolarHBondContact O-CG 3.26Å; A248-L252 PolarHBondContact O-N 2.67Å; E249-L252 PolarHBondContact O-N 3.22Å; L252-Q254 HydrophobicContact CB-CG 4.3Å; L252-I256 HydrophobicContact CD1-CB 3.78Å; L252-I256 HydrophobicContact CD1-CD1 4.35Å; L252-I256 HydrophobicContact CD1-CG1 3.97Å; L252-V304 WeakPolarHBondContact CD2-O 3.37Å; L252-F305 HydrophobicContact CD1-CD1 4.5Å; L252-F305 HydrophobicContact CD1-CE1 4.2Å; L252-F305 HydrophobicContact CD2-CD1 3.68Å; L252-F305 HydrophobicContact CD2-CE1 4.21Å; L252-F305 HydrophobicContact CG-CD1 3.81Å; L252-F305 HydrophobicContact CG-CE1 3.89Å; L252-R306 PolarHBondContact O-NH2 3.22Å
253	G	96.3	Very high	96.9	Very high	20 Å²	20	29.3 Å²	29.3	21%	0.206	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.7	7.6	-168.4	0	0	0	0	0	114	S147 E249	S147-G253 WeakPolarHBondContact CB-O 3.41Å; S147-G253 PolarHBondContact OG-O 2.73Å; E249-G253 WeakPolarHBondContact O-CA 3.34Å; E249-G253 PolarHBondContact O-N 2.87Å
254	Q	96.7	Very high	96.6	Very high	129 Å²	129	32.5 Å²	32.5	60%	0.603	19%	0.193	S	C	*	.	S	Bend	trans	-156.8	157.4	178.2	65.8	-177.1	1.7	0	0	110.6	E249 L252 I256	E249-Q254 WeakPolarHBondContact CA-O 3.29Å; E249-Q254 PolarHBondContact O-N 3.34Å; L252-Q254 HydrophobicContact CB-CG 4.3Å; Q254-I256 PolarHBondContact O-N 3.13Å
255	P	98.4	Very high	96.5	Very high	37 Å²	37	32.5 Å²	32.5	24%	0.24	19%	0.193	C	C	.	.			trans	-55.9	134.9	178	-25.3	34.5	0	0	0	112.4	Y221	Y221-P255 HydrophobicContact CD2-CB 3.9Å; Y221-P255 HydrophobicContact CD2-CG 3.86Å; Y221-P255 HydrophobicContact CE2-CB 4.49Å; Y221-P255 HydrophobicContact CE2-CG 4.19Å; Y221-P255 HydrophobicContact CG-CB 4.43Å
256	I	98.6	Very high	96.4	Very high	16 Å²	16	32.9 Å²	32.9	8%	0.082	20%	0.195	C	C	.	.	S	Bend	trans	-72.1	-31.3	179.7	-174.7	168.4	0	0	0	112.8	A248 L252 Q254 P258 W301 V304 L321	A248-I256 HydrophobicContact CB-CB 3.82Å; A248-I256 HydrophobicContact CB-CD1 3.73Å; A248-I256 HydrophobicContact CB-CG1 4.35Å; A248-I256 HydrophobicContact CB-CG2 3.7Å; L252-I256 HydrophobicContact CD1-CB 3.78Å; L252-I256 HydrophobicContact CD1-CD1 4.35Å; L252-I256 HydrophobicContact CD1-CG1 3.97Å; Q254-I256 PolarHBondContact O-N 3.13Å; I256-P258 WeakPolarHBondContact O-CD 3.37Å; I256-W301 HydrophobicContact CD1-CH2 4.49Å; I256-W301 HydrophobicContact CD1-CZ3 3.97Å; I256-V304 HydrophobicContact CD1-CG1 4Å; I256-L321 HydrophobicContact CD1-CD1 4.32Å
257	F	98.6	Very high	96.2	Very high	1 Å²	1	35.9 Å²	35.9	0%	0.004	21%	0.214	C	C	.	.			trans	-126.6	77.6	-178.3	-52.2	-50.3	0	0	0	111.6	W241 G259 Q265 E268 I269 V272 L321	W241-F257 HydrophobicContact CH2-CE2 4.25Å; W241-F257 HydrophobicContact CZ2-CD2 4.14Å; W241-F257 AromaticContact CZ2-CE2 3.67Å; W241-F257 HydrophobicContact CZ2-CE2 3.67Å; W241-F257 HydrophobicContact CZ2-CZ 4.45Å; F257-G259 PolarHBondContact O-N 3.04Å; F257-Q265 PolarHBondContact O-NE2 3.16Å; F257-Q265 PolarHBondContact O-OE1 2.96Å; F257-Q265 VanDerWaalsContact O-OE1 3.06Å; F257-E268 HydrophobicContact CB-CB 4.12Å; F257-E268 HydrophobicContact CD1-CB 4.34Å; F257-I269 HydrophobicContact CB-CG1 4.27Å; F257-I269 HydrophobicContact CD1-CB 4.48Å; F257-I269 HydrophobicContact CD1-CG1 3.97Å; F257-I269 HydrophobicContact CD2-CG1 3.87Å; F257-I269 HydrophobicContact CE1-CB 4.48Å; F257-I269 HydrophobicContact CE1-CG1 4.26Å; F257-I269 HydrophobicContact CE2-CG1 4.18Å; F257-I269 HydrophobicContact CG-CG1 3.78Å; F257-I269 HydrophobicContact CZ-CG1 4.37Å; F257-V272 HydrophobicContact CD1-CG2 4.46Å; F257-V272 HydrophobicContact CE1-CB 3.9Å; F257-V272 HydrophobicContact CE1-CG1 4.47Å; F257-V272 HydrophobicContact CE1-CG2 3.76Å; F257-L321 HydrophobicContact CE2-CD1 3.98Å; F257-L321 HydrophobicContact CE2-CD2 4.21Å; F257-L321 HydrophobicContact CZ-CD1 4.11Å
258	P	97.6	Very high	96.2	Very high	58 Å²	58	38 Å²	38	38%	0.377	22%	0.224	S	C	.	.			trans	-88.9	83.2	-178.7	34.9	-33.8	0	0	0	112.3	Y221 I256	Y221-P258 HydrophobicContact CE1-CB 4.32Å; I256-P258 WeakPolarHBondContact O-CD 3.37Å
259	G	95.9	Very high	96.2	Very high	1 Å²	1	38 Å²	38	1%	0.01	22%	0.224	C	C	.	.			trans	-94.6	142.3	175.8	0	0	0	0	0	114.4	R220 Y221 F257	R220-G259 WeakPolarHBondContact CD-O 3.47Å; Y221-G259 WeakPolarHBondContact CE1-O 3.44Å; F257-G259 PolarHBondContact O-N 3.04Å
260	D	93.4	Very high	96.1	Very high	125 Å²	125	37.6 Å²	37.6	67%	0.668	22%	0.222	S	C	*	.	S	Bend	trans	-82.3	-32.1	176.4	-72.7	-40.7	0	0	0	113.2	R220	R220-D260 PolarHBondContact NE-O 2.89Å; R220-D260 PolarHBondContact NH1-O 2.99Å; R220-D260 PolarHBondContact NH2-O 3.08Å
261	S	93	Very high	96.1	Very high	45 Å²	45	42.5 Å²	42.5	32%	0.315	24%	0.242	S	C	.	.	S	Bend	trans	-120.4	178.5	173.9	73.9	0	0	0	0	112.4	V263 D264 Q265	S261-V263 VanDerWaalsContact C-N 3.28Å; S261-V263 PolarHBondContact OG-N 2.87Å; S261-D264 VanDerWaalsContact CB-OD2 3.25Å; S261-D264 WeakPolarHBondContact CB-OD2 3.28Å; S261-D264 PolarHBondContact N-OD2 2.99Å; S261-D264 PolarHBondContact OG-N 3.24Å; S261-D264 VanDerWaalsContact OG-N 3.1Å; S261-D264 PolarHBondContact OG-OD2 3.27Å; S261-Q265 WeakPolarHBondContact O-CB 3.48Å; S261-Q265 PolarHBondContact O-N 3.13Å
262	G	89.6	Confident	96.1	Very high	32 Å²	32	42.9 Å²	42.9	33%	0.33	25%	0.245	S	C	.	.	H	α-helix	trans	-63.9	-35.3	172.1	0	0	0	0	0	112.4	I228 L266	I228-G262 VanDerWaalsContact CG2-O 3.26Å; I228-G262 WeakPolarHBondContact CG2-O 3.49Å; G262-L266 PolarHBondContact O-N 3.48Å
263	V	90.6	Very high	96.2	Very high	96 Å²	96	43.2 Å²	43.2	58%	0.582	25%	0.247	S	C	*	.	H	α-helix	trans	-70.6	-46.9	177.2	178.1	0	0	0	0	110.4	S261 Q265 L266 V267	S261-V263 VanDerWaalsContact C-N 3.28Å; S261-V263 PolarHBondContact OG-N 2.87Å; V263-Q265 VanDerWaalsContact C-N 3.25Å; V263-Q265 PolarHBondContact O-N 2.9Å; V263-L266 WeakPolarHBondContact O-CB 3.22Å; V263-L266 PolarHBondContact O-N 3.5Å; V263-V267 WeakPolarHBondContact O-CG2 3.44Å; V263-V267 PolarHBondContact O-N 3.26Å
264	D	94.2	Very high	96.3	Very high	66 Å²	66	42.3 Å²	42.3	35%	0.353	24%	0.238	S	C	.	.	H	α-helix	trans	-62.1	-37.4	178.2	-54.7	-42.7	0	0	0	111.3	S261 L266 V267 E268	S261-D264 VanDerWaalsContact CB-OD2 3.25Å; S261-D264 WeakPolarHBondContact CB-OD2 3.28Å; S261-D264 PolarHBondContact N-OD2 2.99Å; S261-D264 PolarHBondContact OG-N 3.24Å; S261-D264 VanDerWaalsContact OG-N 3.1Å; S261-D264 PolarHBondContact OG-OD2 3.27Å; D264-L266 VanDerWaalsContact C-N 3.29Å; D264-L266 PolarHBondContact O-N 3.28Å; D264-V267 WeakPolarHBondContact O-CB 3.4Å; D264-V267 PolarHBondContact O-N 2.87Å; D264-V267 VanDerWaalsContact O-N 3.16Å; D264-E268 PolarHBondContact O-N 3.33Å
265	Q	97.1	Very high	96.3	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-58.4	-43.1	174.4	-172.8	66.5	37.3	0	0	111.5	R220 I228 F257 S261 V263 E268 I269	R220-Q265 HydrophobicContact CG-CB 4.41Å; R220-Q265 HydrophobicContact CG-CG 4.41Å; R220-Q265 VanDerWaalsContact O-CD 3.27Å; R220-Q265 PolarHBondContact O-OE1 3.39Å; I228-Q265 HydrophobicContact CD1-CB 4.04Å; I228-Q265 HydrophobicContact CD1-CG 3.54Å; F257-Q265 PolarHBondContact O-NE2 3.16Å; F257-Q265 PolarHBondContact O-OE1 2.96Å; F257-Q265 VanDerWaalsContact O-OE1 3.06Å; S261-Q265 WeakPolarHBondContact O-CB 3.48Å; S261-Q265 PolarHBondContact O-N 3.13Å; V263-Q265 VanDerWaalsContact C-N 3.25Å; V263-Q265 PolarHBondContact O-N 2.9Å; Q265-E268 PolarHBondContact O-N 3.5Å; Q265-I269 HydrophobicContact CG-CD1 4.48Å; Q265-I269 VanDerWaalsContact O-CG1 3.3Å; Q265-I269 WeakPolarHBondContact O-CG1 3.39Å; Q265-I269 PolarHBondContact O-N 3.05Å
266	L	95.3	Very high	96.2	Very high	10 Å²	10	35.5 Å²	35.5	5%	0.052	21%	0.205	C	C	.	.	H	α-helix	trans	-67.8	-37.7	176.4	-174.9	58.9	0	0	0	111.9	I228 F229 G262 V263 D264 I269 I270 F293	I228-L266 HydrophobicContact CG2-CB 4.22Å; F229-L266 HydrophobicContact CE1-CD2 4.06Å; F229-L266 HydrophobicContact CE2-CD1 3.96Å; F229-L266 HydrophobicContact CE2-CD2 4.35Å; F229-L266 HydrophobicContact CZ-CD1 4.03Å; F229-L266 HydrophobicContact CZ-CD2 3.74Å; G262-L266 PolarHBondContact O-N 3.48Å; V263-L266 WeakPolarHBondContact O-CB 3.22Å; V263-L266 PolarHBondContact O-N 3.5Å; D264-L266 VanDerWaalsContact C-N 3.29Å; D264-L266 PolarHBondContact O-N 3.28Å; L266-I269 PolarHBondContact O-N 3.49Å; L266-I270 HydrophobicContact CD1-CD1 4.36Å; L266-I270 HydrophobicContact CD1-CG1 4.46Å; L266-I270 HydrophobicContact CG-CD1 3.96Å; L266-I270 HydrophobicContact CG-CG1 4.49Å; L266-I270 WeakPolarHBondContact O-CG1 3.38Å; L266-I270 PolarHBondContact O-N 3.02Å; L266-F293 HydrophobicContact CD2-CE1 3.59Å; L266-F293 HydrophobicContact CD2-CZ 3.54Å; L266-F293 HydrophobicContact CG-CE1 4.42Å
267	V	95.6	Very high	96	Very high	63 Å²	63	38 Å²	38	38%	0.382	22%	0.221	S	C	.	.	H	α-helix	trans	-59.9	-45.7	174.8	169.8	0	0	0	0	111.2	V263 D264 I269 I270 K271	V263-V267 WeakPolarHBondContact O-CG2 3.44Å; V263-V267 PolarHBondContact O-N 3.26Å; D264-V267 WeakPolarHBondContact O-CB 3.4Å; D264-V267 PolarHBondContact O-N 2.87Å; D264-V267 VanDerWaalsContact O-N 3.16Å; V267-I269 VanDerWaalsContact C-N 3.3Å; V267-I269 PolarHBondContact O-N 3.41Å; V267-I270 PolarHBondContact O-N 3.19Å; V267-K271 WeakPolarHBondContact O-CG 3.45Å; V267-K271 PolarHBondContact O-N 2.88Å
268	E	98.1	Very high	95.7	Very high	45 Å²	45	48 Å²	48	21%	0.21	26%	0.258	C	S	.	.	H	α-helix	trans	-61.6	-37.9	176.2	-67.9	-53.5	126.4	0	0	112.5	F257 D264 Q265 K271	F257-E268 HydrophobicContact CB-CB 4.12Å; F257-E268 HydrophobicContact CD1-CB 4.34Å; D264-E268 PolarHBondContact O-N 3.33Å; Q265-E268 PolarHBondContact O-N 3.5Å; E268-K271 PolarHBondContact O-N 3.38Å; E268-K271 IonicContact OE1-NZ 2.73Å; E268-K271 PolarHBondContact OE1-NZ 2.69Å; E268-K271 IonicContact OE2-NZ 2.66Å
269	I	98.6	Very high	95.6	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-64.7	-47.4	175.2	-64.7	165.8	0	0	0	110.6	P225 I228 W241 F257 Q265 L266 V267 K271 V272 L273 Y323	P225-I269 HydrophobicContact CB-CD1 4.43Å; I228-I269 HydrophobicContact CD1-CD1 3.85Å; W241-I269 HydrophobicContact CH2-CD1 4.36Å; W241-I269 HydrophobicContact CH2-CG1 4.45Å; W241-I269 HydrophobicContact CH2-CG2 3.77Å; W241-I269 HydrophobicContact CZ2-CD1 3.72Å; W241-I269 HydrophobicContact CZ2-CG1 3.96Å; W241-I269 HydrophobicContact CZ2-CG2 4.14Å; F257-I269 HydrophobicContact CB-CG1 4.27Å; F257-I269 HydrophobicContact CD1-CB 4.48Å; F257-I269 HydrophobicContact CD1-CG1 3.97Å; F257-I269 HydrophobicContact CD2-CG1 3.87Å; F257-I269 HydrophobicContact CE1-CB 4.48Å; F257-I269 HydrophobicContact CE1-CG1 4.26Å; F257-I269 HydrophobicContact CE2-CG1 4.18Å; F257-I269 HydrophobicContact CG-CG1 3.78Å; F257-I269 HydrophobicContact CZ-CG1 4.37Å; Q265-I269 HydrophobicContact CG-CD1 4.48Å; Q265-I269 VanDerWaalsContact O-CG1 3.3Å; Q265-I269 WeakPolarHBondContact O-CG1 3.39Å; Q265-I269 PolarHBondContact O-N 3.05Å; L266-I269 PolarHBondContact O-N 3.49Å; V267-I269 VanDerWaalsContact C-N 3.3Å; V267-I269 PolarHBondContact O-N 3.41Å; I269-K271 VanDerWaalsContact C-N 3.29Å; I269-K271 PolarHBondContact O-N 2.94Å; I269-V272 PolarHBondContact O-N 3.24Å; I269-V272 VanDerWaalsContact O-N 3.07Å; I269-L273 HydrophobicContact CG2-CD1 3.76Å; I269-L273 HydrophobicContact CG2-CG 4.16Å; I269-L273 PolarHBondContact O-N 2.64Å; I269-Y323 HydrophobicContact CG2-CE1 3.75Å
270	I	97.9	Very high	95.6	Very high	7 Å²	7	52.9 Å²	52.9	4%	0.036	28%	0.276	C	S	.	.	H	α-helix	trans	-62.3	-35	-179.7	-71.1	169.2	0	0	0	111.6	L266 V267 V272 G274 F293 I296 Y323	L266-I270 HydrophobicContact CD1-CD1 4.36Å; L266-I270 HydrophobicContact CD1-CG1 4.46Å; L266-I270 HydrophobicContact CG-CD1 3.96Å; L266-I270 HydrophobicContact CG-CG1 4.49Å; L266-I270 WeakPolarHBondContact O-CG1 3.38Å; L266-I270 PolarHBondContact O-N 3.02Å; V267-I270 PolarHBondContact O-N 3.19Å; I270-V272 PolarHBondContact O-N 3.11Å; I270-G274 CarbonylContact O-C 3.54Å; I270-G274 WeakPolarHBondContact O-CA 3.38Å; I270-G274 PolarHBondContact O-N 3.15Å; I270-F293 HydrophobicContact CD1-CD1 3.77Å; I270-F293 HydrophobicContact CD1-CE1 4.17Å; I270-F293 HydrophobicContact CD1-CG 4.21Å; I270-I296 HydrophobicContact CG2-CB 3.92Å; I270-I296 HydrophobicContact CG2-CD1 3.72Å; I270-I296 HydrophobicContact CG2-CG1 4.29Å; I270-I296 HydrophobicContact CG2-CG2 4.3Å; I270-Y323 WeakPolarHBondContact CG1-OH 3.48Å
271	K	97.6	Very high	95.7	Very high	109 Å²	109	48.4 Å²	48.4	47%	0.474	25%	0.252	S	S	.	.	H	α-helix	trans	-58.5	-28.6	175.4	-75.4	172.5	-177.7	170.9	0	112.9	V267 E268 I269	V267-K271 WeakPolarHBondContact O-CG 3.45Å; V267-K271 PolarHBondContact O-N 2.88Å; E268-K271 PolarHBondContact O-N 3.38Å; E268-K271 IonicContact OE1-NZ 2.73Å; E268-K271 PolarHBondContact OE1-NZ 2.69Å; E268-K271 IonicContact OE2-NZ 2.66Å; I269-K271 VanDerWaalsContact C-N 3.29Å; I269-K271 PolarHBondContact O-N 2.94Å
272	V	98.5	Very high	95.8	Very high	17 Å²	17	53.6 Å²	53.6	10%	0.103	26%	0.264	C	S	.	.	H	α-helix	trans	-96.4	-54.8	179.5	179.9	0	0	0	0	111.2	F257 I269 I270 G274 H299 W301 V304	F257-V272 HydrophobicContact CD1-CG2 4.46Å; F257-V272 HydrophobicContact CE1-CB 3.9Å; F257-V272 HydrophobicContact CE1-CG1 4.47Å; F257-V272 HydrophobicContact CE1-CG2 3.76Å; I269-V272 PolarHBondContact O-N 3.24Å; I269-V272 VanDerWaalsContact O-N 3.07Å; I270-V272 PolarHBondContact O-N 3.11Å; V272-G274 VanDerWaalsContact C-N 3.34Å; V272-G274 PolarHBondContact O-N 3.08Å; V272-H299 PolarHBondContact O-N 3.47Å; V272-W301 HydrophobicContact CG1-CE3 4.32Å; V272-W301 HydrophobicContact CG1-CH2 3.95Å; V272-W301 HydrophobicContact CG1-CZ2 4.4Å; V272-W301 HydrophobicContact CG1-CZ3 3.92Å; V272-V304 HydrophobicContact CG1-CG2 3.87Å
273	L	98.6	Very high	96.2	Very high	30 Å²	30	55.8 Å²	55.8	16%	0.157	27%	0.266	C	S	.	.	H	α-helix	trans	-83.3	-10.1	-173.6	-58.1	-172.1	0	0	0	113.9	W241 I269 A298 W301 L321 Y323	W241-L273 HydrophobicContact CH2-CD1 3.72Å; W241-L273 HydrophobicContact CZ3-CD1 4Å; I269-L273 HydrophobicContact CG2-CD1 3.76Å; I269-L273 HydrophobicContact CG2-CG 4.16Å; I269-L273 PolarHBondContact O-N 2.64Å; L273-A298 WeakPolarHBondContact O-CB 3.35Å; L273-W301 HydrophobicContact CD2-CH2 3.98Å; L273-W301 HydrophobicContact CD2-CZ2 3.37Å; L273-L321 WeakPolarHBondContact CD1-O 3.12Å; L273-L321 WeakPolarHBondContact CD2-O 3.45Å; L273-Y323 HydrophobicContact CB-CD2 4.27Å; L273-Y323 HydrophobicContact CB-CE2 3.5Å; L273-Y323 VanDerWaalsContact CB-CE2 3.5Å; L273-Y323 HydrophobicContact CD1-CD1 4.43Å; L273-Y323 HydrophobicContact CD1-CD2 4.19Å; L273-Y323 HydrophobicContact CD1-CE1 4.23Å; L273-Y323 HydrophobicContact CD1-CE2 3.97Å; L273-Y323 HydrophobicContact CD1-CG 4.41Å; L273-Y323 HydrophobicContact CG-CE2 4.4Å
274	G	98.3	Very high	96.5	Very high	2 Å²	2	51.4 Å²	51.4	2%	0.021	24%	0.239	C	C	.	.			trans	76.8	179.1	-168.2	0	0	0	0	0	111.9	I270 V272 I296 Y323	I270-G274 CarbonylContact O-C 3.54Å; I270-G274 WeakPolarHBondContact O-CA 3.38Å; I270-G274 PolarHBondContact O-N 3.15Å; V272-G274 VanDerWaalsContact C-N 3.34Å; V272-G274 PolarHBondContact O-N 3.08Å; G274-I296 CarbonylContact C-O 3.53Å; G274-I296 WeakPolarHBondContact CA-O 3.43Å; G274-Y323 PolarHBondContact O-OH 3.09Å
275	T	97	Very high	96.5	Very high	17 Å²	17	49 Å²	49	10%	0.104	23%	0.226	C	C	.	.	S	Bend	trans	-69.8	128.4	178.5	-57.2	0	0	0	0	110	T277 F293 P294 I296	T275-T277 PolarHBondContact O-N 3.3Å; T275-F293 HydrophobicContact CG2-CB 3.59Å; T275-F293 HydrophobicContact CG2-CG 4.43Å; T275-P294 PolarHBondContact OG1-O 2.7Å; T275-I296 PolarHBondContact N-O 2.98Å; T275-I296 PolarHBondContact OG1-N 3.44Å
276	P	96.3	Very high	96.3	Very high	6 Å²	6	52.6 Å²	52.6	4%	0.039	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-63.1	139	178.8	26.5	-34.1	0	0	0	110.5	F229 Q280 I281 M284 Y323	F229-P276 HydrophobicContact CZ-CG 4.5Å; P276-Q280 HydrophobicContact CB-CB 4.2Å; P276-I281 HydrophobicContact CB-CG1 3.98Å; P276-I281 HydrophobicContact CG-CD1 4.18Å; P276-I281 HydrophobicContact CG-CG1 3.9Å; P276-M284 HydrophobicContact CB-CE 4Å; P276-M284 HydrophobicContact CG-CE 4.4Å; P276-Y323 HydrophobicContact CB-CD1 4.19Å; P276-Y323 HydrophobicContact CB-CD2 3.84Å; P276-Y323 HydrophobicContact CB-CE1 4.14Å; P276-Y323 HydrophobicContact CB-CE2 3.78Å; P276-Y323 HydrophobicContact CB-CG 4.05Å; P276-Y323 HydrophobicContact CG-CE1 4.34Å; P276-Y323 HydrophobicContact CG-CE2 4.43Å
277	T	94.8	Very high	96	Very high	68 Å²	68	58.2 Å²	58.2	42%	0.417	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-65.4	163.4	172.5	59.3	0	0	0	0	111.1	T275 E279 Q280 I281	T275-T277 PolarHBondContact O-N 3.3Å; T277-E279 PolarHBondContact O-N 2.63Å; T277-Q280 PolarHBondContact O-N 3.45Å; T277-Q280 WeakPolarHBondContact OG1-CB 3.43Å; T277-Q280 VanDerWaalsContact OG1-CD 3.3Å; T277-Q280 VanDerWaalsContact OG1-CG 3.24Å; T277-Q280 WeakPolarHBondContact OG1-CG 3.33Å; T277-Q280 PolarHBondContact OG1-N 2.87Å; T277-Q280 PolarHBondContact OG1-OE1 3.34Å; T277-I281 WeakPolarHBondContact O-CG1 3.36Å; T277-I281 PolarHBondContact O-N 2.78Å
278	R	92.1	Very high	95.3	Very high	210 Å²	210	58.2 Å²	58.2	79%	0.792	27%	0.273	S	S	*	.	H	α-helix	trans	-59.4	-39.2	177.3	-175.8	179.6	179.6	-179	-1.1	111.4	I281 R282	R278-I281 PolarHBondContact O-N 2.79Å; R278-R282 WeakPolarHBondContact O-CB 3.2Å; R278-R282 PolarHBondContact O-N 2.87Å
279	E	94.9	Very high	94	Very high	121 Å²	121	62.4 Å²	62.4	57%	0.565	30%	0.302	S	S	*	.	H	α-helix	trans	-64.4	-47.2	177.7	-65.9	65.6	-143.4	0	0	110.2	T277 I281 R282 E283	T277-E279 PolarHBondContact O-N 2.63Å; E279-I281 PolarHBondContact O-N 2.97Å; E279-R282 WeakPolarHBondContact O-CB 3.42Å; E279-R282 PolarHBondContact O-N 3.32Å; E279-R282 VanDerWaalsContact O-N 3.16Å; E279-E283 WeakPolarHBondContact O-CG 3.2Å; E279-E283 PolarHBondContact O-N 3.44Å
280	Q	97	Very high	92.6	Very high	42 Å²	42	68.7 Å²	68.7	20%	0.196	33%	0.332	C	S	.	.	H	α-helix	trans	-60.8	-42.1	175.6	-77.2	166.4	-36	0	0	112.6	P276 T277 R282 E283 M284	P276-Q280 HydrophobicContact CB-CB 4.2Å; T277-Q280 PolarHBondContact O-N 3.45Å; T277-Q280 WeakPolarHBondContact OG1-CB 3.43Å; T277-Q280 VanDerWaalsContact OG1-CD 3.3Å; T277-Q280 VanDerWaalsContact OG1-CG 3.24Å; T277-Q280 WeakPolarHBondContact OG1-CG 3.33Å; T277-Q280 PolarHBondContact OG1-N 2.87Å; T277-Q280 PolarHBondContact OG1-OE1 3.34Å; Q280-R282 VanDerWaalsContact C-N 3.31Å; Q280-R282 PolarHBondContact O-N 3.44Å; Q280-E283 PolarHBondContact O-N 3.4Å; Q280-M284 WeakPolarHBondContact O-CE 3.31Å; Q280-M284 WeakPolarHBondContact O-CG 3.34Å; Q280-M284 PolarHBondContact O-N 3.5Å
281	I	95.4	Very high	91	Very high	31 Å²	31	74.8 Å²	74.8	16%	0.159	36%	0.358	C	S	.	.	H	α-helix	trans	-60.2	-44.4	174.7	-66.7	170.5	0	0	0	110.3	P276 T277 R278 E279 E283 M284 N285 Y288 F293	P276-I281 HydrophobicContact CB-CG1 3.98Å; P276-I281 HydrophobicContact CG-CD1 4.18Å; P276-I281 HydrophobicContact CG-CG1 3.9Å; T277-I281 WeakPolarHBondContact O-CG1 3.36Å; T277-I281 PolarHBondContact O-N 2.78Å; R278-I281 PolarHBondContact O-N 2.79Å; E279-I281 PolarHBondContact O-N 2.97Å; I281-E283 VanDerWaalsContact C-N 3.35Å; I281-E283 PolarHBondContact O-N 3.02Å; I281-M284 HydrophobicContact CG1-CE 4.28Å; I281-M284 PolarHBondContact O-N 3.07Å; I281-M284 VanDerWaalsContact O-N 3.14Å; I281-N285 CarbonylContact O-C 3.6Å; I281-N285 PolarHBondContact O-N 3.02Å; I281-Y288 HydrophobicContact CG2-CD1 4.07Å; I281-F293 HydrophobicContact CD1-CE2 4.49Å
282	R	94.3	Very high	89.8	Confident	153 Å²	153	79.5 Å²	79.5	58%	0.577	38%	0.379	S	S	*	.	H	α-helix	trans	-61.8	-40.7	178	-170.4	-166.6	71.7	133.6	4.8	112.5	R278 E279 Q280 M284 P286	R278-R282 WeakPolarHBondContact O-CB 3.2Å; R278-R282 PolarHBondContact O-N 2.87Å; E279-R282 WeakPolarHBondContact O-CB 3.42Å; E279-R282 PolarHBondContact O-N 3.32Å; E279-R282 VanDerWaalsContact O-N 3.16Å; Q280-R282 VanDerWaalsContact C-N 3.31Å; Q280-R282 PolarHBondContact O-N 3.44Å; R282-M284 VanDerWaalsContact C-N 3.29Å; R282-M284 PolarHBondContact O-N 3.18Å; R282-P286 HydrophobicContact CG-CB 4.3Å; R282-P286 WeakPolarHBondContact O-CD 3.31Å
283	E	97.3	Very high	88.9	Confident	78 Å²	78	80.5 Å²	80.5	36%	0.364	38%	0.382	S	S	.	.	H	α-helix	trans	-68.4	-27.2	175.8	-65.2	-59.9	136.1	0	0	112.8	E279 Q280 I281 T324	E279-E283 WeakPolarHBondContact O-CG 3.2Å; E279-E283 PolarHBondContact O-N 3.44Å; Q280-E283 PolarHBondContact O-N 3.4Å; I281-E283 VanDerWaalsContact C-N 3.35Å; I281-E283 PolarHBondContact O-N 3.02Å; E283-T324 HydrophobicContact CB-CG2 4.02Å; E283-T324 HydrophobicContact CG-CG2 3.93Å
284	M	96.8	Very high	88.3	Confident	4 Å²	4	83.7 Å²	83.7	2%	0.02	40%	0.404	C	S	.	.	H	α-helix	trans	-81.9	-47.6	176.5	-74.8	-173.8	-67.9	0	0	112.6	P225 E226 F229 A231 P276 Q280 I281 R282 Y323	P225-M284 HydrophobicContact CB-SD 3.56Å; P225-M284 VanDerWaalsContact CB-SD 3.56Å; P225-M284 HydrophobicContact CG-SD 3.57Å; P225-M284 VanDerWaalsContact CG-SD 3.57Å; E226-M284 HydrophobicContact CB-CB 3.86Å; E226-M284 HydrophobicContact CB-CG 4.13Å; E226-M284 WeakPolarHBondContact CB-O 3.41Å; F229-M284 HydrophobicContact CD2-CB 4.27Å; F229-M284 HydrophobicContact CD2-CE 3.79Å; F229-M284 HydrophobicContact CD2-SD 3.82Å; F229-M284 HydrophobicContact CE2-CE 3.34Å; F229-M284 HydrophobicContact CE2-SD 3.81Å; F229-M284 HydrophobicContact CZ-CE 4.15Å; A231-M284 VanDerWaalsContact CB-O 3.31Å; A231-M284 WeakPolarHBondContact CB-O 3.12Å; P276-M284 HydrophobicContact CB-CE 4Å; P276-M284 HydrophobicContact CG-CE 4.4Å; Q280-M284 WeakPolarHBondContact O-CE 3.31Å; Q280-M284 WeakPolarHBondContact O-CG 3.34Å; Q280-M284 PolarHBondContact O-N 3.5Å; I281-M284 HydrophobicContact CG1-CE 4.28Å; I281-M284 PolarHBondContact O-N 3.07Å; I281-M284 VanDerWaalsContact O-N 3.14Å; R282-M284 VanDerWaalsContact C-N 3.29Å; R282-M284 PolarHBondContact O-N 3.18Å; M284-Y323 HydrophobicContact CE-CD1 3.74Å; M284-Y323 HydrophobicContact CE-CE1 4.43Å; M284-Y323 HydrophobicContact CE-CG 4.22Å; M284-Y323 VanDerWaalsContact CG-O 3.25Å; M284-Y323 WeakPolarHBondContact CG-O 3.31Å; M284-Y323 HydrophobicContact SD-CD1 3.63Å; M284-Y323 HydrophobicContact SD-CG 4.32Å
285	N	95.7	Very high	88	Confident	15 Å²	15	91.5 Å²	91.5	8%	0.08	44%	0.44	C	S	.	.			trans	-156.1	106.7	173.8	-177.2	-0.4	0	0	0	109.9	F229 A231 I281 N287 Y288	F229-N285 HydrophobicContact CB-CB 4.02Å; F229-N285 PolarHBondContact O-ND2 3.21Å; A231-N285 HydrophobicContact CB-CB 4.19Å; I281-N285 CarbonylContact O-C 3.6Å; I281-N285 PolarHBondContact O-N 3.02Å; N285-N287 PolarHBondContact O-N 3.34Å; N285-N287 WeakPolarHBondContact OD1-CB 3.38Å; N285-N287 PolarHBondContact OD1-N 3.09Å; N285-Y288 WeakPolarHBondContact O-CB 3.39Å; N285-Y288 PolarHBondContact O-N 2.94Å; N285-Y288 VanDerWaalsContact O-N 3.17Å
286	P	91.7	Very high	88	Confident	77 Å²	77	94.2 Å²	94.2	50%	0.5	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-19.1	-178.7	27.8	-35.2	0	0	0	113.4	R282 Y288	R282-P286 HydrophobicContact CG-CB 4.3Å; R282-P286 WeakPolarHBondContact O-CD 3.31Å; P286-Y288 VanDerWaalsContact C-N 3.32Å
287	N	89.2	Confident	88	Confident	127 Å²	127	103.2 Å²	103.2	68%	0.679	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-0.4	179.4	-59.6	-51	0	0	0	113	N285 T289	N285-N287 PolarHBondContact O-N 3.34Å; N285-N287 WeakPolarHBondContact OD1-CB 3.38Å; N285-N287 PolarHBondContact OD1-N 3.09Å; N287-T289 PolarHBondContact O-N 2.88Å
288	Y	82.4	Confident	88.1	Confident	63 Å²	63	103 Å²	103	25%	0.247	50%	0.497	C	S	.	.			trans	-76.9	106.5	-179.9	-165.2	-104.6	0	0	0	110.3	F229 I281 N285 P286 E290 F291 F293	F229-Y288 HydrophobicContact CB-CD2 4.39Å; F229-Y288 AromaticContact CD1-CD1 3.55Å; F229-Y288 HydrophobicContact CD1-CD1 3.55Å; F229-Y288 AromaticContact CD1-CD2 3.75Å; F229-Y288 HydrophobicContact CD1-CD2 3.75Å; F229-Y288 AromaticContact CD1-CE1 3.44Å; F229-Y288 HydrophobicContact CD1-CE1 3.44Å; F229-Y288 VanDerWaalsContact CD1-CE1 3.44Å; F229-Y288 AromaticContact CD1-CE2 3.7Å; F229-Y288 HydrophobicContact CD1-CE2 3.7Å; F229-Y288 AromaticContact CD1-CG 3.68Å; F229-Y288 HydrophobicContact CD1-CG 3.68Å; F229-Y288 AromaticContact CD1-CZ 3.54Å; F229-Y288 AromaticContact CE1-CD1 3.75Å; F229-Y288 HydrophobicContact CE1-CD1 3.75Å; F229-Y288 AromaticContact CE1-CE1 3.36Å; F229-Y288 HydrophobicContact CE1-CE1 3.36Å; F229-Y288 HydrophobicContact CE1-CE2 4.37Å; F229-Y288 HydrophobicContact CE1-CG 4.36Å; F229-Y288 AromaticContact CE1-CZ 3.73Å; I281-Y288 HydrophobicContact CG2-CD1 4.07Å; N285-Y288 WeakPolarHBondContact O-CB 3.39Å; N285-Y288 PolarHBondContact O-N 2.94Å; N285-Y288 VanDerWaalsContact O-N 3.17Å; P286-Y288 VanDerWaalsContact C-N 3.32Å; Y288-E290 WeakPolarHBondContact CD1-O 3.31Å; Y288-E290 WeakPolarHBondContact CE1-O 3.33Å; Y288-F291 HydrophobicContact CE1-CB 4.44Å; Y288-F291 VanDerWaalsContact OH-CD2 3.23Å; Y288-F291 WeakPolarHBondContact OH-CD2 3.48Å; Y288-F293 HydrophobicContact CE1-CE2 4.48Å
289	T	70.7	Confident	88.4	Confident	133 Å²	133	97 Å²	97	82%	0.816	48%	0.478	S	S	*	.			trans	-103.5	-7.2	-175.3	50.9	0	0	0	0	113.6	N287	N287-T289 PolarHBondContact O-N 2.88Å
290	E	67.9	Low	88.5	Confident	132 Å²	132	94.2 Å²	94.2	62%	0.617	47%	0.471	S	S	*	.			trans	-106.9	161.8	-171.1	-67.1	-168.3	159.1	0	0	113.2	Y288	Y288-E290 WeakPolarHBondContact CD1-O 3.31Å; Y288-E290 WeakPolarHBondContact CE1-O 3.33Å
291	F	63.7	Low	88.6	Confident	135 Å²	135	94.6 Å²	94.6	59%	0.592	47%	0.47	S	S	*	.			trans	74.3	113	175.5	-71.6	-90.8	0	0	0	118.7	Y288 F293	Y288-F291 HydrophobicContact CE1-CB 4.44Å; Y288-F291 VanDerWaalsContact OH-CD2 3.23Å; Y288-F291 WeakPolarHBondContact OH-CD2 3.48Å; F291-F293 HydrophobicContact CB-CE1 4.27Å; F291-F293 HydrophobicContact CB-CE2 4.09Å; F291-F293 HydrophobicContact CB-CZ 3.88Å
292	K	72.4	Confident	88.7	Confident	208 Å²	208	98 Å²	98	90%	0.904	49%	0.492	S	S	*	.			trans	-82.3	111	152.9	-72.5	-175.9	179	179.8	0	108.2
293	F	80.6	Confident	88.8	Confident	38 Å²	38	97.9 Å²	97.9	17%	0.167	50%	0.496	C	S	.	.			trans	-77.4	142.8	168.5	-62.3	-75.1	0	0	0	110	F229 L266 I270 T275 I281 Y288 F291	F229-F293 HydrophobicContact CE1-CE2 4.02Å; F229-F293 AromaticContact CE1-CZ 3.92Å; F229-F293 HydrophobicContact CE1-CZ 3.92Å; F229-F293 HydrophobicContact CZ-CE2 4.16Å; F229-F293 HydrophobicContact CZ-CZ 4.13Å; L266-F293 HydrophobicContact CD2-CE1 3.59Å; L266-F293 HydrophobicContact CD2-CZ 3.54Å; L266-F293 HydrophobicContact CG-CE1 4.42Å; I270-F293 HydrophobicContact CD1-CD1 3.77Å; I270-F293 HydrophobicContact CD1-CE1 4.17Å; I270-F293 HydrophobicContact CD1-CG 4.21Å; T275-F293 HydrophobicContact CG2-CB 3.59Å; T275-F293 HydrophobicContact CG2-CG 4.43Å; I281-F293 HydrophobicContact CD1-CE2 4.49Å; Y288-F293 HydrophobicContact CE1-CE2 4.48Å; F291-F293 HydrophobicContact CB-CE1 4.27Å; F291-F293 HydrophobicContact CB-CE2 4.09Å; F291-F293 HydrophobicContact CB-CZ 3.88Å
294	P	85.6	Confident	88.8	Confident	97 Å²	97	95.5 Å²	95.5	63%	0.63	49%	0.487	S	S	*	.			trans	-52.3	142.3	162.1	-22.7	33.4	0	0	0	109.6	T275 I296	T275-P294 PolarHBondContact OG1-O 2.7Å; P294-I296 HydrophobicContact CB-CG1 4.5Å; P294-I296 PolarHBondContact O-N 3.23Å
295	Q	92.1	Very high	88.9	Confident	167 Å²	167	95.8 Å²	95.8	78%	0.78	49%	0.488	S	S	*	.			trans	-79.3	106.9	177.5	-69.1	-62.8	-37.7	0	0	109.6
296	I	96.3	Very high	88.8	Confident	74 Å²	74	100.8 Å²	100.8	38%	0.379	51%	0.506	S	S	.	.			trans	-113.5	128.5	-179.6	-63.7	174.3	0	0	0	107.5	I270 G274 T275 P294	I270-I296 HydrophobicContact CG2-CB 3.92Å; I270-I296 HydrophobicContact CG2-CD1 3.72Å; I270-I296 HydrophobicContact CG2-CG1 4.29Å; I270-I296 HydrophobicContact CG2-CG2 4.3Å; G274-I296 CarbonylContact C-O 3.53Å; G274-I296 WeakPolarHBondContact CA-O 3.43Å; T275-I296 PolarHBondContact N-O 2.98Å; T275-I296 PolarHBondContact OG1-N 3.44Å; P294-I296 HydrophobicContact CB-CG1 4.5Å; P294-I296 PolarHBondContact O-N 3.23Å
297	K	96.9	Very high	88.9	Confident	194 Å²	194	103.7 Å²	103.7	84%	0.843	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-74.3	143.5	175	-68.2	-174.4	178.4	-178.5	0	110.1
298	A	97.6	Very high	89.1	Confident	64 Å²	64	109 Å²	109	53%	0.529	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-55.6	138.9	173.7	0	0	0	0	0	111.4	L273	L273-A298 WeakPolarHBondContact O-CB 3.35Å
299	H	97.6	Very high	89.9	Confident	83 Å²	83	107 Å²	107	38%	0.384	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-80.5	130.6	171.3	-160.9	66.6	0	0	0	109.1	V272 W301 K303	V272-H299 PolarHBondContact O-N 3.47Å; H299-W301 PolarHBondContact O-N 3.22Å; H299-K303 VanDerWaalsContact NE2-CB 3.31Å; H299-K303 WeakPolarHBondContact NE2-CB 3.42Å
300	P	97.9	Very high	91.2	Very high	64 Å²	64	102.2 Å²	102.2	42%	0.416	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-56.8	126.2	178.6	-25.5	34.5	0	0	0	111.3	T302 K303 V304	P300-T302 PolarHBondContact O-N 3.11Å; P300-T302 VanDerWaalsContact O-N 3.11Å; P300-K303 HydrophobicContact CB-CD 4.44Å; P300-K303 HydrophobicContact CB-CG 4.33Å; P300-K303 HydrophobicContact CG-CD 4.33Å; P300-K303 WeakPolarHBondContact O-CA 3.47Å; P300-K303 WeakPolarHBondContact O-CB 3.19Å; P300-K303 PolarHBondContact O-N 2.98Å; P300-V304 PolarHBondContact O-N 3.2Å
301	W	98.1	Very high	92.6	Very high	50 Å²	50	100.4 Å²	100.4	19%	0.189	50%	0.5	C	S	.	.	H	α-helix	trans	-54	-34.5	-178.2	-81	112.7	0	0	0	113.8	I256 V272 L273 H299 K303 V304 F305 I314 S318 L321	I256-W301 HydrophobicContact CD1-CH2 4.49Å; I256-W301 HydrophobicContact CD1-CZ3 3.97Å; V272-W301 HydrophobicContact CG1-CE3 4.32Å; V272-W301 HydrophobicContact CG1-CH2 3.95Å; V272-W301 HydrophobicContact CG1-CZ2 4.4Å; V272-W301 HydrophobicContact CG1-CZ3 3.92Å; L273-W301 HydrophobicContact CD2-CH2 3.98Å; L273-W301 HydrophobicContact CD2-CZ2 3.37Å; H299-W301 PolarHBondContact O-N 3.22Å; W301-K303 PolarHBondContact O-N 3.39Å; W301-V304 HydrophobicContact CE3-CB 4.36Å; W301-V304 HydrophobicContact CE3-CG2 4.13Å; W301-V304 WeakPolarHBondContact O-CB 3.05Å; W301-V304 PolarHBondContact O-N 3.09Å; W301-V304 VanDerWaalsContact O-N 3.16Å; W301-F305 AromaticContact CE3-CE2 3.65Å; W301-F305 HydrophobicContact CE3-CE2 3.65Å; W301-F305 HydrophobicContact CE3-CZ 4.2Å; W301-F305 HydrophobicContact CZ3-CE2 4.03Å; W301-F305 HydrophobicContact CZ3-CZ 4.1Å; W301-F305 WeakPolarHBondContact O-CD2 3.32Å; W301-I314 HydrophobicContact CB-CG2 3.56Å; W301-I314 HydrophobicContact CG-CG2 4.49Å; W301-S318 VanDerWaalsContact NE1-CB 3.32Å; W301-L321 HydrophobicContact CH2-CB 3.87Å; W301-L321 HydrophobicContact CH2-CD1 3.7Å; W301-L321 HydrophobicContact CH2-CG 4.39Å; W301-L321 HydrophobicContact CZ2-CB 4.06Å; W301-L321 HydrophobicContact CZ3-CD1 4.34Å
302	T	97.1	Very high	94.3	Very high	101 Å²	101	98.1 Å²	98.1	62%	0.62	49%	0.491	S	S	*	.	H	α-helix	trans	-64.4	-20	175.7	52.1	0	0	0	0	114.1	P300 I314	P300-T302 PolarHBondContact O-N 3.11Å; P300-T302 VanDerWaalsContact O-N 3.11Å; T302-I314 HydrophobicContact CG2-CD1 4.48Å
303	K	97.6	Very high	95.6	Very high	152 Å²	152	88.2 Å²	88.2	66%	0.661	45%	0.448	S	S	*	.	H	α-helix	trans	-97.2	-15.1	175.7	-64.4	-173.5	178	-176.2	0	113.4	H299 P300 W301	H299-K303 VanDerWaalsContact NE2-CB 3.31Å; H299-K303 WeakPolarHBondContact NE2-CB 3.42Å; P300-K303 HydrophobicContact CB-CD 4.44Å; P300-K303 HydrophobicContact CB-CG 4.33Å; P300-K303 HydrophobicContact CG-CD 4.33Å; P300-K303 WeakPolarHBondContact O-CA 3.47Å; P300-K303 WeakPolarHBondContact O-CB 3.19Å; P300-K303 PolarHBondContact O-N 2.98Å; W301-K303 PolarHBondContact O-N 3.39Å
304	V	97.9	Very high	96.4	Very high	27 Å²	27	87.2 Å²	87.2	16%	0.164	44%	0.444	C	S	.	.	H	α-helix	trans	-67.8	-42.7	173.1	178.2	0	0	0	0	110.1	L252 I256 V272 P300 W301	L252-V304 WeakPolarHBondContact CD2-O 3.37Å; I256-V304 HydrophobicContact CD1-CG1 4Å; V272-V304 HydrophobicContact CG1-CG2 3.87Å; P300-V304 PolarHBondContact O-N 3.2Å; W301-V304 HydrophobicContact CE3-CB 4.36Å; W301-V304 HydrophobicContact CE3-CG2 4.13Å; W301-V304 WeakPolarHBondContact O-CB 3.05Å; W301-V304 PolarHBondContact O-N 3.09Å; W301-V304 VanDerWaalsContact O-N 3.16Å
305	F	97.5	Very high	97.1	Very high	10 Å²	10	84.5 Å²	84.5	4%	0.044	43%	0.43	C	S	.	.	S	Bend	trans	-96.3	169	-177.2	-57.5	-71.7	0	0	0	112.6	A248 L251 L252 W301 T309 I314 C317	A248-F305 HydrophobicContact CB-CE1 4.08Å; A248-F305 HydrophobicContact CB-CZ 4.16Å; L251-F305 HydrophobicContact CB-CD1 3.92Å; L251-F305 HydrophobicContact CB-CE1 4.02Å; L251-F305 HydrophobicContact CD1-CD1 4.36Å; L251-F305 HydrophobicContact CD1-CE1 4.09Å; L251-F305 HydrophobicContact CD1-CZ 4.38Å; L252-F305 HydrophobicContact CD1-CD1 4.5Å; L252-F305 HydrophobicContact CD1-CE1 4.2Å; L252-F305 HydrophobicContact CD2-CD1 3.68Å; L252-F305 HydrophobicContact CD2-CE1 4.21Å; L252-F305 HydrophobicContact CG-CD1 3.81Å; L252-F305 HydrophobicContact CG-CE1 3.89Å; W301-F305 AromaticContact CE3-CE2 3.65Å; W301-F305 HydrophobicContact CE3-CE2 3.65Å; W301-F305 HydrophobicContact CE3-CZ 4.2Å; W301-F305 HydrophobicContact CZ3-CE2 4.03Å; W301-F305 HydrophobicContact CZ3-CZ 4.1Å; W301-F305 WeakPolarHBondContact O-CD2 3.32Å; F305-T309 HydrophobicContact CB-CG2 3.98Å; F305-T309 HydrophobicContact CG-CG2 4.27Å; F305-I314 HydrophobicContact CB-CD1 4.46Å; F305-I314 HydrophobicContact CD2-CB 4.4Å; F305-I314 HydrophobicContact CD2-CD1 4.19Å; F305-I314 HydrophobicContact CD2-CG1 3.77Å; F305-I314 HydrophobicContact CD2-CG2 4.12Å; F305-I314 HydrophobicContact CE2-CG1 4.37Å; F305-I314 HydrophobicContact CE2-CG2 4.25Å; F305-I314 HydrophobicContact CG-CG1 4.47Å; F305-C317 HydrophobicContact CE2-CB 4.4Å; F305-C317 HydrophobicContact CZ-CB 4.25Å
306	R	94.3	Very high	97.4	Very high	121 Å²	121	76.6 Å²	76.6	46%	0.457	39%	0.393	S	S	.	.			trans	-68.4	151.2	178.4	-56	-179.3	-171.2	-159.8	3.7	110.1	L252 R308 T309	L252-R306 PolarHBondContact O-NH2 3.22Å; R306-R308 PolarHBondContact O-N 3.37Å; R306-T309 WeakPolarHBondContact O-CB 3.44Å; R306-T309 PolarHBondContact O-N 2.83Å; R306-T309 PolarHBondContact O-OG1 3.45Å
307	P	93.7	Very high	97.5	Very high	138 Å²	138	73 Å²	73	90%	0.896	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-22.7	-176	-29.2	35.6	0	0	0	116.4
308	R	93.7	Very high	97.6	Very high	239 Å²	239	65.1 Å²	65.1	90%	0.902	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	8.5	179.2	-66.2	-169.7	-70.3	-139.3	-0.7	113.9	R306	R306-R308 PolarHBondContact O-N 3.37Å
309	T	97.9	Very high	97.6	Very high	19 Å²	19	67.7 Å²	67.7	12%	0.117	34%	0.34	C	S	.	.	S	Bend	trans	-69.4	129	175.3	-65.1	0	0	0	0	109.6	L251 F305 R306 A313 I314	L251-T309 HydrophobicContact CD1-CG2 4.18Å; L251-T309 HydrophobicContact CD2-CG2 4.25Å; F305-T309 HydrophobicContact CB-CG2 3.98Å; F305-T309 HydrophobicContact CG-CG2 4.27Å; R306-T309 WeakPolarHBondContact O-CB 3.44Å; R306-T309 PolarHBondContact O-N 2.83Å; R306-T309 PolarHBondContact O-OG1 3.45Å; T309-A313 HydrophobicContact CG2-CB 4.32Å; T309-I314 HydrophobicContact CG2-CD1 4.1Å; T309-I314 HydrophobicContact CG2-CG1 3.7Å
310	P	98.3	Very high	97.7	Very high	34 Å²	34	63.7 Å²	63.7	22%	0.221	32%	0.322	C	S	.	.			trans	-57.3	134.2	-179.7	-26.6	35.1	0	0	0	112.4	M155 E312 A313 I314	M155-P310 VanDerWaalsContact CE-CD 3.46Å; M155-P310 HydrophobicContact CE-CG 3.72Å; M155-P310 HydrophobicContact CG-CG 4.13Å; M155-P310 HydrophobicContact SD-CG 4.07Å; P310-E312 PolarHBondContact O-N 3.02Å; P310-A313 HydrophobicContact CB-CB 4.28Å; P310-A313 VanDerWaalsContact O-CB 3.32Å; P310-A313 WeakPolarHBondContact O-CB 3.34Å; P310-A313 PolarHBondContact O-N 3.5Å; P310-I314 PolarHBondContact O-N 3.19Å
311	P	98.6	Very high	97.8	Very high	94 Å²	94	60.7 Å²	60.7	61%	0.61	30%	0.302	S	S	*	.	H	α-helix	trans	-55.1	-36.6	179.7	-26.6	35.1	0	0	0	113.6	A313 I314 A315	P311-A313 VanDerWaalsContact C-N 3.29Å; P311-A313 PolarHBondContact O-N 3.05Å; P311-I314 WeakPolarHBondContact O-CB 3.48Å; P311-I314 PolarHBondContact O-N 2.99Å; P311-A315 WeakPolarHBondContact O-CB 3.48Å; P311-A315 PolarHBondContact O-N 3.04Å
312	E	98.8	Very high	97.8	Very high	86 Å²	86	61.2 Å²	61.2	40%	0.402	31%	0.307	S	S	.	.	H	α-helix	trans	-67.2	-31.4	179.7	-56.8	74.3	-164.2	0	0	111.8	P310 L316 H337 F339	P310-E312 PolarHBondContact O-N 3.02Å; E312-L316 WeakPolarHBondContact O-CB 3.27Å; E312-L316 PolarHBondContact O-N 3.44Å; E312-H337 PolarHBondContact O-CE1 3.43Å; E312-H337 VanDerWaalsContact O-CE1 3.31Å; E312-F339 HydrophobicContact CB-CB 4.03Å; E312-F339 HydrophobicContact CB-CD2 4.26Å
313	A	98.8	Very high	97.9	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-69.1	-41.2	175.1	0	0	0	0	0	110.8	L251 T309 P310 P311 C317 F339	L251-A313 HydrophobicContact CD1-CB 3.93Å; L251-A313 HydrophobicContact CD2-CB 4.19Å; T309-A313 HydrophobicContact CG2-CB 4.32Å; P310-A313 HydrophobicContact CB-CB 4.28Å; P310-A313 VanDerWaalsContact O-CB 3.32Å; P310-A313 WeakPolarHBondContact O-CB 3.34Å; P310-A313 PolarHBondContact O-N 3.5Å; P311-A313 VanDerWaalsContact C-N 3.29Å; P311-A313 PolarHBondContact O-N 3.05Å; A313-C317 WeakPolarHBondContact O-CB 3.31Å; A313-C317 PolarHBondContact O-N 3.36Å; A313-F339 HydrophobicContact CB-CD2 3.72Å; A313-F339 HydrophobicContact CB-CE2 3.43Å; A313-F339 VanDerWaalsContact CB-CE2 3.43Å; A313-F339 HydrophobicContact CB-CZ 4.07Å
314	I	98.8	Very high	97.9	Very high	17 Å²	17	50.7 Å²	50.7	9%	0.087	26%	0.255	C	S	.	.	H	α-helix	trans	-65.5	-46.2	176.5	-56.3	-178.5	0	0	0	109.9	W301 T302 F305 T309 P310 P311 C317 S318	W301-I314 HydrophobicContact CB-CG2 3.56Å; W301-I314 HydrophobicContact CG-CG2 4.49Å; T302-I314 HydrophobicContact CG2-CD1 4.48Å; F305-I314 HydrophobicContact CB-CD1 4.46Å; F305-I314 HydrophobicContact CD2-CB 4.4Å; F305-I314 HydrophobicContact CD2-CD1 4.19Å; F305-I314 HydrophobicContact CD2-CG1 3.77Å; F305-I314 HydrophobicContact CD2-CG2 4.12Å; F305-I314 HydrophobicContact CE2-CG1 4.37Å; F305-I314 HydrophobicContact CE2-CG2 4.25Å; F305-I314 HydrophobicContact CG-CG1 4.47Å; T309-I314 HydrophobicContact CG2-CD1 4.1Å; T309-I314 HydrophobicContact CG2-CG1 3.7Å; P310-I314 PolarHBondContact O-N 3.19Å; P311-I314 WeakPolarHBondContact O-CB 3.48Å; P311-I314 PolarHBondContact O-N 2.99Å; I314-C317 WeakPolarHBondContact O-CB 3.34Å; I314-C317 PolarHBondContact O-N 2.9Å; I314-S318 PolarHBondContact O-N 3.3Å; I314-S318 PolarHBondContact O-OG 3.26Å
315	A	98.8	Very high	98	Very high	41 Å²	41	50.2 Å²	50.2	34%	0.339	25%	0.252	S	S	.	.	H	α-helix	trans	-61.2	-43.6	177.4	0	0	0	0	0	112.1	P311 S318 R319	P311-A315 WeakPolarHBondContact O-CB 3.48Å; P311-A315 PolarHBondContact O-N 3.04Å; A315-S318 PolarHBondContact O-N 2.98Å; A315-S318 PolarHBondContact O-OG 2.93Å; A315-R319 VanDerWaalsContact O-CG 3.27Å; A315-R319 WeakPolarHBondContact O-CG 3.31Å; A315-R319 PolarHBondContact O-N 3.13Å
316	L	98.9	Very high	98	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-59.9	-48.3	173.4	178.8	56.6	0	0	0	110.5	F166 L247 E312 S318 R319 L320 L329 A334 H337 F339 F340	F166-L316 HydrophobicContact CE2-CD2 4.37Å; L247-L316 HydrophobicContact CD2-CB 4.23Å; L247-L316 HydrophobicContact CD2-CD2 3.84Å; L247-L316 HydrophobicContact CD2-CG 3.83Å; E312-L316 WeakPolarHBondContact O-CB 3.27Å; E312-L316 PolarHBondContact O-N 3.44Å; L316-S318 VanDerWaalsContact C-N 3.35Å; L316-S318 PolarHBondContact O-N 2.94Å; L316-R319 PolarHBondContact O-N 3.48Å; L316-R319 VanDerWaalsContact O-N 3.11Å; L316-L320 HydrophobicContact CD1-CD1 3.97Å; L316-L320 HydrophobicContact CD1-CD2 4.46Å; L316-L320 HydrophobicContact CD1-CG 4.15Å; L316-L320 HydrophobicContact CG-CD1 3.84Å; L316-L320 HydrophobicContact CG-CG 4.47Å; L316-L320 VanDerWaalsContact O-CG 3.27Å; L316-L320 WeakPolarHBondContact O-CG 3.27Å; L316-L320 PolarHBondContact O-N 3.46Å; L316-L329 HydrophobicContact CD1-CD1 3.88Å; L316-A334 HydrophobicContact CD1-CB 4.39Å; L316-H337 HydrophobicContact CD1-CB 4Å; L316-F339 HydrophobicContact CB-CB 4.4Å; L316-F339 HydrophobicContact CD2-CB 4.09Å; L316-F339 HydrophobicContact CD2-CD1 3.55Å; L316-F339 HydrophobicContact CD2-CE1 4.37Å; L316-F339 HydrophobicContact CD2-CG 4.12Å; L316-F340 HydrophobicContact CD2-CE2 3.66Å; L316-F340 HydrophobicContact CD2-CZ 3.73Å
317	C	98.8	Very high	98.2	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-59.1	-44	-178.8	-164.7	0	0	0	0	112.3	L247 F305 A313 I314 R319 L320 L321	L247-C317 HydrophobicContact CD2-CB 4.02Å; F305-C317 HydrophobicContact CE2-CB 4.4Å; F305-C317 HydrophobicContact CZ-CB 4.25Å; A313-C317 WeakPolarHBondContact O-CB 3.31Å; A313-C317 PolarHBondContact O-N 3.36Å; I314-C317 WeakPolarHBondContact O-CB 3.34Å; I314-C317 PolarHBondContact O-N 2.9Å; C317-R319 VanDerWaalsContact C-N 3.25Å; C317-R319 PolarHBondContact O-N 3.02Å; C317-L320 PolarHBondContact O-N 2.88Å; C317-L320 VanDerWaalsContact O-N 3.13Å; C317-L321 PolarHBondContact O-N 3.21Å
318	S	98.7	Very high	98.5	Very high	28 Å²	28	45.5 Å²	45.5	20%	0.196	24%	0.238	C	C	.	.	H	α-helix	trans	-63.9	-29.4	177.6	61.8	0	0	0	0	113.3	W301 I314 A315 L316 L320	W301-S318 VanDerWaalsContact NE1-CB 3.32Å; I314-S318 PolarHBondContact O-N 3.3Å; I314-S318 PolarHBondContact O-OG 3.26Å; A315-S318 PolarHBondContact O-N 2.98Å; A315-S318 PolarHBondContact O-OG 2.93Å; L316-S318 VanDerWaalsContact C-N 3.35Å; L316-S318 PolarHBondContact O-N 2.94Å; S318-L320 VanDerWaalsContact C-N 3.34Å
319	R	98.9	Very high	98.7	Very high	117 Å²	117	34.8 Å²	34.8	44%	0.442	20%	0.199	S	C	.	.	H	α-helix	trans	-83.6	-8	177.9	-65.6	-63.8	-57.2	-80.6	-0.6	113.9	A315 L316 C317 R328 L329	A315-R319 VanDerWaalsContact O-CG 3.27Å; A315-R319 WeakPolarHBondContact O-CG 3.31Å; A315-R319 PolarHBondContact O-N 3.13Å; L316-R319 PolarHBondContact O-N 3.48Å; L316-R319 VanDerWaalsContact O-N 3.11Å; C317-R319 VanDerWaalsContact C-N 3.25Å; C317-R319 PolarHBondContact O-N 3.02Å; R319-R328 WeakPolarHBondContact O-CA 3.22Å; R319-L329 HydrophobicContact CB-CD1 3.7Å; R319-L329 HydrophobicContact CB-CG 3.88Å; R319-L329 PolarHBondContact O-N 3.14Å; R319-L329 VanDerWaalsContact O-N 3.13Å
320	L	98.9	Very high	98.8	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-101.3	-40.3	175.7	-62.6	166.9	0	0	0	111.5	F166 V240 L247 L316 C317 S318 E322 R328 L329 A334	F166-L320 HydrophobicContact CE1-CD1 4.41Å; F166-L320 HydrophobicContact CE1-CD2 3.95Å; F166-L320 HydrophobicContact CE2-CD1 4.41Å; F166-L320 HydrophobicContact CZ-CD1 3.6Å; F166-L320 HydrophobicContact CZ-CD2 3.89Å; F166-L320 HydrophobicContact CZ-CG 4.42Å; V240-L320 HydrophobicContact CG1-CB 4.49Å; V240-L320 HydrophobicContact CG1-CD2 3.43Å; V240-L320 VanDerWaalsContact CG1-CD2 3.43Å; L247-L320 HydrophobicContact CD2-CD1 4.01Å; L316-L320 HydrophobicContact CD1-CD1 3.97Å; L316-L320 HydrophobicContact CD1-CD2 4.46Å; L316-L320 HydrophobicContact CD1-CG 4.15Å; L316-L320 HydrophobicContact CG-CD1 3.84Å; L316-L320 HydrophobicContact CG-CG 4.47Å; L316-L320 VanDerWaalsContact O-CG 3.27Å; L316-L320 WeakPolarHBondContact O-CG 3.27Å; L316-L320 PolarHBondContact O-N 3.46Å; C317-L320 PolarHBondContact O-N 2.88Å; C317-L320 VanDerWaalsContact O-N 3.13Å; S318-L320 VanDerWaalsContact C-N 3.34Å; L320-E322 VanDerWaalsContact C-N 3.3Å; L320-E322 PolarHBondContact O-N 3.28Å; L320-R328 WeakPolarHBondContact O-CD 3.24Å; L320-R328 WeakPolarHBondContact O-CG 3.14Å; L320-L329 HydrophobicContact CD2-CB 4.33Å; L320-A334 HydrophobicContact CD2-CB 4.37Å
321	L	98.9	Very high	98.8	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	20%	0.202	C	C	.	.	S	Bend	trans	-91.9	59.4	-177.3	-64.1	-179.8	0	0	0	111.5	W241 A248 I256 F257 L273 W301 C317	W241-L321 HydrophobicContact CD2-CD2 3.74Å; W241-L321 HydrophobicContact CE3-CB 4.49Å; W241-L321 HydrophobicContact CE3-CD2 3.89Å; W241-L321 HydrophobicContact CG-CD2 4.21Å; W241-L321 HydrophobicContact CH2-CD2 4.33Å; W241-L321 HydrophobicContact CZ2-CD2 4.18Å; W241-L321 HydrophobicContact CZ3-CB 4.21Å; W241-L321 HydrophobicContact CZ3-CD2 4.2Å; W241-L321 WeakPolarHBondContact O-CD2 3.38Å; A248-L321 HydrophobicContact CB-CD1 4.45Å; I256-L321 HydrophobicContact CD1-CD1 4.32Å; F257-L321 HydrophobicContact CE2-CD1 3.98Å; F257-L321 HydrophobicContact CE2-CD2 4.21Å; F257-L321 HydrophobicContact CZ-CD1 4.11Å; L273-L321 WeakPolarHBondContact CD1-O 3.12Å; L273-L321 WeakPolarHBondContact CD2-O 3.45Å; W301-L321 HydrophobicContact CH2-CB 3.87Å; W301-L321 HydrophobicContact CH2-CD1 3.7Å; W301-L321 HydrophobicContact CH2-CG 4.39Å; W301-L321 HydrophobicContact CZ2-CB 4.06Å; W301-L321 HydrophobicContact CZ3-CD1 4.34Å; C317-L321 PolarHBondContact O-N 3.21Å
322	E	98.9	Very high	98.8	Very high	61 Å²	61	30.9 Å²	30.9	29%	0.285	17%	0.173	S	C	.	.			trans	-101.3	142.2	175.8	-69.6	-77.7	-170.5	0	0	111	W241 L320 A327 R328	W241-E322 WeakPolarHBondContact CZ3-O 3.43Å; L320-E322 VanDerWaalsContact C-N 3.3Å; L320-E322 PolarHBondContact O-N 3.28Å; E322-A327 HydrophobicContact CB-CB 4.29Å; E322-A327 HydrophobicContact CG-CB 4.39Å; E322-R328 HydrophobicContact CB-CG 3.92Å; E322-R328 PolarHBondContact O-NE 3.41Å; E322-R328 PolarHBondContact O-NH2 3.01Å; E322-R328 VanDerWaalsContact O-NH2 3.09Å
323	Y	98.8	Very high	98.8	Very high	4 Å²	4	30.2 Å²	30.2	2%	0.016	17%	0.17	C	C	.	.	S	Bend	trans	-63	-51.9	174	-80.3	-58.3	0	0	0	111.5	P225 I269 I270 L273 G274 P276 M284 P325 R328	P225-Y323 HydrophobicContact CB-CD1 4.1Å; P225-Y323 HydrophobicContact CB-CE1 4.22Å; P225-Y323 HydrophobicContact CG-CD1 3.91Å; P225-Y323 HydrophobicContact CG-CE1 4.4Å; I269-Y323 HydrophobicContact CG2-CE1 3.75Å; I270-Y323 WeakPolarHBondContact CG1-OH 3.48Å; L273-Y323 HydrophobicContact CB-CD2 4.27Å; L273-Y323 HydrophobicContact CB-CE2 3.5Å; L273-Y323 VanDerWaalsContact CB-CE2 3.5Å; L273-Y323 HydrophobicContact CD1-CD1 4.43Å; L273-Y323 HydrophobicContact CD1-CD2 4.19Å; L273-Y323 HydrophobicContact CD1-CE1 4.23Å; L273-Y323 HydrophobicContact CD1-CE2 3.97Å; L273-Y323 HydrophobicContact CD1-CG 4.41Å; L273-Y323 HydrophobicContact CG-CE2 4.4Å; G274-Y323 PolarHBondContact O-OH 3.09Å; P276-Y323 HydrophobicContact CB-CD1 4.19Å; P276-Y323 HydrophobicContact CB-CD2 3.84Å; P276-Y323 HydrophobicContact CB-CE1 4.14Å; P276-Y323 HydrophobicContact CB-CE2 3.78Å; P276-Y323 HydrophobicContact CB-CG 4.05Å; P276-Y323 HydrophobicContact CG-CE1 4.34Å; P276-Y323 HydrophobicContact CG-CE2 4.43Å; M284-Y323 HydrophobicContact CE-CD1 3.74Å; M284-Y323 HydrophobicContact CE-CE1 4.43Å; M284-Y323 HydrophobicContact CE-CG 4.22Å; M284-Y323 VanDerWaalsContact CG-O 3.25Å; M284-Y323 WeakPolarHBondContact CG-O 3.31Å; M284-Y323 HydrophobicContact SD-CD1 3.63Å; M284-Y323 HydrophobicContact SD-CG 4.32Å; Y323-P325 WeakPolarHBondContact O-CD 3.47Å; Y323-R328 PolarHBondContact O-NH2 2.91Å
324	T	98.8	Very high	98.8	Very high	27 Å²	27	30.2 Å²	30.2	17%	0.166	17%	0.17	C	C	.	.	S	Bend	trans	-66.2	113.2	179.6	-63.5	0	0	0	0	109.7	E283 T326 A327	E283-T324 HydrophobicContact CB-CG2 4.02Å; E283-T324 HydrophobicContact CG-CG2 3.93Å; T324-T326 WeakPolarHBondContact CG2-OG1 3.5Å; T324-T326 PolarHBondContact O-N 3.2Å; T324-T326 VanDerWaalsContact O-N 3.13Å; T324-A327 HydrophobicContact CG2-CB 4.05Å; T324-A327 WeakPolarHBondContact O-CB 3.41Å; T324-A327 PolarHBondContact O-N 3.22Å
325	P	98.8	Very high	98.8	Very high	17 Å²	17	29.4 Å²	29.4	11%	0.11	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-28.9	-171.3	-25.6	35.8	0	0	0	114.1	E226 S237 Y323	E226-P325 HydrophobicContact CG-CG 4.41Å; S237-P325 WeakPolarHBondContact CB-O 3.48Å; S237-P325 WeakPolarHBondContact OG-CB 3.23Å; S237-P325 PolarHBondContact OG-O 3.21Å; Y323-P325 WeakPolarHBondContact O-CD 3.47Å
326	T	98.6	Very high	98.8	Very high	116 Å²	116	28.2 Å²	28.2	71%	0.712	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-12.7	178.6	50.8	0	0	0	0	113.9	T324	T324-T326 WeakPolarHBondContact CG2-OG1 3.5Å; T324-T326 PolarHBondContact O-N 3.2Å; T324-T326 VanDerWaalsContact O-N 3.13Å
327	A	98.8	Very high	98.8	Very high	42 Å²	42	29.7 Å²	29.7	35%	0.347	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-15.8	176.2	0	0	0	0	0	112.8	E322 T324	E322-A327 HydrophobicContact CB-CB 4.29Å; E322-A327 HydrophobicContact CG-CB 4.39Å; T324-A327 HydrophobicContact CG2-CB 4.05Å; T324-A327 WeakPolarHBondContact O-CB 3.41Å; T324-A327 PolarHBondContact O-N 3.22Å
328	R	98.9	Very high	98.8	Very high	12 Å²	12	32.3 Å²	32.3	5%	0.045	18%	0.181	C	C	.	.	S	Bend	trans	-68	141	176.7	-57.7	179.3	-168.3	145.1	9.2	109.9	E226 S237 V240 R319 L320 E322 Y323	E226-R328 IonicContact OE1-CZ 3.94Å; E226-R328 IonicContact OE1-NH1 2.95Å; E226-R328 PolarHBondContact OE1-NH1 2.75Å; E226-R328 IonicContact OE1-NH2 3.45Å; E226-R328 PolarHBondContact OE1-NH2 3.38Å; E226-R328 IonicContact OE2-CZ 3.01Å; E226-R328 IonicContact OE2-NH1 3.58Å; E226-R328 IonicContact OE2-NH2 2.69Å; E226-R328 PolarHBondContact OE2-NH2 3.14Å; S237-R328 PolarHBondContact O-NH1 3.45Å; V240-R328 HydrophobicContact CG1-CB 4.03Å; R319-R328 WeakPolarHBondContact O-CA 3.22Å; L320-R328 WeakPolarHBondContact O-CD 3.24Å; L320-R328 WeakPolarHBondContact O-CG 3.14Å; E322-R328 HydrophobicContact CB-CG 3.92Å; E322-R328 PolarHBondContact O-NE 3.41Å; E322-R328 PolarHBondContact O-NH2 3.01Å; E322-R328 VanDerWaalsContact O-NH2 3.09Å; Y323-R328 PolarHBondContact O-NH2 2.91Å
329	L	98.9	Very high	98.8	Very high	14 Å²	14	31 Å²	31	7%	0.073	17%	0.172	C	C	.	.	P	Polyproline II helix	trans	-56.1	140.9	171	-65.9	172.7	0	0	0	110.8	V240 L316 R319 L320 E333 A334	V240-L329 WeakPolarHBondContact CG1-O 3.25Å; L316-L329 HydrophobicContact CD1-CD1 3.88Å; R319-L329 HydrophobicContact CB-CD1 3.7Å; R319-L329 HydrophobicContact CB-CG 3.88Å; R319-L329 PolarHBondContact O-N 3.14Å; R319-L329 VanDerWaalsContact O-N 3.13Å; L320-L329 HydrophobicContact CD2-CB 4.33Å; L329-E333 HydrophobicContact CB-CB 4.33Å; L329-E333 HydrophobicContact CD2-CB 4.11Å; L329-A334 HydrophobicContact CB-CB 4.45Å
330	T	98.9	Very high	98.8	Very high	57 Å²	57	25.5 Å²	25.5	35%	0.35	15%	0.151	S	C	.	.	P	Polyproline II helix	trans	-66.1	158	163.6	64.6	0	0	0	0	110.1	L332 E333 A334	T330-L332 PolarHBondContact O-N 3.23Å; T330-E333 WeakPolarHBondContact CB-OE2 3.38Å; T330-E333 WeakPolarHBondContact CG2-OE2 3.21Å; T330-E333 PolarHBondContact N-OE2 2.78Å; T330-E333 PolarHBondContact O-N 3.14Å; T330-E333 WeakPolarHBondContact OG1-CB 3.47Å; T330-E333 WeakPolarHBondContact OG1-CG 3.5Å; T330-E333 PolarHBondContact OG1-N 3.25Å; T330-E333 PolarHBondContact OG1-OE2 3.45Å; T330-A334 PolarHBondContact O-N 3.32Å
331	P	98.9	Very high	98.8	Very high	8 Å²	8	29.4 Å²	29.4	5%	0.052	17%	0.172	C	C	.	.	H	α-helix	trans	-58	-35.5	178.1	-24.7	33.2	0	0	0	113.5	F166 L169 A170 H173 V240 A334 C335	F166-P331 HydrophobicContact CB-CB 4.49Å; F166-P331 HydrophobicContact CD1-CB 4.4Å; F166-P331 VanDerWaalsContact O-CB 3.31Å; F166-P331 WeakPolarHBondContact O-CB 3.27Å; L169-P331 HydrophobicContact CB-CB 3.8Å; L169-P331 HydrophobicContact CB-CG 3.75Å; A170-P331 HydrophobicContact CB-CB 3.99Å; H173-P331 WeakPolarHBondContact ND1-CG 3.32Å; V240-P331 HydrophobicContact CG2-CG 4.08Å; P331-A334 WeakPolarHBondContact O-CB 3.12Å; P331-A334 PolarHBondContact O-N 2.94Å; P331-C335 PolarHBondContact O-N 3.47Å
332	L	98.8	Very high	98.8	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-71.4	-39.1	179.9	-163.2	64.9	0	0	0	112	A170 T330 A334 C335 A336 F362 L367 S369 N370 L373 L377	A170-L332 HydrophobicContact CB-CB 4.39Å; A170-L332 HydrophobicContact CB-CD1 4.32Å; T330-L332 PolarHBondContact O-N 3.23Å; L332-A334 VanDerWaalsContact C-N 3.33Å; L332-C335 WeakPolarHBondContact O-CB 3.29Å; L332-C335 PolarHBondContact O-N 3.03Å; L332-A336 PolarHBondContact O-N 3.16Å; L332-F362 HydrophobicContact CD1-CD1 4.45Å; L332-F362 HydrophobicContact CD1-CE1 4Å; L332-L367 HydrophobicContact CD1-CD2 4.26Å; L332-L367 HydrophobicContact CD2-CD2 4.25Å; L332-S369 WeakPolarHBondContact CD2-OG 3.41Å; L332-N370 HydrophobicContact CD2-CB 4.37Å; L332-L373 HydrophobicContact CB-CD1 4.27Å; L332-L373 HydrophobicContact CD2-CD1 4.17Å; L332-L373 HydrophobicContact CG-CD1 3.93Å; L332-L377 HydrophobicContact CD1-CD1 3.42Å; L332-L377 VanDerWaalsContact CD1-CD1 3.42Å; L332-L377 HydrophobicContact CD2-CD1 4.44Å; L332-L377 HydrophobicContact CG-CD1 3.78Å
333	E	98.9	Very high	98.7	Very high	72 Å²	72	29.9 Å²	29.9	34%	0.336	17%	0.174	S	C	.	.	H	α-helix	trans	-64.7	-37.9	170.8	-69.7	164.6	148.1	0	0	111.6	L329 T330 A336 H337 L373	L329-E333 HydrophobicContact CB-CB 4.33Å; L329-E333 HydrophobicContact CD2-CB 4.11Å; T330-E333 WeakPolarHBondContact CB-OE2 3.38Å; T330-E333 WeakPolarHBondContact CG2-OE2 3.21Å; T330-E333 PolarHBondContact N-OE2 2.78Å; T330-E333 PolarHBondContact O-N 3.14Å; T330-E333 WeakPolarHBondContact OG1-CB 3.47Å; T330-E333 WeakPolarHBondContact OG1-CG 3.5Å; T330-E333 PolarHBondContact OG1-N 3.25Å; T330-E333 PolarHBondContact OG1-OE2 3.45Å; E333-A336 CarbonylContact O-C 3.6Å; E333-A336 PolarHBondContact O-N 2.99Å; E333-A336 VanDerWaalsContact O-N 3.09Å; E333-H337 PolarHBondContact O-N 3.14Å; E333-L373 HydrophobicContact CG-CD1 3.9Å
334	A	98.9	Very high	98.7	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.8	-45.1	174	0	0	0	0	0	111	F166 L316 L320 L329 T330 P331 L332 A336 H337 F340	F166-A334 HydrophobicContact CB-CB 4.4Å; F166-A334 HydrophobicContact CD1-CB 3.75Å; F166-A334 HydrophobicContact CD2-CB 3.8Å; F166-A334 HydrophobicContact CE1-CB 3.92Å; F166-A334 HydrophobicContact CE2-CB 3.97Å; F166-A334 HydrophobicContact CG-CB 3.72Å; F166-A334 HydrophobicContact CZ-CB 4.04Å; L316-A334 HydrophobicContact CD1-CB 4.39Å; L320-A334 HydrophobicContact CD2-CB 4.37Å; L329-A334 HydrophobicContact CB-CB 4.45Å; T330-A334 PolarHBondContact O-N 3.32Å; P331-A334 WeakPolarHBondContact O-CB 3.12Å; P331-A334 PolarHBondContact O-N 2.94Å; L332-A334 VanDerWaalsContact C-N 3.33Å; A334-A336 PolarHBondContact O-N 2.85Å; A334-H337 WeakPolarHBondContact O-CB 3.42Å; A334-H337 PolarHBondContact O-N 3.45Å; A334-F340 WeakPolarHBondContact O-CD2 3.42Å; A334-F340 WeakPolarHBondContact O-CE2 3.33Å
335	C	98.9	Very high	98.6	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-57.2	-32.7	173	-73.5	0	0	0	0	113.1	Y163 F166 P331 L332 H337 R344 L377	Y163-C335 HydrophobicContact CD2-CB 4.21Å; Y163-C335 HydrophobicContact CE2-CB 3.81Å; Y163-C335 WeakPolarHBondContact CE2-O 3.4Å; F166-C335 WeakPolarHBondContact CB-SG 3.39Å; P331-C335 PolarHBondContact O-N 3.47Å; L332-C335 WeakPolarHBondContact O-CB 3.29Å; L332-C335 PolarHBondContact O-N 3.03Å; C335-H337 VanDerWaalsContact C-N 3.3Å; C335-R344 PolarHBondContact O-NH1 2.78Å; C335-L377 HydrophobicContact CB-CD2 3.49Å; C335-L377 VanDerWaalsContact CB-CD2 3.49Å
336	A	98.8	Very high	98.4	Very high	16 Å²	16	35.5 Å²	35.5	13%	0.132	20%	0.204	C	C	.	.	H	α-helix	trans	-80.9	-6.5	178.3	0	0	0	0	0	113.8	L332 E333 A334 L373 I376 L377	L332-A336 PolarHBondContact O-N 3.16Å; E333-A336 CarbonylContact O-C 3.6Å; E333-A336 PolarHBondContact O-N 2.99Å; E333-A336 VanDerWaalsContact O-N 3.09Å; A334-A336 PolarHBondContact O-N 2.85Å; A336-L373 HydrophobicContact CB-CD2 4.1Å; A336-I376 HydrophobicContact CB-CB 4.46Å; A336-I376 HydrophobicContact CB-CG2 4.04Å; A336-L377 HydrophobicContact CB-CD2 4.01Å; A336-L377 HydrophobicContact CB-CG 4.43Å
337	H	98.9	Very high	98.2	Very high	31 Å²	31	36 Å²	36	14%	0.144	20%	0.203	C	C	.	.	S	Bend	trans	-63.8	147.5	-178.6	-167.2	-90.3	0	0	0	112.5	E312 L316 E333 A334 C335 F339 F340 R344	E312-H337 PolarHBondContact O-CE1 3.43Å; E312-H337 VanDerWaalsContact O-CE1 3.31Å; L316-H337 HydrophobicContact CD1-CB 4Å; E333-H337 PolarHBondContact O-N 3.14Å; A334-H337 WeakPolarHBondContact O-CB 3.42Å; A334-H337 PolarHBondContact O-N 3.45Å; C335-H337 VanDerWaalsContact C-N 3.3Å; H337-F339 WeakPolarHBondContact ND1-CB 3.5Å; H337-F339 PolarHBondContact ND1-N 2.94Å; H337-F339 VanDerWaalsContact ND1-N 3.18Å; H337-F339 PolarHBondContact O-N 3.03Å; H337-F340 HydrophobicContact CB-CD2 4.29Å; H337-F340 PolarHBondContact O-N 3.38Å; H337-R344 PolarHBondContact O-NH2 3.17Å
338	S	98.8	Very high	98	Very high	55 Å²	55	35.6 Å²	35.6	39%	0.385	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-62.4	-24.3	-176.3	57.9	0	0	0	0	114.3	F340 D341	S338-F340 PolarHBondContact O-N 2.94Å; S338-D341 VanDerWaalsContact CA-OD2 3.25Å; S338-D341 WeakPolarHBondContact CA-OD2 3.42Å; S338-D341 WeakPolarHBondContact CB-OD2 3.34Å; S338-D341 WeakPolarHBondContact O-CB 3.4Å; S338-D341 PolarHBondContact O-N 3.08Å
339	F	98.9	Very high	97.7	Very high	1 Å²	1	40.2 Å²	40.2	0%	0.004	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-50.6	-29.9	170.3	179.6	-118.8	0	0	0	112.6	M155 V158 K159 L247 E312 A313 L316 H337	M155-F339 HydrophobicContact CG-CE2 4.43Å; M155-F339 HydrophobicContact SD-CE2 3.61Å; M155-F339 HydrophobicContact SD-CZ 3.68Å; V158-F339 HydrophobicContact CG1-CE1 4.41Å; V158-F339 HydrophobicContact CG1-CZ 4.03Å; K159-F339 HydrophobicContact CB-CE1 4.42Å; K159-F339 HydrophobicContact CB-CZ 4.49Å; K159-F339 HydrophobicContact CD-CE2 4.41Å; K159-F339 VanDerWaalsContact CD-O 3.29Å; K159-F339 WeakPolarHBondContact CD-O 3.26Å; K159-F339 WeakPolarHBondContact CE-O 3.3Å; K159-F339 HydrophobicContact CG-CD1 4.25Å; K159-F339 HydrophobicContact CG-CD2 4.38Å; K159-F339 HydrophobicContact CG-CE1 3.7Å; K159-F339 HydrophobicContact CG-CE2 3.81Å; K159-F339 HydrophobicContact CG-CZ 3.46Å; K159-F339 VanDerWaalsContact CG-CZ 3.46Å; K159-F339 PolarHBondContact NZ-O 3.49Å; L247-F339 HydrophobicContact CD1-CE1 4.24Å; L247-F339 HydrophobicContact CD1-CZ 4.49Å; E312-F339 HydrophobicContact CB-CB 4.03Å; E312-F339 HydrophobicContact CB-CD2 4.26Å; A313-F339 HydrophobicContact CB-CD2 3.72Å; A313-F339 HydrophobicContact CB-CE2 3.43Å; A313-F339 VanDerWaalsContact CB-CE2 3.43Å; A313-F339 HydrophobicContact CB-CZ 4.07Å; L316-F339 HydrophobicContact CB-CB 4.4Å; L316-F339 HydrophobicContact CD2-CB 4.09Å; L316-F339 HydrophobicContact CD2-CD1 3.55Å; L316-F339 HydrophobicContact CD2-CE1 4.37Å; L316-F339 HydrophobicContact CD2-CG 4.12Å; H337-F339 WeakPolarHBondContact ND1-CB 3.5Å; H337-F339 PolarHBondContact ND1-N 2.94Å; H337-F339 VanDerWaalsContact ND1-N 3.18Å; H337-F339 PolarHBondContact O-N 3.03Å
340	F	98.8	Very high	97.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-97.1	5.4	-179.9	-56.2	-63.8	0	0	0	114.4	K159 M162 Y163 F166 L316 A334 H337 S338 E342 L343	K159-F340 HydrophobicContact CB-CD1 4.24Å; K159-F340 VanDerWaalsContact O-CE1 3.24Å; K159-F340 WeakPolarHBondContact O-CE1 3.39Å; M162-F340 HydrophobicContact CB-CE1 3.99Å; M162-F340 HydrophobicContact CB-CZ 3.93Å; Y163-F340 HydrophobicContact CD2-CB 3.89Å; Y163-F340 HydrophobicContact CD2-CD1 4.01Å; Y163-F340 HydrophobicContact CD2-CD2 4.1Å; Y163-F340 AromaticContact CD2-CG 3.73Å; Y163-F340 HydrophobicContact CD2-CG 3.73Å; Y163-F340 HydrophobicContact CE2-CB 4.41Å; Y163-F340 HydrophobicContact CG-CD1 4.38Å; F166-F340 HydrophobicContact CD2-CE2 4.06Å; F166-F340 AromaticContact CD2-CZ 3.88Å; F166-F340 HydrophobicContact CD2-CZ 3.88Å; F166-F340 HydrophobicContact CE2-CE2 4.28Å; F166-F340 AromaticContact CE2-CZ 3.98Å; F166-F340 HydrophobicContact CE2-CZ 3.98Å; L316-F340 HydrophobicContact CD2-CE2 3.66Å; L316-F340 HydrophobicContact CD2-CZ 3.73Å; A334-F340 WeakPolarHBondContact O-CD2 3.42Å; A334-F340 WeakPolarHBondContact O-CE2 3.33Å; H337-F340 HydrophobicContact CB-CD2 4.29Å; H337-F340 PolarHBondContact O-N 3.38Å; S338-F340 PolarHBondContact O-N 2.94Å; F340-E342 VanDerWaalsContact C-N 3.27Å; F340-E342 PolarHBondContact O-N 3.24Å; F340-L343 HydrophobicContact CB-CD1 4.37Å; F340-L343 HydrophobicContact CD1-CD1 3.93Å; F340-L343 WeakPolarHBondContact O-CB 3.29Å; F340-L343 PolarHBondContact O-N 2.81Å
341	D	98.5	Very high	97.2	Very high	83 Å²	83	41.1 Å²	41.1	44%	0.444	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-59.7	-37.6	-178.7	-74.2	-21.6	0	0	0	112.5	S338 L343 R344 D345	S338-D341 VanDerWaalsContact CA-OD2 3.25Å; S338-D341 WeakPolarHBondContact CA-OD2 3.42Å; S338-D341 WeakPolarHBondContact CB-OD2 3.34Å; S338-D341 WeakPolarHBondContact O-CB 3.4Å; S338-D341 PolarHBondContact O-N 3.08Å; D341-L343 PolarHBondContact O-N 3.15Å; D341-R344 CarbonylContact O-C 3.51Å; D341-R344 WeakPolarHBondContact O-CA 3.34Å; D341-R344 WeakPolarHBondContact O-CB 3.45Å; D341-R344 PolarHBondContact O-N 3.39Å; D341-R344 IonicContact OD1-CZ 3.82Å; D341-R344 IonicContact OD1-NE 3.31Å; D341-R344 PolarHBondContact OD1-NE 3.2Å; D341-R344 IonicContact OD1-NH2 3.66Å; D341-R344 PolarHBondContact OD1-NH2 2.91Å; D341-D345 PolarHBondContact O-N 3.23Å
342	E	97.9	Very high	96.9	Very high	71 Å²	71	44.2 Å²	44.2	33%	0.332	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-55.8	-37.5	173.9	-176.3	-179.7	-163.9	0	0	111.6	K159 F340 R344 D345 I348	K159-E342 HydrophobicContact CD-CB 4.24Å; K159-E342 VanDerWaalsContact CD-OE2 3.29Å; K159-E342 WeakPolarHBondContact CD-OE2 3.22Å; K159-E342 WeakPolarHBondContact CE-OE2 3.38Å; K159-E342 IonicContact NZ-OE2 3.62Å; K159-E342 PolarHBondContact NZ-OE2 2.87Å; F340-E342 VanDerWaalsContact C-N 3.27Å; F340-E342 PolarHBondContact O-N 3.24Å; E342-R344 PolarHBondContact O-N 3.33Å; E342-D345 WeakPolarHBondContact O-CB 3.36Å; E342-D345 PolarHBondContact O-N 3.16Å; E342-D345 VanDerWaalsContact O-N 3.08Å; E342-I348 HydrophobicContact CG-CD1 3.55Å; E342-I348 HydrophobicContact CG-CG1 3.72Å; E342-I348 VanDerWaalsContact O-CG1 3.3Å; E342-I348 WeakPolarHBondContact O-CG1 3.37Å
343	L	98.2	Very high	96.7	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-65.9	-25	178.9	-57.9	-175.7	0	0	0	112.6	K159 L160 Y163 F340 D341 D345 K356 L359 F360	K159-L343 HydrophobicContact CB-CD1 4.07Å; K159-L343 HydrophobicContact CB-CD2 3.93Å; K159-L343 HydrophobicContact CB-CG 4.05Å; L160-L343 HydrophobicContact CD2-CD2 3.88Å; L160-L343 HydrophobicContact CG-CD2 3.92Å; Y163-L343 HydrophobicContact CD2-CD1 4.21Å; Y163-L343 HydrophobicContact CG-CD1 3.9Å; F340-L343 HydrophobicContact CB-CD1 4.37Å; F340-L343 HydrophobicContact CD1-CD1 3.93Å; F340-L343 WeakPolarHBondContact O-CB 3.29Å; F340-L343 PolarHBondContact O-N 2.81Å; D341-L343 PolarHBondContact O-N 3.15Å; L343-D345 VanDerWaalsContact C-N 3.34Å; L343-K356 WeakPolarHBondContact O-CE 3.26Å; L343-L359 HydrophobicContact CB-CD1 3.88Å; L343-L359 HydrophobicContact CD1-CD1 4.15Å; L343-L359 HydrophobicContact CG-CD1 4.45Å; L343-F360 VanDerWaalsContact O-CZ 3.28Å; L343-F360 WeakPolarHBondContact O-CZ 3.23Å
344	R	97.8	Very high	96.5	Very high	26 Å²	26	48.6 Å²	48.6	10%	0.098	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-86.8	0.9	177.6	-66.2	179.3	-85.5	-92.3	3.8	113.1	C335 H337 D341 E342 F360 I376 P379 H381	C335-R344 PolarHBondContact O-NH1 2.78Å; H337-R344 PolarHBondContact O-NH2 3.17Å; D341-R344 CarbonylContact O-C 3.51Å; D341-R344 WeakPolarHBondContact O-CA 3.34Å; D341-R344 WeakPolarHBondContact O-CB 3.45Å; D341-R344 PolarHBondContact O-N 3.39Å; D341-R344 IonicContact OD1-CZ 3.82Å; D341-R344 IonicContact OD1-NE 3.31Å; D341-R344 PolarHBondContact OD1-NE 3.2Å; D341-R344 IonicContact OD1-NH2 3.66Å; D341-R344 PolarHBondContact OD1-NH2 2.91Å; E342-R344 PolarHBondContact O-N 3.33Å; R344-F360 HydrophobicContact CB-CZ 4.47Å; R344-F360 HydrophobicContact CG-CE1 3.89Å; R344-F360 HydrophobicContact CG-CZ 4.07Å; R344-I376 WeakPolarHBondContact CD-O 3.32Å; R344-P379 HydrophobicContact CB-CB 4.38Å; R344-P379 HydrophobicContact CB-CG 4.4Å; R344-P379 HydrophobicContact CG-CG 4.48Å; R344-H381 PolarHBondContact O-CE1 3.07Å
345	D	96.4	Very high	96.3	Very high	65 Å²	65	54 Å²	54	35%	0.348	29%	0.292	S	S	.	.			trans	-78.2	127.4	168	-172.5	-31.4	0	0	0	109.5	D341 E342 L343 N347 I348	D341-D345 PolarHBondContact O-N 3.23Å; E342-D345 WeakPolarHBondContact O-CB 3.36Å; E342-D345 PolarHBondContact O-N 3.16Å; E342-D345 VanDerWaalsContact O-N 3.08Å; L343-D345 VanDerWaalsContact C-N 3.34Å; D345-N347 PolarHBondContact O-N 3.18Å; D345-N347 WeakPolarHBondContact OD1-CB 3.38Å; D345-N347 PolarHBondContact OD1-N 3.22Å; D345-N347 PolarHBondContact OD1-ND2 2.86Å; D345-I348 HydrophobicContact CB-CG1 3.79Å; D345-I348 PolarHBondContact O-N 3Å
346	P	94.5	Very high	96.1	Very high	75 Å²	75	56 Å²	56	49%	0.487	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-18.1	177.9	26.7	-35.6	0	0	0	114.2	H381	P346-H381 HydrophobicContact CB-CB 4.44Å
347	N	94.8	Very high	96	Very high	127 Å²	127	56.1 Å²	56.1	68%	0.679	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-7.7	-175.6	-54.9	-63.8	0	0	0	113.5	D345 K349	D345-N347 PolarHBondContact O-N 3.18Å; D345-N347 WeakPolarHBondContact OD1-CB 3.38Å; D345-N347 PolarHBondContact OD1-N 3.22Å; D345-N347 PolarHBondContact OD1-ND2 2.86Å; N347-K349 PolarHBondContact O-N 3.3Å
348	I	93.6	Very high	95.9	Very high	34 Å²	34	57.8 Å²	57.8	17%	0.174	32%	0.316	C	S	.	.			trans	-75.1	123.5	-176.9	-73	-72.1	0	0	0	110.8	E342 D345	E342-I348 HydrophobicContact CG-CD1 3.55Å; E342-I348 HydrophobicContact CG-CG1 3.72Å; E342-I348 VanDerWaalsContact O-CG1 3.3Å; E342-I348 WeakPolarHBondContact O-CG1 3.37Å; D345-I348 HydrophobicContact CB-CG1 3.79Å; D345-I348 PolarHBondContact O-N 3Å
349	K	94	Very high	95.8	Very high	109 Å²	109	55.3 Å²	55.3	47%	0.474	30%	0.298	S	S	.	.	B	Isolated β-bridge	trans	-115	161.6	175.2	-61.2	-163.6	-177.1	-138.8	0	111	N347 E355	N347-K349 PolarHBondContact O-N 3.3Å; K349-E355 WeakPolarHBondContact CE-OE1 3.34Å; K349-E355 IonicContact NZ-OE1 2.71Å; K349-E355 PolarHBondContact NZ-OE1 3.45Å
350	L	94.4	Very high	95.8	Very high	7 Å²	7	56.2 Å²	56.2	4%	0.037	30%	0.302	C	S	.	.			trans	-65.4	152.3	170	-61	-174.8	0	0	0	110.1	L160 A194 N352 G353 R354	L160-L350 HydrophobicContact CD1-CD2 3.36Å; A194-L350 HydrophobicContact CB-CD1 3.99Å; A194-L350 HydrophobicContact CB-CD2 3.87Å; L350-N352 WeakPolarHBondContact CB-OD1 3.43Å; L350-N352 PolarHBondContact O-N 2.92Å; L350-G353 PolarHBondContact O-N 3.41Å; L350-R354 WeakPolarHBondContact CB-O 3.35Å; L350-R354 HydrophobicContact CD1-CB 4.21Å; L350-R354 PolarHBondContact N-O 3.49Å
351	P	93.3	Very high	95.7	Very high	82 Å²	82	59.9 Å²	59.9	53%	0.532	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-22.5	176.1	-29.2	36.8	0	0	0	114.9	V156 Y157 G353	V156-P351 HydrophobicContact CG1-CG 3.59Å; Y157-P351 HydrophobicContact CE2-CG 3.9Å; P351-G353 VanDerWaalsContact C-N 3.25Å; P351-G353 PolarHBondContact O-N 2.91Å
352	N	92.2	Very high	95.7	Very high	73 Å²	73	57 Å²	57	39%	0.39	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	7	175.2	66.3	8.3	0	0	0	113.5	E192 L350 R354	E192-N352 PolarHBondContact O-ND2 3.3Å; E192-N352 VanDerWaalsContact O-ND2 3.12Å; L350-N352 WeakPolarHBondContact CB-OD1 3.43Å; L350-N352 PolarHBondContact O-N 2.92Å; N352-R354 VanDerWaalsContact C-N 3.3Å; N352-R354 PolarHBondContact O-N 3.44Å; N352-R354 VanDerWaalsContact OD1-CB 3.3Å; N352-R354 WeakPolarHBondContact OD1-CB 3.3Å; N352-R354 WeakPolarHBondContact OD1-CG 3.41Å; N352-R354 PolarHBondContact OD1-N 3.23Å
353	G	94.4	Very high	95.7	Very high	49 Å²	49	56.8 Å²	56.8	51%	0.505	31%	0.308	S	S	.	.	S	Bend	trans	82.9	-5.7	179.7	0	0	0	0	0	115.3	L350 P351	L350-G353 PolarHBondContact O-N 3.41Å; P351-G353 VanDerWaalsContact C-N 3.25Å; P351-G353 PolarHBondContact O-N 2.91Å
354	R	95	Very high	95.7	Very high	117 Å²	117	62.8 Å²	62.8	44%	0.442	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-78.7	160.9	179.2	-61.9	-175.7	-179.5	-154.6	6	112.3	E192 L350 N352	E192-R354 VanDerWaalsContact CD-NH1 3.31Å; E192-R354 VanDerWaalsContact CG-CZ 3.45Å; E192-R354 IonicContact OE1-CZ 3.89Å; E192-R354 IonicContact OE1-NH1 2.81Å; E192-R354 PolarHBondContact OE1-NH1 2.99Å; E192-R354 IonicContact OE1-NH2 4Å; E192-R354 PolarHBondContact OE1-NH2 2.82Å; L350-R354 WeakPolarHBondContact CB-O 3.35Å; L350-R354 HydrophobicContact CD1-CB 4.21Å; L350-R354 PolarHBondContact N-O 3.49Å; N352-R354 VanDerWaalsContact C-N 3.3Å; N352-R354 PolarHBondContact O-N 3.44Å; N352-R354 VanDerWaalsContact OD1-CB 3.3Å; N352-R354 WeakPolarHBondContact OD1-CB 3.3Å; N352-R354 WeakPolarHBondContact OD1-CG 3.41Å; N352-R354 PolarHBondContact OD1-N 3.23Å
355	E	95	Very high	95.7	Very high	113 Å²	113	65 Å²	65	53%	0.528	36%	0.357	S	S	.	.	B	Isolated β-bridge	trans	-66.4	149	171.6	-61.9	-55.7	143.9	0	0	111.4	K349	K349-E355 WeakPolarHBondContact CE-OE1 3.34Å; K349-E355 IonicContact NZ-OE1 2.71Å; K349-E355 PolarHBondContact NZ-OE1 3.45Å
356	K	94.5	Very high	95.8	Very high	42 Å²	42	62 Å²	62	18%	0.183	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-65	151.3	172.6	59.4	-174.3	173.9	60.5	0	110.9	L160 L343 L359	L160-K356 HydrophobicContact CD2-CB 4.48Å; L343-K356 WeakPolarHBondContact O-CE 3.26Å; K356-L359 HydrophobicContact CD-CD1 4.03Å
357	P	96.7	Very high	95.9	Very high	19 Å²	19	59.5 Å²	59.5	12%	0.123	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-63.8	173.1	176.5	27.9	-35.4	0	0	0	111.9	L160 V195 L359	L160-P357 HydrophobicContact CD2-CG 4.36Å; V195-P357 HydrophobicContact CG2-CB 3.64Å; V195-P357 HydrophobicContact CG2-CG 4.44Å; P357-L359 HydrophobicContact CG-CD2 4.18Å; P357-L359 WeakPolarHBondContact O-CG 2.88Å; P357-L359 PolarHBondContact O-N 3.38Å
358	S	95.6	Very high	96.1	Very high	66 Å²	66	56.3 Å²	56.3	46%	0.462	31%	0.311	S	S	.	.			trans	-64.1	110.5	176.9	-169.6	0	0	0	0	111.3	N361	S358-N361 PolarHBondContact OG-ND2 3.5Å; S358-N361 PolarHBondContact OG-OD1 3Å
359	L	98.1	Very high	96.2	Very high	2 Å²	2	58.5 Å²	58.5	1%	0.01	33%	0.329	C	S	.	.			trans	-107.6	-23.4	-177.4	-61.5	-173.6	0	0	0	113.9	L160 Y163 Q164 R167 L343 K356 P357 F362	L160-L359 HydrophobicContact CD2-CD1 4.1Å; L160-L359 HydrophobicContact CD2-CD2 4.34Å; Y163-L359 HydrophobicContact CD1-CB 4.5Å; Y163-L359 HydrophobicContact CD1-CD2 4.01Å; Y163-L359 HydrophobicContact CE1-CB 3.92Å; Y163-L359 HydrophobicContact CE1-CD2 4.25Å; Y163-L359 WeakPolarHBondContact CE1-O 2.79Å; Y163-L359 PolarHBondContact OH-O 3.26Å; Q164-L359 HydrophobicContact CG-CD2 4.03Å; R167-L359 VanDerWaalsContact NH1-C 3.27Å; R167-L359 PolarHBondContact NH1-O 3.11Å; L343-L359 HydrophobicContact CB-CD1 3.88Å; L343-L359 HydrophobicContact CD1-CD1 4.15Å; L343-L359 HydrophobicContact CG-CD1 4.45Å; K356-L359 HydrophobicContact CD-CD1 4.03Å; P357-L359 HydrophobicContact CG-CD2 4.18Å; P357-L359 WeakPolarHBondContact O-CG 2.88Å; P357-L359 PolarHBondContact O-N 3.38Å; L359-F362 WeakPolarHBondContact O-CE2 3.45Å
360	F	98	Very high	96.4	Very high	21 Å²	21	55.6 Å²	55.6	9%	0.092	32%	0.319	C	S	.	.			trans	-119.1	5.8	-164.5	-46.9	-50.9	0	0	0	114.7	L343 R344 F362 L377 P379 H381 A382	L343-F360 VanDerWaalsContact O-CZ 3.28Å; L343-F360 WeakPolarHBondContact O-CZ 3.23Å; R344-F360 HydrophobicContact CB-CZ 4.47Å; R344-F360 HydrophobicContact CG-CE1 3.89Å; R344-F360 HydrophobicContact CG-CZ 4.07Å; F360-F362 PolarHBondContact O-N 3.32Å; F360-L377 VanDerWaalsContact CD1-O 3.27Å; F360-L377 WeakPolarHBondContact CD1-O 3.37Å; F360-P379 HydrophobicContact CD1-CG 4.37Å; F360-P379 HydrophobicContact CD2-CG 3.84Å; F360-P379 HydrophobicContact CE1-CG 4.27Å; F360-P379 HydrophobicContact CE2-CG 3.67Å; F360-P379 HydrophobicContact CG-CG 4.17Å; F360-P379 HydrophobicContact CZ-CG 3.92Å; F360-H381 AromaticContact CE2-NE2 3.71Å; F360-A382 HydrophobicContact CB-CB 3.93Å; F360-A382 HydrophobicContact CD2-CB 3.73Å; F360-A382 HydrophobicContact CG-CB 4.18Å
361	N	97.6	Very high	96.5	Very high	77 Å²	77	59.4 Å²	59.4	41%	0.412	34%	0.344	S	S	.	.			trans	-77.5	54.3	175.7	63.6	-34.8	0	0	0	111.5	R167 S358	R167-N361 PolarHBondContact NH1-OD1 3.44Å; R167-N361 VanDerWaalsContact NH2-C 3.26Å; R167-N361 PolarHBondContact NH2-O 3.39Å; R167-N361 PolarHBondContact NH2-OD1 3.1Å; S358-N361 PolarHBondContact OG-ND2 3.5Å; S358-N361 PolarHBondContact OG-OD1 3Å
362	F	98.3	Very high	96.8	Very high	23 Å²	23	59.4 Å²	59.4	10%	0.101	35%	0.346	C	S	.	.			trans	-69.2	133.1	179.2	-73.9	-89.6	0	0	0	111	Y163 R167 L332 L359 F360 E366 L367 L377 I378	Y163-F362 VanDerWaalsContact OH-CE2 3.27Å; Y163-F362 WeakPolarHBondContact OH-CE2 3.46Å; Y163-F362 VanDerWaalsContact OH-CZ 3.26Å; Y163-F362 WeakPolarHBondContact OH-CZ 3.47Å; R167-F362 HydrophobicContact CG-CE1 3.68Å; R167-F362 HydrophobicContact CG-CZ 3.75Å; L332-F362 HydrophobicContact CD1-CD1 4.45Å; L332-F362 HydrophobicContact CD1-CE1 4Å; L359-F362 WeakPolarHBondContact O-CE2 3.45Å; F360-F362 PolarHBondContact O-N 3.32Å; F362-E366 WeakPolarHBondContact CA-OE2 3.34Å; F362-E366 HydrophobicContact CD1-CB 4.07Å; F362-E366 WeakPolarHBondContact CD1-OE1 3.34Å; F362-L367 HydrophobicContact CB-CD1 3.94Å; F362-L367 HydrophobicContact CB-CD2 4.18Å; F362-L367 HydrophobicContact CB-CG 3.96Å; F362-L367 HydrophobicContact CD1-CD2 4.11Å; F362-L367 HydrophobicContact CD1-CG 4.49Å; F362-L367 HydrophobicContact CG-CD2 4.23Å; F362-L367 HydrophobicContact CG-CG 4.5Å; F362-L377 HydrophobicContact CD2-CB 4.26Å; F362-L377 HydrophobicContact CE1-CD1 4.21Å; F362-L377 HydrophobicContact CE2-CB 3.82Å; F362-L377 HydrophobicContact CZ-CB 4.11Å; F362-L377 HydrophobicContact CZ-CD1 4.2Å; F362-L377 HydrophobicContact CZ-CD2 4.08Å; F362-L377 HydrophobicContact CZ-CG 4.37Å; F362-I378 HydrophobicContact CB-CD1 4.4Å; F362-I378 HydrophobicContact CD2-CG1 4.06Å
363	T	98	Very high	97	Very high	65 Å²	65	57 Å²	57	40%	0.399	33%	0.333	S	S	.	.			trans	-85.2	161.4	170.4	61.1	0	0	0	0	111.6	Q365 E366 L367	T363-Q365 PolarHBondContact O-N 2.92Å; T363-E366 PolarHBondContact N-OE2 2.96Å; T363-E366 PolarHBondContact O-N 2.56Å; T363-E366 VanDerWaalsContact O-N 3.17Å; T363-E366 WeakPolarHBondContact OG1-CG 3.36Å; T363-E366 PolarHBondContact OG1-N 2.92Å; T363-E366 PolarHBondContact OG1-OE2 3.48Å; T363-E366 VanDerWaalsContact OG1-OE2 3.07Å; T363-L367 PolarHBondContact O-N 3.49Å; T363-L367 VanDerWaalsContact O-N 3.16Å
364	T	97.8	Very high	97.2	Very high	127 Å²	127	55.8 Å²	55.8	78%	0.779	32%	0.318	S	S	*	.	H	α-helix	trans	-56.5	-34.9	171.1	-48.4	0	0	0	0	111.8	L367 S368	T364-L367 PolarHBondContact O-N 3.32Å; T364-S368 PolarHBondContact O-N 2.94Å; T364-S368 VanDerWaalsContact O-N 3.07Å
365	Q	97.4	Very high	97.3	Very high	73 Å²	73	54.1 Å²	54.1	34%	0.341	32%	0.324	S	S	.	.	H	α-helix	trans	-64.2	-45.8	177.2	-175.8	61.5	38.3	0	0	111.8	S174 F175 T363 L367 S368	S174-Q365 VanDerWaalsContact CB-NE2 3.33Å; S174-Q365 WeakPolarHBondContact CB-O 3.44Å; S174-Q365 PolarHBondContact O-NE2 2.86Å; S174-Q365 PolarHBondContact OG-NE2 3.06Å; F175-Q365 HydrophobicContact CE1-CG 4.32Å; F175-Q365 HydrophobicContact CE2-CG 4Å; F175-Q365 HydrophobicContact CZ-CG 3.68Å; T363-Q365 PolarHBondContact O-N 2.92Å; Q365-L367 VanDerWaalsContact C-N 3.28Å; Q365-L367 PolarHBondContact O-N 3.22Å; Q365-S368 WeakPolarHBondContact O-CB 3.4Å; Q365-S368 PolarHBondContact O-N 3.34Å; Q365-S368 PolarHBondContact O-OG 2.96Å
366	E	97.8	Very high	97.4	Very high	2 Å²	2	52.4 Å²	52.4	1%	0.009	32%	0.318	C	S	.	.	H	α-helix	trans	-62	-36.4	176.6	-74.7	170	80.3	0	0	112.5	H106 R167 Y171 F362 T363 S368	H106-E366 IonicContact CD2-OE1 2.92Å; H106-E366 IonicContact CD2-OE2 3.25Å; H106-E366 IonicContact NE2-OE1 2.65Å; H106-E366 PolarHBondContact NE2-OE1 3.41Å; H106-E366 VanDerWaalsContact NE2-OE1 3.16Å; H106-E366 IonicContact NE2-OE2 3.38Å; R167-E366 IonicContact CZ-OE1 2.64Å; R167-E366 VanDerWaalsContact CZ-OE1 3.29Å; R167-E366 IonicContact NE-OE1 3.02Å; R167-E366 PolarHBondContact NE-OE1 3.31Å; R167-E366 IonicContact NH2-OE1 2.67Å; R167-E366 PolarHBondContact NH2-OE1 3.33Å; R167-E366 IonicContact NH2-OE2 3.01Å; R167-E366 PolarHBondContact NH2-OE2 3.25Å; Y171-E366 HydrophobicContact CD2-CG 3.85Å; F362-E366 WeakPolarHBondContact CA-OE2 3.34Å; F362-E366 HydrophobicContact CD1-CB 4.07Å; F362-E366 WeakPolarHBondContact CD1-OE1 3.34Å; T363-E366 PolarHBondContact N-OE2 2.96Å; T363-E366 PolarHBondContact O-N 2.56Å; T363-E366 VanDerWaalsContact O-N 3.17Å; T363-E366 WeakPolarHBondContact OG1-CG 3.36Å; T363-E366 PolarHBondContact OG1-N 2.92Å; T363-E366 PolarHBondContact OG1-OE2 3.48Å; T363-E366 VanDerWaalsContact OG1-OE2 3.07Å; E366-S368 VanDerWaalsContact C-N 3.33Å
367	L	98.3	Very high	97.6	Very high	21 Å²	21	50.4 Å²	50.4	11%	0.11	31%	0.309	C	S	.	.	H	α-helix	trans	-84.5	-6.1	-178	-65.2	169.9	0	0	0	113.5	L332 F362 T363 T364 Q365 S369 N370 P371 A374 L377 I378	L332-L367 HydrophobicContact CD1-CD2 4.26Å; L332-L367 HydrophobicContact CD2-CD2 4.25Å; F362-L367 HydrophobicContact CB-CD1 3.94Å; F362-L367 HydrophobicContact CB-CD2 4.18Å; F362-L367 HydrophobicContact CB-CG 3.96Å; F362-L367 HydrophobicContact CD1-CD2 4.11Å; F362-L367 HydrophobicContact CD1-CG 4.49Å; F362-L367 HydrophobicContact CG-CD2 4.23Å; F362-L367 HydrophobicContact CG-CG 4.5Å; T363-L367 PolarHBondContact O-N 3.49Å; T363-L367 VanDerWaalsContact O-N 3.16Å; T364-L367 PolarHBondContact O-N 3.32Å; Q365-L367 VanDerWaalsContact C-N 3.28Å; Q365-L367 PolarHBondContact O-N 3.22Å; L367-S369 PolarHBondContact O-N 3.15Å; L367-S369 VanDerWaalsContact O-N 3.11Å; L367-N370 CarbonylContact O-C 3.58Å; L367-N370 PolarHBondContact O-N 2.94Å; L367-P371 WeakPolarHBondContact O-CA 3.48Å; L367-P371 WeakPolarHBondContact O-CD 3.36Å; L367-P371 VanDerWaalsContact O-N 3.09Å; L367-A374 HydrophobicContact CD1-CB 4Å; L367-A374 HydrophobicContact CD2-CB 4.32Å; L367-L377 HydrophobicContact CD2-CD1 3.76Å; L367-I378 HydrophobicContact CD1-CD1 4.49Å
368	S	97.6	Very high	97.7	Very high	61 Å²	61	51.1 Å²	51.1	43%	0.427	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-29.2	-170.4	60.6	0	0	0	0	114.7	T364 Q365 E366	T364-S368 PolarHBondContact O-N 2.94Å; T364-S368 VanDerWaalsContact O-N 3.07Å; Q365-S368 WeakPolarHBondContact O-CB 3.4Å; Q365-S368 PolarHBondContact O-N 3.34Å; Q365-S368 PolarHBondContact O-OG 2.96Å; E366-S368 VanDerWaalsContact C-N 3.33Å
369	S	95.9	Very high	97.7	Very high	80 Å²	80	48.9 Å²	48.9	56%	0.559	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-31.5	178.7	61.6	0	0	0	0	113.4	L332 L367	L332-S369 WeakPolarHBondContact CD2-OG 3.41Å; L367-S369 PolarHBondContact O-N 3.15Å; L367-S369 VanDerWaalsContact O-N 3.11Å
370	N	97.8	Very high	97.6	Very high	47 Å²	47	52 Å²	52	25%	0.251	32%	0.322	S	S	.	.			trans	-158.2	86.5	175.4	-170.2	-14.8	0	0	0	111.2	L332 L367 S372 L373	L332-N370 HydrophobicContact CD2-CB 4.37Å; L367-N370 CarbonylContact O-C 3.58Å; L367-N370 PolarHBondContact O-N 2.94Å; N370-S372 PolarHBondContact O-N 2.89Å; N370-S372 VanDerWaalsContact O-N 3.16Å; N370-S372 PolarHBondContact OD1-N 3.18Å; N370-S372 PolarHBondContact OD1-OG 3.14Å; N370-L373 HydrophobicContact CB-CD1 3.93Å; N370-L373 HydrophobicContact CB-CG 4.12Å; N370-L373 PolarHBondContact O-N 3.33Å
371	P	97.9	Very high	97.4	Very high	88 Å²	88	53.3 Å²	53.3	57%	0.571	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-60.7	-26.4	-177.7	-26.5	35.6	0	0	0	114.3	L367 L373 A374	L367-P371 WeakPolarHBondContact O-CA 3.48Å; L367-P371 WeakPolarHBondContact O-CD 3.36Å; L367-P371 VanDerWaalsContact O-N 3.09Å; P371-L373 PolarHBondContact O-N 2.97Å; P371-A374 VanDerWaalsContact O-CB 3.29Å; P371-A374 WeakPolarHBondContact O-CB 3.49Å; P371-A374 PolarHBondContact O-N 3.4Å; P371-A374 VanDerWaalsContact O-N 3.16Å
372	S	98.2	Very high	97.2	Very high	82 Å²	82	50.3 Å²	50.3	57%	0.573	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-63.8	-25.8	-178.8	75.1	0	0	0	0	113.1	N370 A374 S375	N370-S372 PolarHBondContact O-N 2.89Å; N370-S372 VanDerWaalsContact O-N 3.16Å; N370-S372 PolarHBondContact OD1-N 3.18Å; N370-S372 PolarHBondContact OD1-OG 3.14Å; S372-A374 PolarHBondContact O-N 3.11Å; S372-S375 PolarHBondContact O-N 2.84Å; S372-S375 PolarHBondContact O-OG 3.16Å
373	L	98.3	Very high	96.7	Very high	21 Å²	21	54.8 Å²	54.8	11%	0.11	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-67.9	-15.2	178.3	-67.4	178.9	0	0	0	113.2	L332 E333 A336 N370 P371 S375 I376 L377	L332-L373 HydrophobicContact CB-CD1 4.27Å; L332-L373 HydrophobicContact CD2-CD1 4.17Å; L332-L373 HydrophobicContact CG-CD1 3.93Å; E333-L373 HydrophobicContact CG-CD1 3.9Å; A336-L373 HydrophobicContact CB-CD2 4.1Å; N370-L373 HydrophobicContact CB-CD1 3.93Å; N370-L373 HydrophobicContact CB-CG 4.12Å; N370-L373 PolarHBondContact O-N 3.33Å; P371-L373 PolarHBondContact O-N 2.97Å; L373-S375 PolarHBondContact O-N 3.32Å; L373-S375 VanDerWaalsContact O-N 3.11Å; L373-I376 HydrophobicContact CD2-CD1 4.37Å; L373-I376 PolarHBondContact O-N 3.23Å; L373-L377 HydrophobicContact CB-CD1 3.81Å; L373-L377 HydrophobicContact CB-CG 4.27Å; L373-L377 WeakPolarHBondContact O-CB 3.11Å; L373-L377 VanDerWaalsContact O-CG 3.28Å; L373-L377 WeakPolarHBondContact O-CG 3.19Å; L373-L377 PolarHBondContact O-N 3.08Å
374	A	97.6	Very high	95.8	Very high	24 Å²	24	57.1 Å²	57.1	20%	0.198	34%	0.341	C	S	.	.	H	α-helix	trans	-54.7	-30.5	173.4	0	0	0	0	0	112.6	L367 P371 S372 I376 I378	L367-A374 HydrophobicContact CD1-CB 4Å; L367-A374 HydrophobicContact CD2-CB 4.32Å; P371-A374 VanDerWaalsContact O-CB 3.29Å; P371-A374 WeakPolarHBondContact O-CB 3.49Å; P371-A374 PolarHBondContact O-N 3.4Å; P371-A374 VanDerWaalsContact O-N 3.16Å; S372-A374 PolarHBondContact O-N 3.11Å; A374-I376 PolarHBondContact O-N 3.2Å; A374-I378 HydrophobicContact CB-CD1 4.33Å; A374-I378 WeakPolarHBondContact O-CB 3.39Å; A374-I378 PolarHBondContact O-N 2.94Å
375	S	97.1	Very high	94.5	Very high	82 Å²	82	57.8 Å²	57.8	57%	0.573	34%	0.335	S	S	*	.	H	α-helix	trans	-60	-32	176.4	61.6	0	0	0	0	113.4	S372 L373 R383	S372-S375 PolarHBondContact O-N 2.84Å; S372-S375 PolarHBondContact O-OG 3.16Å; L373-S375 PolarHBondContact O-N 3.32Å; L373-S375 VanDerWaalsContact O-N 3.11Å; S375-R383 PolarHBondContact O-NH2 3.36Å
376	I	98.2	Very high	92.7	Very high	77 Å²	77	57 Å²	57	40%	0.395	34%	0.341	S	S	.	.	H	α-helix	trans	-94.9	-44.5	178.3	-59.4	170.7	0	0	0	110.7	A336 R344 L373 A374 I378	A336-I376 HydrophobicContact CB-CB 4.46Å; A336-I376 HydrophobicContact CB-CG2 4.04Å; R344-I376 WeakPolarHBondContact CD-O 3.32Å; L373-I376 HydrophobicContact CD2-CD1 4.37Å; L373-I376 PolarHBondContact O-N 3.23Å; A374-I376 PolarHBondContact O-N 3.2Å; I376-I378 PolarHBondContact O-N 2.94Å
377	L	98.1	Very high	91	Very high	0 Å²	0	62 Å²	62	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-69.1	-32.5	-172.6	-67.7	171.7	0	0	0	113.4	L332 C335 A336 F360 F362 L367 L373 P379	L332-L377 HydrophobicContact CD1-CD1 3.42Å; L332-L377 VanDerWaalsContact CD1-CD1 3.42Å; L332-L377 HydrophobicContact CD2-CD1 4.44Å; L332-L377 HydrophobicContact CG-CD1 3.78Å; C335-L377 HydrophobicContact CB-CD2 3.49Å; C335-L377 VanDerWaalsContact CB-CD2 3.49Å; A336-L377 HydrophobicContact CB-CD2 4.01Å; A336-L377 HydrophobicContact CB-CG 4.43Å; F360-L377 VanDerWaalsContact CD1-O 3.27Å; F360-L377 WeakPolarHBondContact CD1-O 3.37Å; F362-L377 HydrophobicContact CD2-CB 4.26Å; F362-L377 HydrophobicContact CE1-CD1 4.21Å; F362-L377 HydrophobicContact CE2-CB 3.82Å; F362-L377 HydrophobicContact CZ-CB 4.11Å; F362-L377 HydrophobicContact CZ-CD1 4.2Å; F362-L377 HydrophobicContact CZ-CD2 4.08Å; F362-L377 HydrophobicContact CZ-CG 4.37Å; L367-L377 HydrophobicContact CD2-CD1 3.76Å; L373-L377 HydrophobicContact CB-CD1 3.81Å; L373-L377 HydrophobicContact CB-CG 4.27Å; L373-L377 WeakPolarHBondContact O-CB 3.11Å; L373-L377 VanDerWaalsContact O-CG 3.28Å; L373-L377 WeakPolarHBondContact O-CG 3.19Å; L373-L377 PolarHBondContact O-N 3.08Å; L377-P379 WeakPolarHBondContact O-CD 3.45Å
378	I	98	Very high	88.7	Confident	34 Å²	34	65.2 Å²	65.2	17%	0.174	40%	0.401	C	S	.	.	S	Bend	trans	-109.1	95.5	-178.7	-50.7	176.3	0	0	0	108.4	F362 L367 A374 I376 A382 R383	F362-I378 HydrophobicContact CB-CD1 4.4Å; F362-I378 HydrophobicContact CD2-CG1 4.06Å; L367-I378 HydrophobicContact CD1-CD1 4.49Å; A374-I378 HydrophobicContact CB-CD1 4.33Å; A374-I378 WeakPolarHBondContact O-CB 3.39Å; A374-I378 PolarHBondContact O-N 2.94Å; I376-I378 PolarHBondContact O-N 2.94Å; I378-A382 HydrophobicContact CG2-CB 4.27Å; I378-R383 HydrophobicContact CG2-CG 3.68Å; I378-R383 PolarHBondContact O-NE 3.18Å; I378-R383 VanDerWaalsContact O-NE 3.09Å; I378-R383 PolarHBondContact O-NH2 3.49Å
379	P	96.6	Very high	86.5	Confident	19 Å²	19	66.7 Å²	66.7	12%	0.123	41%	0.411	C	S	.	.			trans	-67.2	157.8	-178.6	28.8	-35.2	0	0	0	111.6	R344 F360 L377 H381 A382 R383	R344-P379 HydrophobicContact CB-CB 4.38Å; R344-P379 HydrophobicContact CB-CG 4.4Å; R344-P379 HydrophobicContact CG-CG 4.48Å; F360-P379 HydrophobicContact CD1-CG 4.37Å; F360-P379 HydrophobicContact CD2-CG 3.84Å; F360-P379 HydrophobicContact CE1-CG 4.27Å; F360-P379 HydrophobicContact CE2-CG 3.67Å; F360-P379 HydrophobicContact CG-CG 4.17Å; F360-P379 HydrophobicContact CZ-CG 3.92Å; L377-P379 WeakPolarHBondContact O-CD 3.45Å; P379-H381 VanDerWaalsContact C-N 3.29Å; P379-H381 WeakPolarHBondContact CG-CE1 3.46Å; P379-H381 PolarHBondContact O-N 2.87Å; P379-A382 HydrophobicContact CG-CB 4.03Å; P379-A382 WeakPolarHBondContact O-CB 3.45Å; P379-A382 PolarHBondContact O-N 3.41Å; P379-R383 PolarHBondContact O-N 3.44Å
380	A	95.1	Very high	83.7	Confident	69 Å²	69	67.1 Å²	67.1	57%	0.57	41%	0.411	S	S	*	.	H	α-helix	trans	-53.9	-41.7	-173.5	0	0	0	0	0	113.5	A382 R383 N384	A380-A382 VanDerWaalsContact C-N 3.27Å; A380-A382 PolarHBondContact O-N 3.49Å; A380-R383 PolarHBondContact O-N 2.82Å; A380-N384 PolarHBondContact O-N 2.91Å
381	H	94.1	Very high	80.8	Confident	47 Å²	47	70.2 Å²	70.2	22%	0.218	43%	0.433	C	S	.	.	H	α-helix	trans	-64	-30.4	179.5	66.9	-100.8	0	0	0	113.2	R344 P346 F360 P379 Q385	R344-H381 PolarHBondContact O-CE1 3.07Å; P346-H381 HydrophobicContact CB-CB 4.44Å; F360-H381 AromaticContact CE2-NE2 3.71Å; P379-H381 VanDerWaalsContact C-N 3.29Å; P379-H381 WeakPolarHBondContact CG-CE1 3.46Å; P379-H381 PolarHBondContact O-N 2.87Å; H381-Q385 PolarHBondContact O-N 2.99Å
382	A	93.3	Very high	78	Confident	15 Å²	15	72.4 Å²	72.4	12%	0.124	45%	0.445	C	S	.	.	H	α-helix	trans	-76.1	-31.4	178.5	0	0	0	0	0	112.1	F360 I378 P379 A380 Q385 A386	F360-A382 HydrophobicContact CB-CB 3.93Å; F360-A382 HydrophobicContact CD2-CB 3.73Å; F360-A382 HydrophobicContact CG-CB 4.18Å; I378-A382 HydrophobicContact CG2-CB 4.27Å; P379-A382 HydrophobicContact CG-CB 4.03Å; P379-A382 WeakPolarHBondContact O-CB 3.45Å; P379-A382 PolarHBondContact O-N 3.41Å; A380-A382 VanDerWaalsContact C-N 3.27Å; A380-A382 PolarHBondContact O-N 3.49Å; A382-Q385 PolarHBondContact O-N 3.27Å; A382-A386 PolarHBondContact O-N 3.24Å
383	R	88.4	Confident	75.3	Confident	116 Å²	116	76.3 Å²	76.3	44%	0.438	46%	0.46	S	S	.	.	H	α-helix	trans	-64.6	-42.2	175.2	-60.3	-176.8	-166.1	160	7.4	111.2	S375 I378 P379 A380 Q385 A386 V387	S375-R383 PolarHBondContact O-NH2 3.36Å; I378-R383 HydrophobicContact CG2-CG 3.68Å; I378-R383 PolarHBondContact O-NE 3.18Å; I378-R383 VanDerWaalsContact O-NE 3.09Å; I378-R383 PolarHBondContact O-NH2 3.49Å; P379-R383 PolarHBondContact O-N 3.44Å; A380-R383 PolarHBondContact O-N 2.82Å; R383-Q385 VanDerWaalsContact C-N 3.35Å; R383-Q385 PolarHBondContact O-N 2.92Å; R383-A386 PolarHBondContact O-N 3.21Å; R383-V387 WeakPolarHBondContact O-CG2 3.25Å; R383-V387 PolarHBondContact O-N 2.94Å
384	N	77.7	Confident	72.4	Confident	115 Å²	115	79.4 Å²	79.4	62%	0.615	49%	0.488	S	S	*	.	H	α-helix	trans	-67.7	-34.7	-179	-64.5	-11.6	0	0	0	112.3	A380 A388	A380-N384 PolarHBondContact O-N 2.91Å; N384-A388 WeakPolarHBondContact O-CB 3.47Å; N384-A388 PolarHBondContact O-N 3.33Å; N384-A388 VanDerWaalsContact O-N 3.11Å
385	Q	70.4	Confident	69.3	Low	140 Å²	140	83.5 Å²	83.5	65%	0.654	52%	0.515	S	S	*	.	H	α-helix	trans	-66.4	-39.4	175.1	-74.4	-179.1	2.7	0	0	112.4	H381 A382 R383 V387 A388 S389	H381-Q385 PolarHBondContact O-N 2.99Å; A382-Q385 PolarHBondContact O-N 3.27Å; R383-Q385 VanDerWaalsContact C-N 3.35Å; R383-Q385 PolarHBondContact O-N 2.92Å; Q385-V387 PolarHBondContact O-N 3.16Å; Q385-A388 PolarHBondContact O-N 3.03Å; Q385-S389 PolarHBondContact O-N 3.1Å; Q385-S389 PolarHBondContact O-OG 3.41Å
386	A	61.6	Low	66.3	Low	56 Å²	56	83.6 Å²	83.6	46%	0.463	52%	0.521	S	S	.	.	H	α-helix	trans	-63.5	-41.3	177.5	0	0	0	0	0	112.2	A382 R383 S389 T390	A382-A386 PolarHBondContact O-N 3.24Å; R383-A386 PolarHBondContact O-N 3.21Å; A386-S389 WeakPolarHBondContact CA-OG 3.31Å; A386-S389 PolarHBondContact O-N 2.98Å; A386-S389 PolarHBondContact O-OG 3.48Å; A386-T390 PolarHBondContact O-OG1 2.62Å; A386-T390 VanDerWaalsContact O-OG1 3.13Å
387	V	60.2	Low	63.2	Low	108 Å²	108	86.2 Å²	86.2	66%	0.655	54%	0.541	S	S	*	.	H	α-helix	trans	-65.2	-42.6	176.6	178.8	0	0	0	0	111	R383 Q385 S389 T390	R383-V387 WeakPolarHBondContact O-CG2 3.25Å; R383-V387 PolarHBondContact O-N 2.94Å; Q385-V387 PolarHBondContact O-N 3.16Å; V387-S389 VanDerWaalsContact C-N 3.32Å; V387-S389 PolarHBondContact O-N 2.95Å; V387-T390 PolarHBondContact O-N 3.4Å; V387-T390 PolarHBondContact O-OG1 3.05Å
388	A	51.9	Low	60	Low	88 Å²	88	92.5 Å²	92.5	73%	0.727	58%	0.58	S	S	*	*	H	α-helix	trans	-68.5	-26.7	178.6	0	0	0	0	0	114	N384 Q385 T390	N384-A388 WeakPolarHBondContact O-CB 3.47Å; N384-A388 PolarHBondContact O-N 3.33Å; N384-A388 VanDerWaalsContact O-N 3.11Å; Q385-A388 PolarHBondContact O-N 3.03Å; A388-T390 VanDerWaalsContact C-N 3.32Å
389	S	51.1	Low	56.9	Low	92 Å²	92	98.9 Å²	98.9	64%	0.643	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	-2.8	177.1	59.5	0	0	0	0	114.8	Q385 A386 V387	Q385-S389 PolarHBondContact O-N 3.1Å; Q385-S389 PolarHBondContact O-OG 3.41Å; A386-S389 WeakPolarHBondContact CA-OG 3.31Å; A386-S389 PolarHBondContact O-N 2.98Å; A386-S389 PolarHBondContact O-OG 3.48Å; V387-S389 VanDerWaalsContact C-N 3.32Å; V387-S389 PolarHBondContact O-N 2.95Å
390	T	36.4	Very low	53.8	Low	90 Å²	90	101.9 Å²	101.9	55%	0.552	65%	0.648	S	S	*	*	S	Bend	trans	-82.1	120.9	175.5	-44.5	0	0	0	0	108.1	A386 V387 A388 T392	A386-T390 PolarHBondContact O-OG1 2.62Å; A386-T390 VanDerWaalsContact O-OG1 3.13Å; V387-T390 PolarHBondContact O-N 3.4Å; V387-T390 PolarHBondContact O-OG1 3.05Å; A388-T390 VanDerWaalsContact C-N 3.32Å; T390-T392 PolarHBondContact O-N 3.35Å
391	P	37.3	Very low	50.7	Low	111 Å²	111	103.8 Å²	103.8	72%	0.721	66%	0.658	S	S	*	*			trans	-63.5	115	176.8	-1.9	12.3	0	0	0	108.4	N393	P391-N393 VanDerWaalsContact C-N 3.3Å; P391-N393 PolarHBondContact O-N 2.86Å
392	T	39.4	Very low	47.8	Very low	134 Å²	134	107.4 Å²	107.4	82%	0.822	69%	0.688	S	S	*	*			trans	-66.9	92.2	165.9	32.3	0	0	0	0	108.2	T390 A394	T390-T392 PolarHBondContact O-N 3.35Å; T392-A394 PolarHBondContact O-N 3.26Å
393	N	40.7	Very low	45	Very low	165 Å²	165	113 Å²	113	88%	0.882	72%	0.721	S	S	*	*			trans	-67.7	83.2	156.8	-97.8	0.1	0	0	0	107.8	P391	P391-N393 VanDerWaalsContact C-N 3.3Å; P391-N393 PolarHBondContact O-N 2.86Å
394	A	36.9	Very low	42.4	Very low	85 Å²	85	116.3 Å²	116.3	70%	0.702	74%	0.741	S	S	*	*			trans	-125.5	71.6	163.6	0	0	0	0	0	107.7	T392 A396	T392-A394 PolarHBondContact O-N 3.26Å; A394-A396 VanDerWaalsContact C-N 3.27Å; A394-A396 PolarHBondContact O-N 2.86Å; A394-A396 VanDerWaalsContact O-N 3.12Å
395	S	33.3	Very low	40.3	Very low	110 Å²	110	123 Å²	123	77%	0.769	76%	0.758	S	S	*	*			trans	-72.8	90.4	156.3	52.3	0	0	0	0	107.3	T397	S395-T397 PolarHBondContact O-N 2.64Å
396	A	34.6	Very low	38.4	Very low	85 Å²	85	119.8 Å²	119.8	70%	0.702	76%	0.762	S	S	*	*			trans	-68.8	107.4	162.3	0	0	0	0	0	107.7	A394 T398	A394-A396 VanDerWaalsContact C-N 3.27Å; A394-A396 PolarHBondContact O-N 2.86Å; A394-A396 VanDerWaalsContact O-N 3.12Å; A396-T398 PolarHBondContact O-N 2.66Å; A396-T398 VanDerWaalsContact O-N 3.13Å
397	T	32.7	Very low	37.5	Very low	131 Å²	131	123.4 Å²	123.4	80%	0.804	78%	0.781	S	S	*	*			trans	-66.2	99.3	163.1	41.7	0	0	0	0	108.7	S395	S395-T397 PolarHBondContact O-N 2.64Å
398	T	31.4	Very low	36.1	Very low	133 Å²	133	125.6 Å²	125.6	82%	0.816	79%	0.789	S	S	*	*			trans	-95	90.4	157.9	40.8	0	0	0	0	108.2	A396	A396-T398 PolarHBondContact O-N 2.66Å; A396-T398 VanDerWaalsContact O-N 3.13Å
399	D	32.5	Very low	35.2	Very low	168 Å²	168	128.2 Å²	128.2	90%	0.898	79%	0.79	S	S	*	*			trans	-90.2	118.2	159.2	-92.5	-24.9	0	0	0	108
400	G	30.1	Very low	34.2	Very low	81 Å²	81	129.6 Å²	129.6	84%	0.835	79%	0.794	S	S	*	*			trans	-168.9	64.2	-179.1	0	0	0	0	0	110.9
401	S	31.4	Very low	34	Very low	110 Å²	110	131 Å²	131	77%	0.769	80%	0.803	S	S	*	*			trans	-130.5	91.9	173.5	156.8	0	0	0	0	108.7
402	S	32.1	Very low	33.7	Very low	123 Å²	123	130.3 Å²	130.3	86%	0.86	81%	0.807	S	S	*	*			trans	-101.2	107.8	167.1	54.7	0	0	0	0	109.4
403	T	35.2	Very low	33.4	Very low	133 Å²	133	129 Å²	129	82%	0.816	80%	0.802	S	S	*	*			trans	-88.7	125.8	167.9	29.9	0	0	0	0	110.2
404	E	33.1	Very low	33.2	Very low	184 Å²	184	125.7 Å²	125.7	86%	0.86	80%	0.798	S	S	*	*			trans	-70.3	137.7	168.3	-67.2	-178.2	142	0	0	111.6
405	R	33.9	Very low	33.1	Very low	256 Å²	256	126.7 Å²	126.7	97%	0.966	80%	0.8	S	S	*	*				166	124.7	125.2	-94.3	179.7	-180	-154.5	0.5	111.3
406	G	30.2	Very low	33.3	Very low	72 Å²	72	126 Å²	126	74%	0.742	80%	0.802	S	S	*	*			trans	167.8	129.3	163.9	0	0	0	0	0	111.9
407	P	43.4	Very low	33.5	Very low	133 Å²	133	127.2 Å²	127.2	86%	0.864	80%	0.804	S	S	*	*			trans	-94.9	164.9	-151.5	37	-35.4	0	0	0	116.4
408	N	30.9	Very low	33.7	Very low	153 Å²	153	128.3 Å²	128.3	82%	0.818	81%	0.805	S	S	*	*			trans	-28.8	147.8	168.4	-74.4	-27	0	0	0	116.9
409	I	32.6	Very low	34.1	Very low	144 Å²	144	126.2 Å²	126.2	74%	0.738	80%	0.796	S	S	*	*				168.9	126.9	107.8	-87.3	174.1	0	0	0	110.9
410	T	30.6	Very low	34.8	Very low	120 Å²	120	125 Å²	125	74%	0.736	80%	0.795	S	S	*	*			trans	62.2	144.2	154.5	58.3	0	0	0	0	119
411	T	30.8	Very low	35.6	Very low	121 Å²	121	130.2 Å²	130.2	74%	0.742	82%	0.819	S	S	*	*			cis	-176.1	152.2	9.7	15.8	0	0	0	0	107.5
412	A	32.7	Very low	35.8	Very low	96 Å²	96	131.3 Å²	131.3	79%	0.793	82%	0.821	S	S	*	*			trans	63.4	143.4	150.7	0	0	0	0	0	117.6
413	S	32.9	Very low	36	Very low	105 Å²	105	131.7 Å²	131.7	73%	0.734	82%	0.819	S	S	*	*			cis	-179.3	151.5	5.5	39	0	0	0	0	107.4
414	A	35.7	Very low	36	Very low	96 Å²	96	131.6 Å²	131.6	79%	0.793	82%	0.82	S	S	*	*			trans	66.2	147.9	149.8	0	0	0	0	0	118.4
415	S	35.1	Very low	36.2	Very low	106 Å²	106	128.5 Å²	128.5	74%	0.741	82%	0.817	S	S	*	*			cis	-178.9	142.3	-19.9	47.3	0	0	0	0	105.7
416	A	37.3	Very low	36.3	Very low	97 Å²	97	120.6 Å²	120.6	80%	0.802	81%	0.808	S	S	*	*			trans	56.5	102.4	146.3	0	0	0	0	0	119.6
417	S	39.4	Very low	36.8	Very low	109 Å²	109	123.8 Å²	123.8	76%	0.762	81%	0.812	S	S	*	*			trans	-67.7	141.9	139.9	52.1	0	0	0	0	111.7
418	N	37.2	Very low	36.3	Very low	154 Å²	154	123.1 Å²	123.1	82%	0.824	81%	0.809	S	S	*	*			trans	-179	147.3	145.5	-98	-4.2	0	0	0	106.3
419	S	39	Very low	36.7	Very low	89 Å²	89	120.8 Å²	120.8	62%	0.622	81%	0.808	S	S	*	*			cis	165.6	133.7	-8.7	48.8	0	0	0	0	102.7
420	T	47.5	Very low	37	Very low	144 Å²	144	118.9 Å²	118.9	88%	0.883	81%	0.814	S	S	*	*			trans	175	129.3	155.3	33.3	0	0	0	0	105.2
421	S	46.3	Very low	37.6	Very low	190 Å²	190	118.8 Å²	118.8	100%	1.329	82%	0.821	S	S	*	*			cis	-168.8	0	7.9	35.3	0	0	0	0	107.4

Retrieved 421 of 421 residues in 115.9 ms (Link to these results)

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