A0A5K4F313_SCHMA Loading...

Serine incorporator

AlphaFold DB , UniProt , Accession A0A5K4F313, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 450 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	44.5	Very low	54.7	Low	199 Å²	199	53.9 Å²	53.9	98%	0.98	33%	0.33	S	S	*	.				0	-35.3	0	-69.6	-139.2	-116.5	0	0	114.1	C3 I4	M1-C3 VanDerWaalsContact C-N 3.33Å; M1-C3 PolarHBondContact O-N 3.44Å; M1-I4 WeakPolarHBondContact O-CB 3.47Å; M1-I4 PolarHBondContact O-N 2.64Å
2	G	55.3	Low	54.3	Low	26 Å²	26	62.1 Å²	62.1	27%	0.268	36%	0.358	S	S	.	.	H	α-helix	trans	-59.6	-32.3	-178.3	0	0	0	0	0	116.4	I4 V5 S6	G2-I4 PolarHBondContact O-N 3.07Å; G2-V5 PolarHBondContact O-N 3.41Å; G2-S6 WeakPolarHBondContact O-CB 3.42Å; G2-S6 PolarHBondContact O-N 3.35Å
3	C	53.6	Low	53.6	Low	28 Å²	28	62.5 Å²	62.5	19%	0.189	37%	0.365	C	S	.	.	H	α-helix	trans	-61.7	-29.2	173.5	-77.2	0	0	0	0	113.3	M1 S7 C27	M1-C3 VanDerWaalsContact C-N 3.33Å; M1-C3 PolarHBondContact O-N 3.44Å; C3-S7 VanDerWaalsContact O-CB 3.27Å; C3-S7 WeakPolarHBondContact O-CB 3.22Å; C3-S7 PolarHBondContact O-N 3.34Å; C3-S7 PolarHBondContact O-OG 2.78Å; C3-C27 HydrophobicContact CB-CB 4.23Å; C3-C27 WeakPolarHBondContact CB-SG 3.46Å; C3-C27 WeakPolarHBondContact SG-CB 3.47Å; C3-C27 CovalentContact SG-SG 2.06Å; C3-C27 PolarHBondContact SG-SG 2.89Å
4	I	57.2	Low	53.5	Low	52 Å²	52	62.1 Å²	62.1	27%	0.267	37%	0.368	S	S	.	.	H	α-helix	trans	-69.1	-53	-179.7	-56.9	-169.4	0	0	0	109.4	M1 G2 S6 S7 V8 M35	M1-I4 WeakPolarHBondContact O-CB 3.47Å; M1-I4 PolarHBondContact O-N 2.64Å; G2-I4 PolarHBondContact O-N 3.07Å; I4-S6 VanDerWaalsContact C-N 3.28Å; I4-S6 PolarHBondContact O-N 3.24Å; I4-S7 PolarHBondContact O-N 3.06Å; I4-V8 WeakPolarHBondContact O-CB 3.34Å; I4-V8 VanDerWaalsContact O-CG2 3.3Å; I4-V8 WeakPolarHBondContact O-CG2 3.11Å; I4-V8 PolarHBondContact O-N 3.34Å; I4-M35 HydrophobicContact CB-CE 3.73Å; I4-M35 HydrophobicContact CB-SD 4.5Å; I4-M35 HydrophobicContact CD1-CE 3.97Å; I4-M35 HydrophobicContact CG1-CE 3.46Å; I4-M35 VanDerWaalsContact CG1-CE 3.46Å; I4-M35 HydrophobicContact CG1-SD 3.85Å; I4-M35 HydrophobicContact CG2-CE 3.53Å
5	V	59.1	Low	53.1	Low	90 Å²	90	65.2 Å²	65.2	55%	0.545	39%	0.394	S	S	.	.	H	α-helix	trans	-60.5	-43.2	178.5	-179	0	0	0	0	110	G2 A9 L24	G2-V5 PolarHBondContact O-N 3.41Å; V5-A9 WeakPolarHBondContact O-CB 3.4Å; V5-A9 PolarHBondContact O-N 2.98Å; V5-L24 HydrophobicContact CB-CD2 4.14Å; V5-L24 HydrophobicContact CG1-CD2 3.97Å
6	S	56.1	Low	52.7	Low	4 Å²	4	64.1 Å²	64.1	3%	0.028	39%	0.394	C	S	.	.	H	α-helix	trans	-58.9	-53.2	174.5	154.6	0	0	0	0	112	G2 I4 V8 A9 C10 Q369	G2-S6 WeakPolarHBondContact O-CB 3.42Å; G2-S6 PolarHBondContact O-N 3.35Å; I4-S6 VanDerWaalsContact C-N 3.28Å; I4-S6 PolarHBondContact O-N 3.24Å; S6-V8 VanDerWaalsContact C-N 3.29Å; S6-V8 PolarHBondContact O-N 3.18Å; S6-A9 PolarHBondContact O-N 3.17Å; S6-C10 WeakPolarHBondContact O-CB 3.07Å; S6-C10 PolarHBondContact O-N 3.31Å; S6-C10 PolarHBondContact O-SG 3.31Å; S6-Q369 PolarHBondContact OG-NE2 2.91Å; S6-Q369 PolarHBondContact OG-OE1 2.86Å
7	S	57.2	Low	52.5	Low	3 Å²	3	61.1 Å²	61.1	2%	0.021	38%	0.377	C	S	.	.	H	α-helix	trans	-63.5	-38.4	-175.4	-56.5	0	0	0	0	111.3	C3 I4 C11	C3-S7 VanDerWaalsContact O-CB 3.27Å; C3-S7 WeakPolarHBondContact O-CB 3.22Å; C3-S7 PolarHBondContact O-N 3.34Å; C3-S7 PolarHBondContact O-OG 2.78Å; I4-S7 PolarHBondContact O-N 3.06Å; S7-C11 WeakPolarHBondContact O-CA 3.41Å; S7-C11 PolarHBondContact O-N 3.48Å; S7-C11 PolarHBondContact O-SG 3.32Å
8	V	58.5	Low	52.4	Low	86 Å²	86	60 Å²	60	52%	0.521	37%	0.372	S	S	.	.	H	α-helix	trans	-69.4	-45.5	176.8	175.2	0	0	0	0	111.8	I4 S6 C10 C11 I39	I4-V8 WeakPolarHBondContact O-CB 3.34Å; I4-V8 VanDerWaalsContact O-CG2 3.3Å; I4-V8 WeakPolarHBondContact O-CG2 3.11Å; I4-V8 PolarHBondContact O-N 3.34Å; S6-V8 VanDerWaalsContact C-N 3.29Å; S6-V8 PolarHBondContact O-N 3.18Å; V8-C10 VanDerWaalsContact C-N 3.27Å; V8-C10 PolarHBondContact O-N 3.4Å; V8-C11 WeakPolarHBondContact O-CB 3.36Å; V8-C11 PolarHBondContact O-N 3.05Å; V8-C11 PolarHBondContact O-SG 3.37Å; V8-I39 HydrophobicContact CG2-CD1 3.97Å
9	A	53.4	Low	52	Low	67 Å²	67	64.8 Å²	64.8	55%	0.554	39%	0.394	S	S	*	.	H	α-helix	trans	-67.4	-30.8	178.8	0	0	0	0	0	112.3	V5 S6 L24	V5-A9 WeakPolarHBondContact O-CB 3.4Å; V5-A9 PolarHBondContact O-N 2.98Å; S6-A9 PolarHBondContact O-N 3.17Å; A9-L24 HydrophobicContact CB-CD1 4.49Å
10	C	53.7	Low	52	Low	20 Å²	20	67.1 Å²	67.1	14%	0.135	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	8.6	-176.1	-63.8	0	0	0	0	113.7	S6 V8 F12 C13 A17	S6-C10 WeakPolarHBondContact O-CB 3.07Å; S6-C10 PolarHBondContact O-N 3.31Å; S6-C10 PolarHBondContact O-SG 3.31Å; V8-C10 VanDerWaalsContact C-N 3.27Å; V8-C10 PolarHBondContact O-N 3.4Å; C10-F12 PolarHBondContact O-N 2.75Å; C10-C13 PolarHBondContact O-N 3.13Å; C10-A17 HydrophobicContact CB-CB 3.47Å; C10-A17 VanDerWaalsContact CB-CB 3.47Å; C10-A17 VanDerWaalsContact SG-CB 3.54Å
11	C	53.2	Low	52.2	Low	18 Å²	18	64.5 Å²	64.5	12%	0.122	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.2	-13.4	-168.9	-101.1	0	0	0	0	116.2	S7 V8 M36	S7-C11 WeakPolarHBondContact O-CA 3.41Å; S7-C11 PolarHBondContact O-N 3.48Å; S7-C11 PolarHBondContact O-SG 3.32Å; V8-C11 WeakPolarHBondContact O-CB 3.36Å; V8-C11 PolarHBondContact O-N 3.05Å; V8-C11 PolarHBondContact O-SG 3.37Å; C11-M36 HydrophobicContact CB-CE 4.18Å; C11-M36 WeakPolarHBondContact O-CE 3.38Å
12	F	50.4	Low	52.7	Low	152 Å²	152	59.7 Å²	59.7	67%	0.667	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	-12.3	-174	-69.8	-75.4	0	0	0	116.2	C10	C10-F12 PolarHBondContact O-N 2.75Å
13	C	44.4	Very low	52.5	Low	67 Å²	67	64 Å²	64	45%	0.453	41%	0.407	S	S	.	.			trans	-167.2	107.4	175.5	-102.8	0	0	0	0	113	C10 S15 A16 A17	C10-C13 PolarHBondContact O-N 3.13Å; C13-S15 PolarHBondContact O-N 3.28Å; C13-A16 HydrophobicContact CB-CB 3.5Å; C13-A16 VanDerWaalsContact CB-CB 3.5Å; C13-A16 PolarHBondContact O-N 2.73Å; C13-A16 VanDerWaalsContact O-N 3.15Å; C13-A17 WeakPolarHBondContact O-CB 3.45Å; C13-A17 PolarHBondContact O-N 2.82Å
14	S	52.5	Low	52.6	Low	58 Å²	58	64 Å²	64	41%	0.406	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-16.4	170.6	-64.1	0	0	0	0	114.1	W130	S14-W130 PolarHBondContact OG-NE1 3.2Å
15	S	47.6	Very low	52.7	Low	108 Å²	108	64.6 Å²	64.6	76%	0.755	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	-19.7	178.2	-49.9	0	0	0	0	114.3	C13 S18	C13-S15 PolarHBondContact O-N 3.28Å; S15-S18 PolarHBondContact O-OG 3.32Å
16	A	46.8	Very low	52.9	Low	48 Å²	48	63.9 Å²	63.9	40%	0.397	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-19.3	176.6	0	0	0	0	0	112.2	C13 S18 L19	C13-A16 HydrophobicContact CB-CB 3.5Å; C13-A16 VanDerWaalsContact CB-CB 3.5Å; C13-A16 PolarHBondContact O-N 2.73Å; C13-A16 VanDerWaalsContact O-N 3.15Å; A16-S18 PolarHBondContact O-N 3.07Å; A16-L19 PolarHBondContact O-N 3.07Å
17	A	49.3	Very low	53.3	Low	13 Å²	13	63.8 Å²	63.8	11%	0.107	41%	0.411	C	S	.	.	H	α-helix	trans	-58.2	-26.4	174.2	0	0	0	0	0	113.9	C10 C13 L19 C20	C10-A17 HydrophobicContact CB-CB 3.47Å; C10-A17 VanDerWaalsContact CB-CB 3.47Å; C10-A17 VanDerWaalsContact SG-CB 3.54Å; C13-A17 WeakPolarHBondContact O-CB 3.45Å; C13-A17 PolarHBondContact O-N 2.82Å; A17-L19 PolarHBondContact O-N 3.24Å; A17-C20 PolarHBondContact O-N 3.37Å
18	S	50.1	Low	54	Low	41 Å²	41	68.3 Å²	68.3	29%	0.287	43%	0.427	S	S	.	.	H	α-helix	trans	-61.1	-28.1	174.8	60.4	0	0	0	0	112	S15 A16 G368	S15-S18 PolarHBondContact O-OG 3.32Å; A16-S18 PolarHBondContact O-N 3.07Å; S18-G368 WeakPolarHBondContact O-CA 3.49Å
19	L	45.6	Very low	54.9	Low	151 Å²	151	65.3 Å²	65.3	79%	0.791	41%	0.41	S	S	*	.	H	α-helix	trans	-84.1	-22.3	-177.6	-80.2	137.4	0	0	0	114.3	A16 A17	A16-L19 PolarHBondContact O-N 3.07Å; A17-L19 PolarHBondContact O-N 3.24Å
20	C	52.6	Low	56.1	Low	110 Å²	110	62.1 Å²	62.1	74%	0.743	38%	0.384	S	S	*	.	H	α-helix	trans	-104	-7.4	-172.6	-71.4	0	0	0	0	114.6	A17	A17-C20 PolarHBondContact O-N 3.37Å
21	C	54.9	Low	57.3	Low	14 Å²	14	62 Å²	62	10%	0.095	38%	0.383	C	S	.	.			trans	-141.8	42	-159.8	-74.4	0	0	0	0	114.3	C23 L24	C21-C23 PolarHBondContact O-N 2.61Å; C21-C23 VanDerWaalsContact O-N 3.13Å; C21-L24 HydrophobicContact CB-CB 4.35Å; C21-L24 HydrophobicContact CB-CD1 3.48Å; C21-L24 VanDerWaalsContact CB-CD1 3.48Å; C21-L24 HydrophobicContact CB-CG 4.38Å; C21-L24 PolarHBondContact O-N 3.46Å; C21-L24 VanDerWaalsContact O-N 3.07Å; C21-L24 WeakPolarHBondContact SG-CD1 3.33Å
22	S	54.5	Low	58.6	Low	97 Å²	97	61.9 Å²	61.9	68%	0.678	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-21.4	174.9	48.9	0	0	0	0	114.1	L24	S22-L24 VanDerWaalsContact C-N 3.32Å; S22-L24 PolarHBondContact O-N 2.9Å
23	C	52.8	Low	60.3	Low	117 Å²	117	54.7 Å²	54.7	79%	0.791	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-4.1	176.5	61	0	0	0	0	114.9	C21	C21-C23 PolarHBondContact O-N 2.61Å; C21-C23 VanDerWaalsContact O-N 3.13Å
24	L	55.7	Low	62.5	Low	27 Å²	27	51.6 Å²	51.6	14%	0.141	33%	0.33	C	S	.	.	S	Bend	trans	-99.9	139.2	-175	-77.5	156.8	0	0	0	111.6	V5 A9 C21 S22	V5-L24 HydrophobicContact CB-CD2 4.14Å; V5-L24 HydrophobicContact CG1-CD2 3.97Å; A9-L24 HydrophobicContact CB-CD1 4.49Å; C21-L24 HydrophobicContact CB-CB 4.35Å; C21-L24 HydrophobicContact CB-CD1 3.48Å; C21-L24 VanDerWaalsContact CB-CD1 3.48Å; C21-L24 HydrophobicContact CB-CG 4.38Å; C21-L24 PolarHBondContact O-N 3.46Å; C21-L24 VanDerWaalsContact O-N 3.07Å; C21-L24 WeakPolarHBondContact SG-CD1 3.33Å; S22-L24 VanDerWaalsContact C-N 3.32Å; S22-L24 PolarHBondContact O-N 2.9Å
25	P	58.9	Low	64.1	Low	66 Å²	66	49.1 Å²	49.1	43%	0.429	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-64.4	148.1	-175.1	24.4	-31.4	0	0	0	111.5	C27 Q369	P25-C27 PolarHBondContact O-N 3.27Å; P25-Q369 PolarHBondContact O-NE2 3.24Å
26	S	61.8	Low	66.1	Low	74 Å²	74	44.1 Å²	44.1	52%	0.517	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-53.8	133.8	172.7	55.3	0	0	0	0	110.9	K370	S26-K370 WeakPolarHBondContact CA-O 3.47Å; S26-K370 WeakPolarHBondContact CB-O 3.35Å
27	C	65	Low	68.3	Low	3 Å²	3	41.9 Å²	41.9	2%	0.02	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	142.5	178.2	-156.2	0	0	0	0	110.2	C3 P25 K370 V371	C3-C27 HydrophobicContact CB-CB 4.23Å; C3-C27 WeakPolarHBondContact CB-SG 3.46Å; C3-C27 WeakPolarHBondContact SG-CB 3.47Å; C3-C27 CovalentContact SG-SG 2.06Å; C3-C27 PolarHBondContact SG-SG 2.89Å; P25-C27 PolarHBondContact O-N 3.27Å; C27-K370 PolarHBondContact N-O 3.47Å; C27-V371 VanDerWaalsContact O-CA 3.32Å; C27-V371 WeakPolarHBondContact O-CA 3.29Å; C27-V371 WeakPolarHBondContact O-CG1 3.29Å
28	R	73.3	Confident	70.3	Confident	97 Å²	97	41.2 Å²	41.2	37%	0.366	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	138	173.6	-67	-179	-176.8	171.3	-3	109.5	S30 T31 S32 S335 W372 N374	R28-S30 PolarHBondContact O-N 2.97Å; R28-T31 PolarHBondContact O-N 3.42Å; R28-S32 PolarHBondContact O-N 3.05Å; R28-S335 PolarHBondContact NH1-OG 2.87Å; R28-W372 HydrophobicContact CG-CZ2 3.75Å; R28-N374 HydrophobicContact CG-CB 4.5Å
29	S	76.7	Confident	72.3	Confident	24 Å²	24	40 Å²	40	17%	0.168	24%	0.243	C	C	.	.	H	α-helix	trans	-55.9	-40.7	178.9	-163.5	0	0	0	0	111.8	T31 S32 S33 W372	S29-T31 VanDerWaalsContact C-N 3.34Å; S29-T31 PolarHBondContact O-N 3.43Å; S29-S32 PolarHBondContact O-N 3.46Å; S29-S33 PolarHBondContact O-N 3.38Å; S29-S33 PolarHBondContact O-OG 3.39Å; S29-W372 PolarHBondContact N-O 3.31Å; S29-W372 VanDerWaalsContact N-O 3.1Å
30	S	78.1	Confident	74.6	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.5	-34.4	177.1	75	0	0	0	0	114.1	R28 S33 R34 N374 E375	R28-S30 PolarHBondContact O-N 2.97Å; S30-S33 PolarHBondContact O-OG 3.3Å; S30-R34 VanDerWaalsContact O-CG 3.28Å; S30-R34 WeakPolarHBondContact O-CG 3.43Å; S30-R34 PolarHBondContact O-N 3.01Å; S30-R34 PolarHBondContact O-NE 3.27Å; S30-N374 WeakPolarHBondContact CB-OD1 3.49Å; S30-N374 PolarHBondContact OG-ND2 2.93Å; S30-N374 PolarHBondContact OG-OD1 3.46Å; S30-E375 WeakPolarHBondContact CB-OE1 3.33Å; S30-E375 WeakPolarHBondContact CB-OE2 3.5Å
31	T	79.4	Confident	76.7	Confident	18 Å²	18	27.6 Å²	27.6	11%	0.11	17%	0.17	C	C	.	.	H	α-helix	trans	-78.8	-40.7	177.6	-61.4	0	0	0	0	110.6	R28 S29 R34 M35	R28-T31 PolarHBondContact O-N 3.42Å; S29-T31 VanDerWaalsContact C-N 3.34Å; S29-T31 PolarHBondContact O-N 3.43Å; T31-R34 PolarHBondContact OG1-NH2 3.46Å; T31-M35 VanDerWaalsContact O-CB 3.3Å; T31-M35 WeakPolarHBondContact O-CB 3.23Å; T31-M35 PolarHBondContact O-N 3.44Å
32	S	81.3	Confident	78.5	Confident	15 Å²	15	28.7 Å²	28.7	11%	0.105	17%	0.174	C	C	.	.	H	α-helix	trans	-60.5	-46.6	176	-177.7	0	0	0	0	111.2	R28 S29 R34 M35 M36	R28-S32 PolarHBondContact O-N 3.05Å; S29-S32 PolarHBondContact O-N 3.46Å; S32-R34 PolarHBondContact O-N 3.13Å; S32-M35 WeakPolarHBondContact O-CB 3.45Å; S32-M35 PolarHBondContact O-N 3.39Å; S32-M36 VanDerWaalsContact O-CG 3.28Å; S32-M36 WeakPolarHBondContact O-CG 3.24Å; S32-M36 PolarHBondContact O-N 3.47Å
33	S	86.4	Confident	80.4	Confident	1 Å²	1	29.2 Å²	29.2	1%	0.007	16%	0.164	C	C	.	.	H	α-helix	trans	-64.2	-43.6	-179.3	63.7	0	0	0	0	113	S29 S30 M35 M36 F37 N127 W130	S29-S33 PolarHBondContact O-N 3.38Å; S29-S33 PolarHBondContact O-OG 3.39Å; S30-S33 PolarHBondContact O-OG 3.3Å; S33-M35 VanDerWaalsContact C-N 3.35Å; S33-M35 PolarHBondContact O-N 2.62Å; S33-M36 PolarHBondContact O-N 3.14Å; S33-F37 WeakPolarHBondContact O-CD2 3.4Å; S33-F37 PolarHBondContact O-N 2.98Å; S33-F37 VanDerWaalsContact O-N 3.09Å; S33-N127 VanDerWaalsContact CB-OD1 3.25Å; S33-N127 WeakPolarHBondContact CB-OD1 3.48Å; S33-N127 PolarHBondContact OG-OD1 3.41Å; S33-W130 VanDerWaalsContact CA-CZ2 3.48Å; S33-W130 VanDerWaalsContact O-CH2 3.29Å; S33-W130 WeakPolarHBondContact O-CH2 3.36Å
34	R	88.7	Confident	82.5	Confident	2 Å²	2	23.6 Å²	23.6	1%	0.008	13%	0.127	C	C	.	.	H	α-helix	trans	-62.6	-40.2	173.8	-69.4	-176.1	-65.9	127.4	11.5	112.5	S30 T31 S32 M36 F37 S38 S330 T331 Y381 Y386	S30-R34 VanDerWaalsContact O-CG 3.28Å; S30-R34 WeakPolarHBondContact O-CG 3.43Å; S30-R34 PolarHBondContact O-N 3.01Å; S30-R34 PolarHBondContact O-NE 3.27Å; T31-R34 PolarHBondContact OG1-NH2 3.46Å; S32-R34 PolarHBondContact O-N 3.13Å; R34-M36 VanDerWaalsContact C-N 3.32Å; R34-M36 PolarHBondContact O-N 2.76Å; R34-F37 PolarHBondContact O-N 2.9Å; R34-S38 PolarHBondContact O-N 3.11Å; R34-S38 PolarHBondContact O-OG 3.33Å; R34-S330 PolarHBondContact NH1-O 3.4Å; R34-T331 HydrophobicContact CB-CG2 3.98Å; R34-T331 VanDerWaalsContact NH1-C 3.3Å; R34-T331 PolarHBondContact NH1-O 3.37Å; R34-T331 PolarHBondContact NH2-O 2.82Å; R34-T331 WeakPolarHBondContact O-CG2 3.34Å; R34-Y381 HydrophobicContact CG-CE1 3.97Å; R34-Y381 HydrophobicContact CG-CE2 4.09Å; R34-Y381 VanDerWaalsContact CG-OH 3.32Å; R34-Y381 WeakPolarHBondContact CG-OH 3.46Å; R34-Y386 WeakPolarHBondContact CA-OH 3.33Å; R34-Y386 HydrophobicContact CB-CE1 4.44Å; R34-Y386 HydrophobicContact CB-CE2 3.96Å; R34-Y386 HydrophobicContact CG-CD1 4.35Å; R34-Y386 HydrophobicContact CG-CD2 4.1Å; R34-Y386 HydrophobicContact CG-CE1 4Å; R34-Y386 HydrophobicContact CG-CE2 3.73Å; R34-Y386 HydrophobicContact CG-CG 4.39Å; R34-Y386 PolarHBondContact O-OH 2.96Å
35	M	86.9	Confident	84.3	Confident	5 Å²	5	22.5 Å²	22.5	3%	0.025	12%	0.121	C	C	.	.	H	α-helix	trans	-57.6	-46.4	174.9	-170.3	88.1	-157.9	0	0	111.3	I4 T31 S32 S33 S38 I39 L328	I4-M35 HydrophobicContact CB-CE 3.73Å; I4-M35 HydrophobicContact CB-SD 4.5Å; I4-M35 HydrophobicContact CD1-CE 3.97Å; I4-M35 HydrophobicContact CG1-CE 3.46Å; I4-M35 VanDerWaalsContact CG1-CE 3.46Å; I4-M35 HydrophobicContact CG1-SD 3.85Å; I4-M35 HydrophobicContact CG2-CE 3.53Å; T31-M35 VanDerWaalsContact O-CB 3.3Å; T31-M35 WeakPolarHBondContact O-CB 3.23Å; T31-M35 PolarHBondContact O-N 3.44Å; S32-M35 WeakPolarHBondContact O-CB 3.45Å; S32-M35 PolarHBondContact O-N 3.39Å; S33-M35 VanDerWaalsContact C-N 3.35Å; S33-M35 PolarHBondContact O-N 2.62Å; M35-S38 WeakPolarHBondContact O-CB 3.46Å; M35-S38 PolarHBondContact O-N 2.98Å; M35-S38 VanDerWaalsContact O-N 3.16Å; M35-I39 HydrophobicContact CG-CD1 4.48Å; M35-I39 WeakPolarHBondContact O-CG1 3.5Å; M35-I39 PolarHBondContact O-N 2.89Å; M35-L328 HydrophobicContact CE-CD2 4.15Å
36	M	89.2	Confident	86	Confident	4 Å²	4	23.3 Å²	23.3	2%	0.02	12%	0.121	C	C	.	.	H	α-helix	trans	-65.5	-39.2	-179.2	-67.4	-64	-78	0	0	112.6	C11 S32 S33 R34 I39 I40 W130 Y134	C11-M36 HydrophobicContact CB-CE 4.18Å; C11-M36 WeakPolarHBondContact O-CE 3.38Å; S32-M36 VanDerWaalsContact O-CG 3.28Å; S32-M36 WeakPolarHBondContact O-CG 3.24Å; S32-M36 PolarHBondContact O-N 3.47Å; S33-M36 PolarHBondContact O-N 3.14Å; R34-M36 VanDerWaalsContact C-N 3.32Å; R34-M36 PolarHBondContact O-N 2.76Å; M36-I39 WeakPolarHBondContact O-CB 3.1Å; M36-I39 PolarHBondContact O-N 2.83Å; M36-I39 HydrophobicContact SD-CD1 4.1Å; M36-I40 PolarHBondContact O-N 2.92Å; M36-W130 HydrophobicContact CB-CD2 4.01Å; M36-W130 HydrophobicContact CB-CE3 3.59Å; M36-W130 HydrophobicContact CB-CH2 3.4Å; M36-W130 HydrophobicContact CB-CZ2 3.81Å; M36-W130 HydrophobicContact CB-CZ3 3.26Å; M36-W130 HydrophobicContact CE-CB 4.41Å; M36-W130 HydrophobicContact CE-CD2 4.08Å; M36-W130 HydrophobicContact CE-CE3 4.22Å; M36-W130 HydrophobicContact CE-CG 4.14Å; M36-W130 HydrophobicContact CG-CD2 4.16Å; M36-W130 HydrophobicContact CG-CE3 4.24Å; M36-W130 HydrophobicContact CG-CH2 4.23Å; M36-W130 HydrophobicContact CG-CZ2 4.14Å; M36-W130 HydrophobicContact CG-CZ3 4.26Å; M36-Y134 HydrophobicContact CE-CE2 3.69Å; M36-Y134 WeakPolarHBondContact CE-OH 3.31Å
37	F	93.4	Very high	87.5	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-65.8	-35.7	171.5	-78.5	-64.9	0	0	0	112.6	S33 R34 I39 I40 L41 F104 Y105 F108 W130 K133 Y386 H387	S33-F37 WeakPolarHBondContact O-CD2 3.4Å; S33-F37 PolarHBondContact O-N 2.98Å; S33-F37 VanDerWaalsContact O-N 3.09Å; R34-F37 PolarHBondContact O-N 2.9Å; F37-I39 VanDerWaalsContact C-N 3.33Å; F37-I40 HydrophobicContact CD1-CD1 4.27Å; F37-I40 WeakPolarHBondContact O-CB 3.39Å; F37-I40 PolarHBondContact O-N 3.15Å; F37-L41 PolarHBondContact O-N 2.91Å; F37-F104 AromaticContact CD1-CE1 4Å; F37-F104 HydrophobicContact CD1-CE1 4Å; F37-F104 AromaticContact CE1-CE1 3.82Å; F37-F104 HydrophobicContact CE1-CE1 3.82Å; F37-F104 HydrophobicContact CE1-CZ 4.01Å; F37-Y105 HydrophobicContact CB-CE1 4.31Å; F37-Y105 HydrophobicContact CD1-CE1 4.05Å; F37-Y105 PolarHBondContact O-OH 3.44Å; F37-F108 HydrophobicContact CE1-CD1 4.31Å; F37-F108 HydrophobicContact CE1-CD2 4.25Å; F37-F108 HydrophobicContact CE1-CE1 4.44Å; F37-F108 HydrophobicContact CE1-CE2 4.38Å; F37-F108 HydrophobicContact CE1-CG 4.24Å; F37-F108 HydrophobicContact CE1-CZ 4.49Å; F37-F108 AromaticContact CZ-CD1 3.87Å; F37-F108 HydrophobicContact CZ-CD1 3.87Å; F37-F108 AromaticContact CZ-CE1 3.92Å; F37-F108 HydrophobicContact CZ-CE1 3.92Å; F37-F108 HydrophobicContact CZ-CG 4.25Å; F37-F108 HydrophobicContact CZ-CZ 4.32Å; F37-W130 HydrophobicContact CD1-CZ3 4.49Å; F37-W130 AromaticContact CD2-CH2 3.77Å; F37-W130 HydrophobicContact CD2-CH2 3.77Å; F37-W130 HydrophobicContact CD2-CZ3 4.2Å; F37-W130 HydrophobicContact CE1-CZ3 4.41Å; F37-W130 AromaticContact CE2-CH2 3.62Å; F37-W130 HydrophobicContact CE2-CH2 3.62Å; F37-W130 HydrophobicContact CE2-CZ3 4.09Å; F37-W130 HydrophobicContact CG-CH2 4.38Å; F37-W130 HydrophobicContact CG-CZ3 4.38Å; F37-W130 HydrophobicContact CZ-CH2 4.14Å; F37-W130 HydrophobicContact CZ-CZ3 4.2Å; F37-K133 HydrophobicContact CE1-CD 4.46Å; F37-K133 HydrophobicContact CZ-CD 4.19Å; F37-Y386 HydrophobicContact CB-CE1 3.99Å; F37-Y386 WeakPolarHBondContact CB-OH 3.47Å; F37-Y386 HydrophobicContact CD2-CE1 4.18Å; F37-Y386 HydrophobicContact CG-CE1 4.33Å; F37-H387 AromaticContact CD1-CE1 3.99Å; F37-H387 AromaticContact CD2-CE1 3.8Å; F37-H387 AromaticContact CE1-CE1 3.75Å; F37-H387 AromaticContact CE2-CE1 3.57Å; F37-H387 AromaticContact CZ-CE1 3.54Å
38	S	92.2	Very high	88.8	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-65.7	-34.7	172.4	-75.8	0	0	0	0	113.5	R34 M35 I40 L41 I42 V327 T331 M390	R34-S38 PolarHBondContact O-N 3.11Å; R34-S38 PolarHBondContact O-OG 3.33Å; M35-S38 WeakPolarHBondContact O-CB 3.46Å; M35-S38 PolarHBondContact O-N 2.98Å; M35-S38 VanDerWaalsContact O-N 3.16Å; S38-I40 VanDerWaalsContact C-N 3.29Å; S38-I40 PolarHBondContact O-N 3.01Å; S38-L41 PolarHBondContact O-N 2.76Å; S38-I42 VanDerWaalsContact O-CG1 3.32Å; S38-I42 WeakPolarHBondContact O-CG1 3.49Å; S38-I42 PolarHBondContact O-N 3.1Å; S38-V327 VanDerWaalsContact OG-CG1 3.24Å; S38-V327 WeakPolarHBondContact OG-CG1 3.37Å; S38-T331 WeakPolarHBondContact OG-CG2 3.49Å; S38-M390 WeakPolarHBondContact OG-CE 3.41Å
39	I	91.4	Very high	89.6	Confident	16 Å²	16	19.8 Å²	19.8	8%	0.082	10%	0.104	C	C	.	.	H	α-helix	trans	-60.7	-41.6	174.8	-71.4	167.5	0	0	0	110.4	V8 M35 M36 F37 L41 I42 F43	V8-I39 HydrophobicContact CG2-CD1 3.97Å; M35-I39 HydrophobicContact CG-CD1 4.48Å; M35-I39 WeakPolarHBondContact O-CG1 3.5Å; M35-I39 PolarHBondContact O-N 2.89Å; M36-I39 WeakPolarHBondContact O-CB 3.1Å; M36-I39 PolarHBondContact O-N 2.83Å; M36-I39 HydrophobicContact SD-CD1 4.1Å; F37-I39 VanDerWaalsContact C-N 3.33Å; I39-L41 VanDerWaalsContact C-N 3.32Å; I39-L41 PolarHBondContact O-N 2.51Å; I39-I42 PolarHBondContact O-N 3.03Å; I39-F43 HydrophobicContact CG2-CD2 3.57Å; I39-F43 HydrophobicContact CG2-CE2 3.43Å; I39-F43 VanDerWaalsContact CG2-CE2 3.43Å; I39-F43 WeakPolarHBondContact O-CD2 3.32Å; I39-F43 PolarHBondContact O-N 3.39Å
40	I	94.4	Very high	90.2	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-58	-44	174.3	-65.8	172.7	0	0	0	111.3	M36 F37 S38 F43 T44 F104 Y134 W137	M36-I40 PolarHBondContact O-N 2.92Å; F37-I40 HydrophobicContact CD1-CD1 4.27Å; F37-I40 WeakPolarHBondContact O-CB 3.39Å; F37-I40 PolarHBondContact O-N 3.15Å; S38-I40 VanDerWaalsContact C-N 3.29Å; S38-I40 PolarHBondContact O-N 3.01Å; I40-F43 PolarHBondContact O-N 3.34Å; I40-T44 PolarHBondContact O-N 3.38Å; I40-T44 PolarHBondContact O-OG1 3.47Å; I40-F104 HydrophobicContact CD1-CE1 3.67Å; I40-F104 HydrophobicContact CD1-CZ 3.86Å; I40-F104 HydrophobicContact CG2-CD1 4.49Å; I40-F104 HydrophobicContact CG2-CE1 4.43Å; I40-Y134 HydrophobicContact CD1-CD1 4.2Å; I40-Y134 HydrophobicContact CD1-CE1 3.94Å; I40-Y134 HydrophobicContact CG1-CD1 3.96Å; I40-Y134 HydrophobicContact CG1-CE1 3.46Å; I40-Y134 VanDerWaalsContact CG1-CE1 3.46Å; I40-W137 HydrophobicContact CG2-CD2 3.71Å; I40-W137 HydrophobicContact CG2-CE3 4.4Å; I40-W137 HydrophobicContact CG2-CG 3.82Å; I40-W137 HydrophobicContact CG2-CZ2 4.09Å
41	L	95.1	Very high	90.6	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-65.4	-42.5	177.5	-178.4	57.9	0	0	0	111.6	F37 S38 I39 F43 T44 I45 Y105 V327 M390 A393 T394 V397	F37-L41 PolarHBondContact O-N 2.91Å; S38-L41 PolarHBondContact O-N 2.76Å; I39-L41 VanDerWaalsContact C-N 3.32Å; I39-L41 PolarHBondContact O-N 2.51Å; L41-F43 PolarHBondContact O-N 3.19Å; L41-T44 WeakPolarHBondContact O-CA 3.48Å; L41-T44 VanDerWaalsContact O-CB 3.26Å; L41-T44 WeakPolarHBondContact O-CB 3.38Å; L41-T44 PolarHBondContact O-N 3.2Å; L41-T44 VanDerWaalsContact O-N 3.13Å; L41-I45 HydrophobicContact CG-CD1 4.26Å; L41-I45 WeakPolarHBondContact O-CG1 3.35Å; L41-I45 PolarHBondContact O-N 3.16Å; L41-Y105 WeakPolarHBondContact CB-OH 3.43Å; L41-Y105 PolarHBondContact N-OH 3.28Å; L41-Y105 VanDerWaalsContact N-OH 3.11Å; L41-V327 HydrophobicContact CD2-CB 4.43Å; L41-V327 HydrophobicContact CD2-CG1 3.97Å; L41-V327 HydrophobicContact CD2-CG2 3.58Å; L41-M390 HydrophobicContact CD2-CE 4.23Å; L41-M390 HydrophobicContact CD2-SD 3.83Å; L41-A393 HydrophobicContact CD1-CB 4.5Å; L41-A393 HydrophobicContact CD2-CB 3.6Å; L41-T394 HydrophobicContact CD1-CG2 3.46Å; L41-T394 VanDerWaalsContact CD1-CG2 3.46Å; L41-V397 HydrophobicContact CD1-CG2 4.41Å
42	I	94.2	Very high	90.7	Very high	37 Å²	37	22.7 Å²	22.7	19%	0.19	12%	0.117	C	C	.	.	H	α-helix	trans	-61.4	-44.5	176.6	-68.5	165.9	0	0	0	110.4	S38 I39 T44 I45 L46 I324 L328	S38-I42 VanDerWaalsContact O-CG1 3.32Å; S38-I42 WeakPolarHBondContact O-CG1 3.49Å; S38-I42 PolarHBondContact O-N 3.1Å; I39-I42 PolarHBondContact O-N 3.03Å; I42-T44 VanDerWaalsContact C-N 3.31Å; I42-T44 PolarHBondContact O-N 3.22Å; I42-I45 WeakPolarHBondContact O-CB 3.28Å; I42-I45 PolarHBondContact O-N 2.85Å; I42-L46 HydrophobicContact CG2-CD1 4.14Å; I42-L46 HydrophobicContact CG2-CG 4.44Å; I42-L46 WeakPolarHBondContact O-CG 3.49Å; I42-L46 PolarHBondContact O-N 2.85Å; I42-I324 HydrophobicContact CD1-CG2 4.41Å; I42-I324 HydrophobicContact CG1-CG2 4.46Å; I42-L328 HydrophobicContact CD1-CD2 4.02Å; I42-L328 HydrophobicContact CD1-CG 4.44Å
43	F	94.4	Very high	90.8	Very high	107 Å²	107	25.4 Å²	25.4	47%	0.469	13%	0.13	S	C	.	.	H	α-helix	trans	-62.8	-38.1	173.5	-81.8	-69.8	0	0	0	112.3	I39 I40 L41 I45 L46 L47 W137	I39-F43 HydrophobicContact CG2-CD2 3.57Å; I39-F43 HydrophobicContact CG2-CE2 3.43Å; I39-F43 VanDerWaalsContact CG2-CE2 3.43Å; I39-F43 WeakPolarHBondContact O-CD2 3.32Å; I39-F43 PolarHBondContact O-N 3.39Å; I40-F43 PolarHBondContact O-N 3.34Å; L41-F43 PolarHBondContact O-N 3.19Å; F43-I45 VanDerWaalsContact C-N 3.33Å; F43-I45 PolarHBondContact O-N 2.75Å; F43-L46 PolarHBondContact O-N 2.95Å; F43-L47 WeakPolarHBondContact O-CB 3.36Å; F43-L47 VanDerWaalsContact O-CG 3.28Å; F43-L47 WeakPolarHBondContact O-CG 3.39Å; F43-L47 PolarHBondContact O-N 3.3Å; F43-W137 HydrophobicContact CB-CH2 3.73Å; F43-W137 HydrophobicContact CB-CZ2 4.48Å; F43-W137 HydrophobicContact CB-CZ3 4.42Å
44	T	96.1	Very high	90.2	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-58.2	-45.6	173	-56	0	0	0	0	111.1	I40 L41 I42 S48 I97 S101 W137	I40-T44 PolarHBondContact O-N 3.38Å; I40-T44 PolarHBondContact O-OG1 3.47Å; L41-T44 WeakPolarHBondContact O-CA 3.48Å; L41-T44 VanDerWaalsContact O-CB 3.26Å; L41-T44 WeakPolarHBondContact O-CB 3.38Å; L41-T44 PolarHBondContact O-N 3.2Å; L41-T44 VanDerWaalsContact O-N 3.13Å; I42-T44 VanDerWaalsContact C-N 3.31Å; I42-T44 PolarHBondContact O-N 3.22Å; T44-S48 VanDerWaalsContact O-CB 3.32Å; T44-S48 WeakPolarHBondContact O-CB 3.25Å; T44-S48 PolarHBondContact O-N 3.49Å; T44-S48 PolarHBondContact O-OG 3.08Å; T44-I97 HydrophobicContact CG2-CG2 3.93Å; T44-S101 WeakPolarHBondContact CG2-OG 3.24Å; T44-S101 PolarHBondContact OG1-OG 2.94Å; T44-W137 WeakPolarHBondContact OG1-CZ2 3.42Å
45	I	94.6	Very high	89.7	Confident	3 Å²	3	34 Å²	34	2%	0.015	18%	0.18	C	C	.	.	H	α-helix	trans	-61.4	-49.7	176.9	-67.8	165.3	0	0	0	110.2	L41 I42 F43 L47 S48 V49 I320 L323 I324 V397	L41-I45 HydrophobicContact CG-CD1 4.26Å; L41-I45 WeakPolarHBondContact O-CG1 3.35Å; L41-I45 PolarHBondContact O-N 3.16Å; I42-I45 WeakPolarHBondContact O-CB 3.28Å; I42-I45 PolarHBondContact O-N 2.85Å; F43-I45 VanDerWaalsContact C-N 3.33Å; F43-I45 PolarHBondContact O-N 2.75Å; I45-L47 PolarHBondContact O-N 2.93Å; I45-S48 PolarHBondContact O-N 3.25Å; I45-V49 HydrophobicContact CG2-CG2 4.43Å; I45-V49 WeakPolarHBondContact O-CG2 3.17Å; I45-V49 PolarHBondContact O-N 3.48Å; I45-I320 HydrophobicContact CG2-CG2 3.57Å; I45-L323 HydrophobicContact CD1-CD2 4.02Å; I45-L323 HydrophobicContact CD1-CG 4.37Å; I45-I324 HydrophobicContact CD1-CG1 4.02Å; I45-V397 HydrophobicContact CD1-CG2 3.92Å; I45-V397 HydrophobicContact CG1-CB 4.42Å; I45-V397 HydrophobicContact CG1-CG1 3.97Å; I45-V397 HydrophobicContact CG1-CG2 3.47Å; I45-V397 VanDerWaalsContact CG1-CG2 3.47Å
46	L	93.4	Very high	89.4	Confident	83 Å²	83	35.9 Å²	35.9	44%	0.435	19%	0.191	S	C	.	.	H	α-helix	trans	-60	-48.2	-179.7	-69.4	173.9	0	0	0	111.6	I42 F43 S48 V49 I50	I42-L46 HydrophobicContact CG2-CD1 4.14Å; I42-L46 HydrophobicContact CG2-CG 4.44Å; I42-L46 WeakPolarHBondContact O-CG 3.49Å; I42-L46 PolarHBondContact O-N 2.85Å; F43-L46 PolarHBondContact O-N 2.95Å; L46-S48 VanDerWaalsContact C-N 3.29Å; L46-S48 PolarHBondContact O-N 3.35Å; L46-V49 PolarHBondContact O-N 3.45Å; L46-I50 WeakPolarHBondContact O-CB 3.4Å; L46-I50 WeakPolarHBondContact O-CD1 3.45Å; L46-I50 WeakPolarHBondContact O-CG1 3.35Å; L46-I50 PolarHBondContact O-N 3.37Å
47	L	93.7	Very high	88.7	Confident	61 Å²	61	36 Å²	36	32%	0.319	19%	0.192	S	C	.	.	H	α-helix	trans	-61	-39.1	176.7	-70.2	175.5	0	0	0	111.9	F43 I45 I50 A51 I97 W137 L141	F43-L47 WeakPolarHBondContact O-CB 3.36Å; F43-L47 VanDerWaalsContact O-CG 3.28Å; F43-L47 WeakPolarHBondContact O-CG 3.39Å; F43-L47 PolarHBondContact O-N 3.3Å; I45-L47 PolarHBondContact O-N 2.93Å; L47-I50 PolarHBondContact O-N 3.17Å; L47-A51 WeakPolarHBondContact O-CB 3.45Å; L47-A51 PolarHBondContact O-N 2.84Å; L47-I97 HydrophobicContact CB-CD1 4.34Å; L47-I97 HydrophobicContact CB-CG2 4.28Å; L47-W137 HydrophobicContact CD1-CH2 4.05Å; L47-L141 HydrophobicContact CD1-CD1 4.02Å
48	S	92.7	Very high	87.8	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-67.6	-38.9	177.4	-56.7	0	0	0	0	112.2	T44 I45 L46 A51 V94 I97	T44-S48 VanDerWaalsContact O-CB 3.32Å; T44-S48 WeakPolarHBondContact O-CB 3.25Å; T44-S48 PolarHBondContact O-N 3.49Å; T44-S48 PolarHBondContact O-OG 3.08Å; I45-S48 PolarHBondContact O-N 3.25Å; L46-S48 VanDerWaalsContact C-N 3.29Å; L46-S48 PolarHBondContact O-N 3.35Å; S48-A51 PolarHBondContact O-N 3.24Å; S48-V94 WeakPolarHBondContact O-CG2 3.32Å; S48-I97 WeakPolarHBondContact OG-CG2 3.1Å
49	V	90	Very high	87.1	Confident	39 Å²	39	47.8 Å²	47.8	24%	0.236	24%	0.243	C	C	.	.	H	α-helix	trans	-67	-43.1	174	172.3	0	0	0	0	110.7	I45 L46 A51 L52 I320 L401	I45-V49 HydrophobicContact CG2-CG2 4.43Å; I45-V49 WeakPolarHBondContact O-CG2 3.17Å; I45-V49 PolarHBondContact O-N 3.48Å; L46-V49 PolarHBondContact O-N 3.45Å; V49-A51 VanDerWaalsContact C-N 3.27Å; V49-A51 PolarHBondContact O-N 3.06Å; V49-L52 PolarHBondContact O-N 2.63Å; V49-I320 HydrophobicContact CG2-CD1 3.78Å; V49-L401 HydrophobicContact CG2-CD1 4.38Å; V49-L401 HydrophobicContact CG2-CD2 3.94Å
50	I	89.2	Confident	86.3	Confident	80 Å²	80	48.2 Å²	48.2	41%	0.41	25%	0.246	S	C	.	.	H	α-helix	trans	-59.5	-40.6	176.8	-70	165.5	0	0	0	110.6	L46 L47 L52 I53 V56	L46-I50 WeakPolarHBondContact O-CB 3.4Å; L46-I50 WeakPolarHBondContact O-CD1 3.45Å; L46-I50 WeakPolarHBondContact O-CG1 3.35Å; L46-I50 PolarHBondContact O-N 3.37Å; L47-I50 PolarHBondContact O-N 3.17Å; I50-L52 PolarHBondContact O-N 3.13Å; I50-L52 VanDerWaalsContact O-N 3.14Å; I50-I53 HydrophobicContact CG1-CD1 4.43Å; I50-I53 WeakPolarHBondContact O-CB 3.32Å; I50-I53 PolarHBondContact O-N 3.35Å; I50-I53 VanDerWaalsContact O-N 3.08Å; I50-V56 HydrophobicContact CG2-CG1 4.39Å; I50-V56 HydrophobicContact CG2-CG2 4Å; I50-V56 WeakPolarHBondContact O-CB 3.3Å
51	A	86	Confident	85.2	Confident	6 Å²	6	50.1 Å²	50.1	5%	0.05	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-16.8	177.3	0	0	0	0	0	114.2	L47 S48 V49 R57 A93 I97	L47-A51 WeakPolarHBondContact O-CB 3.45Å; L47-A51 PolarHBondContact O-N 2.84Å; S48-A51 PolarHBondContact O-N 3.24Å; V49-A51 VanDerWaalsContact C-N 3.27Å; V49-A51 PolarHBondContact O-N 3.06Å; A51-R57 VanDerWaalsContact O-CG 3.22Å; A51-R57 WeakPolarHBondContact O-CG 3.41Å; A51-A93 HydrophobicContact CB-CB 3.94Å; A51-I97 HydrophobicContact CB-CD1 3.98Å
52	L	81.9	Confident	84.1	Confident	17 Å²	17	57.2 Å²	57.2	9%	0.089	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-9.6	176.6	-65.8	172.9	0	0	0	113.5	V49 I50 R57 F91 V94 L310 L401	V49-L52 PolarHBondContact O-N 2.63Å; I50-L52 PolarHBondContact O-N 3.13Å; I50-L52 VanDerWaalsContact O-N 3.14Å; L52-R57 PolarHBondContact O-NE 2.86Å; L52-F91 HydrophobicContact CD2-CD1 3.99Å; L52-F91 HydrophobicContact CD2-CE1 4.28Å; L52-V94 HydrophobicContact CD1-CG2 4.1Å; L52-V94 HydrophobicContact CD2-CG2 3.83Å; L52-V94 HydrophobicContact CG-CG2 3.77Å; L52-L310 HydrophobicContact CD2-CD2 4Å; L52-L401 HydrophobicContact CD1-CB 4.04Å; L52-L401 HydrophobicContact CD1-CD2 4.05Å; L52-L401 HydrophobicContact CD1-CG 4.46Å
53	I	82.2	Confident	83	Confident	72 Å²	72	59.2 Å²	59.2	37%	0.369	30%	0.299	S	S	.	.	S	Bend	trans	-64.5	130.1	177.4	-62.7	175.7	0	0	0	108.8	I50 D55 V56 R57	I50-I53 HydrophobicContact CG1-CD1 4.43Å; I50-I53 WeakPolarHBondContact O-CB 3.32Å; I50-I53 PolarHBondContact O-N 3.35Å; I50-I53 VanDerWaalsContact O-N 3.08Å; I53-D55 VanDerWaalsContact C-N 3.32Å; I53-D55 HydrophobicContact CG2-CB 4.43Å; I53-D55 PolarHBondContact O-N 3.08Å; I53-V56 HydrophobicContact CB-CB 4.33Å; I53-V56 HydrophobicContact CB-CG2 4.04Å; I53-V56 HydrophobicContact CG2-CG2 4.36Å; I53-V56 PolarHBondContact O-N 3.13Å; I53-R57 WeakPolarHBondContact O-CG 3.42Å; I53-R57 PolarHBondContact O-N 3.05Å
54	P	74.2	Confident	81.5	Confident	72 Å²	72	58.6 Å²	58.6	47%	0.468	31%	0.305	S	S	.	.	H	α-helix	trans	-48.1	-49.7	-177.9	-25	30.1	0	0	0	113.6	V56 R57 D58	P54-V56 VanDerWaalsContact C-N 3.29Å; P54-V56 PolarHBondContact O-N 3.16Å; P54-R57 WeakPolarHBondContact O-CA 3.24Å; P54-R57 WeakPolarHBondContact O-CB 3.44Å; P54-R57 PolarHBondContact O-N 2.85Å; P54-D58 PolarHBondContact O-N 2.99Å
55	D	77.8	Confident	80	Confident	112 Å²	112	61.2 Å²	61.2	60%	0.599	33%	0.327	S	S	*	.	H	α-helix	trans	-59	-40	-179.5	-56.5	-22.2	0	0	0	112.5	I53 D58 Y59	I53-D55 VanDerWaalsContact C-N 3.32Å; I53-D55 HydrophobicContact CG2-CB 4.43Å; I53-D55 PolarHBondContact O-N 3.08Å; D55-D58 PolarHBondContact O-N 2.93Å; D55-Y59 WeakPolarHBondContact O-CD2 3.38Å; D55-Y59 PolarHBondContact O-N 3.31Å
56	V	80.5	Confident	78.5	Confident	44 Å²	44	61.2 Å²	61.2	27%	0.267	33%	0.327	S	S	.	.	H	α-helix	trans	-70.4	-38.6	178.6	179.5	0	0	0	0	110.3	I50 I53 P54 D58 Y59 L60	I50-V56 HydrophobicContact CG2-CG1 4.39Å; I50-V56 HydrophobicContact CG2-CG2 4Å; I50-V56 WeakPolarHBondContact O-CB 3.3Å; I53-V56 HydrophobicContact CB-CB 4.33Å; I53-V56 HydrophobicContact CB-CG2 4.04Å; I53-V56 HydrophobicContact CG2-CG2 4.36Å; I53-V56 PolarHBondContact O-N 3.13Å; P54-V56 VanDerWaalsContact C-N 3.29Å; P54-V56 PolarHBondContact O-N 3.16Å; V56-D58 VanDerWaalsContact C-N 3.31Å; V56-D58 PolarHBondContact O-N 2.9Å; V56-Y59 PolarHBondContact O-N 2.89Å; V56-Y59 VanDerWaalsContact O-N 3.12Å; V56-L60 HydrophobicContact CG1-CD1 4.14Å; V56-L60 HydrophobicContact CG1-CG 4.4Å; V56-L60 WeakPolarHBondContact O-CG 3.41Å; V56-L60 PolarHBondContact O-N 3.12Å
57	R	75.6	Confident	77.1	Confident	8 Å²	8	58.6 Å²	58.6	3%	0.03	32%	0.316	C	S	.	.	H	α-helix	trans	-61.6	-39.6	175.4	-66.4	-173.2	-79	126.7	-0.9	111.5	A51 L52 I53 P54 Y59 L60 T61 D86	A51-R57 VanDerWaalsContact O-CG 3.22Å; A51-R57 WeakPolarHBondContact O-CG 3.41Å; L52-R57 PolarHBondContact O-NE 2.86Å; I53-R57 WeakPolarHBondContact O-CG 3.42Å; I53-R57 PolarHBondContact O-N 3.05Å; P54-R57 WeakPolarHBondContact O-CA 3.24Å; P54-R57 WeakPolarHBondContact O-CB 3.44Å; P54-R57 PolarHBondContact O-N 2.85Å; R57-Y59 VanDerWaalsContact C-N 3.25Å; R57-Y59 PolarHBondContact O-N 3.19Å; R57-L60 CarbonylContact O-C 3.58Å; R57-L60 PolarHBondContact O-N 3.32Å; R57-T61 WeakPolarHBondContact O-CG2 3Å; R57-T61 PolarHBondContact O-N 2.97Å; R57-T61 PolarHBondContact O-OG1 3.42Å; R57-D86 VanDerWaalsContact CB-OD1 3.24Å; R57-D86 WeakPolarHBondContact CB-OD1 3.44Å; R57-D86 IonicContact CZ-OD2 3.27Å; R57-D86 VanDerWaalsContact NH1-CG 3.33Å; R57-D86 IonicContact NH1-OD1 2.9Å; R57-D86 PolarHBondContact NH1-OD1 3Å; R57-D86 IonicContact NH1-OD2 3.03Å; R57-D86 PolarHBondContact NH1-OD2 3.33Å
58	D	74.1	Confident	75.2	Confident	84 Å²	84	60.1 Å²	60.1	45%	0.449	33%	0.328	S	S	.	.	H	α-helix	trans	-62.1	-29.7	174.1	-71.5	-22.2	0	0	0	113.5	P54 D55 V56 T61	P54-D58 PolarHBondContact O-N 2.99Å; D55-D58 PolarHBondContact O-N 2.93Å; V56-D58 VanDerWaalsContact C-N 3.31Å; V56-D58 PolarHBondContact O-N 2.9Å; D58-T61 PolarHBondContact O-OG1 3.05Å
59	Y	77.9	Confident	73.2	Confident	162 Å²	162	62.5 Å²	62.5	64%	0.635	34%	0.343	S	S	*	.	H	α-helix	trans	-78	-36.2	170.7	-72.9	-75.1	0	0	0	112.2	D55 V56 R57 K62	D55-Y59 WeakPolarHBondContact O-CD2 3.38Å; D55-Y59 PolarHBondContact O-N 3.31Å; V56-Y59 PolarHBondContact O-N 2.89Å; V56-Y59 VanDerWaalsContact O-N 3.12Å; R57-Y59 VanDerWaalsContact C-N 3.25Å; R57-Y59 PolarHBondContact O-N 3.19Å; Y59-K62 WeakPolarHBondContact O-CB 3.38Å; Y59-K62 PolarHBondContact O-N 3.15Å
60	L	75.1	Confident	71.1	Confident	25 Å²	25	66.6 Å²	66.6	13%	0.131	36%	0.358	C	S	.	.	H	α-helix	trans	-69.6	-33.9	178.9	-69.5	171.6	0	0	0	112.6	V56 R57 K62 I63 L66 A93	V56-L60 HydrophobicContact CG1-CD1 4.14Å; V56-L60 HydrophobicContact CG1-CG 4.4Å; V56-L60 WeakPolarHBondContact O-CG 3.41Å; V56-L60 PolarHBondContact O-N 3.12Å; R57-L60 CarbonylContact O-C 3.58Å; R57-L60 PolarHBondContact O-N 3.32Å; L60-K62 PolarHBondContact O-N 3Å; L60-I63 HydrophobicContact CD2-CD1 4.35Å; L60-I63 WeakPolarHBondContact O-CB 3.13Å; L60-I63 PolarHBondContact O-N 3.46Å; L60-L66 HydrophobicContact CB-CD1 4.22Å; L60-L66 HydrophobicContact CD2-CD1 3.97Å; L60-A93 HydrophobicContact CD1-CB 3.98Å
61	T	69.9	Low	68.7	Low	40 Å²	40	73.6 Å²	73.6	25%	0.245	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-24.5	175.9	55.1	0	0	0	0	112.7	R57 D58 I63 D86 T89	R57-T61 WeakPolarHBondContact O-CG2 3Å; R57-T61 PolarHBondContact O-N 2.97Å; R57-T61 PolarHBondContact O-OG1 3.42Å; D58-T61 PolarHBondContact O-OG1 3.05Å; T61-I63 PolarHBondContact O-N 3.21Å; T61-D86 HydrophobicContact CG2-CB 4.36Å; T61-T89 HydrophobicContact CG2-CG2 3.89Å
62	K	73.6	Confident	66.5	Low	149 Å²	149	79.1 Å²	79.1	65%	0.648	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-15.9	174.5	-63.7	172.9	-178	168.4	0	113.3	Y59 L60 P64	Y59-K62 WeakPolarHBondContact O-CB 3.38Å; Y59-K62 PolarHBondContact O-N 3.15Å; L60-K62 PolarHBondContact O-N 3Å; K62-P64 VanDerWaalsContact O-CD 3.25Å; K62-P64 WeakPolarHBondContact O-CD 3.29Å
63	I	70.1	Confident	64.5	Low	80 Å²	80	84.4 Å²	84.4	41%	0.41	44%	0.436	S	S	.	.	S	Bend	trans	-85.9	107.8	176.1	-58.4	173.3	0	0	0	107.7	L60 T61 A65 L66	L60-I63 HydrophobicContact CD2-CD1 4.35Å; L60-I63 WeakPolarHBondContact O-CB 3.13Å; L60-I63 PolarHBondContact O-N 3.46Å; T61-I63 PolarHBondContact O-N 3.21Å; I63-A65 HydrophobicContact CG2-CB 4.28Å; I63-A65 PolarHBondContact O-N 3.16Å; I63-A65 VanDerWaalsContact O-N 3.12Å; I63-L66 HydrophobicContact CB-CD1 4.07Å; I63-L66 HydrophobicContact CB-CG 4.45Å; I63-L66 HydrophobicContact CD1-CD1 4.09Å; I63-L66 HydrophobicContact CG2-CD1 4.3Å; I63-L66 HydrophobicContact CG2-CG 4.34Å; I63-L66 PolarHBondContact O-N 3.02Å
64	P	63.7	Low	62.4	Low	93 Å²	93	86.8 Å²	86.8	60%	0.604	46%	0.456	S	S	*	.	H	α-helix	trans	-59.2	-34	-172.2	20	-30.6	0	0	0	112.4	K62 L66 C67 T68	K62-P64 VanDerWaalsContact O-CD 3.25Å; K62-P64 WeakPolarHBondContact O-CD 3.29Å; P64-L66 PolarHBondContact O-N 2.76Å; P64-L66 VanDerWaalsContact O-N 3.14Å; P64-C67 CarbonylContact O-C 3.6Å; P64-C67 PolarHBondContact O-N 3.3Å; P64-T68 WeakPolarHBondContact O-CB 3.49Å; P64-T68 VanDerWaalsContact O-CG2 3.31Å; P64-T68 WeakPolarHBondContact O-CG2 2.91Å; P64-T68 PolarHBondContact O-N 3.41Å; P64-T68 PolarHBondContact O-OG1 2.8Å
65	A	64.4	Low	61	Low	56 Å²	56	91 Å²	91	46%	0.463	47%	0.467	S	S	.	.	H	α-helix	trans	-60	-24.4	178.1	0	0	0	0	0	114.6	I63	I63-A65 HydrophobicContact CG2-CB 4.28Å; I63-A65 PolarHBondContact O-N 3.16Å; I63-A65 VanDerWaalsContact O-N 3.12Å
66	L	63.3	Low	59.7	Low	3 Å²	3	92.2 Å²	92.2	2%	0.016	48%	0.479	C	S	.	.	H	α-helix	trans	-89.2	-22.7	177.3	-70.2	170.2	0	0	0	112.5	L60 I63 P64 T89 F145	L60-L66 HydrophobicContact CB-CD1 4.22Å; L60-L66 HydrophobicContact CD2-CD1 3.97Å; I63-L66 HydrophobicContact CB-CD1 4.07Å; I63-L66 HydrophobicContact CB-CG 4.45Å; I63-L66 HydrophobicContact CD1-CD1 4.09Å; I63-L66 HydrophobicContact CG2-CD1 4.3Å; I63-L66 HydrophobicContact CG2-CG 4.34Å; I63-L66 PolarHBondContact O-N 3.02Å; P64-L66 PolarHBondContact O-N 2.76Å; P64-L66 VanDerWaalsContact O-N 3.14Å; L66-T89 HydrophobicContact CB-CG2 4.14Å; L66-F145 HydrophobicContact CD1-CD1 4.45Å; L66-F145 HydrophobicContact CD2-CD1 4.37Å
67	C	62.7	Low	58.4	Low	28 Å²	28	95 Å²	95	19%	0.189	49%	0.492	C	S	.	.	H	α-helix	trans	-110.2	0.9	-174.6	-109.7	0	0	0	0	114.1	P64 P69 C85 T89	P64-C67 CarbonylContact O-C 3.6Å; P64-C67 PolarHBondContact O-N 3.3Å; C67-P69 WeakPolarHBondContact O-CD 3.24Å; C67-C85 WeakPolarHBondContact CA-SG 3.45Å; C67-C85 WeakPolarHBondContact CB-SG 3.19Å; C67-C85 PolarHBondContact O-SG 3.47Å; C67-C85 VanDerWaalsContact O-SG 3.35Å; C67-C85 WeakPolarHBondContact SG-CB 3.22Å; C67-C85 CovalentContact SG-SG 2.03Å; C67-C85 PolarHBondContact SG-SG 3Å; C67-T89 HydrophobicContact CB-CG2 4.36Å; C67-T89 WeakPolarHBondContact SG-CG2 3.12Å
68	T	55	Low	57.4	Low	93 Å²	93	103.3 Å²	103.3	57%	0.571	53%	0.531	S	S	*	.			trans	-92.2	89.2	170	50.2	0	0	0	0	111.3	P64	P64-T68 WeakPolarHBondContact O-CB 3.49Å; P64-T68 VanDerWaalsContact O-CG2 3.31Å; P64-T68 WeakPolarHBondContact O-CG2 2.91Å; P64-T68 PolarHBondContact O-N 3.41Å; P64-T68 PolarHBondContact O-OG1 2.8Å
69	P	49.9	Very low	56.2	Low	49 Å²	49	105.6 Å²	105.6	32%	0.318	54%	0.537	S	S	.	.			trans	-122	139.9	147.2	33	-21	0	0	0	111	C67 V149	C67-P69 WeakPolarHBondContact O-CD 3.24Å; P69-V149 HydrophobicContact CB-CG1 4.45Å
70	F	47.3	Very low	54.8	Low	125 Å²	125	103.8 Å²	103.8	55%	0.548	53%	0.533	S	S	.	.			trans	78.5	76	164.1	-116.6	-104.8	0	0	0	118.7	L72 F73	F70-L72 HydrophobicContact CD1-CB 3.38Å; F70-L72 HydrophobicContact CE1-CB 3.3Å; F70-L72 HydrophobicContact CE1-CD2 3.71Å; F70-L72 HydrophobicContact CE1-CG 4.14Å; F70-L72 HydrophobicContact CG-CB 4.23Å; F70-L72 HydrophobicContact CZ-CB 4.09Å; F70-L72 HydrophobicContact CZ-CD2 3.95Å; F70-L72 PolarHBondContact O-N 3.41Å; F70-L72 VanDerWaalsContact O-N 3.1Å; F70-F73 HydrophobicContact CD1-CD2 4.21Å; F70-F73 AromaticContact CE1-CD2 3.92Å; F70-F73 HydrophobicContact CE1-CD2 3.92Å; F70-F73 HydrophobicContact CE1-CE2 4.02Å
71	K	36.9	Very low	53.6	Low	228 Å²	228	105.3 Å²	105.3	99%	0.991	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	18	158.9	-110.9	-173.8	-175.6	-178.6	0	114
72	L	40.1	Very low	52.6	Low	122 Å²	122	106.7 Å²	106.7	64%	0.639	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	-6.2	-169.1	-144.8	86.8	0	0	0	115.7	F70	F70-L72 HydrophobicContact CD1-CB 3.38Å; F70-L72 HydrophobicContact CE1-CB 3.3Å; F70-L72 HydrophobicContact CE1-CD2 3.71Å; F70-L72 HydrophobicContact CE1-CG 4.14Å; F70-L72 HydrophobicContact CG-CB 4.23Å; F70-L72 HydrophobicContact CZ-CB 4.09Å; F70-L72 HydrophobicContact CZ-CD2 3.95Å; F70-L72 PolarHBondContact O-N 3.41Å; F70-L72 VanDerWaalsContact O-N 3.1Å
73	F	40.3	Very low	51.6	Low	127 Å²	127	101.6 Å²	101.6	56%	0.557	54%	0.54	S	S	*	.			trans	-147.2	134.6	177.2	-73.5	-75.6	0	0	0	111.9	F70 F75	F70-F73 HydrophobicContact CD1-CD2 4.21Å; F70-F73 AromaticContact CE1-CD2 3.92Å; F70-F73 HydrophobicContact CE1-CD2 3.92Å; F70-F73 HydrophobicContact CE1-CE2 4.02Å; F73-F75 VanDerWaalsContact C-N 3.26Å; F73-F75 HydrophobicContact CB-CD2 3.52Å; F73-F75 HydrophobicContact CB-CE2 3.3Å; F73-F75 HydrophobicContact CB-CG 4.41Å; F73-F75 HydrophobicContact CB-CZ 4.02Å; F73-F75 HydrophobicContact CD2-CE2 4.09Å; F73-F75 AromaticContact CG-CE2 3.86Å; F73-F75 HydrophobicContact CG-CE2 3.86Å; F73-F75 HydrophobicContact CG-CZ 4.27Å; F73-F75 PolarHBondContact O-N 2.72Å
74	P	37.4	Very low	51.2	Low	122 Å²	122	100 Å²	100	79%	0.792	53%	0.532	S	S	*	.			trans	-76.3	84.5	170.5	32.8	-28.7	0	0	0	107.2	T76	P74-T76 PolarHBondContact O-N 2.71Å
75	F	46.3	Very low	51.3	Low	161 Å²	161	96.5 Å²	96.5	71%	0.706	51%	0.51	S	S	*	.			trans	-80.1	118.7	173.5	-80.2	-70.6	0	0	0	109.8	F73 D77	F73-F75 VanDerWaalsContact C-N 3.26Å; F73-F75 HydrophobicContact CB-CD2 3.52Å; F73-F75 HydrophobicContact CB-CE2 3.3Å; F73-F75 HydrophobicContact CB-CG 4.41Å; F73-F75 HydrophobicContact CB-CZ 4.02Å; F73-F75 HydrophobicContact CD2-CE2 4.09Å; F73-F75 AromaticContact CG-CE2 3.86Å; F73-F75 HydrophobicContact CG-CE2 3.86Å; F73-F75 HydrophobicContact CG-CZ 4.27Å; F73-F75 PolarHBondContact O-N 2.72Å; F75-D77 PolarHBondContact O-N 2.93Å; F75-D77 VanDerWaalsContact O-N 3.09Å
76	T	48.8	Very low	51.1	Low	137 Å²	137	95.6 Å²	95.6	84%	0.84	50%	0.497	S	S	*	.	S	Bend	trans	-77.9	31.7	-174.3	48.8	0	0	0	0	114.2	P74	P74-T76 PolarHBondContact O-N 2.71Å
77	D	53.7	Low	51	Low	104 Å²	104	95.8 Å²	95.8	56%	0.556	50%	0.499	S	S	*	.			trans	-149.4	95.1	179.9	-107.2	-38.4	0	0	0	111.7	F75 K79 K80 A81	F75-D77 PolarHBondContact O-N 2.93Å; F75-D77 VanDerWaalsContact O-N 3.09Å; D77-K79 PolarHBondContact O-N 2.97Å; D77-K80 HydrophobicContact CB-CB 4.13Å; D77-K80 PolarHBondContact O-N 3.29Å; D77-K80 VanDerWaalsContact O-N 3.15Å; D77-A81 PolarHBondContact O-N 3.27Å
78	E	54.3	Low	51.2	Low	182 Å²	182	97.8 Å²	97.8	85%	0.85	51%	0.507	S	S	*	.	H	α-helix	trans	-58.2	-34.1	-178.8	-67.2	-173.3	157.9	0	0	112.9	S82	E78-S82 WeakPolarHBondContact O-CB 3.13Å; E78-S82 PolarHBondContact O-N 3.34Å; E78-S82 PolarHBondContact O-OG 3.31Å
79	K	49.6	Very low	52	Low	131 Å²	131	93.4 Å²	93.4	57%	0.57	48%	0.48	S	S	*	.	H	α-helix	trans	-67	-36.7	177.6	-86.6	-170.8	170	-168.8	0	113	D77 S82 L83 D305	D77-K79 PolarHBondContact O-N 2.97Å; K79-S82 WeakPolarHBondContact CA-OG 3.19Å; K79-S82 PolarHBondContact O-OG 3.38Å; K79-L83 WeakPolarHBondContact O-CB 2.88Å; K79-L83 PolarHBondContact O-N 3.47Å; K79-D305 IonicContact NZ-OD1 3Å; K79-D305 PolarHBondContact NZ-OD1 3.03Å; K79-D305 IonicContact NZ-OD2 2.59Å; K79-D305 PolarHBondContact NZ-OD2 3.37Å
80	K	48.2	Very low	53.3	Low	124 Å²	124	91 Å²	91	54%	0.539	47%	0.465	S	S	.	.	H	α-helix	trans	-76.4	-35.5	-179.9	-162.4	175.6	-177.8	-176.9	0	111.2	D77 N84	D77-K80 HydrophobicContact CB-CB 4.13Å; D77-K80 PolarHBondContact O-N 3.29Å; D77-K80 VanDerWaalsContact O-N 3.15Å; K80-N84 WeakPolarHBondContact O-CB 3.07Å; K80-N84 PolarHBondContact O-N 3.06Å; K80-N84 VanDerWaalsContact O-N 3.17Å; K80-N84 PolarHBondContact O-ND2 3.25Å
81	A	51.4	Low	54.8	Low	57 Å²	57	86.2 Å²	86.2	47%	0.471	44%	0.444	S	S	.	.	H	α-helix	trans	-66.2	-43.6	174.5	0	0	0	0	0	112.3	D77 N84 C85	D77-A81 PolarHBondContact O-N 3.27Å; A81-N84 PolarHBondContact O-N 2.06Å; A81-C85 PolarHBondContact O-N 3.4Å; A81-C85 VanDerWaalsContact O-N 3.11Å
82	S	48.8	Very low	56.9	Low	70 Å²	70	75.6 Å²	75.6	49%	0.49	40%	0.399	S	S	.	.	H	α-helix	trans	-65.1	-43.6	177.9	49.4	0	0	0	0	112.9	E78 K79 N84 C85 D86	E78-S82 WeakPolarHBondContact O-CB 3.13Å; E78-S82 PolarHBondContact O-N 3.34Å; E78-S82 PolarHBondContact O-OG 3.31Å; K79-S82 WeakPolarHBondContact CA-OG 3.19Å; K79-S82 PolarHBondContact O-OG 3.38Å; S82-N84 PolarHBondContact O-N 3.25Å; S82-C85 VanDerWaalsContact O-CB 3.31Å; S82-C85 WeakPolarHBondContact O-CB 3.5Å; S82-C85 PolarHBondContact O-N 3.28Å; S82-C85 VanDerWaalsContact O-N 3.12Å; S82-D86 PolarHBondContact O-N 3.19Å; S82-D86 VanDerWaalsContact O-N 3.13Å
83	L	52.4	Low	59.1	Low	41 Å²	41	69.8 Å²	69.8	22%	0.215	37%	0.368	C	S	.	.	H	α-helix	trans	-63.4	-39.6	177.3	-171.9	80.5	0	0	0	112.6	K79 C85 D86 A87 G306 L411	K79-L83 WeakPolarHBondContact O-CB 2.88Å; K79-L83 PolarHBondContact O-N 3.47Å; L83-C85 VanDerWaalsContact C-N 3.27Å; L83-C85 PolarHBondContact O-N 3.09Å; L83-D86 PolarHBondContact O-N 2.92Å; L83-A87 PolarHBondContact O-N 2.93Å; L83-G306 WeakPolarHBondContact CD2-O 3.29Å; L83-L411 HydrophobicContact CD2-CD2 3.79Å
84	N	60.4	Low	61.5	Low	46 Å²	46	63.7 Å²	63.7	25%	0.246	34%	0.342	C	S	.	.	H	α-helix	trans	-62.5	-39.1	174.2	-71.8	-18.9	0	0	0	110.8	K80 A81 S82 I88 L411	K80-N84 WeakPolarHBondContact O-CB 3.07Å; K80-N84 PolarHBondContact O-N 3.06Å; K80-N84 VanDerWaalsContact O-N 3.17Å; K80-N84 PolarHBondContact O-ND2 3.25Å; A81-N84 PolarHBondContact O-N 2.06Å; S82-N84 PolarHBondContact O-N 3.25Å; N84-I88 HydrophobicContact CB-CD1 4.37Å; N84-I88 VanDerWaalsContact O-CB 3.28Å; N84-I88 WeakPolarHBondContact O-CB 3.28Å; N84-I88 VanDerWaalsContact O-CD1 3.22Å; N84-I88 WeakPolarHBondContact O-CD1 3.3Å; N84-I88 WeakPolarHBondContact O-CG1 3.33Å; N84-I88 PolarHBondContact O-N 3.24Å; N84-I88 VanDerWaalsContact O-N 3.09Å; N84-L411 WeakPolarHBondContact OD1-CD1 3.08Å
85	C	66.7	Low	64	Low	21 Å²	21	58.2 Å²	58.2	14%	0.142	31%	0.305	C	S	.	.	H	α-helix	trans	-61.7	-44.8	178.5	-134.9	0	0	0	0	112	C67 A81 S82 L83 A87 I88 T89	C67-C85 WeakPolarHBondContact CA-SG 3.45Å; C67-C85 WeakPolarHBondContact CB-SG 3.19Å; C67-C85 PolarHBondContact O-SG 3.47Å; C67-C85 VanDerWaalsContact O-SG 3.35Å; C67-C85 WeakPolarHBondContact SG-CB 3.22Å; C67-C85 CovalentContact SG-SG 2.03Å; C67-C85 PolarHBondContact SG-SG 3Å; A81-C85 PolarHBondContact O-N 3.4Å; A81-C85 VanDerWaalsContact O-N 3.11Å; S82-C85 VanDerWaalsContact O-CB 3.31Å; S82-C85 WeakPolarHBondContact O-CB 3.5Å; S82-C85 PolarHBondContact O-N 3.28Å; S82-C85 VanDerWaalsContact O-N 3.12Å; L83-C85 VanDerWaalsContact C-N 3.27Å; L83-C85 PolarHBondContact O-N 3.09Å; C85-A87 PolarHBondContact O-N 3.27Å; C85-I88 PolarHBondContact O-N 2.89Å; C85-T89 WeakPolarHBondContact O-CB 3.34Å; C85-T89 WeakPolarHBondContact O-CG2 3.26Å; C85-T89 PolarHBondContact O-N 3.3Å; C85-T89 PolarHBondContact O-OG1 3.26Å; C85-T89 VanDerWaalsContact O-OG1 3.11Å
86	D	60.3	Low	66.1	Low	36 Å²	36	50.7 Å²	50.7	19%	0.193	27%	0.272	C	S	.	.	H	α-helix	trans	-63.5	-40.7	-177.3	-175.8	37.4	0	0	0	113.8	R57 T61 S82 L83 T89 G90	R57-D86 VanDerWaalsContact CB-OD1 3.24Å; R57-D86 WeakPolarHBondContact CB-OD1 3.44Å; R57-D86 IonicContact CZ-OD2 3.27Å; R57-D86 VanDerWaalsContact NH1-CG 3.33Å; R57-D86 IonicContact NH1-OD1 2.9Å; R57-D86 PolarHBondContact NH1-OD1 3Å; R57-D86 IonicContact NH1-OD2 3.03Å; R57-D86 PolarHBondContact NH1-OD2 3.33Å; T61-D86 HydrophobicContact CG2-CB 4.36Å; S82-D86 PolarHBondContact O-N 3.19Å; S82-D86 VanDerWaalsContact O-N 3.13Å; L83-D86 PolarHBondContact O-N 2.92Å; D86-T89 WeakPolarHBondContact CA-OG1 3.37Å; D86-T89 PolarHBondContact O-OG1 3.02Å; D86-G90 PolarHBondContact O-N 3.26Å
87	A	59.9	Low	68.3	Low	7 Å²	7	44.6 Å²	44.6	6%	0.058	23%	0.234	C	C	.	.	H	α-helix	trans	-70.6	-38.7	174.6	0	0	0	0	0	112	L83 C85 F91 L310	L83-A87 PolarHBondContact O-N 2.93Å; C85-A87 PolarHBondContact O-N 3.27Å; A87-F91 WeakPolarHBondContact O-CD2 3.2Å; A87-F91 PolarHBondContact O-N 3.46Å; A87-L310 HydrophobicContact CB-CD1 4.36Å
88	I	66.8	Low	70.3	Confident	71 Å²	71	39.6 Å²	39.6	36%	0.364	21%	0.208	S	C	.	.	H	α-helix	trans	-68.2	-37.2	179.2	-69.3	167.6	0	0	0	111.2	N84 C85 G92	N84-I88 HydrophobicContact CB-CD1 4.37Å; N84-I88 VanDerWaalsContact O-CB 3.28Å; N84-I88 WeakPolarHBondContact O-CB 3.28Å; N84-I88 VanDerWaalsContact O-CD1 3.22Å; N84-I88 WeakPolarHBondContact O-CD1 3.3Å; N84-I88 WeakPolarHBondContact O-CG1 3.33Å; N84-I88 PolarHBondContact O-N 3.24Å; N84-I88 VanDerWaalsContact O-N 3.09Å; C85-I88 PolarHBondContact O-N 2.89Å; I88-G92 WeakPolarHBondContact O-CA 3.2Å; I88-G92 PolarHBondContact O-N 3.19Å
89	T	72.7	Confident	72.2	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-68.7	-46.1	-180	52.9	0	0	0	0	111.5	T61 L66 C67 C85 D86 G92 A93	T61-T89 HydrophobicContact CG2-CG2 3.89Å; L66-T89 HydrophobicContact CB-CG2 4.14Å; C67-T89 HydrophobicContact CB-CG2 4.36Å; C67-T89 WeakPolarHBondContact SG-CG2 3.12Å; C85-T89 WeakPolarHBondContact O-CB 3.34Å; C85-T89 WeakPolarHBondContact O-CG2 3.26Å; C85-T89 PolarHBondContact O-N 3.3Å; C85-T89 PolarHBondContact O-OG1 3.26Å; C85-T89 VanDerWaalsContact O-OG1 3.11Å; D86-T89 WeakPolarHBondContact CA-OG1 3.37Å; D86-T89 PolarHBondContact O-OG1 3.02Å; T89-G92 PolarHBondContact O-N 2.79Å; T89-A93 WeakPolarHBondContact O-CB 3.39Å; T89-A93 PolarHBondContact O-N 2.78Å
90	G	77.6	Confident	74.5	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-59.3	-54.2	178	0	0	0	0	0	112.2	D86 A93 V94	D86-G90 PolarHBondContact O-N 3.26Å; G90-A93 PolarHBondContact O-N 2.82Å; G90-V94 WeakPolarHBondContact O-CG2 3.37Å; G90-V94 PolarHBondContact O-N 2.97Å
91	F	79.4	Confident	76.8	Confident	24 Å²	24	21.1 Å²	21.1	11%	0.105	13%	0.125	C	C	.	.	H	α-helix	trans	-63.3	-44.5	176	-69.4	-31.9	0	0	0	112.1	L52 A87 A93 V94 Y95 L310 T402 L405	L52-F91 HydrophobicContact CD2-CD1 3.99Å; L52-F91 HydrophobicContact CD2-CE1 4.28Å; A87-F91 WeakPolarHBondContact O-CD2 3.2Å; A87-F91 PolarHBondContact O-N 3.46Å; F91-A93 PolarHBondContact O-N 3.01Å; F91-V94 WeakPolarHBondContact O-CB 3.48Å; F91-V94 PolarHBondContact O-N 3.35Å; F91-V94 VanDerWaalsContact O-N 3.07Å; F91-Y95 HydrophobicContact CB-CD2 4.4Å; F91-Y95 HydrophobicContact CB-CE2 4.29Å; F91-Y95 WeakPolarHBondContact O-CD2 3.26Å; F91-Y95 PolarHBondContact O-N 3.31Å; F91-L310 HydrophobicContact CD1-CD2 4.15Å; F91-L310 HydrophobicContact CE1-CD1 4.15Å; F91-L310 HydrophobicContact CE1-CD2 3.45Å; F91-L310 VanDerWaalsContact CE1-CD2 3.45Å; F91-L310 HydrophobicContact CE1-CG 4.25Å; F91-L310 HydrophobicContact CE2-CD1 3.59Å; F91-L310 HydrophobicContact CE2-CD2 4.38Å; F91-L310 HydrophobicContact CZ-CD1 3.37Å; F91-L310 HydrophobicContact CZ-CD2 3.59Å; F91-L310 HydrophobicContact CZ-CG 3.89Å; F91-T402 HydrophobicContact CB-CG2 4.39Å; F91-T402 HydrophobicContact CD1-CG2 3.79Å; F91-T402 HydrophobicContact CE1-CG2 4.34Å; F91-T402 HydrophobicContact CG-CG2 4.28Å; F91-L405 HydrophobicContact CE2-CD1 3.66Å; F91-L405 HydrophobicContact CZ-CD1 3.55Å
92	G	80.9	Confident	79	Confident	4 Å²	4	18.6 Å²	18.6	4%	0.041	10%	0.103	C	C	.	.	H	α-helix	trans	-58	-33.8	177.7	0	0	0	0	0	113.3	I88 T89 R96	I88-G92 WeakPolarHBondContact O-CA 3.2Å; I88-G92 PolarHBondContact O-N 3.19Å; T89-G92 PolarHBondContact O-N 2.79Å; G92-R96 VanDerWaalsContact C-NH1 3.31Å; G92-R96 WeakPolarHBondContact O-CD 3.31Å; G92-R96 VanDerWaalsContact O-CG 3.31Å; G92-R96 WeakPolarHBondContact O-CG 3.41Å; G92-R96 PolarHBondContact O-N 2.86Å; G92-R96 PolarHBondContact O-NH1 3.09Å
93	A	86.3	Confident	81.2	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-69.2	-45.3	173.6	0	0	0	0	0	111.4	A51 L60 T89 G90 F91 Y95 R96 I97 F145	A51-A93 HydrophobicContact CB-CB 3.94Å; L60-A93 HydrophobicContact CD1-CB 3.98Å; T89-A93 WeakPolarHBondContact O-CB 3.39Å; T89-A93 PolarHBondContact O-N 2.78Å; G90-A93 PolarHBondContact O-N 2.82Å; F91-A93 PolarHBondContact O-N 3.01Å; A93-Y95 PolarHBondContact O-N 2.95Å; A93-R96 PolarHBondContact O-N 2.98Å; A93-I97 WeakPolarHBondContact O-CG1 3.15Å; A93-I97 PolarHBondContact O-N 2.93Å; A93-F145 HydrophobicContact CB-CE1 4.18Å
94	V	89.6	Confident	83.4	Confident	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-57.7	-47.2	175.1	175.6	0	0	0	0	111.2	S48 L52 G90 F91 R96 I97 C98 M398 L401 T402	S48-V94 WeakPolarHBondContact O-CG2 3.32Å; L52-V94 HydrophobicContact CD1-CG2 4.1Å; L52-V94 HydrophobicContact CD2-CG2 3.83Å; L52-V94 HydrophobicContact CG-CG2 3.77Å; G90-V94 WeakPolarHBondContact O-CG2 3.37Å; G90-V94 PolarHBondContact O-N 2.97Å; F91-V94 WeakPolarHBondContact O-CB 3.48Å; F91-V94 PolarHBondContact O-N 3.35Å; F91-V94 VanDerWaalsContact O-N 3.07Å; V94-R96 VanDerWaalsContact C-N 3.26Å; V94-R96 PolarHBondContact O-N 2.56Å; V94-I97 PolarHBondContact O-N 3.19Å; V94-C98 WeakPolarHBondContact O-CB 3.44Å; V94-C98 PolarHBondContact O-N 3.27Å; V94-C98 PolarHBondContact O-SG 3.47Å; V94-C98 VanDerWaalsContact O-SG 3.41Å; V94-M398 HydrophobicContact CG1-CG 4.43Å; V94-L401 HydrophobicContact CG1-CB 4.13Å; V94-L401 HydrophobicContact CG1-CD1 4.18Å; V94-T402 HydrophobicContact CG1-CG2 4.24Å
95	Y	90.1	Very high	85.1	Confident	6 Å²	6	13.7 Å²	13.7	2%	0.024	7%	0.071	C	C	.	.	H	α-helix	trans	-55.3	-41.1	177.5	-82.5	-76.4	0	0	0	112.1	F91 A93 F99 T153 W156 M157 M398 T402	F91-Y95 HydrophobicContact CB-CD2 4.4Å; F91-Y95 HydrophobicContact CB-CE2 4.29Å; F91-Y95 WeakPolarHBondContact O-CD2 3.26Å; F91-Y95 PolarHBondContact O-N 3.31Å; A93-Y95 PolarHBondContact O-N 2.95Å; Y95-F99 WeakPolarHBondContact O-CB 3.38Å; Y95-F99 PolarHBondContact O-N 2.82Å; Y95-T153 HydrophobicContact CD2-CG2 3.76Å; Y95-T153 HydrophobicContact CE2-CG2 3.81Å; Y95-T153 HydrophobicContact CG-CG2 4.25Å; Y95-W156 HydrophobicContact CD1-CB 4.27Å; Y95-W156 AromaticContact CD1-CD1 3.6Å; Y95-W156 HydrophobicContact CD1-CG 4.24Å; Y95-W156 PolarHBondContact O-NE1 3.06Å; Y95-M157 HydrophobicContact CE1-CB 3.89Å; Y95-M157 WeakPolarHBondContact OH-CB 3.45Å; Y95-M157 WeakPolarHBondContact OH-CG 3.35Å; Y95-M398 HydrophobicContact CD1-CE 3.96Å; Y95-M398 HydrophobicContact CD1-CG 3.85Å; Y95-M398 HydrophobicContact CD1-SD 3.27Å; Y95-M398 WeakPolarHBondContact CD1-SD 3.46Å; Y95-M398 HydrophobicContact CE1-CE 3.81Å; Y95-M398 HydrophobicContact CE1-CG 3.99Å; Y95-M398 HydrophobicContact CE1-SD 3.68Å; Y95-M398 HydrophobicContact CG-CG 4.42Å; Y95-M398 HydrophobicContact CG-SD 4.14Å; Y95-T402 HydrophobicContact CD2-CG2 4.31Å; Y95-T402 HydrophobicContact CE2-CG2 3.72Å
96	R	91.3	Very high	86.6	Confident	3 Å²	3	16 Å²	16	1%	0.011	8%	0.081	C	C	.	.	H	α-helix	trans	-74.7	-43.3	-179.3	-70.4	170.7	174.2	94.6	-7	113.1	G92 A93 V94 F99 A100 A144 I147 F152	G92-R96 VanDerWaalsContact C-NH1 3.31Å; G92-R96 WeakPolarHBondContact O-CD 3.31Å; G92-R96 VanDerWaalsContact O-CG 3.31Å; G92-R96 WeakPolarHBondContact O-CG 3.41Å; G92-R96 PolarHBondContact O-N 2.86Å; G92-R96 PolarHBondContact O-NH1 3.09Å; A93-R96 PolarHBondContact O-N 2.98Å; V94-R96 VanDerWaalsContact C-N 3.26Å; V94-R96 PolarHBondContact O-N 2.56Å; R96-F99 WeakPolarHBondContact O-CB 3.36Å; R96-F99 PolarHBondContact O-N 2.62Å; R96-A100 PolarHBondContact O-N 2.77Å; R96-A144 HydrophobicContact CB-CB 4.14Å; R96-A144 VanDerWaalsContact CD-O 3.32Å; R96-A144 WeakPolarHBondContact CD-O 3.34Å; R96-A144 WeakPolarHBondContact CG-O 3.29Å; R96-A144 WeakPolarHBondContact O-CB 3.36Å; R96-I147 PolarHBondContact NE-O 3.15Å; R96-I147 VanDerWaalsContact NE-O 3.12Å; R96-I147 PolarHBondContact NH2-O 3.24Å; R96-F152 HydrophobicContact CG-CE1 3.9Å
97	I	94.2	Very high	88.3	Confident	9 Å²	9	18.3 Å²	18.3	5%	0.046	9%	0.093	C	C	.	.	H	α-helix	trans	-59.8	-49.1	175.4	-68.2	165.8	0	0	0	109.7	T44 L47 S48 A51 A93 V94 F99 A100 S101 L141 F145	T44-I97 HydrophobicContact CG2-CG2 3.93Å; L47-I97 HydrophobicContact CB-CD1 4.34Å; L47-I97 HydrophobicContact CB-CG2 4.28Å; S48-I97 WeakPolarHBondContact OG-CG2 3.1Å; A51-I97 HydrophobicContact CB-CD1 3.98Å; A93-I97 WeakPolarHBondContact O-CG1 3.15Å; A93-I97 PolarHBondContact O-N 2.93Å; V94-I97 PolarHBondContact O-N 3.19Å; I97-F99 PolarHBondContact O-N 3.08Å; I97-A100 PolarHBondContact O-N 2.58Å; I97-S101 PolarHBondContact O-N 3.13Å; I97-S101 PolarHBondContact O-OG 3.3Å; I97-L141 HydrophobicContact CB-CD2 4.28Å; I97-L141 HydrophobicContact CG1-CD2 4.43Å; I97-L141 HydrophobicContact CG2-CD2 3.9Å; I97-F145 HydrophobicContact CD1-CZ 4.16Å; I97-F145 HydrophobicContact CG1-CE2 3.99Å; I97-F145 HydrophobicContact CG1-CZ 3.86Å
98	C	95.4	Very high	90	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-64.8	-38.5	176.8	-69	0	0	0	0	111.9	V94 S101 T102 M398	V94-C98 WeakPolarHBondContact O-CB 3.44Å; V94-C98 PolarHBondContact O-N 3.27Å; V94-C98 PolarHBondContact O-SG 3.47Å; V94-C98 VanDerWaalsContact O-SG 3.41Å; C98-S101 PolarHBondContact O-N 3.06Å; C98-T102 WeakPolarHBondContact O-CB 2.99Å; C98-T102 PolarHBondContact O-N 3.01Å; C98-T102 PolarHBondContact O-OG1 2.59Å; C98-M398 HydrophobicContact CB-CB 3.79Å; C98-M398 HydrophobicContact CB-CG 4.05Å; C98-M398 HydrophobicContact CB-SD 4.03Å
99	F	95.3	Very high	91.2	Very high	48 Å²	48	15.3 Å²	15.3	21%	0.211	8%	0.077	C	C	.	.	H	α-helix	trans	-57.5	-50	175.3	176.2	-98.1	0	0	0	112.6	Y95 R96 I97 S101 T102 M103 A144 I147 F152 W156	Y95-F99 WeakPolarHBondContact O-CB 3.38Å; Y95-F99 PolarHBondContact O-N 2.82Å; R96-F99 WeakPolarHBondContact O-CB 3.36Å; R96-F99 PolarHBondContact O-N 2.62Å; I97-F99 PolarHBondContact O-N 3.08Å; F99-S101 VanDerWaalsContact C-N 3.33Å; F99-S101 PolarHBondContact O-N 3.05Å; F99-T102 PolarHBondContact O-N 3.38Å; F99-M103 HydrophobicContact CD1-CG 4.26Å; F99-M103 HydrophobicContact CD2-CG 4.33Å; F99-M103 HydrophobicContact CE1-CG 3.84Å; F99-M103 HydrophobicContact CE2-CE 4.23Å; F99-M103 HydrophobicContact CE2-CG 3.92Å; F99-M103 HydrophobicContact CE2-SD 4.11Å; F99-M103 HydrophobicContact CG-CG 4.49Å; F99-M103 HydrophobicContact CZ-CG 3.65Å; F99-M103 HydrophobicContact CZ-SD 4.09Å; F99-M103 WeakPolarHBondContact O-CG 3.41Å; F99-M103 PolarHBondContact O-N 3.24Å; F99-A144 HydrophobicContact CD1-CB 4.18Å; F99-I147 HydrophobicContact CD1-CD1 3.74Å; F99-I147 HydrophobicContact CE1-CD1 3.53Å; F99-I147 HydrophobicContact CZ-CD1 4.31Å; F99-F152 HydrophobicContact CB-CE2 4.4Å; F99-F152 HydrophobicContact CB-CZ 3.79Å; F99-F152 HydrophobicContact CD1-CE2 4.39Å; F99-F152 HydrophobicContact CD1-CZ 4.35Å; F99-F152 AromaticContact CD2-CE2 3.71Å; F99-F152 HydrophobicContact CD2-CE2 3.71Å; F99-F152 AromaticContact CD2-CZ 3.96Å; F99-F152 HydrophobicContact CD2-CZ 3.96Å; F99-F152 HydrophobicContact CE2-CE2 4.03Å; F99-F152 AromaticContact CG-CE2 3.91Å; F99-F152 HydrophobicContact CG-CE2 3.91Å; F99-F152 AromaticContact CG-CZ 3.77Å; F99-F152 HydrophobicContact CG-CZ 3.77Å; F99-W156 HydrophobicContact CB-CZ2 3.99Å; F99-W156 AromaticContact CD2-CD2 3.83Å; F99-W156 HydrophobicContact CD2-CD2 3.83Å; F99-W156 AromaticContact CD2-CE2 3.63Å; F99-W156 AromaticContact CD2-CE3 3.88Å; F99-W156 HydrophobicContact CD2-CE3 3.88Å; F99-W156 AromaticContact CD2-CH2 3.63Å; F99-W156 HydrophobicContact CD2-CH2 3.63Å; F99-W156 AromaticContact CD2-CZ2 3.59Å; F99-W156 HydrophobicContact CD2-CZ2 3.59Å; F99-W156 AromaticContact CD2-CZ3 3.77Å; F99-W156 HydrophobicContact CD2-CZ3 3.77Å; F99-W156 HydrophobicContact CE2-CE3 4.32Å; F99-W156 HydrophobicContact CE2-CH2 4.19Å; F99-W156 HydrophobicContact CE2-CZ3 4.05Å; F99-W156 HydrophobicContact CG-CZ2 4.24Å
100	A	96.3	Very high	92.3	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.008	10%	0.102	C	C	.	.	H	α-helix	trans	-56.2	-47.8	178.1	0	0	0	0	0	112	R96 I97 M103 F104 L140 L141 A144	R96-A100 PolarHBondContact O-N 2.77Å; I97-A100 PolarHBondContact O-N 2.58Å; A100-M103 PolarHBondContact O-N 2.88Å; A100-F104 PolarHBondContact O-N 2.86Å; A100-L140 HydrophobicContact CB-CB 4.08Å; A100-L140 WeakPolarHBondContact CB-O 3.23Å; A100-L141 HydrophobicContact CB-CB 4.44Å; A100-L141 HydrophobicContact CB-CD2 3.8Å; A100-L141 HydrophobicContact CB-CG 4.13Å; A100-A144 HydrophobicContact CB-CB 3.97Å
101	S	97	Very high	93.1	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-66.8	-40.1	178.4	-61.1	0	0	0	0	112.4	T44 I97 C98 F99 M103 F104 Y105 W137	T44-S101 WeakPolarHBondContact CG2-OG 3.24Å; T44-S101 PolarHBondContact OG1-OG 2.94Å; I97-S101 PolarHBondContact O-N 3.13Å; I97-S101 PolarHBondContact O-OG 3.3Å; C98-S101 PolarHBondContact O-N 3.06Å; F99-S101 VanDerWaalsContact C-N 3.33Å; F99-S101 PolarHBondContact O-N 3.05Å; S101-M103 VanDerWaalsContact C-N 3.33Å; S101-M103 PolarHBondContact O-N 3.48Å; S101-F104 WeakPolarHBondContact O-CB 3.43Å; S101-F104 PolarHBondContact O-N 3.37Å; S101-Y105 WeakPolarHBondContact O-CD2 3.39Å; S101-Y105 PolarHBondContact O-N 3.42Å; S101-W137 PolarHBondContact OG-NE1 2.69Å
102	T	97	Very high	93.8	Very high	3 Å²	3	20.7 Å²	20.7	2%	0.018	11%	0.109	C	C	.	.	H	α-helix	trans	-60.2	-43.4	174.5	-58	0	0	0	0	111	C98 F99 Y105 L106 W156 L391 T394 L395	C98-T102 WeakPolarHBondContact O-CB 2.99Å; C98-T102 PolarHBondContact O-N 3.01Å; C98-T102 PolarHBondContact O-OG1 2.59Å; F99-T102 PolarHBondContact O-N 3.38Å; T102-Y105 PolarHBondContact O-N 3.37Å; T102-L106 VanDerWaalsContact O-CB 3.26Å; T102-L106 WeakPolarHBondContact O-CB 3.27Å; T102-L106 PolarHBondContact O-N 2.87Å; T102-W156 HydrophobicContact CG2-CH2 3.74Å; T102-W156 HydrophobicContact CG2-CZ2 3.94Å; T102-L391 HydrophobicContact CG2-CD1 4.35Å; T102-L391 HydrophobicContact CG2-CD2 3.75Å; T102-L391 HydrophobicContact CG2-CG 3.61Å; T102-T394 WeakPolarHBondContact CA-OG1 3.11Å; T102-T394 WeakPolarHBondContact OG1-CB 3.49Å; T102-T394 PolarHBondContact OG1-OG1 2.84Å; T102-L395 HydrophobicContact CG2-CD1 4.47Å; T102-L395 HydrophobicContact CG2-CD2 4.02Å; T102-L395 HydrophobicContact CG2-CG 4.13Å
103	M	96.6	Very high	94.2	Very high	55 Å²	55	24 Å²	24	27%	0.271	13%	0.125	S	C	.	.	H	α-helix	trans	-65.9	-37.6	176.8	-68.8	-57.1	97.4	0	0	112.3	F99 A100 S101 L106 L107 W156	F99-M103 HydrophobicContact CD1-CG 4.26Å; F99-M103 HydrophobicContact CD2-CG 4.33Å; F99-M103 HydrophobicContact CE1-CG 3.84Å; F99-M103 HydrophobicContact CE2-CE 4.23Å; F99-M103 HydrophobicContact CE2-CG 3.92Å; F99-M103 HydrophobicContact CE2-SD 4.11Å; F99-M103 HydrophobicContact CG-CG 4.49Å; F99-M103 HydrophobicContact CZ-CG 3.65Å; F99-M103 HydrophobicContact CZ-SD 4.09Å; F99-M103 WeakPolarHBondContact O-CG 3.41Å; F99-M103 PolarHBondContact O-N 3.24Å; A100-M103 PolarHBondContact O-N 2.88Å; S101-M103 VanDerWaalsContact C-N 3.33Å; S101-M103 PolarHBondContact O-N 3.48Å; M103-L106 HydrophobicContact CE-CD2 3.83Å; M103-L106 PolarHBondContact O-N 3.2Å; M103-L106 HydrophobicContact SD-CD2 4.14Å; M103-L107 WeakPolarHBondContact O-CB 3.23Å; M103-L107 PolarHBondContact O-N 2.93Å; M103-W156 HydrophobicContact CE-CH2 3.88Å; M103-W156 HydrophobicContact CE-CZ3 4.41Å
104	F	97.4	Very high	94.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61	-50.1	174.1	177.2	-98.1	0	0	0	111.8	F37 I40 A100 S101 L106 L107 F108 K133 W137 L140	F37-F104 AromaticContact CD1-CE1 4Å; F37-F104 HydrophobicContact CD1-CE1 4Å; F37-F104 AromaticContact CE1-CE1 3.82Å; F37-F104 HydrophobicContact CE1-CE1 3.82Å; F37-F104 HydrophobicContact CE1-CZ 4.01Å; I40-F104 HydrophobicContact CD1-CE1 3.67Å; I40-F104 HydrophobicContact CD1-CZ 3.86Å; I40-F104 HydrophobicContact CG2-CD1 4.49Å; I40-F104 HydrophobicContact CG2-CE1 4.43Å; A100-F104 PolarHBondContact O-N 2.86Å; S101-F104 WeakPolarHBondContact O-CB 3.43Å; S101-F104 PolarHBondContact O-N 3.37Å; F104-L106 VanDerWaalsContact C-N 3.32Å; F104-L106 PolarHBondContact O-N 3.11Å; F104-L107 PolarHBondContact O-N 3.03Å; F104-F108 HydrophobicContact CD2-CD2 4.47Å; F104-F108 HydrophobicContact CD2-CE2 4.34Å; F104-F108 HydrophobicContact CE1-CD2 4.18Å; F104-F108 HydrophobicContact CE1-CE2 4.3Å; F104-F108 HydrophobicContact CE2-CD2 4.07Å; F104-F108 AromaticContact CE2-CE2 3.6Å; F104-F108 HydrophobicContact CE2-CE2 3.6Å; F104-F108 AromaticContact CZ-CD2 3.9Å; F104-F108 HydrophobicContact CZ-CD2 3.9Å; F104-F108 AromaticContact CZ-CE2 3.58Å; F104-F108 HydrophobicContact CZ-CE2 3.58Å; F104-F108 PolarHBondContact O-N 2.86Å; F104-K133 HydrophobicContact CE2-CB 4.48Å; F104-K133 HydrophobicContact CZ-CB 4.22Å; F104-W137 HydrophobicContact CD2-CB 3.86Å; F104-W137 HydrophobicContact CE2-CB 3.96Å; F104-W137 HydrophobicContact CG-CB 4.21Å; F104-W137 AromaticContact CG-CD1 3.97Å; F104-W137 HydrophobicContact CG-CG 4.47Å; F104-W137 HydrophobicContact CZ-CB 4.41Å; F104-L140 HydrophobicContact CB-CD1 3.87Å; F104-L140 HydrophobicContact CD2-CD1 4.33Å
105	Y	97.1	Very high	94.3	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-67.4	-33	176.5	-69.2	-65.5	0	0	0	112.4	F37 L41 S101 T102 F108 C109 M390 T394	F37-Y105 HydrophobicContact CB-CE1 4.31Å; F37-Y105 HydrophobicContact CD1-CE1 4.05Å; F37-Y105 PolarHBondContact O-OH 3.44Å; L41-Y105 WeakPolarHBondContact CB-OH 3.43Å; L41-Y105 PolarHBondContact N-OH 3.28Å; L41-Y105 VanDerWaalsContact N-OH 3.11Å; S101-Y105 WeakPolarHBondContact O-CD2 3.39Å; S101-Y105 PolarHBondContact O-N 3.42Å; T102-Y105 PolarHBondContact O-N 3.37Å; Y105-F108 PolarHBondContact O-N 2.65Å; Y105-C109 WeakPolarHBondContact O-CB 3.15Å; Y105-C109 PolarHBondContact O-N 2.91Å; Y105-M390 HydrophobicContact CD1-CB 3.57Å; Y105-M390 HydrophobicContact CD1-CG 4.44Å; Y105-M390 HydrophobicContact CD2-CB 4.25Å; Y105-M390 HydrophobicContact CE1-CB 3.67Å; Y105-M390 HydrophobicContact CE1-CG 4.21Å; Y105-M390 HydrophobicContact CE2-CB 4.36Å; Y105-M390 HydrophobicContact CG-CB 3.89Å; Y105-T394 HydrophobicContact CD2-CG2 3.71Å; Y105-T394 HydrophobicContact CE2-CG2 3.65Å
106	L	96.8	Very high	94	Very high	69 Å²	69	39.6 Å²	39.6	36%	0.361	19%	0.19	S	C	.	.	H	α-helix	trans	-63.2	-43.1	174.7	-177.7	61.1	0	0	0	111.7	T102 M103 F104 F108 C109 V110 L391	T102-L106 VanDerWaalsContact O-CB 3.26Å; T102-L106 WeakPolarHBondContact O-CB 3.27Å; T102-L106 PolarHBondContact O-N 2.87Å; M103-L106 HydrophobicContact CE-CD2 3.83Å; M103-L106 PolarHBondContact O-N 3.2Å; M103-L106 HydrophobicContact SD-CD2 4.14Å; F104-L106 VanDerWaalsContact C-N 3.32Å; F104-L106 PolarHBondContact O-N 3.11Å; L106-F108 VanDerWaalsContact C-N 3.35Å; L106-F108 PolarHBondContact O-N 3.38Å; L106-C109 WeakPolarHBondContact O-CB 3.33Å; L106-C109 PolarHBondContact O-N 2.92Å; L106-V110 HydrophobicContact CD1-CG2 4.44Å; L106-V110 WeakPolarHBondContact O-CG2 3.4Å; L106-V110 PolarHBondContact O-N 3.24Å; L106-L391 HydrophobicContact CB-CD1 3.66Å; L106-L391 HydrophobicContact CD1-CD1 3.71Å; L106-L391 HydrophobicContact CG-CD1 4.23Å
107	L	96.1	Very high	93.6	Very high	84 Å²	84	40.6 Å²	40.6	44%	0.44	20%	0.197	S	C	.	.	H	α-helix	trans	-58	-48.7	175.8	177.8	65.2	0	0	0	110.9	M103 F104 V110 I111	M103-L107 WeakPolarHBondContact O-CB 3.23Å; M103-L107 PolarHBondContact O-N 2.93Å; F104-L107 PolarHBondContact O-N 3.03Å; L107-V110 PolarHBondContact O-N 3.2Å; L107-I111 HydrophobicContact CD1-CD1 3.97Å; L107-I111 HydrophobicContact CD1-CG1 4.49Å; L107-I111 HydrophobicContact CG-CD1 3.9Å; L107-I111 VanDerWaalsContact O-CG1 3.28Å; L107-I111 WeakPolarHBondContact O-CG1 3.36Å; L107-I111 PolarHBondContact O-N 3.19Å
108	F	95.2	Very high	93.1	Very high	12 Å²	12	40.6 Å²	40.6	5%	0.053	20%	0.198	C	C	.	.	H	α-helix	trans	-66.6	-36.7	177.1	-88.1	-84.2	0	0	0	112.8	F37 F104 Y105 L106 V110 I111 M112 L125 K133	F37-F108 HydrophobicContact CE1-CD1 4.31Å; F37-F108 HydrophobicContact CE1-CD2 4.25Å; F37-F108 HydrophobicContact CE1-CE1 4.44Å; F37-F108 HydrophobicContact CE1-CE2 4.38Å; F37-F108 HydrophobicContact CE1-CG 4.24Å; F37-F108 HydrophobicContact CE1-CZ 4.49Å; F37-F108 AromaticContact CZ-CD1 3.87Å; F37-F108 HydrophobicContact CZ-CD1 3.87Å; F37-F108 AromaticContact CZ-CE1 3.92Å; F37-F108 HydrophobicContact CZ-CE1 3.92Å; F37-F108 HydrophobicContact CZ-CG 4.25Å; F37-F108 HydrophobicContact CZ-CZ 4.32Å; F104-F108 HydrophobicContact CD2-CD2 4.47Å; F104-F108 HydrophobicContact CD2-CE2 4.34Å; F104-F108 HydrophobicContact CE1-CD2 4.18Å; F104-F108 HydrophobicContact CE1-CE2 4.3Å; F104-F108 HydrophobicContact CE2-CD2 4.07Å; F104-F108 AromaticContact CE2-CE2 3.6Å; F104-F108 HydrophobicContact CE2-CE2 3.6Å; F104-F108 AromaticContact CZ-CD2 3.9Å; F104-F108 HydrophobicContact CZ-CD2 3.9Å; F104-F108 AromaticContact CZ-CE2 3.58Å; F104-F108 HydrophobicContact CZ-CE2 3.58Å; F104-F108 PolarHBondContact O-N 2.86Å; Y105-F108 PolarHBondContact O-N 2.65Å; L106-F108 VanDerWaalsContact C-N 3.35Å; L106-F108 PolarHBondContact O-N 3.38Å; F108-V110 PolarHBondContact O-N 3.37Å; F108-I111 PolarHBondContact O-N 3.29Å; F108-M112 HydrophobicContact CD1-CE 3.9Å; F108-M112 HydrophobicContact CE1-CE 4.18Å; F108-M112 WeakPolarHBondContact O-CB 3.5Å; F108-M112 WeakPolarHBondContact O-CG 3.09Å; F108-M112 PolarHBondContact O-N 2.95Å; F108-L125 HydrophobicContact CE1-CG 4.29Å; F108-K133 HydrophobicContact CE1-CD 4.49Å; F108-K133 HydrophobicContact CE2-CG 4.37Å; F108-K133 HydrophobicContact CZ-CD 3.97Å; F108-K133 HydrophobicContact CZ-CG 3.81Å
109	C	93.9	Very high	92.5	Very high	4 Å²	4	47 Å²	47	3%	0.027	23%	0.23	C	C	.	.	H	α-helix	trans	-55.7	-50.8	172.9	-172	0	0	0	0	110.5	Y105 L106 M112 F384 H387	Y105-C109 WeakPolarHBondContact O-CB 3.15Å; Y105-C109 PolarHBondContact O-N 2.91Å; L106-C109 WeakPolarHBondContact O-CB 3.33Å; L106-C109 PolarHBondContact O-N 2.92Å; C109-M112 PolarHBondContact O-N 3.1Å; C109-F384 VanDerWaalsContact O-CD2 3.3Å; C109-F384 WeakPolarHBondContact O-CD2 3.11Å; C109-F384 WeakPolarHBondContact SG-CD2 3.31Å; C109-F384 WeakPolarHBondContact SG-CE2 3.49Å; C109-H387 HydrophobicContact CB-CB 3.87Å
110	V	95.5	Very high	92.1	Very high	86 Å²	86	47.2 Å²	47.2	52%	0.521	23%	0.233	S	C	.	.	H	α-helix	trans	-64.4	-43	179.4	174.5	0	0	0	0	112.5	L106 L107 F108 M112 I113	L106-V110 HydrophobicContact CD1-CG2 4.44Å; L106-V110 WeakPolarHBondContact O-CG2 3.4Å; L106-V110 PolarHBondContact O-N 3.24Å; L107-V110 PolarHBondContact O-N 3.2Å; F108-V110 PolarHBondContact O-N 3.37Å; V110-M112 VanDerWaalsContact C-N 3.28Å; V110-M112 PolarHBondContact O-N 3.46Å; V110-I113 HydrophobicContact CG1-CD1 4.48Å; V110-I113 WeakPolarHBondContact O-CD1 3.46Å; V110-I113 WeakPolarHBondContact O-CG1 3.28Å; V110-I113 PolarHBondContact O-N 3.36Å
111	I	94.5	Very high	91.8	Very high	50 Å²	50	56.3 Å²	56.3	26%	0.256	27%	0.267	S	S	.	.	H	α-helix	trans	-64.5	-35	-180	-66	166.6	0	0	0	111.4	L107 F108 I113 R122 L125	L107-I111 HydrophobicContact CD1-CD1 3.97Å; L107-I111 HydrophobicContact CD1-CG1 4.49Å; L107-I111 HydrophobicContact CG-CD1 3.9Å; L107-I111 VanDerWaalsContact O-CG1 3.28Å; L107-I111 WeakPolarHBondContact O-CG1 3.36Å; L107-I111 PolarHBondContact O-N 3.19Å; F108-I111 PolarHBondContact O-N 3.29Å; I111-I113 VanDerWaalsContact C-N 3.32Å; I111-I113 PolarHBondContact O-N 2.64Å; I111-R122 HydrophobicContact CG2-CG 4.44Å; I111-R122 WeakPolarHBondContact O-CD 3.47Å; I111-L125 HydrophobicContact CD1-CD2 4.27Å; I111-L125 HydrophobicContact CG2-CD2 4.24Å
112	M	92.9	Very high	91.5	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	11.3	-174.6	-60.1	-53.9	153.9	0	0	114.5	F108 C109 V110 R114 V115 R122 Q126 Y383	F108-M112 HydrophobicContact CD1-CE 3.9Å; F108-M112 HydrophobicContact CE1-CE 4.18Å; F108-M112 WeakPolarHBondContact O-CB 3.5Å; F108-M112 WeakPolarHBondContact O-CG 3.09Å; F108-M112 PolarHBondContact O-N 2.95Å; C109-M112 PolarHBondContact O-N 3.1Å; V110-M112 VanDerWaalsContact C-N 3.28Å; V110-M112 PolarHBondContact O-N 3.46Å; M112-R114 PolarHBondContact O-N 2.84Å; M112-V115 HydrophobicContact SD-CG2 4.2Å; M112-R122 WeakPolarHBondContact CE-O 3.37Å; M112-R122 HydrophobicContact SD-CB 4.32Å; M112-Q126 HydrophobicContact CE-CB 3.74Å; M112-Q126 HydrophobicContact SD-CB 3.96Å; M112-Y383 HydrophobicContact SD-CD2 4.11Å
113	I	90.7	Very high	91.1	Very high	75 Å²	75	59 Å²	59	39%	0.385	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	124.8	174.1	-66.6	170.6	0	0	0	110	V110 I111 V115 R122 F384	V110-I113 HydrophobicContact CG1-CD1 4.48Å; V110-I113 WeakPolarHBondContact O-CD1 3.46Å; V110-I113 WeakPolarHBondContact O-CG1 3.28Å; V110-I113 PolarHBondContact O-N 3.36Å; I111-I113 VanDerWaalsContact C-N 3.32Å; I111-I113 PolarHBondContact O-N 2.64Å; I113-V115 PolarHBondContact O-N 3.28Å; I113-R122 PolarHBondContact O-NH1 2.88Å; I113-F384 HydrophobicContact CD1-CD2 4.48Å; I113-F384 HydrophobicContact CD1-CE2 4.35Å; I113-F384 HydrophobicContact CG1-CD2 3.52Å; I113-F384 HydrophobicContact CG1-CE2 3.85Å
114	R	88.7	Confident	90.6	Very high	201 Å²	201	63 Å²	63	76%	0.758	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	48	176.9	-61.8	179.3	-179.9	175	-0.8	113.5	M112 R122	M112-R114 PolarHBondContact O-N 2.84Å; R114-R122 PolarHBondContact O-NH2 3.17Å
115	V	87.4	Confident	90.3	Very high	5 Å²	5	65.5 Å²	65.5	3%	0.03	31%	0.306	C	S	.	.			trans	-89.9	121.6	164.3	177.8	0	0	0	0	107.7	M112 I113 D120 R122 A123 V379 Y383	M112-V115 HydrophobicContact SD-CG2 4.2Å; I113-V115 PolarHBondContact O-N 3.28Å; V115-D120 HydrophobicContact CG1-CB 4.27Å; V115-R122 HydrophobicContact CG2-CB 3.99Å; V115-A123 HydrophobicContact CG1-CB 4.29Å; V115-V379 HydrophobicContact CG1-CG1 4.38Å; V115-Y383 HydrophobicContact CB-CD2 4.04Å; V115-Y383 HydrophobicContact CG1-CD2 3.79Å; V115-Y383 HydrophobicContact CG1-CE2 3.82Å
116	H	84	Confident	89.9	Confident	127 Å²	127	65.5 Å²	65.5	59%	0.588	31%	0.306	S	S	*	.			trans	-108.8	-20.7	-175.6	-69.7	-82.1	0	0	0	113.3	G378 V379	H116-G378 CarbonylContact O-C 3.59Å; H116-G378 WeakPolarHBondContact O-CA 3.42Å; H116-V379 PolarHBondContact O-N 3.41Å
117	S	84.3	Confident	89.4	Confident	24 Å²	24	63.2 Å²	63.2	17%	0.168	29%	0.294	C	S	.	.	S	Bend	trans	-144.8	153	-177.1	159.3	0	0	0	0	110.8	M119 D120 K376	S117-M119 PolarHBondContact O-N 3.22Å; S117-M119 WeakPolarHBondContact OG-CB 3.42Å; S117-M119 WeakPolarHBondContact OG-CG 3.05Å; S117-M119 PolarHBondContact OG-N 3.12Å; S117-D120 PolarHBondContact O-N 3.29Å; S117-K376 PolarHBondContact OG-O 2.95Å
118	S	83.1	Confident	88.8	Confident	8 Å²	8	60.2 Å²	60.2	6%	0.056	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-11.8	173.6	72.3	0	0	0	0	114.1	D120 A123 D373 E375 K376	S118-D120 VanDerWaalsContact C-N 3.25Å; S118-D120 PolarHBondContact O-N 3.21Å; S118-A123 WeakPolarHBondContact O-CB 3.02Å; S118-D373 WeakPolarHBondContact CB-OD2 3.49Å; S118-D373 VanDerWaalsContact OG-CG 3.27Å; S118-D373 PolarHBondContact OG-OD1 2.87Å; S118-D373 PolarHBondContact OG-OD2 3.48Å; S118-E375 WeakPolarHBondContact CB-O 3.11Å; S118-E375 PolarHBondContact N-O 3.25Å; S118-E375 VanDerWaalsContact OG-C 3.23Å; S118-E375 PolarHBondContact OG-O 3.16Å; S118-K376 WeakPolarHBondContact OG-CA 3.34Å; S118-K376 PolarHBondContact OG-N 3.06Å
119	M	82.7	Confident	88.5	Confident	136 Å²	136	65.7 Å²	65.7	67%	0.67	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-20.2	177.3	-63.9	-60.1	-70.9	0	0	112.7	S117	S117-M119 PolarHBondContact O-N 3.22Å; S117-M119 WeakPolarHBondContact OG-CB 3.42Å; S117-M119 WeakPolarHBondContact OG-CG 3.05Å; S117-M119 PolarHBondContact OG-N 3.12Å
120	D	87.6	Confident	88.1	Confident	51 Å²	51	65.8 Å²	65.8	27%	0.273	31%	0.307	S	S	.	.	S	Bend	trans	-61.1	138.2	173.7	-83.4	-12.2	0	0	0	111	V115 S117 S118 R122 A123 K124	V115-D120 HydrophobicContact CG1-CB 4.27Å; S117-D120 PolarHBondContact O-N 3.29Å; S118-D120 VanDerWaalsContact C-N 3.25Å; S118-D120 PolarHBondContact O-N 3.21Å; D120-R122 PolarHBondContact O-N 3.24Å; D120-R122 VanDerWaalsContact O-N 3.07Å; D120-R122 IonicContact OD2-CZ 2.62Å; D120-R122 IonicContact OD2-NE 3.08Å; D120-R122 IonicContact OD2-NH2 2.78Å; D120-R122 PolarHBondContact OD2-NH2 3.13Å; D120-A123 HydrophobicContact CB-CB 4.49Å; D120-A123 WeakPolarHBondContact O-CB 3.28Å; D120-A123 PolarHBondContact O-N 3.49Å; D120-K124 PolarHBondContact O-N 3.07Å
121	W	89.2	Confident	87.7	Confident	192 Å²	192	67.3 Å²	67.3	73%	0.727	31%	0.307	S	S	*	.	H	α-helix	trans	-56.3	-30	175.3	73.7	-79.6	0	0	0	112.7	K124 L125	W121-K124 WeakPolarHBondContact O-CB 3.35Å; W121-K124 PolarHBondContact O-N 3.04Å; W121-L125 PolarHBondContact O-N 3.37Å
122	R	91.4	Very high	87.5	Confident	59 Å²	59	71.1 Å²	71.1	22%	0.223	32%	0.322	C	S	.	.	H	α-helix	trans	-64.8	-36.9	174.7	-62.4	171.4	-69.1	168.5	5.7	111.9	I111 M112 I113 R114 V115 D120 K124 L125 Q126	I111-R122 HydrophobicContact CG2-CG 4.44Å; I111-R122 WeakPolarHBondContact O-CD 3.47Å; M112-R122 WeakPolarHBondContact CE-O 3.37Å; M112-R122 HydrophobicContact SD-CB 4.32Å; I113-R122 PolarHBondContact O-NH1 2.88Å; R114-R122 PolarHBondContact O-NH2 3.17Å; V115-R122 HydrophobicContact CG2-CB 3.99Å; D120-R122 PolarHBondContact O-N 3.24Å; D120-R122 VanDerWaalsContact O-N 3.07Å; D120-R122 IonicContact OD2-CZ 2.62Å; D120-R122 IonicContact OD2-NE 3.08Å; D120-R122 IonicContact OD2-NH2 2.78Å; D120-R122 PolarHBondContact OD2-NH2 3.13Å; R122-K124 VanDerWaalsContact C-N 3.3Å; R122-K124 PolarHBondContact O-N 3.45Å; R122-L125 WeakPolarHBondContact O-CA 3.44Å; R122-L125 WeakPolarHBondContact O-CB 3.46Å; R122-L125 PolarHBondContact O-N 3.14Å; R122-L125 VanDerWaalsContact O-N 3.11Å; R122-Q126 PolarHBondContact O-N 2.89Å
123	A	87.1	Confident	87.6	Confident	1 Å²	1	71.4 Å²	71.4	1%	0.008	32%	0.323	C	S	.	.	H	α-helix	trans	-69.1	-29.7	175.8	0	0	0	0	0	112.2	V115 S118 D120 L125 Q126 N127 Y383	V115-A123 HydrophobicContact CG1-CB 4.29Å; S118-A123 WeakPolarHBondContact O-CB 3.02Å; D120-A123 HydrophobicContact CB-CB 4.49Å; D120-A123 WeakPolarHBondContact O-CB 3.28Å; D120-A123 PolarHBondContact O-N 3.49Å; A123-L125 VanDerWaalsContact C-N 3.28Å; A123-L125 PolarHBondContact O-N 3.49Å; A123-Q126 WeakPolarHBondContact O-CB 3.42Å; A123-Q126 PolarHBondContact O-N 3.36Å; A123-Q126 VanDerWaalsContact O-N 3.15Å; A123-N127 PolarHBondContact O-N 3Å; A123-Y383 HydrophobicContact CB-CE2 4.03Å
124	K	86.7	Confident	87.7	Confident	140 Å²	140	69.2 Å²	69.2	61%	0.609	31%	0.31	S	S	*	.	H	α-helix	trans	-62.3	-38	169.3	-57.7	-175.9	179.5	179.3	0	111.5	D120 W121 R122 G128	D120-K124 PolarHBondContact O-N 3.07Å; W121-K124 WeakPolarHBondContact O-CB 3.35Å; W121-K124 PolarHBondContact O-N 3.04Å; R122-K124 VanDerWaalsContact C-N 3.3Å; R122-K124 PolarHBondContact O-N 3.45Å; K124-G128 WeakPolarHBondContact O-CA 3.27Å; K124-G128 PolarHBondContact O-N 3.13Å
125	L	90.5	Very high	87.9	Confident	52 Å²	52	64.5 Å²	64.5	27%	0.272	30%	0.299	S	S	.	.	H	α-helix	trans	-68.4	-39.1	171.8	-174	64.7	0	0	0	111.6	F108 I111 W121 R122 A123 F129 K133	F108-L125 HydrophobicContact CE1-CG 4.29Å; I111-L125 HydrophobicContact CD1-CD2 4.27Å; I111-L125 HydrophobicContact CG2-CD2 4.24Å; W121-L125 PolarHBondContact O-N 3.37Å; R122-L125 WeakPolarHBondContact O-CA 3.44Å; R122-L125 WeakPolarHBondContact O-CB 3.46Å; R122-L125 PolarHBondContact O-N 3.14Å; R122-L125 VanDerWaalsContact O-N 3.11Å; A123-L125 VanDerWaalsContact C-N 3.28Å; A123-L125 PolarHBondContact O-N 3.49Å; L125-F129 HydrophobicContact CD1-CD2 4.49Å; L125-K133 WeakPolarHBondContact O-CE 3.24Å; L125-K133 PolarHBondContact O-NZ 2.98Å
126	Q	90	Very high	88.2	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-60.9	-46.8	176.7	178.5	66.3	8.5	0	0	112.6	M112 R122 A123 K133 Y381 Y383 H387	M112-Q126 HydrophobicContact CE-CB 3.74Å; M112-Q126 HydrophobicContact SD-CB 3.96Å; R122-Q126 PolarHBondContact O-N 2.89Å; A123-Q126 WeakPolarHBondContact O-CB 3.42Å; A123-Q126 PolarHBondContact O-N 3.36Å; A123-Q126 VanDerWaalsContact O-N 3.15Å; Q126-K133 VanDerWaalsContact C-NZ 3.34Å; Q126-K133 PolarHBondContact O-NZ 3.44Å; Q126-Y381 PolarHBondContact NE2-OH 3Å; Q126-Y383 HydrophobicContact CB-CD2 4.34Å; Q126-Y383 HydrophobicContact CB-CE2 4.15Å; Q126-Y383 HydrophobicContact CG-CD2 3.92Å; Q126-Y383 HydrophobicContact CG-CE2 3.81Å; Q126-Y383 HydrophobicContact CG-CG 4.41Å; Q126-H387 PolarHBondContact NE2-NE2 2.93Å; Q126-H387 PolarHBondContact OE1-NE2 3.19Å
127	N	86.1	Confident	88.8	Confident	21 Å²	21	60.9 Å²	60.9	11%	0.112	29%	0.288	C	S	.	.	H	α-helix	trans	-93.9	-20.5	-172.3	-66.2	-31.3	0	0	0	113.4	S33 A123 W130	S33-N127 VanDerWaalsContact CB-OD1 3.25Å; S33-N127 WeakPolarHBondContact CB-OD1 3.48Å; S33-N127 PolarHBondContact OG-OD1 3.41Å; A123-N127 PolarHBondContact O-N 3Å; N127-W130 PolarHBondContact O-NE1 2.78Å
128	G	84.3	Confident	89.3	Confident	20 Å²	20	64.7 Å²	64.7	21%	0.206	30%	0.301	C	S	.	.	S	Bend	trans	-110.1	-166.3	-177.3	0	0	0	0	0	115.3	K124 W130 K133	K124-G128 WeakPolarHBondContact O-CA 3.27Å; K124-G128 PolarHBondContact O-N 3.13Å; G128-W130 VanDerWaalsContact C-N 3.3Å; G128-W130 PolarHBondContact O-N 3.31Å; G128-W130 VanDerWaalsContact O-N 3.16Å; G128-K133 VanDerWaalsContact O-CE 3.24Å; G128-K133 WeakPolarHBondContact O-CE 3.39Å; G128-K133 PolarHBondContact O-NZ 2.96Å
129	F	87.2	Confident	89.9	Confident	127 Å²	127	66.3 Å²	66.3	56%	0.557	32%	0.319	S	S	*	.			trans	51.1	37.1	172.1	-59.5	-79.9	0	0	0	115.9	L125 F131 F132 K133	L125-F129 HydrophobicContact CD1-CD2 4.49Å; F129-F131 VanDerWaalsContact C-N 3.35Å; F129-F131 PolarHBondContact O-N 2.72Å; F129-F132 HydrophobicContact CB-CD2 4.29Å; F129-F132 AromaticContact CD1-CD2 3.96Å; F129-F132 HydrophobicContact CD1-CD2 3.96Å; F129-F132 HydrophobicContact CD1-CE2 4.24Å; F129-F132 PolarHBondContact O-N 3.01Å; F129-K133 PolarHBondContact O-N 3.24Å; F129-K133 VanDerWaalsContact O-N 3.14Å
130	W	87.2	Confident	90.5	Very high	7 Å²	7	62.8 Å²	62.8	3%	0.027	30%	0.303	C	S	.	.	H	α-helix	trans	-55.8	-42.4	-177.2	-68.1	106.6	0	0	0	114.2	S14 S33 M36 F37 N127 G128 F132 K133 Y134	S14-W130 PolarHBondContact OG-NE1 3.2Å; S33-W130 VanDerWaalsContact CA-CZ2 3.48Å; S33-W130 VanDerWaalsContact O-CH2 3.29Å; S33-W130 WeakPolarHBondContact O-CH2 3.36Å; M36-W130 HydrophobicContact CB-CD2 4.01Å; M36-W130 HydrophobicContact CB-CE3 3.59Å; M36-W130 HydrophobicContact CB-CH2 3.4Å; M36-W130 HydrophobicContact CB-CZ2 3.81Å; M36-W130 HydrophobicContact CB-CZ3 3.26Å; M36-W130 HydrophobicContact CE-CB 4.41Å; M36-W130 HydrophobicContact CE-CD2 4.08Å; M36-W130 HydrophobicContact CE-CE3 4.22Å; M36-W130 HydrophobicContact CE-CG 4.14Å; M36-W130 HydrophobicContact CG-CD2 4.16Å; M36-W130 HydrophobicContact CG-CE3 4.24Å; M36-W130 HydrophobicContact CG-CH2 4.23Å; M36-W130 HydrophobicContact CG-CZ2 4.14Å; M36-W130 HydrophobicContact CG-CZ3 4.26Å; F37-W130 HydrophobicContact CD1-CZ3 4.49Å; F37-W130 AromaticContact CD2-CH2 3.77Å; F37-W130 HydrophobicContact CD2-CH2 3.77Å; F37-W130 HydrophobicContact CD2-CZ3 4.2Å; F37-W130 HydrophobicContact CE1-CZ3 4.41Å; F37-W130 AromaticContact CE2-CH2 3.62Å; F37-W130 HydrophobicContact CE2-CH2 3.62Å; F37-W130 HydrophobicContact CE2-CZ3 4.09Å; F37-W130 HydrophobicContact CG-CH2 4.38Å; F37-W130 HydrophobicContact CG-CZ3 4.38Å; F37-W130 HydrophobicContact CZ-CH2 4.14Å; F37-W130 HydrophobicContact CZ-CZ3 4.2Å; N127-W130 PolarHBondContact O-NE1 2.78Å; G128-W130 VanDerWaalsContact C-N 3.3Å; G128-W130 PolarHBondContact O-N 3.31Å; G128-W130 VanDerWaalsContact O-N 3.16Å; W130-F132 VanDerWaalsContact C-N 3.34Å; W130-F132 PolarHBondContact O-N 3.23Å; W130-K133 HydrophobicContact CD2-CD 4.38Å; W130-K133 HydrophobicContact CE3-CD 3.78Å; W130-K133 HydrophobicContact CZ3-CD 3.86Å; W130-K133 WeakPolarHBondContact O-CB 3.41Å; W130-K133 PolarHBondContact O-N 2.85Å; W130-K133 VanDerWaalsContact O-N 3.13Å; W130-Y134 HydrophobicContact CB-CD2 4.42Å; W130-Y134 HydrophobicContact CB-CE2 4.19Å; W130-Y134 HydrophobicContact CE3-CE2 4.5Å; W130-Y134 WeakPolarHBondContact O-CD2 3.46Å; W130-Y134 PolarHBondContact O-N 2.72Å
131	F	86.4	Confident	90.8	Very high	118 Å²	118	60.8 Å²	60.8	52%	0.518	29%	0.292	S	S	.	.	H	α-helix	trans	-54.2	-49.1	177.1	177	-99.4	0	0	0	112.2	F129 K133 Y134 L135	F129-F131 VanDerWaalsContact C-N 3.35Å; F129-F131 PolarHBondContact O-N 2.72Å; F131-K133 VanDerWaalsContact C-N 3.33Å; F131-K133 PolarHBondContact O-N 3.29Å; F131-Y134 PolarHBondContact O-N 2.91Å; F131-L135 HydrophobicContact CE1-CD2 4.49Å; F131-L135 WeakPolarHBondContact O-CB 3.08Å; F131-L135 PolarHBondContact O-N 3.29Å
132	F	90.6	Very high	91	Very high	130 Å²	130	57 Å²	57	57%	0.57	29%	0.285	S	S	*	.	H	α-helix	trans	-68.5	-32.3	179.6	-64.8	-72.3	0	0	0	112.6	F129 W130 L135 C136	F129-F132 HydrophobicContact CB-CD2 4.29Å; F129-F132 AromaticContact CD1-CD2 3.96Å; F129-F132 HydrophobicContact CD1-CD2 3.96Å; F129-F132 HydrophobicContact CD1-CE2 4.24Å; F129-F132 PolarHBondContact O-N 3.01Å; W130-F132 VanDerWaalsContact C-N 3.34Å; W130-F132 PolarHBondContact O-N 3.23Å; F132-L135 PolarHBondContact O-N 3.47Å; F132-C136 VanDerWaalsContact O-CB 3.28Å; F132-C136 WeakPolarHBondContact O-CB 3.23Å; F132-C136 PolarHBondContact O-N 2.71Å
133	K	93.8	Very high	91	Very high	6 Å²	6	56 Å²	56	3%	0.026	29%	0.293	C	S	.	.	H	α-helix	trans	-64.3	-48.4	174	-70.5	175.1	178.9	160.3	0	112	F37 F104 F108 L125 Q126 G128 F129 W130 F131 L135 C136 W137	F37-K133 HydrophobicContact CE1-CD 4.46Å; F37-K133 HydrophobicContact CZ-CD 4.19Å; F104-K133 HydrophobicContact CE2-CB 4.48Å; F104-K133 HydrophobicContact CZ-CB 4.22Å; F108-K133 HydrophobicContact CE1-CD 4.49Å; F108-K133 HydrophobicContact CE2-CG 4.37Å; F108-K133 HydrophobicContact CZ-CD 3.97Å; F108-K133 HydrophobicContact CZ-CG 3.81Å; L125-K133 WeakPolarHBondContact O-CE 3.24Å; L125-K133 PolarHBondContact O-NZ 2.98Å; Q126-K133 VanDerWaalsContact C-NZ 3.34Å; Q126-K133 PolarHBondContact O-NZ 3.44Å; G128-K133 VanDerWaalsContact O-CE 3.24Å; G128-K133 WeakPolarHBondContact O-CE 3.39Å; G128-K133 PolarHBondContact O-NZ 2.96Å; F129-K133 PolarHBondContact O-N 3.24Å; F129-K133 VanDerWaalsContact O-N 3.14Å; W130-K133 HydrophobicContact CD2-CD 4.38Å; W130-K133 HydrophobicContact CE3-CD 3.78Å; W130-K133 HydrophobicContact CZ3-CD 3.86Å; W130-K133 WeakPolarHBondContact O-CB 3.41Å; W130-K133 PolarHBondContact O-N 2.85Å; W130-K133 VanDerWaalsContact O-N 3.13Å; F131-K133 VanDerWaalsContact C-N 3.33Å; F131-K133 PolarHBondContact O-N 3.29Å; K133-L135 VanDerWaalsContact C-N 3.32Å; K133-L135 PolarHBondContact O-N 2.97Å; K133-C136 PolarHBondContact O-N 3.02Å; K133-W137 WeakPolarHBondContact O-CB 3.01Å; K133-W137 PolarHBondContact O-N 3.26Å
134	Y	92.6	Very high	91.2	Very high	29 Å²	29	56 Å²	56	11%	0.114	29%	0.294	C	S	.	.	H	α-helix	trans	-60.9	-44.4	176.2	-73.4	-62.1	0	0	0	110.9	M36 I40 W130 F131 C136 W137 F138	M36-Y134 HydrophobicContact CE-CE2 3.69Å; M36-Y134 WeakPolarHBondContact CE-OH 3.31Å; I40-Y134 HydrophobicContact CD1-CD1 4.2Å; I40-Y134 HydrophobicContact CD1-CE1 3.94Å; I40-Y134 HydrophobicContact CG1-CD1 3.96Å; I40-Y134 HydrophobicContact CG1-CE1 3.46Å; I40-Y134 VanDerWaalsContact CG1-CE1 3.46Å; W130-Y134 HydrophobicContact CB-CD2 4.42Å; W130-Y134 HydrophobicContact CB-CE2 4.19Å; W130-Y134 HydrophobicContact CE3-CE2 4.5Å; W130-Y134 WeakPolarHBondContact O-CD2 3.46Å; W130-Y134 PolarHBondContact O-N 2.72Å; F131-Y134 PolarHBondContact O-N 2.91Å; Y134-C136 VanDerWaalsContact C-N 3.35Å; Y134-C136 PolarHBondContact O-N 3.35Å; Y134-W137 PolarHBondContact O-N 3.31Å; Y134-F138 WeakPolarHBondContact O-CB 2.87Å; Y134-F138 WeakPolarHBondContact O-CD2 3.37Å; Y134-F138 PolarHBondContact O-N 3.16Å
135	L	93.4	Very high	91.2	Very high	101 Å²	101	52.6 Å²	52.6	53%	0.529	28%	0.279	S	S	.	.	H	α-helix	trans	-60	-44	176.6	-175.7	63	0	0	0	112.2	F131 F132 K133 F138 G139	F131-L135 HydrophobicContact CE1-CD2 4.49Å; F131-L135 WeakPolarHBondContact O-CB 3.08Å; F131-L135 PolarHBondContact O-N 3.29Å; F132-L135 PolarHBondContact O-N 3.47Å; K133-L135 VanDerWaalsContact C-N 3.32Å; K133-L135 PolarHBondContact O-N 2.97Å; L135-F138 PolarHBondContact O-N 3.24Å; L135-G139 PolarHBondContact O-N 3.47Å
136	C	94.6	Very high	91	Very high	55 Å²	55	58.1 Å²	58.1	37%	0.372	30%	0.301	S	S	.	.	H	α-helix	trans	-61.3	-46.6	175.7	179	0	0	0	0	111.6	F132 K133 Y134 G139 L140	F132-C136 VanDerWaalsContact O-CB 3.28Å; F132-C136 WeakPolarHBondContact O-CB 3.23Å; F132-C136 PolarHBondContact O-N 2.71Å; K133-C136 PolarHBondContact O-N 3.02Å; Y134-C136 VanDerWaalsContact C-N 3.35Å; Y134-C136 PolarHBondContact O-N 3.35Å; C136-G139 PolarHBondContact O-N 3.37Å; C136-L140 WeakPolarHBondContact O-CG 3.33Å; C136-L140 PolarHBondContact O-N 2.97Å
137	W	96.1	Very high	90.7	Very high	2 Å²	2	60 Å²	60	1%	0.008	31%	0.311	C	S	.	.	H	α-helix	trans	-61.9	-46.2	177.3	175.5	68.9	0	0	0	112.4	I40 F43 T44 L47 S101 F104 K133 Y134 G139 L140 L141	I40-W137 HydrophobicContact CG2-CD2 3.71Å; I40-W137 HydrophobicContact CG2-CE3 4.4Å; I40-W137 HydrophobicContact CG2-CG 3.82Å; I40-W137 HydrophobicContact CG2-CZ2 4.09Å; F43-W137 HydrophobicContact CB-CH2 3.73Å; F43-W137 HydrophobicContact CB-CZ2 4.48Å; F43-W137 HydrophobicContact CB-CZ3 4.42Å; T44-W137 WeakPolarHBondContact OG1-CZ2 3.42Å; L47-W137 HydrophobicContact CD1-CH2 4.05Å; S101-W137 PolarHBondContact OG-NE1 2.69Å; F104-W137 HydrophobicContact CD2-CB 3.86Å; F104-W137 HydrophobicContact CE2-CB 3.96Å; F104-W137 HydrophobicContact CG-CB 4.21Å; F104-W137 AromaticContact CG-CD1 3.97Å; F104-W137 HydrophobicContact CG-CG 4.47Å; F104-W137 HydrophobicContact CZ-CB 4.41Å; K133-W137 WeakPolarHBondContact O-CB 3.01Å; K133-W137 PolarHBondContact O-N 3.26Å; Y134-W137 PolarHBondContact O-N 3.31Å; W137-G139 VanDerWaalsContact C-N 3.33Å; W137-G139 PolarHBondContact O-N 3.3Å; W137-L140 PolarHBondContact O-N 2.79Å; W137-L141 HydrophobicContact CD2-CD1 3.99Å; W137-L141 HydrophobicContact CE3-CD1 4.09Å; W137-L141 HydrophobicContact CH2-CD1 3.61Å; W137-L141 HydrophobicContact CZ2-CD1 3.49Å; W137-L141 VanDerWaalsContact CZ2-CD1 3.49Å; W137-L141 HydrophobicContact CZ2-CG 4.31Å; W137-L141 HydrophobicContact CZ3-CD1 3.91Å; W137-L141 PolarHBondContact O-N 3.32Å
138	F	94.6	Very high	90.1	Very high	103 Å²	103	63.3 Å²	63.3	45%	0.452	33%	0.333	S	S	.	.	H	α-helix	trans	-62.1	-39	174.1	-84.3	-67.8	0	0	0	112.5	Y134 L135 L141 I142	Y134-F138 WeakPolarHBondContact O-CB 2.87Å; Y134-F138 WeakPolarHBondContact O-CD2 3.37Å; Y134-F138 PolarHBondContact O-N 3.16Å; L135-F138 PolarHBondContact O-N 3.24Å; F138-L141 HydrophobicContact CD1-CD1 4.13Å; F138-L141 WeakPolarHBondContact O-CB 3.49Å; F138-L141 PolarHBondContact O-N 2.96Å; F138-I142 WeakPolarHBondContact O-CG1 3.43Å; F138-I142 PolarHBondContact O-N 3.36Å
139	G	95.5	Very high	89.4	Confident	42 Å²	42	63.3 Å²	63.3	43%	0.433	33%	0.329	S	S	.	.	H	α-helix	trans	-62	-42.6	174.5	0	0	0	0	0	112.6	L135 C136 W137 I142 G143	L135-G139 PolarHBondContact O-N 3.47Å; C136-G139 PolarHBondContact O-N 3.37Å; W137-G139 VanDerWaalsContact C-N 3.33Å; W137-G139 PolarHBondContact O-N 3.3Å; G139-I142 PolarHBondContact O-N 3.32Å; G139-G143 PolarHBondContact O-N 3.42Å
140	L	96	Very high	88.5	Confident	62 Å²	62	64.2 Å²	64.2	33%	0.325	34%	0.335	S	S	.	.	H	α-helix	trans	-64.1	-38.9	174.2	-72.5	171.4	0	0	0	112	A100 F104 C136 W137 G143 A144	A100-L140 HydrophobicContact CB-CB 4.08Å; A100-L140 WeakPolarHBondContact CB-O 3.23Å; F104-L140 HydrophobicContact CB-CD1 3.87Å; F104-L140 HydrophobicContact CD2-CD1 4.33Å; C136-L140 WeakPolarHBondContact O-CG 3.33Å; C136-L140 PolarHBondContact O-N 2.97Å; W137-L140 PolarHBondContact O-N 2.79Å; L140-G143 PolarHBondContact O-N 3.45Å; L140-A144 WeakPolarHBondContact O-CB 3.47Å; L140-A144 PolarHBondContact O-N 3.42Å
141	L	94.2	Very high	87.9	Confident	10 Å²	10	66.3 Å²	66.3	5%	0.052	36%	0.359	C	S	.	.	H	α-helix	trans	-58.8	-52.2	174.9	-78.1	171.7	0	0	0	111.1	L47 I97 A100 W137 F138 G143 A144 F145	L47-L141 HydrophobicContact CD1-CD1 4.02Å; I97-L141 HydrophobicContact CB-CD2 4.28Å; I97-L141 HydrophobicContact CG1-CD2 4.43Å; I97-L141 HydrophobicContact CG2-CD2 3.9Å; A100-L141 HydrophobicContact CB-CB 4.44Å; A100-L141 HydrophobicContact CB-CD2 3.8Å; A100-L141 HydrophobicContact CB-CG 4.13Å; W137-L141 HydrophobicContact CD2-CD1 3.99Å; W137-L141 HydrophobicContact CE3-CD1 4.09Å; W137-L141 HydrophobicContact CH2-CD1 3.61Å; W137-L141 HydrophobicContact CZ2-CD1 3.49Å; W137-L141 VanDerWaalsContact CZ2-CD1 3.49Å; W137-L141 HydrophobicContact CZ2-CG 4.31Å; W137-L141 HydrophobicContact CZ3-CD1 3.91Å; W137-L141 PolarHBondContact O-N 3.32Å; F138-L141 HydrophobicContact CD1-CD1 4.13Å; F138-L141 WeakPolarHBondContact O-CB 3.49Å; F138-L141 PolarHBondContact O-N 2.96Å; L141-G143 VanDerWaalsContact C-N 3.33Å; L141-G143 PolarHBondContact O-N 3.43Å; L141-A144 PolarHBondContact O-N 2.98Å; L141-F145 VanDerWaalsContact O-CD2 3.26Å; L141-F145 WeakPolarHBondContact O-CD2 3.48Å
142	I	92.3	Very high	87.7	Confident	111 Å²	111	62.1 Å²	62.1	57%	0.569	34%	0.341	S	S	*	.	H	α-helix	trans	-60.5	-45.4	178.4	-65.7	168.2	0	0	0	110.3	F138 G139 A144 F145 F146	F138-I142 WeakPolarHBondContact O-CG1 3.43Å; F138-I142 PolarHBondContact O-N 3.36Å; G139-I142 PolarHBondContact O-N 3.32Å; I142-A144 VanDerWaalsContact C-N 3.32Å; I142-A144 PolarHBondContact O-N 2.85Å; I142-F145 PolarHBondContact O-N 2.89Å; I142-F146 HydrophobicContact CG2-CE2 4.02Å; I142-F146 VanDerWaalsContact O-CD2 3.27Å; I142-F146 WeakPolarHBondContact O-CD2 3.48Å
143	G	91.6	Very high	87.1	Confident	38 Å²	38	56.8 Å²	56.8	39%	0.392	32%	0.319	S	S	.	.	H	α-helix	trans	-59.1	-38.9	178.1	0	0	0	0	0	113.6	G139 L140 L141 F145 F146	G139-G143 PolarHBondContact O-N 3.42Å; L140-G143 PolarHBondContact O-N 3.45Å; L141-G143 VanDerWaalsContact C-N 3.33Å; L141-G143 PolarHBondContact O-N 3.43Å; G143-F145 PolarHBondContact O-N 3.03Å; G143-F146 PolarHBondContact O-N 3.06Å; G143-F146 VanDerWaalsContact O-N 3.1Å
144	A	91.7	Very high	86.3	Confident	3 Å²	3	60.3 Å²	60.3	3%	0.025	34%	0.338	C	S	.	.	H	α-helix	trans	-65.3	-26.1	-179.9	0	0	0	0	0	113.3	R96 F99 A100 L140 L141 I142 F146 I147	R96-A144 HydrophobicContact CB-CB 4.14Å; R96-A144 VanDerWaalsContact CD-O 3.32Å; R96-A144 WeakPolarHBondContact CD-O 3.34Å; R96-A144 WeakPolarHBondContact CG-O 3.29Å; R96-A144 WeakPolarHBondContact O-CB 3.36Å; F99-A144 HydrophobicContact CD1-CB 4.18Å; A100-A144 HydrophobicContact CB-CB 3.97Å; L140-A144 WeakPolarHBondContact O-CB 3.47Å; L140-A144 PolarHBondContact O-N 3.42Å; L141-A144 PolarHBondContact O-N 2.98Å; I142-A144 VanDerWaalsContact C-N 3.32Å; I142-A144 PolarHBondContact O-N 2.85Å; A144-F146 PolarHBondContact O-N 2.67Å; A144-I147 HydrophobicContact CB-CD1 4.33Å; A144-I147 WeakPolarHBondContact O-CB 3.48Å; A144-I147 WeakPolarHBondContact O-CG1 3.18Å; A144-I147 PolarHBondContact O-N 3.12Å
145	F	87	Confident	86	Confident	67 Å²	67	64.7 Å²	64.7	29%	0.294	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-18.3	174.5	-81	-82.9	0	0	0	114	L66 A93 I97 L141 I142 G143 I147	L66-F145 HydrophobicContact CD1-CD1 4.45Å; L66-F145 HydrophobicContact CD2-CD1 4.37Å; A93-F145 HydrophobicContact CB-CE1 4.18Å; I97-F145 HydrophobicContact CD1-CZ 4.16Å; I97-F145 HydrophobicContact CG1-CE2 3.99Å; I97-F145 HydrophobicContact CG1-CZ 3.86Å; L141-F145 VanDerWaalsContact O-CD2 3.26Å; L141-F145 WeakPolarHBondContact O-CD2 3.48Å; I142-F145 PolarHBondContact O-N 2.89Å; G143-F145 PolarHBondContact O-N 3.03Å; F145-I147 VanDerWaalsContact C-N 3.34Å
146	F	85.6	Confident	85.8	Confident	168 Å²	168	60.9 Å²	60.9	74%	0.737	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-5.7	174.8	-66.5	-85.7	0	0	0	113.7	I142 G143 A144	I142-F146 HydrophobicContact CG2-CE2 4.02Å; I142-F146 VanDerWaalsContact O-CD2 3.27Å; I142-F146 WeakPolarHBondContact O-CD2 3.48Å; G143-F146 PolarHBondContact O-N 3.06Å; G143-F146 VanDerWaalsContact O-N 3.1Å; A144-F146 PolarHBondContact O-N 2.67Å
147	I	83.6	Confident	85.3	Confident	41 Å²	41	58.5 Å²	58.5	21%	0.21	33%	0.325	C	S	.	.	S	Bend	trans	-73.8	123.7	179.3	-59	172.3	0	0	0	109.3	R96 F99 A144 F145 F152	R96-I147 PolarHBondContact NE-O 3.15Å; R96-I147 VanDerWaalsContact NE-O 3.12Å; R96-I147 PolarHBondContact NH2-O 3.24Å; F99-I147 HydrophobicContact CD1-CD1 3.74Å; F99-I147 HydrophobicContact CE1-CD1 3.53Å; F99-I147 HydrophobicContact CZ-CD1 4.31Å; A144-I147 HydrophobicContact CB-CD1 4.33Å; A144-I147 WeakPolarHBondContact O-CB 3.48Å; A144-I147 WeakPolarHBondContact O-CG1 3.18Å; A144-I147 PolarHBondContact O-N 3.12Å; F145-I147 VanDerWaalsContact C-N 3.34Å; I147-F152 HydrophobicContact CD1-CE2 4.22Å; I147-F152 HydrophobicContact CD1-CZ 4.44Å; I147-F152 HydrophobicContact CG2-CB 3.97Å; I147-F152 HydrophobicContact CG2-CD1 4.11Å; I147-F152 HydrophobicContact CG2-CD2 3.73Å; I147-F152 HydrophobicContact CG2-CE2 4.23Å; I147-F152 HydrophobicContact CG2-CG 3.66Å
148	P	74.4	Confident	84.9	Confident	89 Å²	89	64.6 Å²	64.6	58%	0.578	35%	0.349	S	S	*	.			trans	-65.5	152.9	179	27.6	-34.5	0	0	0	111.8	E150 F152	P148-E150 VanDerWaalsContact C-N 3.33Å; P148-E150 PolarHBondContact O-N 3.44Å; P148-F152 WeakPolarHBondContact O-CB 3.44Å
149	V	69.9	Low	84.8	Confident	20 Å²	20	62.3 Å²	62.3	12%	0.121	34%	0.343	C	S	.	.	S	Bend	trans	-67.6	-33.5	-176.8	179.8	0	0	0	0	112.1	P69 G151	P69-V149 HydrophobicContact CB-CG1 4.45Å; V149-G151 PolarHBondContact O-N 3.26Å
150	E	67.4	Low	84.6	Confident	146 Å²	146	60.3 Å²	60.3	68%	0.682	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	121.7	-172.7	-63.8	-171.4	172.5	0	0	111.7	P148 F152	P148-E150 VanDerWaalsContact C-N 3.33Å; P148-E150 PolarHBondContact O-N 3.44Å; E150-F152 PolarHBondContact O-N 3.4Å
151	G	73.7	Confident	84.3	Confident	52 Å²	52	59 Å²	59	54%	0.536	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	77	-38.9	179.7	0	0	0	0	0	115.3	V149 T153 L155	V149-G151 PolarHBondContact O-N 3.26Å; G151-T153 PolarHBondContact O-N 2.74Å; G151-L155 PolarHBondContact O-N 3.39Å
152	F	83.5	Confident	84.2	Confident	29 Å²	29	64 Å²	64	13%	0.127	34%	0.34	C	S	.	.	H	α-helix	trans	-58.2	-52.9	-175.7	173.5	-105.1	0	0	0	112.7	R96 F99 I147 P148 E150 N154 L155 W156	R96-F152 HydrophobicContact CG-CE1 3.9Å; F99-F152 HydrophobicContact CB-CE2 4.4Å; F99-F152 HydrophobicContact CB-CZ 3.79Å; F99-F152 HydrophobicContact CD1-CE2 4.39Å; F99-F152 HydrophobicContact CD1-CZ 4.35Å; F99-F152 AromaticContact CD2-CE2 3.71Å; F99-F152 HydrophobicContact CD2-CE2 3.71Å; F99-F152 AromaticContact CD2-CZ 3.96Å; F99-F152 HydrophobicContact CD2-CZ 3.96Å; F99-F152 HydrophobicContact CE2-CE2 4.03Å; F99-F152 AromaticContact CG-CE2 3.91Å; F99-F152 HydrophobicContact CG-CE2 3.91Å; F99-F152 AromaticContact CG-CZ 3.77Å; F99-F152 HydrophobicContact CG-CZ 3.77Å; I147-F152 HydrophobicContact CD1-CE2 4.22Å; I147-F152 HydrophobicContact CD1-CZ 4.44Å; I147-F152 HydrophobicContact CG2-CB 3.97Å; I147-F152 HydrophobicContact CG2-CD1 4.11Å; I147-F152 HydrophobicContact CG2-CD2 3.73Å; I147-F152 HydrophobicContact CG2-CE2 4.23Å; I147-F152 HydrophobicContact CG2-CG 3.66Å; P148-F152 WeakPolarHBondContact O-CB 3.44Å; E150-F152 PolarHBondContact O-N 3.4Å; F152-N154 VanDerWaalsContact C-N 3.33Å; F152-N154 PolarHBondContact O-N 2.7Å; F152-L155 PolarHBondContact O-N 3.27Å; F152-W156 HydrophobicContact CE2-CB 4.27Å; F152-W156 HydrophobicContact CE2-CG 4.24Å; F152-W156 HydrophobicContact CZ-CB 4.28Å; F152-W156 AromaticContact CZ-CD1 3.83Å; F152-W156 HydrophobicContact CZ-CG 4.05Å; F152-W156 WeakPolarHBondContact O-CB 3.26Å; F152-W156 PolarHBondContact O-N 3.26Å
153	T	77.1	Confident	84.3	Confident	18 Å²	18	58.8 Å²	58.8	11%	0.11	32%	0.315	C	S	.	.	H	α-helix	trans	-62.2	-40.1	-174.2	-52	0	0	0	0	112.3	Y95 G151 M157 P407	Y95-T153 HydrophobicContact CD2-CG2 3.76Å; Y95-T153 HydrophobicContact CE2-CG2 3.81Å; Y95-T153 HydrophobicContact CG-CG2 4.25Å; G151-T153 PolarHBondContact O-N 2.74Å; T153-M157 VanDerWaalsContact O-CB 3.28Å; T153-M157 WeakPolarHBondContact O-CB 3.48Å; T153-M157 PolarHBondContact O-N 3.39Å; T153-P407 HydrophobicContact CG2-CG 4.33Å
154	N	77.7	Confident	84.3	Confident	81 Å²	81	57 Å²	57	43%	0.433	30%	0.296	S	S	.	.	H	α-helix	trans	-67.2	-49	-179.8	-72	-11.1	0	0	0	111.3	F152 M157 Y158 P407	F152-N154 VanDerWaalsContact C-N 3.33Å; F152-N154 PolarHBondContact O-N 2.7Å; N154-M157 PolarHBondContact O-N 2.81Å; N154-Y158 WeakPolarHBondContact O-CD2 3.36Å; N154-Y158 PolarHBondContact O-N 3.29Å; N154-P407 WeakPolarHBondContact OD1-CG 3.47Å
155	L	85.7	Confident	84.3	Confident	120 Å²	120	59.2 Å²	59.2	63%	0.628	31%	0.311	S	S	*	.	H	α-helix	trans	-61.6	-47.8	177.8	178	64.5	0	0	0	110.8	G151 F152 M157 Y158 V159	G151-L155 PolarHBondContact O-N 3.39Å; F152-L155 PolarHBondContact O-N 3.27Å; L155-M157 VanDerWaalsContact C-N 3.3Å; L155-M157 PolarHBondContact O-N 3.27Å; L155-Y158 PolarHBondContact O-N 2.88Å; L155-Y158 VanDerWaalsContact O-N 3.17Å; L155-V159 WeakPolarHBondContact O-CG2 3.43Å; L155-V159 PolarHBondContact O-N 3.3Å; L155-V159 VanDerWaalsContact O-N 3.16Å
156	W	89.8	Confident	84.6	Confident	21 Å²	21	60.2 Å²	60.2	8%	0.08	32%	0.319	C	S	.	.	H	α-helix	trans	-66.6	-32.5	-176.1	-162.2	-133.7	0	0	0	112.2	Y95 F99 T102 M103 F152 V159 G160 L395 M398	Y95-W156 HydrophobicContact CD1-CB 4.27Å; Y95-W156 AromaticContact CD1-CD1 3.6Å; Y95-W156 HydrophobicContact CD1-CG 4.24Å; Y95-W156 PolarHBondContact O-NE1 3.06Å; F99-W156 HydrophobicContact CB-CZ2 3.99Å; F99-W156 AromaticContact CD2-CD2 3.83Å; F99-W156 HydrophobicContact CD2-CD2 3.83Å; F99-W156 AromaticContact CD2-CE2 3.63Å; F99-W156 AromaticContact CD2-CE3 3.88Å; F99-W156 HydrophobicContact CD2-CE3 3.88Å; F99-W156 AromaticContact CD2-CH2 3.63Å; F99-W156 HydrophobicContact CD2-CH2 3.63Å; F99-W156 AromaticContact CD2-CZ2 3.59Å; F99-W156 HydrophobicContact CD2-CZ2 3.59Å; F99-W156 AromaticContact CD2-CZ3 3.77Å; F99-W156 HydrophobicContact CD2-CZ3 3.77Å; F99-W156 HydrophobicContact CE2-CE3 4.32Å; F99-W156 HydrophobicContact CE2-CH2 4.19Å; F99-W156 HydrophobicContact CE2-CZ3 4.05Å; F99-W156 HydrophobicContact CG-CZ2 4.24Å; T102-W156 HydrophobicContact CG2-CH2 3.74Å; T102-W156 HydrophobicContact CG2-CZ2 3.94Å; M103-W156 HydrophobicContact CE-CH2 3.88Å; M103-W156 HydrophobicContact CE-CZ3 4.41Å; F152-W156 HydrophobicContact CE2-CB 4.27Å; F152-W156 HydrophobicContact CE2-CG 4.24Å; F152-W156 HydrophobicContact CZ-CB 4.28Å; F152-W156 AromaticContact CZ-CD1 3.83Å; F152-W156 HydrophobicContact CZ-CG 4.05Å; F152-W156 WeakPolarHBondContact O-CB 3.26Å; F152-W156 PolarHBondContact O-N 3.26Å; W156-V159 HydrophobicContact CE3-CB 4.06Å; W156-V159 HydrophobicContact CE3-CG1 4.09Å; W156-V159 HydrophobicContact CE3-CG2 4.37Å; W156-V159 HydrophobicContact CH2-CG1 4.3Å; W156-V159 HydrophobicContact CZ3-CB 4.28Å; W156-V159 HydrophobicContact CZ3-CG1 3.8Å; W156-V159 PolarHBondContact O-N 2.94Å; W156-G160 PolarHBondContact O-N 3.37Å; W156-L395 HydrophobicContact CH2-CD2 4.03Å; W156-L395 HydrophobicContact CZ2-CD2 3.62Å; W156-M398 HydrophobicContact CG-CE 4.46Å; W156-M398 HydrophobicContact CG-SD 4.28Å; W156-M398 PolarHBondContact NE1-SD 2.9Å; W156-M398 WeakPolarHBondContact O-CE 3.41Å
157	M	84.4	Confident	85	Confident	5 Å²	5	52.4 Å²	52.4	3%	0.025	29%	0.285	C	S	.	.	H	α-helix	trans	-58.7	-49.8	169.4	179	-160.3	58.8	0	0	112.5	Y95 T153 N154 L155 V159 G160 M161 L405 K406 P407	Y95-M157 HydrophobicContact CE1-CB 3.89Å; Y95-M157 WeakPolarHBondContact OH-CB 3.45Å; Y95-M157 WeakPolarHBondContact OH-CG 3.35Å; T153-M157 VanDerWaalsContact O-CB 3.28Å; T153-M157 WeakPolarHBondContact O-CB 3.48Å; T153-M157 PolarHBondContact O-N 3.39Å; N154-M157 PolarHBondContact O-N 2.81Å; L155-M157 VanDerWaalsContact C-N 3.3Å; L155-M157 PolarHBondContact O-N 3.27Å; M157-V159 VanDerWaalsContact C-N 3.31Å; M157-V159 PolarHBondContact O-N 3.47Å; M157-G160 CarbonylContact O-C 3.59Å; M157-G160 WeakPolarHBondContact O-CA 3.37Å; M157-G160 PolarHBondContact O-N 3.12Å; M157-G160 VanDerWaalsContact O-N 3.09Å; M157-M161 HydrophobicContact CG-CG 4.3Å; M157-M161 HydrophobicContact CG-SD 4.18Å; M157-M161 WeakPolarHBondContact O-CG 3.47Å; M157-M161 PolarHBondContact O-N 3.48Å; M157-M161 HydrophobicContact SD-SD 4.31Å; M157-L405 VanDerWaalsContact SD-O 3.36Å; M157-K406 HydrophobicContact CE-CG 4.41Å; M157-K406 HydrophobicContact SD-CB 4.28Å; M157-K406 HydrophobicContact SD-CG 4.14Å; M157-P407 WeakPolarHBondContact SD-CD 3.49Å; M157-P407 HydrophobicContact SD-CG 4.24Å
158	Y	87.4	Confident	85.4	Confident	131 Å²	131	51 Å²	51	51%	0.514	28%	0.278	S	S	.	.	H	α-helix	trans	-61.3	-42.4	-179.7	-72.4	-68.1	0	0	0	111.7	N154 L155 G160 M161 I162	N154-Y158 WeakPolarHBondContact O-CD2 3.36Å; N154-Y158 PolarHBondContact O-N 3.29Å; L155-Y158 PolarHBondContact O-N 2.88Å; L155-Y158 VanDerWaalsContact O-N 3.17Å; Y158-G160 VanDerWaalsContact C-N 3.3Å; Y158-G160 PolarHBondContact O-N 2.8Å; Y158-M161 PolarHBondContact O-N 3.11Å; Y158-I162 WeakPolarHBondContact O-CG1 3.41Å; Y158-I162 PolarHBondContact O-N 3.42Å; Y158-I162 VanDerWaalsContact O-N 3.12Å
159	V	92.3	Very high	86.3	Confident	55 Å²	55	49.8 Å²	49.8	33%	0.333	27%	0.269	S	S	.	.	H	α-helix	trans	-59.3	-44.2	173.2	176.6	0	0	0	0	110.6	L155 W156 M157 I162 G163 L395	L155-V159 WeakPolarHBondContact O-CG2 3.43Å; L155-V159 PolarHBondContact O-N 3.3Å; L155-V159 VanDerWaalsContact O-N 3.16Å; W156-V159 HydrophobicContact CE3-CB 4.06Å; W156-V159 HydrophobicContact CE3-CG1 4.09Å; W156-V159 HydrophobicContact CE3-CG2 4.37Å; W156-V159 HydrophobicContact CH2-CG1 4.3Å; W156-V159 HydrophobicContact CZ3-CB 4.28Å; W156-V159 HydrophobicContact CZ3-CG1 3.8Å; W156-V159 PolarHBondContact O-N 2.94Å; M157-V159 VanDerWaalsContact C-N 3.31Å; M157-V159 PolarHBondContact O-N 3.47Å; V159-I162 PolarHBondContact O-N 2.92Å; V159-G163 PolarHBondContact O-N 2.91Å; V159-L395 HydrophobicContact CG1-CD1 4.26Å; V159-L395 HydrophobicContact CG1-CD2 4.31Å
160	G	92.4	Very high	87.3	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-56.6	-48.5	174	0	0	0	0	0	114.3	W156 M157 Y158 I162 G163 G164 V399	W156-G160 PolarHBondContact O-N 3.37Å; M157-G160 CarbonylContact O-C 3.59Å; M157-G160 WeakPolarHBondContact O-CA 3.37Å; M157-G160 PolarHBondContact O-N 3.12Å; M157-G160 VanDerWaalsContact O-N 3.09Å; Y158-G160 VanDerWaalsContact C-N 3.3Å; Y158-G160 PolarHBondContact O-N 2.8Å; G160-I162 VanDerWaalsContact C-N 3.35Å; G160-I162 PolarHBondContact O-N 3.34Å; G160-G163 PolarHBondContact O-N 2.94Å; G160-G164 WeakPolarHBondContact O-CA 3.37Å; G160-G164 PolarHBondContact O-N 3.42Å; G160-V399 WeakPolarHBondContact O-CG1 3.33Å
161	M	89.6	Confident	88.6	Confident	34 Å²	34	43 Å²	43	17%	0.167	24%	0.236	C	C	.	.	H	α-helix	trans	-64.1	-41.8	-178.5	-70.5	-179.8	74	0	0	111.3	M157 Y158 S165 V399 W404 A419	M157-M161 HydrophobicContact CG-CG 4.3Å; M157-M161 HydrophobicContact CG-SD 4.18Å; M157-M161 WeakPolarHBondContact O-CG 3.47Å; M157-M161 PolarHBondContact O-N 3.48Å; M157-M161 HydrophobicContact SD-SD 4.31Å; Y158-M161 PolarHBondContact O-N 3.11Å; M161-S165 VanDerWaalsContact O-CB 3.32Å; M161-S165 WeakPolarHBondContact O-CB 2.96Å; M161-S165 PolarHBondContact O-N 3.34Å; M161-S165 PolarHBondContact O-OG 3.37Å; M161-V399 HydrophobicContact CG-CG1 4.28Å; M161-W404 HydrophobicContact CB-CE3 4.48Å; M161-W404 HydrophobicContact CB-CZ3 4.12Å; M161-W404 HydrophobicContact CE-CE3 4.14Å; M161-W404 HydrophobicContact CG-CE3 4.14Å; M161-W404 HydrophobicContact CG-CZ3 4.28Å; M161-A419 HydrophobicContact CE-CB 3.9Å
162	I	91.5	Very high	89.6	Confident	114 Å²	114	40.6 Å²	40.6	59%	0.585	21%	0.211	S	C	*	.	H	α-helix	trans	-65.9	-53.4	177.1	-64.1	166.8	0	0	0	109.8	Y158 V159 G160 G164 S165 L166	Y158-I162 WeakPolarHBondContact O-CG1 3.41Å; Y158-I162 PolarHBondContact O-N 3.42Å; Y158-I162 VanDerWaalsContact O-N 3.12Å; V159-I162 PolarHBondContact O-N 2.92Å; G160-I162 VanDerWaalsContact C-N 3.35Å; G160-I162 PolarHBondContact O-N 3.34Å; I162-G164 PolarHBondContact O-N 3.41Å; I162-S165 PolarHBondContact O-N 3.27Å; I162-L166 WeakPolarHBondContact O-CG 3.36Å; I162-L166 PolarHBondContact O-N 3.45Å; I162-L166 VanDerWaalsContact O-N 3.13Å
163	G	93.4	Very high	90	Very high	3 Å²	3	40.4 Å²	40.4	3%	0.031	21%	0.211	C	C	.	.	H	α-helix	trans	-64.2	-40.7	-178.5	0	0	0	0	0	113.4	V159 G160 S165 L166 Y167	V159-G163 PolarHBondContact O-N 2.91Å; G160-G163 PolarHBondContact O-N 2.94Å; G163-S165 VanDerWaalsContact C-N 3.34Å; G163-S165 PolarHBondContact O-N 3.25Å; G163-L166 PolarHBondContact O-N 3.28Å; G163-Y167 PolarHBondContact O-N 2.91Å
164	G	92.8	Very high	90.6	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-64.2	-37.7	175.5	0	0	0	0	0	112.5	G160 I162 Y167 I168	G160-G164 WeakPolarHBondContact O-CA 3.37Å; G160-G164 PolarHBondContact O-N 3.42Å; I162-G164 PolarHBondContact O-N 3.41Å; G164-Y167 PolarHBondContact O-N 3.14Å; G164-I168 VanDerWaalsContact O-CG1 3.32Å; G164-I168 WeakPolarHBondContact O-CG1 3.24Å; G164-I168 PolarHBondContact O-N 3.19Å
165	S	90.5	Very high	91.3	Very high	49 Å²	49	37 Å²	37	34%	0.343	19%	0.192	S	C	.	.	H	α-helix	trans	-64.4	-41.2	175.1	-59.2	0	0	0	0	111.9	M161 I162 G163 I168 W404	M161-S165 VanDerWaalsContact O-CB 3.32Å; M161-S165 WeakPolarHBondContact O-CB 2.96Å; M161-S165 PolarHBondContact O-N 3.34Å; M161-S165 PolarHBondContact O-OG 3.37Å; I162-S165 PolarHBondContact O-N 3.27Å; G163-S165 VanDerWaalsContact C-N 3.34Å; G163-S165 PolarHBondContact O-N 3.25Å; S165-I168 PolarHBondContact O-N 2.91Å; S165-W404 WeakPolarHBondContact OG-CH2 3.25Å
166	L	92.9	Very high	91.7	Very high	89 Å²	89	31.3 Å²	31.3	47%	0.466	16%	0.162	S	C	.	.	H	α-helix	trans	-63.8	-44.1	174.6	-66.5	173.1	0	0	0	111.5	I162 G163 I168 V169 I170 L392	I162-L166 WeakPolarHBondContact O-CG 3.36Å; I162-L166 PolarHBondContact O-N 3.45Å; I162-L166 VanDerWaalsContact O-N 3.13Å; G163-L166 PolarHBondContact O-N 3.28Å; L166-I168 VanDerWaalsContact C-N 3.32Å; L166-I168 PolarHBondContact O-N 3.1Å; L166-V169 PolarHBondContact O-N 3.13Å; L166-I170 PolarHBondContact O-N 3.22Å; L166-L392 HydrophobicContact CB-CD1 4.09Å; L166-L392 HydrophobicContact CB-CD2 4.3Å; L166-L392 HydrophobicContact CD1-CD2 4.22Å
167	Y	94.4	Very high	91.6	Very high	4 Å²	4	30.6 Å²	30.6	2%	0.016	16%	0.16	C	C	.	.	H	α-helix	trans	-65.3	-34.2	179	-167.7	-97	0	0	0	112.9	G163 G164 V169 I170 Q171 L323 V327 M389 L392 A393 Y396	G163-Y167 PolarHBondContact O-N 2.91Å; G164-Y167 PolarHBondContact O-N 3.14Å; Y167-V169 VanDerWaalsContact C-N 3.28Å; Y167-V169 PolarHBondContact O-N 3.39Å; Y167-I170 CarbonylContact O-C 3.58Å; Y167-I170 WeakPolarHBondContact O-CB 3.3Å; Y167-I170 PolarHBondContact O-N 3.28Å; Y167-I170 VanDerWaalsContact O-N 3.12Å; Y167-Q171 HydrophobicContact CD1-CB 4.37Å; Y167-Q171 HydrophobicContact CE1-CB 4.13Å; Y167-Q171 WeakPolarHBondContact O-CB 3.33Å; Y167-Q171 PolarHBondContact O-N 2.98Å; Y167-L323 HydrophobicContact CD1-CD1 4.22Å; Y167-L323 HydrophobicContact CE1-CD1 3.27Å; Y167-V327 WeakPolarHBondContact OH-CG2 3.47Å; Y167-M389 WeakPolarHBondContact CE2-O 3.5Å; Y167-L392 HydrophobicContact CD2-CB 3.81Å; Y167-L392 HydrophobicContact CG-CB 4.35Å; Y167-A393 HydrophobicContact CD2-CB 3.87Å; Y167-A393 VanDerWaalsContact CD2-N 3.27Å; Y167-A393 HydrophobicContact CE1-CB 4.22Å; Y167-A393 HydrophobicContact CE2-CB 3.34Å; Y167-A393 HydrophobicContact CG-CB 4.48Å; Y167-Y396 AromaticContact CD1-CD1 3.72Å; Y167-Y396 HydrophobicContact CD1-CD1 3.72Å; Y167-Y396 HydrophobicContact CD1-CD2 4.4Å; Y167-Y396 AromaticContact CD1-CG 3.63Å; Y167-Y396 HydrophobicContact CD1-CG 3.63Å; Y167-Y396 HydrophobicContact CE1-CD1 4.08Å; Y167-Y396 HydrophobicContact CE1-CG 4.44Å; Y167-Y396 HydrophobicContact CG-CG 4.36Å
168	I	93.6	Very high	91.9	Very high	11 Å²	11	32.2 Å²	32.2	6%	0.056	17%	0.167	C	C	.	.	H	α-helix	trans	-56.2	-47.1	175.5	-71.5	162.9	0	0	0	109.9	G164 S165 L166 I170 Q171 L172 Y396 W404 V423 S427	G164-I168 VanDerWaalsContact O-CG1 3.32Å; G164-I168 WeakPolarHBondContact O-CG1 3.24Å; G164-I168 PolarHBondContact O-N 3.19Å; S165-I168 PolarHBondContact O-N 2.91Å; L166-I168 VanDerWaalsContact C-N 3.32Å; L166-I168 PolarHBondContact O-N 3.1Å; I168-I170 VanDerWaalsContact C-N 3.28Å; I168-I170 PolarHBondContact O-N 3.26Å; I168-Q171 WeakPolarHBondContact O-CB 3.48Å; I168-Q171 PolarHBondContact O-N 3.29Å; I168-Q171 VanDerWaalsContact O-N 3.11Å; I168-L172 HydrophobicContact CG2-CD1 4.04Å; I168-L172 HydrophobicContact CG2-CG 4.09Å; I168-L172 VanDerWaalsContact O-CG 3.26Å; I168-L172 WeakPolarHBondContact O-CG 3.47Å; I168-L172 PolarHBondContact O-N 3.33Å; I168-Y396 HydrophobicContact CD1-CD2 4.26Å; I168-Y396 HydrophobicContact CD1-CE2 3.79Å; I168-Y396 HydrophobicContact CG1-CD2 3.67Å; I168-Y396 HydrophobicContact CG1-CE2 3.25Å; I168-W404 HydrophobicContact CD1-CH2 4.07Å; I168-W404 HydrophobicContact CD1-CZ2 3.63Å; I168-V423 HydrophobicContact CD1-CG1 3.39Å; I168-S427 VanDerWaalsContact CG2-OG 3.29Å; I168-S427 WeakPolarHBondContact CG2-OG 3.49Å
169	V	92.7	Very high	92.2	Very high	64 Å²	64	26 Å²	26	39%	0.388	14%	0.142	S	C	.	.	H	α-helix	trans	-58.1	-43.5	178.2	-178.9	0	0	0	0	110.9	L166 Y167 L172 I173 I434	L166-V169 PolarHBondContact O-N 3.13Å; Y167-V169 VanDerWaalsContact C-N 3.28Å; Y167-V169 PolarHBondContact O-N 3.39Å; V169-L172 PolarHBondContact O-N 3Å; V169-I173 HydrophobicContact CG1-CD1 4.16Å; V169-I173 WeakPolarHBondContact O-CG1 3.37Å; V169-I173 PolarHBondContact O-N 3.25Å; V169-I434 HydrophobicContact CG1-CD1 4.48Å
170	I	91.3	Very high	92.1	Very high	23 Å²	23	24.5 Å²	24.5	12%	0.118	13%	0.132	C	C	.	.	H	α-helix	trans	-61	-46.4	175.9	-63.3	171.6	0	0	0	111	L166 Y167 I168 L172 I173 L174 L344 M389 L392	L166-I170 PolarHBondContact O-N 3.22Å; Y167-I170 CarbonylContact O-C 3.58Å; Y167-I170 WeakPolarHBondContact O-CB 3.3Å; Y167-I170 PolarHBondContact O-N 3.28Å; Y167-I170 VanDerWaalsContact O-N 3.12Å; I168-I170 VanDerWaalsContact C-N 3.28Å; I168-I170 PolarHBondContact O-N 3.26Å; I170-L172 VanDerWaalsContact C-N 3.31Å; I170-L172 PolarHBondContact O-N 3.42Å; I170-I173 PolarHBondContact O-N 3.34Å; I170-L174 HydrophobicContact CG2-CD1 4.1Å; I170-L174 HydrophobicContact CG2-CG 4.43Å; I170-L174 WeakPolarHBondContact O-CG 3.16Å; I170-L174 PolarHBondContact O-N 3.43Å; I170-L344 HydrophobicContact CG2-CD1 4.47Å; I170-M389 HydrophobicContact CD1-CG 4.28Å; I170-M389 HydrophobicContact CG2-CE 3.59Å; I170-L392 HydrophobicContact CD1-CD1 3.77Å
171	Q	94.1	Very high	91.9	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.8	-40.2	177.6	-177.4	-179.4	30.7	0	0	111.8	Y167 I168 L174 L175 Y396	Y167-Q171 HydrophobicContact CD1-CB 4.37Å; Y167-Q171 HydrophobicContact CE1-CB 4.13Å; Y167-Q171 WeakPolarHBondContact O-CB 3.33Å; Y167-Q171 PolarHBondContact O-N 2.98Å; I168-Q171 WeakPolarHBondContact O-CB 3.48Å; I168-Q171 PolarHBondContact O-N 3.29Å; I168-Q171 VanDerWaalsContact O-N 3.11Å; Q171-L174 PolarHBondContact O-N 2.95Å; Q171-L175 WeakPolarHBondContact O-CB 3.38Å; Q171-L175 PolarHBondContact O-N 3.13Å; Q171-Y396 PolarHBondContact OE1-OH 2.85Å
172	L	94	Very high	91.9	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-63.7	-44.9	176.3	-66.5	-179.7	0	0	0	111.5	I168 V169 I170 L175 V176 Y274 L278 S427 V430 C431 I434	I168-L172 HydrophobicContact CG2-CD1 4.04Å; I168-L172 HydrophobicContact CG2-CG 4.09Å; I168-L172 VanDerWaalsContact O-CG 3.26Å; I168-L172 WeakPolarHBondContact O-CG 3.47Å; I168-L172 PolarHBondContact O-N 3.33Å; V169-L172 PolarHBondContact O-N 3Å; I170-L172 VanDerWaalsContact C-N 3.31Å; I170-L172 PolarHBondContact O-N 3.42Å; L172-L175 PolarHBondContact O-N 3.01Å; L172-V176 WeakPolarHBondContact O-CG2 3.16Å; L172-V176 PolarHBondContact O-N 2.87Å; L172-Y274 HydrophobicContact CD2-CD1 4.34Å; L172-Y274 HydrophobicContact CD2-CE1 3.51Å; L172-L278 HydrophobicContact CD2-CD1 4.34Å; L172-S427 WeakPolarHBondContact CD1-O 3.42Å; L172-V430 HydrophobicContact CD1-CB 4.03Å; L172-V430 HydrophobicContact CD1-CG1 3.8Å; L172-C431 HydrophobicContact CD1-CB 4.09Å; L172-C431 HydrophobicContact CD2-CB 3.76Å; L172-C431 HydrophobicContact CG-CB 4.39Å; L172-I434 HydrophobicContact CB-CD1 3.99Å
173	I	91.6	Very high	91.9	Very high	26 Å²	26	22 Å²	22	13%	0.133	12%	0.117	C	C	.	.	H	α-helix	trans	-61.9	-48.5	175.9	-62.5	165.1	0	0	0	109.7	V169 I170 L175 V176 D177 L344 I434	V169-I173 HydrophobicContact CG1-CD1 4.16Å; V169-I173 WeakPolarHBondContact O-CG1 3.37Å; V169-I173 PolarHBondContact O-N 3.25Å; I170-I173 PolarHBondContact O-N 3.34Å; I173-L175 PolarHBondContact O-N 3.02Å; I173-V176 PolarHBondContact O-N 3.48Å; I173-D177 WeakPolarHBondContact O-CB 3.44Å; I173-D177 PolarHBondContact O-N 3.24Å; I173-L344 HydrophobicContact CB-CD1 3.61Å; I173-L344 HydrophobicContact CD1-CD1 3.95Å; I173-L344 HydrophobicContact CD1-CD2 3.95Å; I173-L344 HydrophobicContact CD1-CG 4.25Å; I173-L344 HydrophobicContact CG1-CD1 4.38Å; I173-L344 HydrophobicContact CG2-CD1 3.29Å; I173-L344 HydrophobicContact CG2-CG 3.98Å; I173-I434 HydrophobicContact CG1-CD1 3.93Å; I173-I434 HydrophobicContact CG1-CG2 4.19Å
174	L	90.9	Very high	91.7	Very high	5 Å²	5	24.4 Å²	24.4	3%	0.026	13%	0.128	C	C	.	.	H	α-helix	trans	-57.8	-35.7	177.8	-71.6	173.4	0	0	0	112.7	I170 Q171 F178 M389	I170-L174 HydrophobicContact CG2-CD1 4.1Å; I170-L174 HydrophobicContact CG2-CG 4.43Å; I170-L174 WeakPolarHBondContact O-CG 3.16Å; I170-L174 PolarHBondContact O-N 3.43Å; Q171-L174 PolarHBondContact O-N 2.95Å; L174-F178 VanDerWaalsContact O-CB 3.29Å; L174-F178 WeakPolarHBondContact O-CB 3.35Å; L174-F178 PolarHBondContact O-N 2.84Å; L174-M389 HydrophobicContact CD1-CE 4.42Å
175	L	92.9	Very high	91.5	Very high	22 Å²	22	28.3 Å²	28.3	12%	0.115	15%	0.149	C	C	.	.	H	α-helix	trans	-72.8	-43.7	178.5	-175.9	143.4	0	0	0	112.2	Q171 L172 I173 D177 F178 A179 I271 Y274 V322	Q171-L175 WeakPolarHBondContact O-CB 3.38Å; Q171-L175 PolarHBondContact O-N 3.13Å; L172-L175 PolarHBondContact O-N 3.01Å; I173-L175 PolarHBondContact O-N 3.02Å; L175-D177 VanDerWaalsContact C-N 3.32Å; L175-F178 WeakPolarHBondContact O-CB 3.48Å; L175-F178 PolarHBondContact O-N 2.96Å; L175-A179 PolarHBondContact O-N 3.49Å; L175-I271 HydrophobicContact CD2-CD1 3.5Å; L175-I271 VanDerWaalsContact CD2-CD1 3.5Å; L175-Y274 HydrophobicContact CD1-CD1 3.85Å; L175-Y274 HydrophobicContact CD1-CD2 3.66Å; L175-Y274 HydrophobicContact CD1-CE1 3.98Å; L175-Y274 HydrophobicContact CD1-CE2 3.82Å; L175-Y274 HydrophobicContact CD1-CG 3.67Å; L175-Y274 HydrophobicContact CD2-CD1 3.94Å; L175-Y274 HydrophobicContact CD2-CG 4.1Å; L175-V322 HydrophobicContact CD1-CG1 4.16Å
176	V	92.3	Very high	91.6	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.006	14%	0.142	C	C	.	.	H	α-helix	trans	-61	-46.7	173.6	167.9	0	0	0	0	110.4	L172 I173 F178 A179 H180 I271 I434 Y435 T438	L172-V176 WeakPolarHBondContact O-CG2 3.16Å; L172-V176 PolarHBondContact O-N 2.87Å; I173-V176 PolarHBondContact O-N 3.48Å; V176-F178 VanDerWaalsContact C-N 3.31Å; V176-F178 PolarHBondContact O-N 3.36Å; V176-A179 WeakPolarHBondContact O-CB 3.3Å; V176-A179 PolarHBondContact O-N 3.22Å; V176-A179 VanDerWaalsContact O-N 3.13Å; V176-H180 PolarHBondContact O-CD2 3.09Å; V176-H180 PolarHBondContact O-N 3.48Å; V176-I271 HydrophobicContact CB-CD1 4.45Å; V176-I271 HydrophobicContact CG2-CD1 3.7Å; V176-I434 HydrophobicContact CB-CG2 4.38Å; V176-I434 HydrophobicContact CG1-CG2 4.39Å; V176-I434 HydrophobicContact CG2-CG2 4.13Å; V176-Y435 HydrophobicContact CG1-CD2 4.2Å; V176-T438 HydrophobicContact CG1-CG2 4.12Å
177	D	89.2	Confident	91.4	Very high	5 Å²	5	26 Å²	26	3%	0.027	13%	0.128	C	C	.	.	H	α-helix	trans	-60.6	-40.3	178.4	-171.6	45.2	0	0	0	111.2	I173 L175 T181 R333 A340 G341	I173-D177 WeakPolarHBondContact O-CB 3.44Å; I173-D177 PolarHBondContact O-N 3.24Å; L175-D177 VanDerWaalsContact C-N 3.32Å; D177-T181 PolarHBondContact O-N 3.28Å; D177-T181 PolarHBondContact O-OG1 2.86Å; D177-T181 VanDerWaalsContact O-OG1 3.06Å; D177-R333 PolarHBondContact O-NH1 2.95Å; D177-R333 IonicContact OD1-CZ 2.75Å; D177-R333 IonicContact OD1-NE 2.76Å; D177-R333 IonicContact OD1-NH1 3.59Å; D177-R333 PolarHBondContact OD1-NH1 3.1Å; D177-R333 VanDerWaalsContact OD1-NH1 3.08Å; D177-R333 IonicContact OD1-NH2 3.28Å; D177-R333 PolarHBondContact OD1-NH2 3.03Å; D177-R333 WeakPolarHBondContact OD2-CD 3.44Å; D177-R333 IonicContact OD2-CZ 3.85Å; D177-R333 IonicContact OD2-NE 3.85Å; D177-R333 PolarHBondContact OD2-NE 3.2Å; D177-R333 VanDerWaalsContact OD2-NE 3.13Å; D177-R333 IonicContact OD2-NH1 3.33Å; D177-R333 PolarHBondContact OD2-NH1 3.25Å; D177-R333 IonicContact OD2-NH2 2.82Å; D177-R333 PolarHBondContact OD2-NH2 3.16Å; D177-A340 HydrophobicContact CB-CB 4.26Å; D177-A340 WeakPolarHBondContact OD1-CB 3.21Å; D177-G341 PolarHBondContact OD1-N 3Å
178	F	91.2	Very high	91.2	Very high	39 Å²	39	27.5 Å²	27.5	17%	0.171	14%	0.138	C	C	.	.	H	α-helix	trans	-62.2	-44.8	171.4	167.7	-109.6	0	0	0	112.9	L174 L175 V176 H180 T181 W182 F325 Y329	L174-F178 VanDerWaalsContact O-CB 3.29Å; L174-F178 WeakPolarHBondContact O-CB 3.35Å; L174-F178 PolarHBondContact O-N 2.84Å; L175-F178 WeakPolarHBondContact O-CB 3.48Å; L175-F178 PolarHBondContact O-N 2.96Å; V176-F178 VanDerWaalsContact C-N 3.31Å; V176-F178 PolarHBondContact O-N 3.36Å; F178-H180 VanDerWaalsContact C-N 3.32Å; F178-H180 PolarHBondContact O-N 3.41Å; F178-T181 PolarHBondContact O-N 3.37Å; F178-W182 AromaticContact CE1-CE3 3.56Å; F178-W182 HydrophobicContact CE1-CE3 3.56Å; F178-W182 AromaticContact CE1-CZ3 3.86Å; F178-W182 HydrophobicContact CE1-CZ3 3.86Å; F178-W182 AromaticContact CE2-CE3 3.94Å; F178-W182 HydrophobicContact CE2-CE3 3.94Å; F178-W182 HydrophobicContact CZ-CD2 4.18Å; F178-W182 AromaticContact CZ-CE3 3.13Å; F178-W182 HydrophobicContact CZ-CE3 3.13Å; F178-W182 AromaticContact CZ-CZ3 3.46Å; F178-W182 HydrophobicContact CZ-CZ3 3.46Å; F178-W182 VanDerWaalsContact CZ-CZ3 3.46Å; F178-W182 PolarHBondContact O-N 3.13Å; F178-F325 AromaticContact CD1-CE1 3.84Å; F178-F325 HydrophobicContact CD1-CE1 3.84Å; F178-F325 HydrophobicContact CD1-CZ 4.09Å; F178-F325 HydrophobicContact CD2-CE1 4.12Å; F178-F325 AromaticContact CD2-CZ 3.84Å; F178-F325 HydrophobicContact CD2-CZ 3.84Å; F178-F325 AromaticContact CE1-CE1 3.89Å; F178-F325 HydrophobicContact CE1-CE1 3.89Å; F178-F325 AromaticContact CE1-CZ 3.77Å; F178-F325 HydrophobicContact CE1-CZ 3.77Å; F178-F325 HydrophobicContact CE2-CE1 4.2Å; F178-F325 AromaticContact CE2-CZ 3.52Å; F178-F325 HydrophobicContact CE2-CZ 3.52Å; F178-F325 AromaticContact CG-CE1 3.93Å; F178-F325 HydrophobicContact CG-CE1 3.93Å; F178-F325 HydrophobicContact CG-CZ 4.1Å; F178-F325 HydrophobicContact CZ-CE1 4.05Å; F178-F325 HydrophobicContact CZ-CE2 4.4Å; F178-F325 AromaticContact CZ-CZ 3.44Å; F178-F325 HydrophobicContact CZ-CZ 3.44Å; F178-F325 VanDerWaalsContact CZ-CZ 3.44Å; F178-Y329 WeakPolarHBondContact CA-OH 3.34Å; F178-Y329 HydrophobicContact CB-CD1 4.22Å; F178-Y329 HydrophobicContact CB-CE1 3.77Å; F178-Y329 HydrophobicContact CB-CE2 4.23Å; F178-Y329 AromaticContact CD2-CD2 3.96Å; F178-Y329 HydrophobicContact CD2-CD2 3.96Å; F178-Y329 AromaticContact CD2-CE2 3.55Å; F178-Y329 HydrophobicContact CD2-CE2 3.55Å; F178-Y329 AromaticContact CD2-CZ 3.9Å; F178-Y329 HydrophobicContact CE2-CE2 4.42Å; F178-Y329 HydrophobicContact CG-CE2 4.34Å
179	A	92.7	Very high	91	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61.1	-42.5	179.8	0	0	0	0	0	111.7	L175 V176 N183 Q267 I270 I271	L175-A179 PolarHBondContact O-N 3.49Å; V176-A179 WeakPolarHBondContact O-CB 3.3Å; V176-A179 PolarHBondContact O-N 3.22Å; V176-A179 VanDerWaalsContact O-N 3.13Å; A179-N183 PolarHBondContact O-N 3.31Å; A179-Q267 HydrophobicContact CB-CB 4.18Å; A179-I270 HydrophobicContact CB-CB 4.31Å; A179-I270 HydrophobicContact CB-CD1 4.29Å; A179-I270 HydrophobicContact CB-CG2 4.17Å; A179-I271 HydrophobicContact CB-CD1 4.44Å
180	H	89.7	Confident	91	Very high	25 Å²	25	31.6 Å²	31.6	12%	0.116	15%	0.149	C	C	.	.	H	α-helix	trans	-59.7	-53.5	172.4	-80.3	-69.5	0	0	0	111.9	V176 F178 W182 N183 E184 Q267 T438	V176-H180 PolarHBondContact O-CD2 3.09Å; V176-H180 PolarHBondContact O-N 3.48Å; F178-H180 VanDerWaalsContact C-N 3.32Å; F178-H180 PolarHBondContact O-N 3.41Å; H180-W182 VanDerWaalsContact C-N 3.34Å; H180-W182 PolarHBondContact O-N 2.64Å; H180-N183 PolarHBondContact O-N 3.15Å; H180-N183 VanDerWaalsContact O-N 3.14Å; H180-E184 WeakPolarHBondContact O-CB 3.22Å; H180-E184 PolarHBondContact O-N 3.29Å; H180-Q267 PolarHBondContact CE1-OE1 2.82Å; H180-Q267 PolarHBondContact ND1-OE1 2.89Å; H180-T438 PolarHBondContact NE2-OG1 3.48Å
181	T	88.1	Confident	91	Very high	28 Å²	28	36.9 Å²	36.9	17%	0.172	17%	0.174	C	C	.	.	H	α-helix	trans	-64.3	-35.6	-176.8	-62.4	0	0	0	0	113.5	D177 F178 N185 Y329 R333	D177-T181 PolarHBondContact O-N 3.28Å; D177-T181 PolarHBondContact O-OG1 2.86Å; D177-T181 VanDerWaalsContact O-OG1 3.06Å; F178-T181 PolarHBondContact O-N 3.37Å; T181-N185 WeakPolarHBondContact O-CB 3.37Å; T181-N185 PolarHBondContact O-N 2.84Å; T181-Y329 WeakPolarHBondContact CB-OH 3.48Å; T181-R333 PolarHBondContact OG1-NH1 3.4Å; T181-R333 PolarHBondContact OG1-NH2 3.46Å
182	W	90.1	Very high	90.8	Very high	56 Å²	56	44 Å²	44	21%	0.212	21%	0.206	C	C	.	.	H	α-helix	trans	-61.9	-51.3	173.3	-169	-20.2	0	0	0	109.7	F178 H180 E184 N185 W186 F205 L266 I270	F178-W182 AromaticContact CE1-CE3 3.56Å; F178-W182 HydrophobicContact CE1-CE3 3.56Å; F178-W182 AromaticContact CE1-CZ3 3.86Å; F178-W182 HydrophobicContact CE1-CZ3 3.86Å; F178-W182 AromaticContact CE2-CE3 3.94Å; F178-W182 HydrophobicContact CE2-CE3 3.94Å; F178-W182 HydrophobicContact CZ-CD2 4.18Å; F178-W182 AromaticContact CZ-CE3 3.13Å; F178-W182 HydrophobicContact CZ-CE3 3.13Å; F178-W182 AromaticContact CZ-CZ3 3.46Å; F178-W182 HydrophobicContact CZ-CZ3 3.46Å; F178-W182 VanDerWaalsContact CZ-CZ3 3.46Å; F178-W182 PolarHBondContact O-N 3.13Å; H180-W182 VanDerWaalsContact C-N 3.34Å; H180-W182 PolarHBondContact O-N 2.64Å; W182-E184 PolarHBondContact O-N 3.14Å; W182-N185 PolarHBondContact O-N 2.86Å; W182-W186 AromaticContact CD1-CD2 3.74Å; W182-W186 AromaticContact CD1-CE2 3.81Å; W182-W186 AromaticContact CD1-CG 3.91Å; W182-W186 AromaticContact CD1-NE1 3.98Å; W182-W186 HydrophobicContact CZ2-CH2 4.05Å; W182-W186 HydrophobicContact CZ2-CZ2 4.15Å; W182-W186 AromaticContact NE1-CD2 3.35Å; W182-W186 AromaticContact NE1-CE2 3.18Å; W182-W186 AromaticContact NE1-CE3 3.6Å; W182-W186 AromaticContact NE1-CH2 3.56Å; W182-W186 AromaticContact NE1-CZ2 3.31Å; W182-W186 VanDerWaalsContact NE1-CZ2 3.31Å; W182-W186 AromaticContact NE1-CZ3 3.69Å; W182-W186 AromaticContact NE1-NE1 3.74Å; W182-W186 PolarHBondContact O-N 3.48Å; W182-W186 VanDerWaalsContact O-N 3.1Å; W182-F205 HydrophobicContact CH2-CD1 4.4Å; W182-F205 HydrophobicContact CH2-CE1 4.3Å; W182-F205 HydrophobicContact CZ2-CD1 4.42Å; W182-F205 HydrophobicContact CZ2-CD2 4.45Å; W182-F205 HydrophobicContact CZ2-CE1 4.38Å; W182-F205 HydrophobicContact CZ2-CE2 4.44Å; W182-F205 HydrophobicContact CZ2-CG 4.45Å; W182-F205 HydrophobicContact CZ2-CZ 4.39Å; W182-L266 HydrophobicContact CG-CD2 4.44Å; W182-I270 HydrophobicContact CE3-CD1 4.29Å
183	N	91.7	Very high	90.7	Very high	10 Å²	10	46.5 Å²	46.5	5%	0.053	22%	0.224	C	C	.	.	H	α-helix	trans	-60.1	-49.4	-178.6	-169	74.3	0	0	0	111.9	A179 H180 L187 Q262 L266	A179-N183 PolarHBondContact O-N 3.31Å; H180-N183 PolarHBondContact O-N 3.15Å; H180-N183 VanDerWaalsContact O-N 3.14Å; N183-L187 WeakPolarHBondContact O-CB 3.41Å; N183-L187 PolarHBondContact O-N 3.07Å; N183-Q262 PolarHBondContact ND2-O 3.28Å; N183-L266 HydrophobicContact CB-CD2 4.41Å; N183-L266 WeakPolarHBondContact OD1-CB 3.41Å
184	E	89.5	Confident	90.5	Very high	55 Å²	55	47.6 Å²	47.6	26%	0.257	24%	0.242	S	C	.	.	H	α-helix	trans	-56.1	-52.2	176.1	166.2	168.7	-153.6	0	0	111.8	H180 W182 W186 L187 T188 Q262 T338	H180-E184 WeakPolarHBondContact O-CB 3.22Å; H180-E184 PolarHBondContact O-N 3.29Å; W182-E184 PolarHBondContact O-N 3.14Å; E184-W186 PolarHBondContact O-N 2.87Å; E184-L187 PolarHBondContact O-N 3.45Å; E184-T188 WeakPolarHBondContact O-CB 3.32Å; E184-T188 PolarHBondContact O-N 2.87Å; E184-T188 PolarHBondContact O-OG1 3.29Å; E184-T188 VanDerWaalsContact O-OG1 3.13Å; E184-Q262 VanDerWaalsContact CG-CD 3.43Å; E184-Q262 HydrophobicContact CG-CG 4.49Å; E184-Q262 VanDerWaalsContact CG-NE2 3.31Å; E184-Q262 VanDerWaalsContact CG-OE1 3.28Å; E184-Q262 PolarHBondContact OE1-NE2 3.21Å; E184-Q262 PolarHBondContact OE1-OE1 2.94Å; E184-Q262 VanDerWaalsContact OE1-OE1 3.08Å; E184-T338 WeakPolarHBondContact OE2-CG2 3.44Å
185	N	88.5	Confident	90.5	Very high	82 Å²	82	52.5 Å²	52.5	44%	0.439	27%	0.265	S	S	.	.	H	α-helix	trans	-59.8	-46.7	-176.5	-178.9	32.5	0	0	0	111.7	T181 W182 Q189	T181-N185 WeakPolarHBondContact O-CB 3.37Å; T181-N185 PolarHBondContact O-N 2.84Å; W182-N185 PolarHBondContact O-N 2.86Å; N185-Q189 WeakPolarHBondContact O-CB 3.19Å; N185-Q189 WeakPolarHBondContact O-CG 3.17Å; N185-Q189 PolarHBondContact O-N 3.47Å
186	W	91.5	Very high	90.4	Very high	55 Å²	55	59.6 Å²	59.6	21%	0.208	30%	0.295	C	S	.	.	H	α-helix	trans	-72.2	-32.9	180	-78.4	17.3	0	0	0	113	W182 E184 Y190 Y198 G201 L202 F205	W182-W186 AromaticContact CD1-CD2 3.74Å; W182-W186 AromaticContact CD1-CE2 3.81Å; W182-W186 AromaticContact CD1-CG 3.91Å; W182-W186 AromaticContact CD1-NE1 3.98Å; W182-W186 HydrophobicContact CZ2-CH2 4.05Å; W182-W186 HydrophobicContact CZ2-CZ2 4.15Å; W182-W186 AromaticContact NE1-CD2 3.35Å; W182-W186 AromaticContact NE1-CE2 3.18Å; W182-W186 AromaticContact NE1-CE3 3.6Å; W182-W186 AromaticContact NE1-CH2 3.56Å; W182-W186 AromaticContact NE1-CZ2 3.31Å; W182-W186 VanDerWaalsContact NE1-CZ2 3.31Å; W182-W186 AromaticContact NE1-CZ3 3.69Å; W182-W186 AromaticContact NE1-NE1 3.74Å; W182-W186 PolarHBondContact O-N 3.48Å; W182-W186 VanDerWaalsContact O-N 3.1Å; E184-W186 PolarHBondContact O-N 2.87Å; W186-Y190 WeakPolarHBondContact O-CB 3.38Å; W186-Y190 PolarHBondContact O-N 3.49Å; W186-Y198 HydrophobicContact CB-CD1 4.38Å; W186-Y198 HydrophobicContact CD2-CD1 4.43Å; W186-Y198 HydrophobicContact CG-CD1 4.07Å; W186-G201 VanDerWaalsContact CZ3-C 3.48Å; W186-L202 HydrophobicContact CB-CD1 4.28Å; W186-L202 HydrophobicContact CB-CD2 3.7Å; W186-L202 HydrophobicContact CB-CG 3.93Å; W186-L202 HydrophobicContact CE3-CD2 4Å; W186-L202 HydrophobicContact CE3-CG 4.07Å; W186-F205 AromaticContact CH2-CD2 3.72Å; W186-F205 HydrophobicContact CH2-CD2 3.72Å; W186-F205 AromaticContact CH2-CE2 3.58Å; W186-F205 HydrophobicContact CH2-CE2 3.58Å; W186-F205 AromaticContact CZ3-CD2 3.63Å; W186-F205 HydrophobicContact CZ3-CD2 3.63Å; W186-F205 AromaticContact CZ3-CE2 3.98Å; W186-F205 HydrophobicContact CZ3-CE2 3.98Å
187	L	90.6	Very high	90.5	Very high	34 Å²	34	64 Å²	64	18%	0.178	33%	0.325	C	S	.	.	H	α-helix	trans	-67.2	-48.8	175.4	-178	63.4	0	0	0	111.2	N183 E184 Q189 Y190 E191 L202 Q262	N183-L187 WeakPolarHBondContact O-CB 3.41Å; N183-L187 PolarHBondContact O-N 3.07Å; E184-L187 PolarHBondContact O-N 3.45Å; L187-Q189 VanDerWaalsContact C-N 3.33Å; L187-Q189 PolarHBondContact O-N 2.87Å; L187-Y190 WeakPolarHBondContact O-CB 3.5Å; L187-Y190 PolarHBondContact O-N 3.34Å; L187-Y190 VanDerWaalsContact O-N 3.11Å; L187-E191 WeakPolarHBondContact O-CG 3.48Å; L187-E191 PolarHBondContact O-N 3.48Å; L187-L202 HydrophobicContact CB-CD1 4.44Å; L187-Q262 HydrophobicContact CD2-CB 4.21Å; L187-Q262 HydrophobicContact CD2-CG 4.24Å
188	T	89.3	Confident	90.6	Very high	35 Å²	35	67 Å²	67	22%	0.215	34%	0.336	C	S	.	.	H	α-helix	trans	-60.9	-42.1	176.6	-61.7	0	0	0	0	111.4	E184 Y190 E191 E192	E184-T188 WeakPolarHBondContact O-CB 3.32Å; E184-T188 PolarHBondContact O-N 2.87Å; E184-T188 PolarHBondContact O-OG1 3.29Å; E184-T188 VanDerWaalsContact O-OG1 3.13Å; T188-Y190 VanDerWaalsContact C-N 3.29Å; T188-Y190 PolarHBondContact O-N 2.91Å; T188-E191 PolarHBondContact O-N 3.43Å; T188-E192 HydrophobicContact CG2-CG 4.15Å; T188-E192 WeakPolarHBondContact CG2-OE1 3.48Å; T188-E192 WeakPolarHBondContact O-CB 3.26Å; T188-E192 WeakPolarHBondContact O-CG 3.42Å; T188-E192 PolarHBondContact O-N 2.83Å
189	Q	90.1	Very high	90.5	Very high	66 Å²	66	66.1 Å²	66.1	31%	0.308	34%	0.336	S	S	.	.	H	α-helix	trans	-61.7	-38.3	175.1	-70.7	-68.1	-0.4	0	0	112.2	N185 L187 S193 Y198	N185-Q189 WeakPolarHBondContact O-CB 3.19Å; N185-Q189 WeakPolarHBondContact O-CG 3.17Å; N185-Q189 PolarHBondContact O-N 3.47Å; L187-Q189 VanDerWaalsContact C-N 3.33Å; L187-Q189 PolarHBondContact O-N 2.87Å; Q189-S193 VanDerWaalsContact O-CB 3.24Å; Q189-S193 WeakPolarHBondContact O-CB 3.33Å; Q189-S193 PolarHBondContact O-N 3.43Å; Q189-S193 PolarHBondContact O-OG 2.93Å; Q189-Y198 HydrophobicContact CB-CD1 4Å; Q189-Y198 HydrophobicContact CB-CD2 3.89Å; Q189-Y198 HydrophobicContact CB-CE1 3.94Å; Q189-Y198 HydrophobicContact CB-CE2 3.84Å; Q189-Y198 HydrophobicContact CB-CG 3.98Å; Q189-Y198 HydrophobicContact CG-CE1 4.28Å
190	Y	91.6	Very high	90.6	Very high	96 Å²	96	72.2 Å²	72.2	38%	0.376	37%	0.368	S	S	.	.	H	α-helix	trans	-65.1	-43.6	174.2	172.9	-116.4	0	0	0	112.3	W186 L187 T188 G194 A199	W186-Y190 WeakPolarHBondContact O-CB 3.38Å; W186-Y190 PolarHBondContact O-N 3.49Å; L187-Y190 WeakPolarHBondContact O-CB 3.5Å; L187-Y190 PolarHBondContact O-N 3.34Å; L187-Y190 VanDerWaalsContact O-N 3.11Å; T188-Y190 VanDerWaalsContact C-N 3.29Å; T188-Y190 PolarHBondContact O-N 2.91Å; Y190-G194 VanDerWaalsContact O-CA 3.27Å; Y190-G194 WeakPolarHBondContact O-CA 3.42Å; Y190-G194 PolarHBondContact O-N 3.27Å; Y190-A199 HydrophobicContact CD1-CB 4.42Å; Y190-A199 HydrophobicContact CD2-CB 3.79Å; Y190-A199 HydrophobicContact CE1-CB 4.4Å; Y190-A199 HydrophobicContact CE2-CB 3.79Å; Y190-A199 HydrophobicContact CG-CB 4.11Å
191	E	91	Very high	90.8	Very high	134 Å²	134	71.6 Å²	71.6	63%	0.626	37%	0.369	S	S	*	.	H	α-helix	trans	-66.1	-39.2	179.3	-71.4	174.5	171.5	0	0	112.5	L187 T188	L187-E191 WeakPolarHBondContact O-CG 3.48Å; L187-E191 PolarHBondContact O-N 3.48Å; T188-E191 PolarHBondContact O-N 3.43Å
192	E	91.5	Very high	91.1	Very high	148 Å²	148	71.2 Å²	71.2	69%	0.692	37%	0.366	S	S	*	.	H	α-helix	trans	-81.7	-46.7	-178.3	-69.9	-179.6	174.7	0	0	113.1	T188	T188-E192 HydrophobicContact CG2-CG 4.15Å; T188-E192 WeakPolarHBondContact CG2-OE1 3.48Å; T188-E192 WeakPolarHBondContact O-CB 3.26Å; T188-E192 WeakPolarHBondContact O-CG 3.42Å; T188-E192 PolarHBondContact O-N 2.83Å
193	S	90.5	Very high	91.3	Very high	54 Å²	54	73.3 Å²	73.3	38%	0.378	38%	0.38	S	S	.	.	H	α-helix	trans	-86.7	-22.9	-175.3	72	0	0	0	0	113.4	Q189 E195	Q189-S193 VanDerWaalsContact O-CB 3.24Å; Q189-S193 WeakPolarHBondContact O-CB 3.33Å; Q189-S193 PolarHBondContact O-N 3.43Å; Q189-S193 PolarHBondContact O-OG 2.93Å; S193-E195 PolarHBondContact O-N 3.26Å; S193-E195 WeakPolarHBondContact OG-CB 3.45Å; S193-E195 PolarHBondContact OG-N 3.45Å; S193-E195 VanDerWaalsContact OG-N 3.09Å
194	G	88	Confident	91.5	Very high	50 Å²	50	78.8 Å²	78.8	52%	0.515	40%	0.403	S	S	.	.			trans	66.2	6.3	-169	0	0	0	0	0	114.1	Y190 K196	Y190-G194 VanDerWaalsContact O-CA 3.27Å; Y190-G194 WeakPolarHBondContact O-CA 3.42Å; Y190-G194 PolarHBondContact O-N 3.27Å; G194-K196 PolarHBondContact O-N 2.85Å
195	E	89.9	Confident	91.8	Very high	107 Å²	107	79 Å²	79	50%	0.5	40%	0.404	S	S	.	.			trans	-72.1	111.9	-178.5	-69.8	-171.8	164.8	0	0	111	S193 C197 Y198	S193-E195 PolarHBondContact O-N 3.26Å; S193-E195 WeakPolarHBondContact OG-CB 3.45Å; S193-E195 PolarHBondContact OG-N 3.45Å; S193-E195 VanDerWaalsContact OG-N 3.09Å; E195-C197 PolarHBondContact O-N 2.97Å; E195-Y198 HydrophobicContact CB-CD2 4.01Å; E195-Y198 HydrophobicContact CB-CE2 4.19Å; E195-Y198 PolarHBondContact O-N 3.44Å; E195-Y198 WeakPolarHBondContact OE2-CE2 3.43Å
196	K	91.6	Very high	92.2	Very high	172 Å²	172	75.9 Å²	75.9	75%	0.748	39%	0.388	S	S	*	.	H	α-helix	trans	-60.5	-14.4	179.8	-62.3	-177.5	-178.9	178.5	0	114.2	G194 Y198 A199 L200	G194-K196 PolarHBondContact O-N 2.85Å; K196-Y198 VanDerWaalsContact C-N 3.33Å; K196-Y198 PolarHBondContact O-N 3.27Å; K196-A199 PolarHBondContact O-N 3.13Å; K196-L200 WeakPolarHBondContact O-CB 3.46Å; K196-L200 PolarHBondContact O-N 2.95Å
197	C	93.8	Very high	92.4	Very high	93 Å²	93	80.4 Å²	80.4	63%	0.628	41%	0.409	S	S	*	.	H	α-helix	trans	-60.1	-42.3	177.7	-171.1	0	0	0	0	111.7	E195 L200 G201	E195-C197 PolarHBondContact O-N 2.97Å; C197-L200 PolarHBondContact O-N 3.41Å; C197-G201 PolarHBondContact O-N 2.91Å
198	Y	91.2	Very high	92.8	Very high	67 Å²	67	83.7 Å²	83.7	26%	0.263	42%	0.422	S	S	.	.	H	α-helix	trans	-65.3	-43.7	178.1	-67.1	-73.5	0	0	0	112	W186 Q189 E195 K196 G201 L202	W186-Y198 HydrophobicContact CB-CD1 4.38Å; W186-Y198 HydrophobicContact CD2-CD1 4.43Å; W186-Y198 HydrophobicContact CG-CD1 4.07Å; Q189-Y198 HydrophobicContact CB-CD1 4Å; Q189-Y198 HydrophobicContact CB-CD2 3.89Å; Q189-Y198 HydrophobicContact CB-CE1 3.94Å; Q189-Y198 HydrophobicContact CB-CE2 3.84Å; Q189-Y198 HydrophobicContact CB-CG 3.98Å; Q189-Y198 HydrophobicContact CG-CE1 4.28Å; E195-Y198 HydrophobicContact CB-CD2 4.01Å; E195-Y198 HydrophobicContact CB-CE2 4.19Å; E195-Y198 PolarHBondContact O-N 3.44Å; E195-Y198 WeakPolarHBondContact OE2-CE2 3.43Å; K196-Y198 VanDerWaalsContact C-N 3.33Å; K196-Y198 PolarHBondContact O-N 3.27Å; Y198-G201 PolarHBondContact O-N 3.35Å; Y198-L202 WeakPolarHBondContact O-CG 3.26Å; Y198-L202 PolarHBondContact O-N 2.89Å
199	A	90.7	Very high	93.2	Very high	22 Å²	22	83.8 Å²	83.8	18%	0.182	42%	0.419	C	S	.	.	H	α-helix	trans	-62.7	-44.5	175.4	0	0	0	0	0	112.2	Y190 K196 G201 L202 I203	Y190-A199 HydrophobicContact CD1-CB 4.42Å; Y190-A199 HydrophobicContact CD2-CB 3.79Å; Y190-A199 HydrophobicContact CE1-CB 4.4Å; Y190-A199 HydrophobicContact CE2-CB 3.79Å; Y190-A199 HydrophobicContact CG-CB 4.11Å; K196-A199 PolarHBondContact O-N 3.13Å; A199-G201 VanDerWaalsContact C-N 3.29Å; A199-G201 PolarHBondContact O-N 2.87Å; A199-L202 PolarHBondContact O-N 3.4Å; A199-I203 VanDerWaalsContact O-CG1 3.29Å; A199-I203 WeakPolarHBondContact O-CG1 3.42Å; A199-I203 PolarHBondContact O-N 3.44Å
200	L	94.1	Very high	93.4	Very high	127 Å²	127	82.5 Å²	82.5	67%	0.665	42%	0.415	S	S	*	.	H	α-helix	trans	-60.4	-41.5	174.5	-171.9	105.3	0	0	0	111.1	K196 C197 I203 F204	K196-L200 WeakPolarHBondContact O-CB 3.46Å; K196-L200 PolarHBondContact O-N 2.95Å; C197-L200 PolarHBondContact O-N 3.41Å; L200-I203 PolarHBondContact O-N 2.9Å; L200-F204 VanDerWaalsContact O-CB 3.29Å; L200-F204 WeakPolarHBondContact O-CB 3.35Å; L200-F204 PolarHBondContact O-N 2.89Å
201	G	94.1	Very high	93.7	Very high	12 Å²	12	83.8 Å²	83.8	12%	0.124	43%	0.427	C	S	.	.	H	α-helix	trans	-59.9	-52	174.6	0	0	0	0	0	112.2	W186 C197 Y198 A199 I203 F204 F205	W186-G201 VanDerWaalsContact CZ3-C 3.48Å; C197-G201 PolarHBondContact O-N 2.91Å; Y198-G201 PolarHBondContact O-N 3.35Å; A199-G201 VanDerWaalsContact C-N 3.29Å; A199-G201 PolarHBondContact O-N 2.87Å; G201-I203 VanDerWaalsContact C-N 3.29Å; G201-I203 PolarHBondContact O-N 3.11Å; G201-F204 PolarHBondContact O-N 3.41Å; G201-F205 WeakPolarHBondContact O-CD2 3.33Å; G201-F205 PolarHBondContact O-N 3.18Å
202	L	93.6	Very high	93.9	Very high	21 Å²	21	81.7 Å²	81.7	11%	0.11	42%	0.42	C	S	.	.	H	α-helix	trans	-54.1	-47.1	177.9	-75.3	172.9	0	0	0	111.2	W186 L187 Y198 A199 T206 L266	W186-L202 HydrophobicContact CB-CD1 4.28Å; W186-L202 HydrophobicContact CB-CD2 3.7Å; W186-L202 HydrophobicContact CB-CG 3.93Å; W186-L202 HydrophobicContact CE3-CD2 4Å; W186-L202 HydrophobicContact CE3-CG 4.07Å; L187-L202 HydrophobicContact CB-CD1 4.44Å; Y198-L202 WeakPolarHBondContact O-CG 3.26Å; Y198-L202 PolarHBondContact O-N 2.89Å; A199-L202 PolarHBondContact O-N 3.4Å; L202-T206 VanDerWaalsContact O-CB 3.28Å; L202-T206 WeakPolarHBondContact O-CB 3.49Å; L202-T206 PolarHBondContact O-N 2.83Å; L202-T206 PolarHBondContact O-OG1 3.25Å; L202-L266 HydrophobicContact CD2-CD2 3.54Å
203	I	94.4	Very high	94.2	Very high	100 Å²	100	74.8 Å²	74.8	51%	0.513	39%	0.388	S	S	.	.	H	α-helix	trans	-62.4	-50.7	177.8	-67.3	167.5	0	0	0	110.4	A199 L200 G201 F205 T206 F207	A199-I203 VanDerWaalsContact O-CG1 3.29Å; A199-I203 WeakPolarHBondContact O-CG1 3.42Å; A199-I203 PolarHBondContact O-N 3.44Å; L200-I203 PolarHBondContact O-N 2.9Å; G201-I203 VanDerWaalsContact C-N 3.29Å; G201-I203 PolarHBondContact O-N 3.11Å; I203-F205 PolarHBondContact O-N 2.84Å; I203-T206 WeakPolarHBondContact O-CB 3.37Å; I203-T206 PolarHBondContact O-N 3.4Å; I203-F207 HydrophobicContact CG2-CD2 3.67Å; I203-F207 HydrophobicContact CG2-CE2 3.7Å; I203-F207 VanDerWaalsContact O-CD2 3.3Å; I203-F207 WeakPolarHBondContact O-CD2 3.35Å; I203-F207 PolarHBondContact O-N 3.23Å
204	F	96.5	Very high	94.5	Very high	125 Å²	125	76.7 Å²	76.7	55%	0.548	39%	0.393	S	S	.	.	H	α-helix	trans	-56.7	-51.7	-178.7	174	-94.6	0	0	0	112.1	L200 G201 T206 F207 F208	L200-F204 VanDerWaalsContact O-CB 3.29Å; L200-F204 WeakPolarHBondContact O-CB 3.35Å; L200-F204 PolarHBondContact O-N 2.89Å; G201-F204 PolarHBondContact O-N 3.41Å; F204-T206 VanDerWaalsContact C-N 3.32Å; F204-T206 PolarHBondContact O-N 3.37Å; F204-F207 PolarHBondContact O-N 3.24Å; F204-F208 WeakPolarHBondContact O-CB 3.45Å; F204-F208 PolarHBondContact O-N 3.01Å
205	F	96.5	Very high	94.9	Very high	59 Å²	59	76.4 Å²	76.4	26%	0.259	39%	0.386	S	S	.	.	H	α-helix	trans	-67.1	-34.9	-178.7	-80.8	-78.6	0	0	0	112.1	W182 W186 G201 I203 F208 F209 L266	W182-F205 HydrophobicContact CH2-CD1 4.4Å; W182-F205 HydrophobicContact CH2-CE1 4.3Å; W182-F205 HydrophobicContact CZ2-CD1 4.42Å; W182-F205 HydrophobicContact CZ2-CD2 4.45Å; W182-F205 HydrophobicContact CZ2-CE1 4.38Å; W182-F205 HydrophobicContact CZ2-CE2 4.44Å; W182-F205 HydrophobicContact CZ2-CG 4.45Å; W182-F205 HydrophobicContact CZ2-CZ 4.39Å; W186-F205 AromaticContact CH2-CD2 3.72Å; W186-F205 HydrophobicContact CH2-CD2 3.72Å; W186-F205 AromaticContact CH2-CE2 3.58Å; W186-F205 HydrophobicContact CH2-CE2 3.58Å; W186-F205 AromaticContact CZ3-CD2 3.63Å; W186-F205 HydrophobicContact CZ3-CD2 3.63Å; W186-F205 AromaticContact CZ3-CE2 3.98Å; W186-F205 HydrophobicContact CZ3-CE2 3.98Å; G201-F205 WeakPolarHBondContact O-CD2 3.33Å; G201-F205 PolarHBondContact O-N 3.18Å; I203-F205 PolarHBondContact O-N 2.84Å; F205-F208 PolarHBondContact O-N 2.83Å; F205-F209 HydrophobicContact CB-CD2 4.4Å; F205-F209 HydrophobicContact CB-CE2 4.32Å; F205-F209 AromaticContact CD1-CE2 3.92Å; F205-F209 HydrophobicContact CD1-CE2 3.92Å; F205-F209 WeakPolarHBondContact O-CD2 3.33Å; F205-F209 PolarHBondContact O-N 3.38Å; F205-L266 HydrophobicContact CB-CD1 3.64Å
206	T	95.9	Very high	95.2	Very high	17 Å²	17	72.2 Å²	72.2	10%	0.104	37%	0.371	C	S	.	.	H	α-helix	trans	-60.5	-47.9	173.6	-60.1	0	0	0	0	111.3	L202 I203 F204 N210 L265 L266	L202-T206 VanDerWaalsContact O-CB 3.28Å; L202-T206 WeakPolarHBondContact O-CB 3.49Å; L202-T206 PolarHBondContact O-N 2.83Å; L202-T206 PolarHBondContact O-OG1 3.25Å; I203-T206 WeakPolarHBondContact O-CB 3.37Å; I203-T206 PolarHBondContact O-N 3.4Å; F204-T206 VanDerWaalsContact C-N 3.32Å; F204-T206 PolarHBondContact O-N 3.37Å; T206-N210 WeakPolarHBondContact O-CB 3.4Å; T206-N210 PolarHBondContact O-N 3.2Å; T206-N210 VanDerWaalsContact O-N 3.15Å; T206-N210 PolarHBondContact O-ND2 3.28Å; T206-L265 HydrophobicContact CG2-CB 3.81Å; T206-L265 HydrophobicContact CG2-CD2 3.61Å; T206-L265 HydrophobicContact CG2-CG 3.66Å; T206-L266 WeakPolarHBondContact OG1-CA 3.48Å; T206-L266 WeakPolarHBondContact OG1-CB 3.38Å; T206-L266 PolarHBondContact OG1-N 3.43Å
207	F	96.5	Very high	95.5	Very high	150 Å²	150	65 Å²	65	66%	0.658	34%	0.341	S	S	*	.	H	α-helix	trans	-64.7	-42.1	176.5	-85.9	-74.6	0	0	0	112	I203 F204 N210 L211	I203-F207 HydrophobicContact CG2-CD2 3.67Å; I203-F207 HydrophobicContact CG2-CE2 3.7Å; I203-F207 VanDerWaalsContact O-CD2 3.3Å; I203-F207 WeakPolarHBondContact O-CD2 3.35Å; I203-F207 PolarHBondContact O-N 3.23Å; F204-F207 PolarHBondContact O-N 3.24Å; F207-N210 PolarHBondContact O-N 3.19Å; F207-L211 VanDerWaalsContact O-CB 3.29Å; F207-L211 WeakPolarHBondContact O-CB 3.44Å; F207-L211 PolarHBondContact O-N 3.42Å
208	F	97.6	Very high	95.6	Very high	102 Å²	102	65 Å²	65	45%	0.447	33%	0.334	S	S	.	.	H	α-helix	trans	-58.4	-51.9	179.5	174.3	-100	0	0	0	112.2	F204 F205 L211 L212	F204-F208 WeakPolarHBondContact O-CB 3.45Å; F204-F208 PolarHBondContact O-N 3.01Å; F205-F208 PolarHBondContact O-N 2.83Å; F208-L211 PolarHBondContact O-N 2.73Å; F208-L212 HydrophobicContact CE1-CD2 4.49Å; F208-L212 WeakPolarHBondContact O-CB 3.29Å; F208-L212 PolarHBondContact O-N 3.45Å
209	F	97.5	Very high	95.8	Very high	37 Å²	37	66.1 Å²	66.1	16%	0.162	34%	0.343	C	S	.	.	H	α-helix	trans	-69.8	-35.2	-178.7	-74.6	-62.4	0	0	0	112.9	F205 S213 L266 I270 A273	F205-F209 HydrophobicContact CB-CD2 4.4Å; F205-F209 HydrophobicContact CB-CE2 4.32Å; F205-F209 AromaticContact CD1-CE2 3.92Å; F205-F209 HydrophobicContact CD1-CE2 3.92Å; F205-F209 WeakPolarHBondContact O-CD2 3.33Å; F205-F209 PolarHBondContact O-N 3.38Å; F209-S213 WeakPolarHBondContact O-CB 3.44Å; F209-S213 PolarHBondContact O-N 2.94Å; F209-S213 PolarHBondContact O-OG 2.98Å; F209-L266 HydrophobicContact CD2-CD1 4.32Å; F209-I270 HydrophobicContact CD2-CD1 4.47Å; F209-I270 HydrophobicContact CD2-CG1 3.6Å; F209-I270 HydrophobicContact CE2-CD1 4.22Å; F209-I270 HydrophobicContact CE2-CG1 3.67Å; F209-I270 HydrophobicContact CG-CG1 4.14Å; F209-I270 HydrophobicContact CZ-CG1 4.25Å; F209-A273 HydrophobicContact CB-CB 4.44Å; F209-A273 HydrophobicContact CD1-CB 4Å
210	N	95.9	Very high	96	Very high	40 Å²	40	65.4 Å²	65.4	21%	0.214	34%	0.336	C	S	.	.	H	α-helix	trans	-64.6	-46	173	-83.2	-65.7	0	0	0	111.6	T206 F207 L212 S213 I214 S269	T206-N210 WeakPolarHBondContact O-CB 3.4Å; T206-N210 PolarHBondContact O-N 3.2Å; T206-N210 VanDerWaalsContact O-N 3.15Å; T206-N210 PolarHBondContact O-ND2 3.28Å; F207-N210 PolarHBondContact O-N 3.19Å; N210-L212 PolarHBondContact O-N 2.9Å; N210-S213 WeakPolarHBondContact O-CB 3.32Å; N210-S213 PolarHBondContact O-N 2.93Å; N210-I214 VanDerWaalsContact O-CG1 3.29Å; N210-I214 WeakPolarHBondContact O-CG1 3.43Å; N210-I214 PolarHBondContact O-N 2.69Å; N210-S269 WeakPolarHBondContact ND2-CB 3.39Å
211	L	96.8	Very high	96.1	Very high	122 Å²	122	62.2 Å²	62.2	64%	0.639	32%	0.317	S	S	*	.	H	α-helix	trans	-63.4	-42.3	178.1	-175	64.3	0	0	0	111.6	F207 F208 S213 I214 A215	F207-L211 VanDerWaalsContact O-CB 3.29Å; F207-L211 WeakPolarHBondContact O-CB 3.44Å; F207-L211 PolarHBondContact O-N 3.42Å; F208-L211 PolarHBondContact O-N 2.73Å; L211-S213 VanDerWaalsContact C-N 3.3Å; L211-S213 PolarHBondContact O-N 3.47Å; L211-I214 PolarHBondContact O-N 3.18Å; L211-A215 WeakPolarHBondContact O-CB 3.32Å; L211-A215 PolarHBondContact O-N 3.48Å
212	L	96.5	Very high	96	Very high	91 Å²	91	66.1 Å²	66.1	48%	0.476	33%	0.334	S	S	.	.	H	α-helix	trans	-58.9	-43	174.6	-179.7	62.1	0	0	0	111.5	F208 N210 G216	F208-L212 HydrophobicContact CE1-CD2 4.49Å; F208-L212 WeakPolarHBondContact O-CB 3.29Å; F208-L212 PolarHBondContact O-N 3.45Å; N210-L212 PolarHBondContact O-N 2.9Å; L212-G216 PolarHBondContact O-N 3.17Å
213	S	96.9	Very high	95.9	Very high	2 Å²	2	70.7 Å²	70.7	1%	0.014	35%	0.354	C	S	.	.	H	α-helix	trans	-65.3	-47.1	177.6	-57.7	0	0	0	0	112	F209 N210 L211 A215 G216 I217 A273	F209-S213 WeakPolarHBondContact O-CB 3.44Å; F209-S213 PolarHBondContact O-N 2.94Å; F209-S213 PolarHBondContact O-OG 2.98Å; N210-S213 WeakPolarHBondContact O-CB 3.32Å; N210-S213 PolarHBondContact O-N 2.93Å; L211-S213 VanDerWaalsContact C-N 3.3Å; L211-S213 PolarHBondContact O-N 3.47Å; S213-A215 PolarHBondContact O-N 3.44Å; S213-G216 PolarHBondContact O-N 3.24Å; S213-I217 WeakPolarHBondContact O-CB 3.43Å; S213-I217 VanDerWaalsContact O-CG1 3.24Å; S213-I217 WeakPolarHBondContact O-CG1 3.34Å; S213-I217 PolarHBondContact O-N 2.89Å; S213-A273 WeakPolarHBondContact OG-CA 3.5Å; S213-A273 WeakPolarHBondContact OG-CB 3.07Å; S213-A273 PolarHBondContact OG-N 3.41Å; S213-A273 VanDerWaalsContact OG-N 3.09Å
214	I	96.5	Very high	95.8	Very high	95 Å²	95	66.8 Å²	66.8	49%	0.487	33%	0.332	S	S	.	.	H	α-helix	trans	-60.1	-48.3	178.3	-68.4	164.7	0	0	0	110.3	N210 L211 G216 I217 I218	N210-I214 VanDerWaalsContact O-CG1 3.29Å; N210-I214 WeakPolarHBondContact O-CG1 3.43Å; N210-I214 PolarHBondContact O-N 2.69Å; L211-I214 PolarHBondContact O-N 3.18Å; I214-G216 VanDerWaalsContact C-N 3.34Å; I214-G216 PolarHBondContact O-N 3.41Å; I214-I217 PolarHBondContact O-N 2.9Å; I214-I218 HydrophobicContact CG2-CD1 3.81Å; I214-I218 VanDerWaalsContact O-CG1 3.28Å; I214-I218 WeakPolarHBondContact O-CG1 3.29Å; I214-I218 PolarHBondContact O-N 3.45Å
215	A	97.1	Very high	95.5	Very high	43 Å²	43	61.4 Å²	61.4	36%	0.355	31%	0.311	S	S	.	.	H	α-helix	trans	-59.4	-45.2	176.1	0	0	0	0	0	111.4	L211 S213 I217 I218 L219	L211-A215 WeakPolarHBondContact O-CB 3.32Å; L211-A215 PolarHBondContact O-N 3.48Å; S213-A215 PolarHBondContact O-N 3.44Å; A215-I217 PolarHBondContact O-N 3.16Å; A215-I218 PolarHBondContact O-N 3.39Å; A215-L219 VanDerWaalsContact O-CG 3.23Å; A215-L219 WeakPolarHBondContact O-CG 3.34Å; A215-L219 PolarHBondContact O-N 3.09Å
216	G	96.5	Very high	95.1	Very high	19 Å²	19	63 Å²	63	20%	0.196	33%	0.33	C	S	.	.	H	α-helix	trans	-58.6	-46	176.4	0	0	0	0	0	112.8	L212 S213 I214 L219 L220	L212-G216 PolarHBondContact O-N 3.17Å; S213-G216 PolarHBondContact O-N 3.24Å; I214-G216 VanDerWaalsContact C-N 3.34Å; I214-G216 PolarHBondContact O-N 3.41Å; G216-L219 PolarHBondContact O-N 3.45Å; G216-L220 VanDerWaalsContact O-CG 3.25Å; G216-L220 WeakPolarHBondContact O-CG 3.17Å; G216-L220 PolarHBondContact O-N 2.75Å
217	I	96.7	Very high	94.7	Very high	21 Å²	21	63.9 Å²	63.9	11%	0.108	34%	0.339	C	S	.	.	H	α-helix	trans	-64.7	-43	179	-67.7	167	0	0	0	111.3	S213 I214 A215 L219 L220 F221 I237 L241 T276	S213-I217 WeakPolarHBondContact O-CB 3.43Å; S213-I217 VanDerWaalsContact O-CG1 3.24Å; S213-I217 WeakPolarHBondContact O-CG1 3.34Å; S213-I217 PolarHBondContact O-N 2.89Å; I214-I217 PolarHBondContact O-N 2.9Å; A215-I217 PolarHBondContact O-N 3.16Å; I217-L219 VanDerWaalsContact C-N 3.35Å; I217-L219 PolarHBondContact O-N 3.44Å; I217-L220 PolarHBondContact O-N 3.46Å; I217-F221 HydrophobicContact CG2-CD2 3.93Å; I217-F221 HydrophobicContact CG2-CE2 3.74Å; I217-F221 WeakPolarHBondContact O-CD2 3.44Å; I217-F221 PolarHBondContact O-N 3.41Å; I217-I237 HydrophobicContact CG2-CG2 4.18Å; I217-L241 HydrophobicContact CD1-CD1 3.82Å; I217-L241 HydrophobicContact CG2-CD2 4.5Å; I217-T276 HydrophobicContact CG1-CG2 3.98Å
218	I	96.6	Very high	94.1	Very high	94 Å²	94	62.5 Å²	62.5	48%	0.482	35%	0.348	S	S	.	.	H	α-helix	trans	-59.5	-47.4	175.5	-68.6	166.4	0	0	0	110.3	I214 A215 L220 F221 I222	I214-I218 HydrophobicContact CG2-CD1 3.81Å; I214-I218 VanDerWaalsContact O-CG1 3.28Å; I214-I218 WeakPolarHBondContact O-CG1 3.29Å; I214-I218 PolarHBondContact O-N 3.45Å; A215-I218 PolarHBondContact O-N 3.39Å; I218-L220 VanDerWaalsContact C-N 3.31Å; I218-L220 PolarHBondContact O-N 3.49Å; I218-F221 PolarHBondContact O-N 3.17Å; I218-I222 HydrophobicContact CG2-CD1 3.8Å; I218-I222 WeakPolarHBondContact O-CG1 3.28Å; I218-I222 PolarHBondContact O-N 2.82Å
219	L	95.7	Very high	93.6	Very high	89 Å²	89	64.5 Å²	64.5	47%	0.466	36%	0.359	S	S	.	.	H	α-helix	trans	-62.2	-38.5	177.8	-67.5	169.1	0	0	0	111.7	A215 G216 I217 F221 I222 F223	A215-L219 VanDerWaalsContact O-CG 3.23Å; A215-L219 WeakPolarHBondContact O-CG 3.34Å; A215-L219 PolarHBondContact O-N 3.09Å; G216-L219 PolarHBondContact O-N 3.45Å; I217-L219 VanDerWaalsContact C-N 3.35Å; I217-L219 PolarHBondContact O-N 3.44Å; L219-F221 PolarHBondContact O-N 2.92Å; L219-I222 PolarHBondContact O-N 3.15Å; L219-F223 HydrophobicContact CB-CD2 4.31Å; L219-F223 HydrophobicContact CD2-CD2 4.31Å; L219-F223 HydrophobicContact CD2-CE2 3.79Å; L219-F223 WeakPolarHBondContact O-CB 3.48Å; L219-F223 VanDerWaalsContact O-CD2 3.28Å; L219-F223 WeakPolarHBondContact O-CD2 3.29Å; L219-F223 PolarHBondContact O-N 2.85Å
220	L	95.2	Very high	93.3	Very high	7 Å²	7	63 Å²	63	4%	0.037	35%	0.352	C	S	.	.	H	α-helix	trans	-62.4	-42.2	175.8	-71.4	168.4	0	0	0	112	G216 I217 I218 Y224 A225 I237 T276 T279 W280 L283	G216-L220 VanDerWaalsContact O-CG 3.25Å; G216-L220 WeakPolarHBondContact O-CG 3.17Å; G216-L220 PolarHBondContact O-N 2.75Å; I217-L220 PolarHBondContact O-N 3.46Å; I218-L220 VanDerWaalsContact C-N 3.31Å; I218-L220 PolarHBondContact O-N 3.49Å; L220-Y224 HydrophobicContact CD2-CD2 3.93Å; L220-Y224 HydrophobicContact CD2-CE2 4.3Å; L220-Y224 WeakPolarHBondContact O-CA 3.28Å; L220-Y224 WeakPolarHBondContact O-CB 3.35Å; L220-Y224 PolarHBondContact O-N 3.43Å; L220-A225 PolarHBondContact O-N 3.35Å; L220-I237 HydrophobicContact CB-CD1 3.79Å; L220-I237 HydrophobicContact CB-CG1 4.2Å; L220-I237 HydrophobicContact CB-CG2 4.41Å; L220-T276 HydrophobicContact CD1-CG2 4.1Å; L220-T279 HydrophobicContact CD1-CG2 4.14Å; L220-W280 HydrophobicContact CD1-CB 4.42Å; L220-W280 HydrophobicContact CD2-CB 3.71Å; L220-W280 HydrophobicContact CD2-CG 4.17Å; L220-L283 HydrophobicContact CD2-CD1 4.02Å
221	F	95	Very high	93.1	Very high	61 Å²	61	63.1 Å²	63.1	27%	0.268	36%	0.363	S	S	.	.	H	α-helix	trans	-63.5	-41.5	175.1	-82.1	-63.8	0	0	0	112.6	I217 I218 L219 A225 S226 K234 I237	I217-F221 HydrophobicContact CG2-CD2 3.93Å; I217-F221 HydrophobicContact CG2-CE2 3.74Å; I217-F221 WeakPolarHBondContact O-CD2 3.44Å; I217-F221 PolarHBondContact O-N 3.41Å; I218-F221 PolarHBondContact O-N 3.17Å; L219-F221 PolarHBondContact O-N 2.92Å; F221-A225 HydrophobicContact CD1-CB 4.15Å; F221-A225 CarbonylContact O-C 3.32Å; F221-A225 PolarHBondContact O-N 3.34Å; F221-S226 PolarHBondContact O-N 3.19Å; F221-K234 HydrophobicContact CE1-CG 4.19Å; F221-I237 HydrophobicContact CD1-CD1 4.46Å; F221-I237 HydrophobicContact CD1-CG2 4.35Å; F221-I237 HydrophobicContact CD2-CG2 3.93Å; F221-I237 HydrophobicContact CE1-CB 4.14Å; F221-I237 HydrophobicContact CE1-CG2 3.94Å; F221-I237 HydrophobicContact CE2-CG2 3.49Å; F221-I237 VanDerWaalsContact CE2-CG2 3.49Å; F221-I237 HydrophobicContact CG-CG2 4.34Å; F221-I237 HydrophobicContact CZ-CB 4.06Å; F221-I237 HydrophobicContact CZ-CG2 3.49Å; F221-I237 VanDerWaalsContact CZ-CG2 3.49Å
222	I	93.4	Very high	92.8	Very high	93 Å²	93	61.8 Å²	61.8	48%	0.477	36%	0.356	S	S	.	.	H	α-helix	trans	-66.9	-48	-179.8	-67.2	168.9	0	0	0	111.4	I218 L219 S226	I218-I222 HydrophobicContact CG2-CD1 3.8Å; I218-I222 WeakPolarHBondContact O-CG1 3.28Å; I218-I222 PolarHBondContact O-N 2.82Å; L219-I222 PolarHBondContact O-N 3.15Å; I222-S226 WeakPolarHBondContact O-CB 3.21Å; I222-S226 PolarHBondContact O-OG 3.34Å
223	F	91	Very high	92.7	Very high	118 Å²	118	58 Å²	58	52%	0.518	34%	0.337	S	S	.	.	H	α-helix	trans	-92.1	-31.4	-169.4	-72.7	-67.3	0	0	0	114.6	L219 P293	L219-F223 HydrophobicContact CB-CD2 4.31Å; L219-F223 HydrophobicContact CD2-CD2 4.31Å; L219-F223 HydrophobicContact CD2-CE2 3.79Å; L219-F223 WeakPolarHBondContact O-CB 3.48Å; L219-F223 VanDerWaalsContact O-CD2 3.28Å; L219-F223 WeakPolarHBondContact O-CD2 3.29Å; L219-F223 PolarHBondContact O-N 2.85Å; F223-P293 HydrophobicContact CB-CG 4.34Å; F223-P293 WeakPolarHBondContact O-CD 3.41Å
224	Y	91.2	Very high	92.6	Very high	17 Å²	17	63.8 Å²	63.8	7%	0.067	36%	0.362	C	S	.	.	H	α-helix	trans	-113.8	-10.2	-172.5	-68.7	-94.7	0	0	0	114.2	L220 N233 W280 L283 T284 C291 S294	L220-Y224 HydrophobicContact CD2-CD2 3.93Å; L220-Y224 HydrophobicContact CD2-CE2 4.3Å; L220-Y224 WeakPolarHBondContact O-CA 3.28Å; L220-Y224 WeakPolarHBondContact O-CB 3.35Å; L220-Y224 PolarHBondContact O-N 3.43Å; Y224-N233 VanDerWaalsContact O-CB 3.26Å; Y224-N233 WeakPolarHBondContact O-CB 3.45Å; Y224-N233 PolarHBondContact O-ND2 3.04Å; Y224-W280 AromaticContact CE2-CD1 3.95Å; Y224-L283 HydrophobicContact CD1-CB 3.64Å; Y224-L283 HydrophobicContact CD1-CD1 4.44Å; Y224-L283 HydrophobicContact CE1-CB 3.99Å; Y224-L283 HydrophobicContact CG-CB 4.11Å; Y224-L283 HydrophobicContact CG-CD1 4.12Å; Y224-T284 PolarHBondContact OH-OG1 3.28Å; Y224-C291 WeakPolarHBondContact CA-O 3.4Å; Y224-C291 VanDerWaalsContact CD1-O 3.32Å; Y224-C291 WeakPolarHBondContact CD1-O 3.44Å; Y224-S294 PolarHBondContact OH-OG 2.71Å
225	A	91.1	Very high	92.5	Very high	12 Å²	12	62 Å²	62	10%	0.099	36%	0.36	C	S	.	.	S	Bend	trans	-136.5	16.1	-175.8	0	0	0	0	0	114.6	L220 F221 N233 K234 I237	L220-A225 PolarHBondContact O-N 3.35Å; F221-A225 HydrophobicContact CD1-CB 4.15Å; F221-A225 CarbonylContact O-C 3.32Å; F221-A225 PolarHBondContact O-N 3.34Å; A225-N233 HydrophobicContact CB-CB 4.38Å; A225-K234 HydrophobicContact CB-CB 4.08Å; A225-I237 HydrophobicContact CB-CD1 3.91Å
226	S	87.5	Confident	92.5	Very high	94 Å²	94	60.4 Å²	60.4	66%	0.657	35%	0.346	S	S	*	.			trans	-74.8	-35.6	-179.4	49	0	0	0	0	113.4	F221 I222	F221-S226 PolarHBondContact O-N 3.19Å; I222-S226 WeakPolarHBondContact O-CB 3.21Å; I222-S226 PolarHBondContact O-OG 3.34Å
227	A	86.6	Confident	92.5	Very high	35 Å²	35	59.6 Å²	59.6	29%	0.289	34%	0.337	S	S	.	.	S	Bend	trans	-76.8	142.6	178.1	0	0	0	0	0	111.8	Q229 C230 V290	A227-Q229 PolarHBondContact O-N 2.93Å; A227-Q229 VanDerWaalsContact O-N 3.16Å; A227-C230 WeakPolarHBondContact O-CB 3.34Å; A227-C230 PolarHBondContact O-N 3.43Å; A227-V290 HydrophobicContact CB-CG1 4.02Å
228	S	85.4	Confident	92.5	Very high	121 Å²	121	60.5 Å²	60.5	85%	0.846	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-26.9	-178.5	55.7	0	0	0	0	113.8	C230	S228-C230 VanDerWaalsContact C-N 3.27Å; S228-C230 PolarHBondContact O-N 2.86Å
229	Q	87.2	Confident	92.5	Very high	144 Å²	144	58.8 Å²	58.8	67%	0.673	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-17.5	179.1	-59.3	177.6	24.9	0	0	112.4	A227 G231	A227-Q229 PolarHBondContact O-N 2.93Å; A227-Q229 VanDerWaalsContact O-N 3.16Å; Q229-G231 PolarHBondContact O-N 3.24Å
230	C	89.7	Confident	92.6	Very high	5 Å²	5	54.8 Å²	54.8	3%	0.034	32%	0.316	C	S	.	.			trans	-84.5	40.5	-176.8	-53	0	0	0	0	113.4	A227 S228 L232 N233 K234 C291	A227-C230 WeakPolarHBondContact O-CB 3.34Å; A227-C230 PolarHBondContact O-N 3.43Å; S228-C230 VanDerWaalsContact C-N 3.27Å; S228-C230 PolarHBondContact O-N 2.86Å; C230-L232 VanDerWaalsContact C-N 3.31Å; C230-L232 PolarHBondContact O-N 3.4Å; C230-N233 HydrophobicContact CB-CB 4.39Å; C230-N233 PolarHBondContact O-N 3.12Å; C230-K234 PolarHBondContact O-N 2.97Å; C230-C291 WeakPolarHBondContact CA-SG 3.4Å; C230-C291 HydrophobicContact CB-CB 3.82Å; C230-C291 WeakPolarHBondContact CB-SG 3.44Å; C230-C291 WeakPolarHBondContact SG-CA 3.13Å; C230-C291 WeakPolarHBondContact SG-CB 3.42Å; C230-C291 CovalentContact SG-SG 2.02Å; C230-C291 PolarHBondContact SG-SG 2.85Å
231	G	91.7	Very high	92.6	Very high	43 Å²	43	58 Å²	58	44%	0.443	33%	0.333	S	S	.	.	H	α-helix	trans	-59	-39.1	-176.3	0	0	0	0	0	113.3	Q229 K234 A235	Q229-G231 PolarHBondContact O-N 3.24Å; G231-K234 PolarHBondContact O-N 3Å; G231-A235 WeakPolarHBondContact O-CB 3.42Å; G231-A235 PolarHBondContact O-N 3.31Å
232	L	91.9	Very high	92.7	Very high	93 Å²	93	59.3 Å²	59.3	49%	0.487	34%	0.342	S	S	.	.	H	α-helix	trans	-63.6	-49.2	176.9	-179.8	64.1	0	0	0	111.6	C230 K234 A235 L236 F421	C230-L232 VanDerWaalsContact C-N 3.31Å; C230-L232 PolarHBondContact O-N 3.4Å; L232-K234 VanDerWaalsContact C-N 3.3Å; L232-K234 PolarHBondContact O-N 2.94Å; L232-A235 PolarHBondContact O-N 3.48Å; L232-A235 VanDerWaalsContact O-N 3.17Å; L232-L236 HydrophobicContact CD1-CD1 4.19Å; L232-L236 HydrophobicContact CD1-CG 4.22Å; L232-L236 HydrophobicContact CG-CD1 4.03Å; L232-L236 HydrophobicContact CG-CG 4.44Å; L232-L236 WeakPolarHBondContact O-CG 3.44Å; L232-L236 PolarHBondContact O-N 3.48Å; L232-F421 HydrophobicContact CD2-CZ 4.31Å
233	N	93.7	Very high	92.9	Very high	13 Å²	13	58.8 Å²	58.8	7%	0.07	34%	0.336	C	S	.	.	H	α-helix	trans	-60	-43.4	178.8	-70.9	5.9	0	0	0	110.9	Y224 A225 C230 A235 L236 I237 L283 C291	Y224-N233 VanDerWaalsContact O-CB 3.26Å; Y224-N233 WeakPolarHBondContact O-CB 3.45Å; Y224-N233 PolarHBondContact O-ND2 3.04Å; A225-N233 HydrophobicContact CB-CB 4.38Å; C230-N233 HydrophobicContact CB-CB 4.39Å; C230-N233 PolarHBondContact O-N 3.12Å; N233-A235 PolarHBondContact O-N 3.31Å; N233-L236 PolarHBondContact O-N 3.03Å; N233-I237 WeakPolarHBondContact O-CD1 3.31Å; N233-I237 VanDerWaalsContact O-CG1 3.24Å; N233-I237 WeakPolarHBondContact O-CG1 3.27Å; N233-I237 PolarHBondContact O-N 2.66Å; N233-L283 HydrophobicContact CB-CD2 4.17Å; N233-L283 WeakPolarHBondContact OD1-CD2 3.16Å; N233-C291 WeakPolarHBondContact ND2-CB 3.39Å
234	K	94.5	Very high	93.2	Very high	123 Å²	123	53.5 Å²	53.5	54%	0.535	31%	0.314	S	S	.	.	H	α-helix	trans	-58.8	-45.9	175.6	-168.3	175.1	-177.2	174.3	0	111.7	F221 A225 C230 G231 L232 S238	F221-K234 HydrophobicContact CE1-CG 4.19Å; A225-K234 HydrophobicContact CB-CB 4.08Å; C230-K234 PolarHBondContact O-N 2.97Å; G231-K234 PolarHBondContact O-N 3Å; L232-K234 VanDerWaalsContact C-N 3.3Å; L232-K234 PolarHBondContact O-N 2.94Å; K234-S238 WeakPolarHBondContact O-CB 3.49Å; K234-S238 PolarHBondContact O-N 2.63Å; K234-S238 PolarHBondContact O-OG 2.67Å
235	A	95.3	Very high	93.4	Very high	56 Å²	56	59 Å²	59	46%	0.463	34%	0.338	S	S	.	.	H	α-helix	trans	-63.3	-44.5	178.4	0	0	0	0	0	112.3	G231 L232 N233 S238 L239	G231-A235 WeakPolarHBondContact O-CB 3.42Å; G231-A235 PolarHBondContact O-N 3.31Å; L232-A235 PolarHBondContact O-N 3.48Å; L232-A235 VanDerWaalsContact O-N 3.17Å; N233-A235 PolarHBondContact O-N 3.31Å; A235-S238 PolarHBondContact O-N 3.17Å; A235-L239 VanDerWaalsContact O-CB 3.23Å; A235-L239 WeakPolarHBondContact O-CB 3.47Å; A235-L239 PolarHBondContact O-N 3.47Å
236	L	96.1	Very high	93.6	Very high	10 Å²	10	63.8 Å²	63.8	5%	0.052	36%	0.357	C	S	.	.	H	α-helix	trans	-65.1	-44.8	-179.6	-68.9	175	0	0	0	112.6	L232 N233 L239 N240 L283 F421 I425 W429	L232-L236 HydrophobicContact CD1-CD1 4.19Å; L232-L236 HydrophobicContact CD1-CG 4.22Å; L232-L236 HydrophobicContact CG-CD1 4.03Å; L232-L236 HydrophobicContact CG-CG 4.44Å; L232-L236 WeakPolarHBondContact O-CG 3.44Å; L232-L236 PolarHBondContact O-N 3.48Å; N233-L236 PolarHBondContact O-N 3.03Å; L236-L239 PolarHBondContact O-N 3.04Å; L236-N240 PolarHBondContact O-N 3.08Å; L236-L283 HydrophobicContact CD1-CD2 4.48Å; L236-F421 HydrophobicContact CD1-CE1 4.06Å; L236-F421 HydrophobicContact CD1-CE2 4.47Å; L236-F421 HydrophobicContact CD1-CZ 3.49Å; L236-F421 VanDerWaalsContact CD1-CZ 3.49Å; L236-I425 HydrophobicContact CD1-CD1 4.18Å; L236-I425 HydrophobicContact CD1-CG1 4.25Å; L236-I425 HydrophobicContact CD2-CG2 3.83Å; L236-W429 HydrophobicContact CD2-CH2 4.5Å; L236-W429 HydrophobicContact CD2-CZ2 3.98Å
237	I	96.7	Very high	94	Very high	3 Å²	3	59.4 Å²	59.4	2%	0.015	33%	0.326	C	S	.	.	H	α-helix	trans	-62.4	-47.1	176.5	-61.7	160.8	0	0	0	110	I217 L220 F221 A225 N233 L239 N240 L241 T279 L283	I217-I237 HydrophobicContact CG2-CG2 4.18Å; L220-I237 HydrophobicContact CB-CD1 3.79Å; L220-I237 HydrophobicContact CB-CG1 4.2Å; L220-I237 HydrophobicContact CB-CG2 4.41Å; F221-I237 HydrophobicContact CD1-CD1 4.46Å; F221-I237 HydrophobicContact CD1-CG2 4.35Å; F221-I237 HydrophobicContact CD2-CG2 3.93Å; F221-I237 HydrophobicContact CE1-CB 4.14Å; F221-I237 HydrophobicContact CE1-CG2 3.94Å; F221-I237 HydrophobicContact CE2-CG2 3.49Å; F221-I237 VanDerWaalsContact CE2-CG2 3.49Å; F221-I237 HydrophobicContact CG-CG2 4.34Å; F221-I237 HydrophobicContact CZ-CB 4.06Å; F221-I237 HydrophobicContact CZ-CG2 3.49Å; F221-I237 VanDerWaalsContact CZ-CG2 3.49Å; A225-I237 HydrophobicContact CB-CD1 3.91Å; N233-I237 WeakPolarHBondContact O-CD1 3.31Å; N233-I237 VanDerWaalsContact O-CG1 3.24Å; N233-I237 WeakPolarHBondContact O-CG1 3.27Å; N233-I237 PolarHBondContact O-N 2.66Å; I237-L239 PolarHBondContact O-N 3.05Å; I237-N240 PolarHBondContact O-N 3.29Å; I237-L241 WeakPolarHBondContact O-CB 3.43Å; I237-L241 PolarHBondContact O-N 3.46Å; I237-T279 HydrophobicContact CG1-CG2 4.19Å; I237-L283 HydrophobicContact CD1-CD1 3.75Å; I237-L283 HydrophobicContact CG1-CD1 3.78Å
238	S	96.5	Very high	94.4	Very high	40 Å²	40	58.7 Å²	58.7	28%	0.28	32%	0.319	S	S	.	.	H	α-helix	trans	-61.3	-42.6	178.8	-67.8	0	0	0	0	112.6	K234 A235 L241 I242	K234-S238 WeakPolarHBondContact O-CB 3.49Å; K234-S238 PolarHBondContact O-N 2.63Å; K234-S238 PolarHBondContact O-OG 2.67Å; A235-S238 PolarHBondContact O-N 3.17Å; S238-L241 PolarHBondContact O-N 3.44Å; S238-I242 WeakPolarHBondContact O-CD1 3.19Å; S238-I242 VanDerWaalsContact O-CG1 3.23Å; S238-I242 WeakPolarHBondContact O-CG1 3.31Å; S238-I242 PolarHBondContact O-N 3.49Å
239	L	96.9	Very high	94.8	Very high	58 Å²	58	55.5 Å²	55.5	30%	0.304	29%	0.294	S	S	.	.	H	α-helix	trans	-66.9	-42.8	-179.9	177.2	149.2	0	0	0	111.6	A235 L236 I237 L241 I242 F243 W429	A235-L239 VanDerWaalsContact O-CB 3.23Å; A235-L239 WeakPolarHBondContact O-CB 3.47Å; A235-L239 PolarHBondContact O-N 3.47Å; L236-L239 PolarHBondContact O-N 3.04Å; I237-L239 PolarHBondContact O-N 3.05Å; L239-L241 PolarHBondContact O-N 2.57Å; L239-I242 PolarHBondContact O-N 3.02Å; L239-F243 HydrophobicContact CD1-CE2 4.4Å; L239-F243 HydrophobicContact CD1-CZ 4.1Å; L239-F243 HydrophobicContact CD2-CD2 3.58Å; L239-F243 HydrophobicContact CD2-CE1 4.46Å; L239-F243 HydrophobicContact CD2-CE2 3.13Å; L239-F243 HydrophobicContact CD2-CG 4.43Å; L239-F243 HydrophobicContact CD2-CZ 3.64Å; L239-F243 HydrophobicContact CG-CD2 4.27Å; L239-F243 HydrophobicContact CG-CE1 4.22Å; L239-F243 HydrophobicContact CG-CE2 3.76Å; L239-F243 HydrophobicContact CG-CZ 3.7Å; L239-F243 VanDerWaalsContact O-CG 3.31Å; L239-F243 WeakPolarHBondContact O-CG 3.44Å; L239-F243 PolarHBondContact O-N 3.39Å; L239-W429 HydrophobicContact CD2-CZ2 3.81Å
240	N	97	Very high	95.1	Very high	5 Å²	5	50.1 Å²	50.1	3%	0.027	27%	0.27	C	S	.	.	H	α-helix	trans	-64.6	-38.9	174.5	-78.6	-5.4	0	0	0	112.1	L236 I237 F243 C244 V275 T279 S428 W429	L236-N240 PolarHBondContact O-N 3.08Å; I237-N240 PolarHBondContact O-N 3.29Å; N240-F243 PolarHBondContact O-N 2.88Å; N240-C244 WeakPolarHBondContact O-CB 3.43Å; N240-C244 PolarHBondContact O-N 2.86Å; N240-C244 PolarHBondContact O-SG 2.83Å; N240-V275 HydrophobicContact CB-CG1 4.13Å; N240-T279 PolarHBondContact ND2-OG1 2.9Å; N240-S428 PolarHBondContact ND2-OG 2.9Å; N240-S428 VanDerWaalsContact ND2-OG 3.13Å; N240-W429 PolarHBondContact OD1-NE1 3.5Å
241	L	96.6	Very high	95.2	Very high	75 Å²	75	49.9 Å²	49.9	39%	0.393	27%	0.269	S	S	.	.	H	α-helix	trans	-59.6	-46.4	173.1	172.1	64.6	0	0	0	111.5	I217 I237 S238 L239 C244 F245	I217-L241 HydrophobicContact CD1-CD1 3.82Å; I217-L241 HydrophobicContact CG2-CD2 4.5Å; I237-L241 WeakPolarHBondContact O-CB 3.43Å; I237-L241 PolarHBondContact O-N 3.46Å; S238-L241 PolarHBondContact O-N 3.44Å; L239-L241 PolarHBondContact O-N 2.57Å; L241-C244 PolarHBondContact O-N 3.23Å; L241-F245 WeakPolarHBondContact O-CB 3.35Å; L241-F245 PolarHBondContact O-N 3.46Å
242	I	96.9	Very high	95.2	Very high	87 Å²	87	52.1 Å²	52.1	45%	0.446	27%	0.27	S	S	.	.	H	α-helix	trans	-60.7	-46.5	177.9	-70.4	164.6	0	0	0	110.6	S238 L239 F245 F246	S238-I242 WeakPolarHBondContact O-CD1 3.19Å; S238-I242 VanDerWaalsContact O-CG1 3.23Å; S238-I242 WeakPolarHBondContact O-CG1 3.31Å; S238-I242 PolarHBondContact O-N 3.49Å; L239-I242 PolarHBondContact O-N 3.02Å; I242-F245 WeakPolarHBondContact O-CB 3.5Å; I242-F245 PolarHBondContact O-N 3.04Å; I242-F246 HydrophobicContact CG2-CD2 3.62Å; I242-F246 HydrophobicContact CG2-CE2 3.42Å; I242-F246 VanDerWaalsContact CG2-CE2 3.42Å; I242-F246 WeakPolarHBondContact O-CD2 3.27Å; I242-F246 PolarHBondContact O-N 3.42Å
243	F	97.1	Very high	95.3	Very high	83 Å²	83	51.4 Å²	51.4	36%	0.364	27%	0.266	S	S	.	.	H	α-helix	trans	-64.5	-40.9	179.1	-67.1	-13.4	0	0	0	112.7	L239 N240 F245 F246 A247 W429 L432	L239-F243 HydrophobicContact CD1-CE2 4.4Å; L239-F243 HydrophobicContact CD1-CZ 4.1Å; L239-F243 HydrophobicContact CD2-CD2 3.58Å; L239-F243 HydrophobicContact CD2-CE1 4.46Å; L239-F243 HydrophobicContact CD2-CE2 3.13Å; L239-F243 HydrophobicContact CD2-CG 4.43Å; L239-F243 HydrophobicContact CD2-CZ 3.64Å; L239-F243 HydrophobicContact CG-CD2 4.27Å; L239-F243 HydrophobicContact CG-CE1 4.22Å; L239-F243 HydrophobicContact CG-CE2 3.76Å; L239-F243 HydrophobicContact CG-CZ 3.7Å; L239-F243 VanDerWaalsContact O-CG 3.31Å; L239-F243 WeakPolarHBondContact O-CG 3.44Å; L239-F243 PolarHBondContact O-N 3.39Å; N240-F243 PolarHBondContact O-N 2.88Å; F243-F245 VanDerWaalsContact C-N 3.33Å; F243-F245 PolarHBondContact O-N 3.24Å; F243-F246 PolarHBondContact O-N 3.43Å; F243-A247 WeakPolarHBondContact O-CB 3.26Å; F243-A247 PolarHBondContact O-N 3.42Å; F243-W429 AromaticContact CD2-CD1 3.97Å; F243-W429 AromaticContact CE2-CD1 3.93Å; F243-W429 HydrophobicContact CE2-CG 4.4Å; F243-L432 HydrophobicContact CB-CD1 3.48Å; F243-L432 VanDerWaalsContact CB-CD1 3.48Å; F243-L432 HydrophobicContact CD2-CD1 4.15Å; F243-L432 HydrophobicContact CG-CD1 4.34Å
244	C	97.1	Very high	95.1	Very high	6 Å²	6	55.1 Å²	55.1	4%	0.041	29%	0.29	C	S	.	.	H	α-helix	trans	-63.4	-38.6	174.4	-70.8	0	0	0	0	112.4	N240 L241 A247 S248 T272 V275	N240-C244 WeakPolarHBondContact O-CB 3.43Å; N240-C244 PolarHBondContact O-N 2.86Å; N240-C244 PolarHBondContact O-SG 2.83Å; L241-C244 PolarHBondContact O-N 3.23Å; C244-A247 PolarHBondContact O-N 3.46Å; C244-S248 WeakPolarHBondContact O-CB 3.34Å; C244-S248 PolarHBondContact O-N 3.02Å; C244-S248 PolarHBondContact O-OG 2.85Å; C244-T272 HydrophobicContact CB-CG2 3.72Å; C244-V275 VanDerWaalsContact SG-CG1 3.56Å
245	F	96	Very high	94.8	Very high	132 Å²	132	55.1 Å²	55.1	58%	0.579	29%	0.29	S	S	*	.	H	α-helix	trans	-61.2	-50.9	174.1	176.4	-97.6	0	0	0	111	L241 I242 F243 A247 S248 V249	L241-F245 WeakPolarHBondContact O-CB 3.35Å; L241-F245 PolarHBondContact O-N 3.46Å; I242-F245 WeakPolarHBondContact O-CB 3.5Å; I242-F245 PolarHBondContact O-N 3.04Å; F243-F245 VanDerWaalsContact C-N 3.33Å; F243-F245 PolarHBondContact O-N 3.24Å; F245-A247 PolarHBondContact O-N 3.34Å; F245-S248 WeakPolarHBondContact O-CB 3.28Å; F245-S248 PolarHBondContact O-N 2.99Å; F245-V249 HydrophobicContact CD1-CG2 4.29Å; F245-V249 HydrophobicContact CE1-CG2 3.86Å; F245-V249 HydrophobicContact CE2-CG2 4.31Å; F245-V249 HydrophobicContact CZ-CG2 3.88Å; F245-V249 WeakPolarHBondContact O-CG2 3.4Å; F245-V249 PolarHBondContact O-N 3.07Å
246	F	95.8	Very high	94.5	Very high	113 Å²	113	52.8 Å²	52.8	50%	0.496	27%	0.271	S	S	.	.	H	α-helix	trans	-61.7	-42.4	177.3	-78	-63.7	0	0	0	112.7	I242 F243 S248 V249 I250	I242-F246 HydrophobicContact CG2-CD2 3.62Å; I242-F246 HydrophobicContact CG2-CE2 3.42Å; I242-F246 VanDerWaalsContact CG2-CE2 3.42Å; I242-F246 WeakPolarHBondContact O-CD2 3.27Å; I242-F246 PolarHBondContact O-N 3.42Å; F243-F246 PolarHBondContact O-N 3.43Å; F246-S248 VanDerWaalsContact C-N 3.26Å; F246-S248 PolarHBondContact O-N 2.73Å; F246-V249 PolarHBondContact O-N 3.35Å; F246-I250 WeakPolarHBondContact O-CB 3.5Å; F246-I250 WeakPolarHBondContact O-CD1 3.46Å; F246-I250 VanDerWaalsContact O-CG1 3.24Å; F246-I250 WeakPolarHBondContact O-CG1 3.49Å; F246-I250 PolarHBondContact O-N 2.91Å
247	A	95.1	Very high	94.1	Very high	2 Å²	2	56 Å²	56	2%	0.017	29%	0.285	C	S	.	.	H	α-helix	trans	-60.5	-36.9	176.3	0	0	0	0	0	112.1	F243 C244 F245 S251 L432 Y435 V436	F243-A247 WeakPolarHBondContact O-CB 3.26Å; F243-A247 PolarHBondContact O-N 3.42Å; C244-A247 PolarHBondContact O-N 3.46Å; F245-A247 PolarHBondContact O-N 3.34Å; A247-S251 PolarHBondContact O-N 3.35Å; A247-S251 VanDerWaalsContact O-N 3.15Å; A247-L432 HydrophobicContact CB-CD2 4.12Å; A247-Y435 HydrophobicContact CB-CD1 4.06Å; A247-Y435 HydrophobicContact CB-CE1 4.08Å; A247-V436 HydrophobicContact CB-CG2 3.9Å
248	S	94.9	Very high	93.7	Very high	21 Å²	21	61.8 Å²	61.8	15%	0.147	31%	0.312	C	S	.	.	H	α-helix	trans	-69.8	-42	174.7	-60.1	0	0	0	0	112.1	C244 F245 F246 S251	C244-S248 WeakPolarHBondContact O-CB 3.34Å; C244-S248 PolarHBondContact O-N 3.02Å; C244-S248 PolarHBondContact O-OG 2.85Å; F245-S248 WeakPolarHBondContact O-CB 3.28Å; F245-S248 PolarHBondContact O-N 2.99Å; F246-S248 VanDerWaalsContact C-N 3.26Å; F246-S248 PolarHBondContact O-N 2.73Å; S248-S251 PolarHBondContact O-N 3.49Å; S248-S251 PolarHBondContact O-OG 3.28Å
249	V	94.6	Very high	93.1	Very high	53 Å²	53	63.2 Å²	63.2	32%	0.321	31%	0.314	S	S	.	.	H	α-helix	trans	-61.1	-46.8	174.4	172.7	0	0	0	0	110.8	F245 F246 S251 I252 L253	F245-V249 HydrophobicContact CD1-CG2 4.29Å; F245-V249 HydrophobicContact CE1-CG2 3.86Å; F245-V249 HydrophobicContact CE2-CG2 4.31Å; F245-V249 HydrophobicContact CZ-CG2 3.88Å; F245-V249 WeakPolarHBondContact O-CG2 3.4Å; F245-V249 PolarHBondContact O-N 3.07Å; F246-V249 PolarHBondContact O-N 3.35Å; V249-S251 PolarHBondContact O-N 3.49Å; V249-I252 WeakPolarHBondContact O-CG1 3.41Å; V249-I252 PolarHBondContact O-N 2.96Å; V249-I252 VanDerWaalsContact O-N 3.14Å; V249-L253 PolarHBondContact O-N 3.39Å
250	I	93.4	Very high	92.5	Very high	32 Å²	32	62.1 Å²	62.1	16%	0.164	31%	0.308	C	S	.	.	H	α-helix	trans	-58.5	-39.3	179.1	-68.5	162.5	0	0	0	111	F246 I252 L253 V256 V436 L439 I440	F246-I250 WeakPolarHBondContact O-CB 3.5Å; F246-I250 WeakPolarHBondContact O-CD1 3.46Å; F246-I250 VanDerWaalsContact O-CG1 3.24Å; F246-I250 WeakPolarHBondContact O-CG1 3.49Å; F246-I250 PolarHBondContact O-N 2.91Å; I250-I252 PolarHBondContact O-N 2.99Å; I250-I252 VanDerWaalsContact O-N 3.16Å; I250-L253 HydrophobicContact CG1-CD1 4.37Å; I250-L253 PolarHBondContact O-N 3.18Å; I250-V256 HydrophobicContact CG2-CG2 4.19Å; I250-V436 HydrophobicContact CD1-CG1 3.95Å; I250-V436 HydrophobicContact CD1-CG2 4.35Å; I250-L439 HydrophobicContact CG2-CB 4.32Å; I250-L439 HydrophobicContact CG2-CD1 4.1Å; I250-I440 HydrophobicContact CD1-CD1 4.33Å; I250-I440 HydrophobicContact CG2-CD1 4.11Å; I250-I440 HydrophobicContact CG2-CG1 3.94Å
251	S	91.7	Very high	91.8	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-64.3	-18.1	-179.5	72	0	0	0	0	115.3	A247 S248 V249 Y435	A247-S251 PolarHBondContact O-N 3.35Å; A247-S251 VanDerWaalsContact O-N 3.15Å; S248-S251 PolarHBondContact O-N 3.49Å; S248-S251 PolarHBondContact O-OG 3.28Å; V249-S251 PolarHBondContact O-N 3.49Å; S251-Y435 WeakPolarHBondContact CB-OH 3.28Å
252	I	92.5	Very high	91.1	Very high	90 Å²	90	66 Å²	66	46%	0.462	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	3.6	179.3	64.2	167.5	0	0	0	113	V249 I250 L265	V249-I252 WeakPolarHBondContact O-CG1 3.41Å; V249-I252 PolarHBondContact O-N 2.96Å; V249-I252 VanDerWaalsContact O-N 3.14Å; I250-I252 PolarHBondContact O-N 2.99Å; I250-I252 VanDerWaalsContact O-N 3.16Å; I252-L265 HydrophobicContact CG2-CD1 4.4Å
253	L	92.5	Very high	90.4	Very high	78 Å²	78	62.1 Å²	62.1	41%	0.408	31%	0.313	S	S	.	.			trans	-66.6	131.3	177.9	-76.3	174.8	0	0	0	109.8	V249 I250 K255 V256 Q257	V249-L253 PolarHBondContact O-N 3.39Å; I250-L253 HydrophobicContact CG1-CD1 4.37Å; I250-L253 PolarHBondContact O-N 3.18Å; L253-K255 PolarHBondContact O-N 2.92Å; L253-K255 VanDerWaalsContact O-N 3.12Å; L253-V256 HydrophobicContact CB-CG2 4.23Å; L253-V256 WeakPolarHBondContact O-CB 3.32Å; L253-V256 PolarHBondContact O-N 3.37Å; L253-Q257 PolarHBondContact O-N 2.94Å; L253-Q257 VanDerWaalsContact O-N 3.12Å
254	P	89.9	Confident	89.8	Confident	90 Å²	90	58.9 Å²	58.9	58%	0.584	30%	0.304	S	S	*	.	H	α-helix	trans	-53.8	-38.1	179.9	-28.3	34.7	0	0	0	113.1	V256 Q257 E258	P254-V256 VanDerWaalsContact C-N 3.29Å; P254-V256 PolarHBondContact O-N 3.38Å; P254-Q257 PolarHBondContact O-N 3Å; P254-E258 WeakPolarHBondContact O-CG 3.31Å; P254-E258 PolarHBondContact O-N 3.39Å
255	K	89	Confident	89.6	Confident	123 Å²	123	62.2 Å²	62.2	54%	0.535	32%	0.321	S	S	.	.	H	α-helix	trans	-62.7	-33.5	179.1	-163.4	72.4	-162.3	151.6	0	113.5	L253 E258 H259	L253-K255 PolarHBondContact O-N 2.92Å; L253-K255 VanDerWaalsContact O-N 3.12Å; K255-E258 WeakPolarHBondContact CD-OE2 3.34Å; K255-E258 IonicContact NZ-OE2 2.77Å; K255-E258 PolarHBondContact NZ-OE2 3.38Å; K255-H259 PolarHBondContact O-ND1 3.28Å
256	V	88.3	Confident	89.5	Confident	8 Å²	8	56 Å²	56	5%	0.048	29%	0.294	C	S	.	.	H	α-helix	trans	-74.4	-45.2	175.2	172.6	0	0	0	0	109.5	I250 L253 P254 E258 H259 M260 L439	I250-V256 HydrophobicContact CG2-CG2 4.19Å; L253-V256 HydrophobicContact CB-CG2 4.23Å; L253-V256 WeakPolarHBondContact O-CB 3.32Å; L253-V256 PolarHBondContact O-N 3.37Å; P254-V256 VanDerWaalsContact C-N 3.29Å; P254-V256 PolarHBondContact O-N 3.38Å; V256-E258 VanDerWaalsContact C-N 3.26Å; V256-E258 PolarHBondContact O-N 3.22Å; V256-H259 PolarHBondContact O-N 3.04Å; V256-M260 PolarHBondContact O-N 3.23Å; V256-L439 HydrophobicContact CG1-CB 4.03Å; V256-L439 HydrophobicContact CG1-CD2 4.33Å
257	Q	88.6	Confident	89.4	Confident	77 Å²	77	50.6 Å²	50.6	36%	0.36	27%	0.27	S	S	.	.	H	α-helix	trans	-63.8	-28.3	178.8	-69.6	-177	-24	0	0	113.4	L253 P254 H259 M260 P261 S263	L253-Q257 PolarHBondContact O-N 2.94Å; L253-Q257 VanDerWaalsContact O-N 3.12Å; P254-Q257 PolarHBondContact O-N 3Å; Q257-H259 VanDerWaalsContact C-N 3.29Å; Q257-H259 PolarHBondContact O-N 3.46Å; Q257-M260 CarbonylContact O-C 3.51Å; Q257-P261 WeakPolarHBondContact O-CA 3.26Å; Q257-P261 VanDerWaalsContact O-N 3.15Å; Q257-S263 PolarHBondContact NE2-O 2.87Å
258	E	87.6	Confident	89.4	Confident	125 Å²	125	50.5 Å²	50.5	58%	0.584	27%	0.269	S	S	*	.	H	α-helix	trans	-59.1	-38.3	170.7	-78.3	170.7	-164.1	0	0	112.8	P254 K255 V256	P254-E258 WeakPolarHBondContact O-CG 3.31Å; P254-E258 PolarHBondContact O-N 3.39Å; K255-E258 WeakPolarHBondContact CD-OE2 3.34Å; K255-E258 IonicContact NZ-OE2 2.77Å; K255-E258 PolarHBondContact NZ-OE2 3.38Å; V256-E258 VanDerWaalsContact C-N 3.26Å; V256-E258 PolarHBondContact O-N 3.22Å
259	H	84.2	Confident	89.4	Confident	69 Å²	69	49.5 Å²	49.5	32%	0.319	26%	0.262	S	S	.	.	H	α-helix	trans	-96.1	-22.4	-177.3	-61.5	80.1	0	0	0	112.5	K255 V256 Q257 P442	K255-H259 PolarHBondContact O-ND1 3.28Å; V256-H259 PolarHBondContact O-N 3.04Å; Q257-H259 VanDerWaalsContact C-N 3.29Å; Q257-H259 PolarHBondContact O-N 3.46Å; H259-P442 HydrophobicContact CB-CB 4.07Å
260	M	83.2	Confident	89.5	Confident	36 Å²	36	47.7 Å²	47.7	18%	0.177	25%	0.251	C	S	.	.			trans	-138.6	80.2	179	-170.9	-179	-64.1	0	0	109	V256 Q257 Q262 S263 T438 L439 P442	V256-M260 PolarHBondContact O-N 3.23Å; Q257-M260 CarbonylContact O-C 3.51Å; M260-Q262 PolarHBondContact O-N 3.29Å; M260-Q262 VanDerWaalsContact O-N 3.16Å; M260-S263 WeakPolarHBondContact CB-OG 3.34Å; M260-S263 VanDerWaalsContact CG-OG 3.29Å; M260-S263 WeakPolarHBondContact CG-OG 3.32Å; M260-S263 VanDerWaalsContact O-CB 3.22Å; M260-S263 WeakPolarHBondContact O-CB 3.45Å; M260-S263 PolarHBondContact O-N 3.34Å; M260-S263 PolarHBondContact O-OG 3.1Å; M260-S263 VanDerWaalsContact O-OG 3.05Å; M260-S263 PolarHBondContact SD-OG 3.31Å; M260-T438 WeakPolarHBondContact CE-O 3.48Å; M260-L439 HydrophobicContact SD-CD2 4Å; M260-P442 HydrophobicContact CE-CG 3.94Å
261	P	82.3	Confident	89.7	Confident	101 Å²	101	46.2 Å²	46.2	66%	0.656	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-26	-173.8	23.8	-34.2	0	0	0	112.9	Q257 S263	Q257-P261 WeakPolarHBondContact O-CA 3.26Å; Q257-P261 VanDerWaalsContact O-N 3.15Å; P261-S263 PolarHBondContact O-N 3.13Å
262	Q	81.8	Confident	90	Very high	59 Å²	59	46.8 Å²	46.8	28%	0.276	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	6.4	174.9	-60.9	167.4	-15.6	0	0	113.2	N183 E184 L187 M260 G264	N183-Q262 PolarHBondContact ND2-O 3.28Å; E184-Q262 VanDerWaalsContact CG-CD 3.43Å; E184-Q262 HydrophobicContact CG-CG 4.49Å; E184-Q262 VanDerWaalsContact CG-NE2 3.31Å; E184-Q262 VanDerWaalsContact CG-OE1 3.28Å; E184-Q262 PolarHBondContact OE1-NE2 3.21Å; E184-Q262 PolarHBondContact OE1-OE1 2.94Å; E184-Q262 VanDerWaalsContact OE1-OE1 3.08Å; L187-Q262 HydrophobicContact CD2-CB 4.21Å; L187-Q262 HydrophobicContact CD2-CG 4.24Å; M260-Q262 PolarHBondContact O-N 3.29Å; M260-Q262 VanDerWaalsContact O-N 3.16Å; Q262-G264 PolarHBondContact O-N 3.44Å
263	S	82	Confident	90.2	Very high	6 Å²	6	43.2 Å²	43.2	4%	0.042	23%	0.23	C	C	.	.			trans	-70.5	122.9	174.1	-70.9	0	0	0	0	111.1	Q257 M260 P261	Q257-S263 PolarHBondContact NE2-O 2.87Å; M260-S263 WeakPolarHBondContact CB-OG 3.34Å; M260-S263 VanDerWaalsContact CG-OG 3.29Å; M260-S263 WeakPolarHBondContact CG-OG 3.32Å; M260-S263 VanDerWaalsContact O-CB 3.22Å; M260-S263 WeakPolarHBondContact O-CB 3.45Å; M260-S263 PolarHBondContact O-N 3.34Å; M260-S263 PolarHBondContact O-OG 3.1Å; M260-S263 VanDerWaalsContact O-OG 3.05Å; M260-S263 PolarHBondContact SD-OG 3.31Å; P261-S263 PolarHBondContact O-N 3.13Å
264	G	84.9	Confident	90.4	Very high	16 Å²	16	40.4 Å²	40.4	17%	0.165	21%	0.214	C	C	.	.			trans	-133.9	-179.9	178.6	0	0	0	0	0	114.1	Q262 Q267	Q262-G264 PolarHBondContact O-N 3.44Å; G264-Q267 VanDerWaalsContact N-NE2 3.11Å; G264-Q267 WeakPolarHBondContact O-CG 3.17Å; G264-Q267 PolarHBondContact O-NE2 3.26Å; G264-Q267 VanDerWaalsContact O-NE2 3.09Å
265	L	92.5	Very high	90.8	Very high	75 Å²	75	36.1 Å²	36.1	39%	0.393	19%	0.187	S	C	.	.	H	α-helix	trans	-83.1	-16.3	178.4	-166.7	70.8	0	0	0	112.8	T206 I252 S268 S269	T206-L265 HydrophobicContact CG2-CB 3.81Å; T206-L265 HydrophobicContact CG2-CD2 3.61Å; T206-L265 HydrophobicContact CG2-CG 3.66Å; I252-L265 HydrophobicContact CG2-CD1 4.4Å; L265-S268 WeakPolarHBondContact CD1-OG 3.33Å; L265-S268 PolarHBondContact O-OG 2.91Å; L265-S269 WeakPolarHBondContact O-CB 3.33Å; L265-S269 PolarHBondContact O-N 2.93Å; L265-S269 PolarHBondContact O-OG 3.18Å
266	L	93.8	Very high	91.2	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.01	17%	0.165	C	C	.	.	H	α-helix	trans	-62.2	-50.4	178.2	177.5	61.5	0	0	0	110.8	W182 N183 L202 F205 T206 F209 S268 S269 I270	W182-L266 HydrophobicContact CG-CD2 4.44Å; N183-L266 HydrophobicContact CB-CD2 4.41Å; N183-L266 WeakPolarHBondContact OD1-CB 3.41Å; L202-L266 HydrophobicContact CD2-CD2 3.54Å; F205-L266 HydrophobicContact CB-CD1 3.64Å; T206-L266 WeakPolarHBondContact OG1-CA 3.48Å; T206-L266 WeakPolarHBondContact OG1-CB 3.38Å; T206-L266 PolarHBondContact OG1-N 3.43Å; F209-L266 HydrophobicContact CD2-CD1 4.32Å; L266-S268 PolarHBondContact O-N 3.45Å; L266-S269 PolarHBondContact O-N 3.48Å; L266-S269 PolarHBondContact O-OG 3.47Å; L266-I270 HydrophobicContact CD1-CD1 4.08Å; L266-I270 HydrophobicContact CD1-CG1 4.37Å; L266-I270 HydrophobicContact CG-CD1 4.01Å; L266-I270 WeakPolarHBondContact O-CG1 3.32Å; L266-I270 PolarHBondContact O-N 3.48Å
267	Q	93.7	Very high	91.6	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-56.7	-48.5	178.4	46.3	169.5	5.1	0	0	112.3	A179 H180 G264 S269 I270 I271 Y435	A179-Q267 HydrophobicContact CB-CB 4.18Å; H180-Q267 PolarHBondContact CE1-OE1 2.82Å; H180-Q267 PolarHBondContact ND1-OE1 2.89Å; G264-Q267 VanDerWaalsContact N-NE2 3.11Å; G264-Q267 WeakPolarHBondContact O-CG 3.17Å; G264-Q267 PolarHBondContact O-NE2 3.26Å; G264-Q267 VanDerWaalsContact O-NE2 3.09Å; Q267-S269 VanDerWaalsContact C-N 3.28Å; Q267-S269 PolarHBondContact O-N 3.35Å; Q267-I270 PolarHBondContact O-N 3.26Å; Q267-I271 WeakPolarHBondContact O-CG1 3.42Å; Q267-I271 PolarHBondContact O-N 2.7Å; Q267-Y435 HydrophobicContact CB-CE2 4.05Å; Q267-Y435 HydrophobicContact CG-CE2 4.17Å; Q267-Y435 WeakPolarHBondContact CG-OH 3.47Å
268	S	95.3	Very high	91.9	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.2	-34.8	179	65.4	0	0	0	0	111.8	L265 L266 I271 T272 Y435	L265-S268 WeakPolarHBondContact CD1-OG 3.33Å; L265-S268 PolarHBondContact O-OG 2.91Å; L266-S268 PolarHBondContact O-N 3.45Å; S268-I271 PolarHBondContact O-N 2.96Å; S268-T272 VanDerWaalsContact O-CB 3.27Å; S268-T272 WeakPolarHBondContact O-CB 3.27Å; S268-T272 PolarHBondContact O-N 2.86Å; S268-T272 PolarHBondContact O-OG1 2.89Å; S268-Y435 WeakPolarHBondContact CA-OH 3.35Å; S268-Y435 WeakPolarHBondContact CB-OH 3Å; S268-Y435 PolarHBondContact N-OH 3.27Å
269	S	96.6	Very high	92.3	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-66.2	-40.5	177	77.4	0	0	0	0	112.4	N210 L265 L266 Q267 T272 A273	N210-S269 WeakPolarHBondContact ND2-CB 3.39Å; L265-S269 WeakPolarHBondContact O-CB 3.33Å; L265-S269 PolarHBondContact O-N 2.93Å; L265-S269 PolarHBondContact O-OG 3.18Å; L266-S269 PolarHBondContact O-N 3.48Å; L266-S269 PolarHBondContact O-OG 3.47Å; Q267-S269 VanDerWaalsContact C-N 3.28Å; Q267-S269 PolarHBondContact O-N 3.35Å; S269-T272 PolarHBondContact O-N 3.37Å; S269-A273 WeakPolarHBondContact O-CB 3.39Å; S269-A273 PolarHBondContact O-N 3.36Å
270	I	96.7	Very high	92.8	Very high	15 Å²	15	23.2 Å²	23.2	8%	0.077	13%	0.126	C	C	.	.	H	α-helix	trans	-65	-46.3	175.5	-67.2	168.4	0	0	0	110.4	A179 W182 F209 L266 Q267 T272 A273 Y274	A179-I270 HydrophobicContact CB-CB 4.31Å; A179-I270 HydrophobicContact CB-CD1 4.29Å; A179-I270 HydrophobicContact CB-CG2 4.17Å; W182-I270 HydrophobicContact CE3-CD1 4.29Å; F209-I270 HydrophobicContact CD2-CD1 4.47Å; F209-I270 HydrophobicContact CD2-CG1 3.6Å; F209-I270 HydrophobicContact CE2-CD1 4.22Å; F209-I270 HydrophobicContact CE2-CG1 3.67Å; F209-I270 HydrophobicContact CG-CG1 4.14Å; F209-I270 HydrophobicContact CZ-CG1 4.25Å; L266-I270 HydrophobicContact CD1-CD1 4.08Å; L266-I270 HydrophobicContact CD1-CG1 4.37Å; L266-I270 HydrophobicContact CG-CD1 4.01Å; L266-I270 WeakPolarHBondContact O-CG1 3.32Å; L266-I270 PolarHBondContact O-N 3.48Å; Q267-I270 PolarHBondContact O-N 3.26Å; I270-T272 VanDerWaalsContact C-N 3.34Å; I270-T272 PolarHBondContact O-N 3.33Å; I270-A273 PolarHBondContact O-N 3.2Å; I270-Y274 PolarHBondContact O-N 2.89Å
271	I	96.9	Very high	93.1	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-62.3	-42.7	177.3	-62.5	-50.7	0	0	0	111	L175 V176 A179 Q267 S268 A273 Y274 V275 L432 Y435	L175-I271 HydrophobicContact CD2-CD1 3.5Å; L175-I271 VanDerWaalsContact CD2-CD1 3.5Å; V176-I271 HydrophobicContact CB-CD1 4.45Å; V176-I271 HydrophobicContact CG2-CD1 3.7Å; A179-I271 HydrophobicContact CB-CD1 4.44Å; Q267-I271 WeakPolarHBondContact O-CG1 3.42Å; Q267-I271 PolarHBondContact O-N 2.7Å; S268-I271 PolarHBondContact O-N 2.96Å; I271-A273 VanDerWaalsContact C-N 3.35Å; I271-A273 PolarHBondContact O-N 2.9Å; I271-Y274 PolarHBondContact O-N 2.95Å; I271-V275 HydrophobicContact CG2-CG2 4.25Å; I271-V275 WeakPolarHBondContact O-CB 3.38Å; I271-V275 VanDerWaalsContact O-CG2 3.29Å; I271-V275 WeakPolarHBondContact O-CG2 3.23Å; I271-V275 PolarHBondContact O-N 3.5Å; I271-L432 HydrophobicContact CG2-CD2 4Å; I271-Y435 HydrophobicContact CB-CG 4.48Å; I271-Y435 HydrophobicContact CG1-CD1 4.41Å; I271-Y435 HydrophobicContact CG1-CD2 3.78Å; I271-Y435 HydrophobicContact CG1-CE2 4.19Å; I271-Y435 HydrophobicContact CG1-CG 3.9Å; I271-Y435 HydrophobicContact CG2-CD1 4.33Å; I271-Y435 HydrophobicContact CG2-CG 4.27Å
272	T	97.5	Very high	93.5	Very high	11 Å²	11	16.7 Å²	16.7	7%	0.067	9%	0.086	C	C	.	.	H	α-helix	trans	-62.5	-41.8	177.7	-60.6	0	0	0	0	111.5	C244 S268 S269 I270 Y274 V275 T276	C244-T272 HydrophobicContact CB-CG2 3.72Å; S268-T272 VanDerWaalsContact O-CB 3.27Å; S268-T272 WeakPolarHBondContact O-CB 3.27Å; S268-T272 PolarHBondContact O-N 2.86Å; S268-T272 PolarHBondContact O-OG1 2.89Å; S269-T272 PolarHBondContact O-N 3.37Å; I270-T272 VanDerWaalsContact C-N 3.34Å; I270-T272 PolarHBondContact O-N 3.33Å; T272-Y274 VanDerWaalsContact C-N 3.34Å; T272-Y274 PolarHBondContact O-N 2.95Å; T272-V275 PolarHBondContact O-N 2.84Å; T272-T276 WeakPolarHBondContact O-CB 3.28Å; T272-T276 PolarHBondContact O-N 3.4Å; T272-T276 PolarHBondContact O-OG1 3.34Å
273	A	97.2	Very high	94	Very high	16 Å²	16	13.9 Å²	13.9	13%	0.132	7%	0.073	C	C	.	.	H	α-helix	trans	-63.2	-42.5	176	0	0	0	0	0	111.4	F209 S213 S269 I270 I271 T276 F277	F209-A273 HydrophobicContact CB-CB 4.44Å; F209-A273 HydrophobicContact CD1-CB 4Å; S213-A273 WeakPolarHBondContact OG-CA 3.5Å; S213-A273 WeakPolarHBondContact OG-CB 3.07Å; S213-A273 PolarHBondContact OG-N 3.41Å; S213-A273 VanDerWaalsContact OG-N 3.09Å; S269-A273 WeakPolarHBondContact O-CB 3.39Å; S269-A273 PolarHBondContact O-N 3.36Å; I270-A273 PolarHBondContact O-N 3.2Å; I271-A273 VanDerWaalsContact C-N 3.35Å; I271-A273 PolarHBondContact O-N 2.9Å; A273-T276 WeakPolarHBondContact O-CB 3.4Å; A273-T276 PolarHBondContact O-N 3.2Å; A273-F277 PolarHBondContact O-N 3.32Å
274	Y	97	Very high	94.2	Very high	18 Å²	18	14.1 Å²	14.1	7%	0.071	7%	0.074	C	C	.	.	H	α-helix	trans	-69.8	-39.1	178.7	-171.7	-109.9	0	0	0	113	L172 L175 I270 I271 T272 T276 F277 L278 V322	L172-Y274 HydrophobicContact CD2-CD1 4.34Å; L172-Y274 HydrophobicContact CD2-CE1 3.51Å; L175-Y274 HydrophobicContact CD1-CD1 3.85Å; L175-Y274 HydrophobicContact CD1-CD2 3.66Å; L175-Y274 HydrophobicContact CD1-CE1 3.98Å; L175-Y274 HydrophobicContact CD1-CE2 3.82Å; L175-Y274 HydrophobicContact CD1-CG 3.67Å; L175-Y274 HydrophobicContact CD2-CD1 3.94Å; L175-Y274 HydrophobicContact CD2-CG 4.1Å; I270-Y274 PolarHBondContact O-N 2.89Å; I271-Y274 PolarHBondContact O-N 2.95Å; T272-Y274 VanDerWaalsContact C-N 3.34Å; T272-Y274 PolarHBondContact O-N 2.95Å; Y274-T276 VanDerWaalsContact C-N 3.31Å; Y274-T276 PolarHBondContact O-N 3.47Å; Y274-F277 AromaticContact CD2-CD1 3.99Å; Y274-F277 HydrophobicContact CD2-CD1 3.99Å; Y274-F277 AromaticContact CE2-CD1 3.76Å; Y274-F277 HydrophobicContact CE2-CD1 3.76Å; Y274-F277 HydrophobicContact CE2-CE1 4.14Å; Y274-F277 WeakPolarHBondContact O-CB 3.19Å; Y274-F277 PolarHBondContact O-N 3.42Å; Y274-L278 HydrophobicContact CD1-CD1 3.98Å; Y274-L278 HydrophobicContact CD1-CG 4.25Å; Y274-L278 HydrophobicContact CE1-CD1 3.55Å; Y274-L278 HydrophobicContact CE1-CD2 4.25Å; Y274-L278 HydrophobicContact CE1-CG 3.85Å; Y274-L278 PolarHBondContact O-N 2.93Å; Y274-V322 HydrophobicContact CE2-CG1 3.82Å; Y274-V322 HydrophobicContact CE2-CG2 4.2Å
275	V	97.6	Very high	94	Very high	1 Å²	1	13.8 Å²	13.8	1%	0.006	7%	0.069	C	C	.	.	H	α-helix	trans	-61.6	-40.7	172	164.2	0	0	0	0	111	N240 C244 I271 T272 F277 L278 T279 C431 L432	N240-V275 HydrophobicContact CB-CG1 4.13Å; C244-V275 VanDerWaalsContact SG-CG1 3.56Å; I271-V275 HydrophobicContact CG2-CG2 4.25Å; I271-V275 WeakPolarHBondContact O-CB 3.38Å; I271-V275 VanDerWaalsContact O-CG2 3.29Å; I271-V275 WeakPolarHBondContact O-CG2 3.23Å; I271-V275 PolarHBondContact O-N 3.5Å; T272-V275 PolarHBondContact O-N 2.84Å; V275-F277 VanDerWaalsContact C-N 3.33Å; V275-F277 PolarHBondContact O-N 3.34Å; V275-L278 PolarHBondContact O-N 3.34Å; V275-T279 WeakPolarHBondContact O-CB 3.32Å; V275-T279 PolarHBondContact O-N 3.17Å; V275-T279 PolarHBondContact O-OG1 3.47Å; V275-C431 HydrophobicContact CG2-CB 4.48Å; V275-L432 HydrophobicContact CG1-CD1 4.12Å; V275-L432 HydrophobicContact CG2-CD1 4.07Å; V275-L432 HydrophobicContact CG2-CD2 3.92Å; V275-L432 HydrophobicContact CG2-CG 3.71Å
276	T	97.3	Very high	93.4	Very high	12 Å²	12	10.6 Å²	10.6	7%	0.074	5%	0.054	C	C	.	.	H	α-helix	trans	-61.7	-42.7	174.6	-56.1	0	0	0	0	110.8	I217 L220 T272 A273 Y274 T279 W280	I217-T276 HydrophobicContact CG1-CG2 3.98Å; L220-T276 HydrophobicContact CD1-CG2 4.1Å; T272-T276 WeakPolarHBondContact O-CB 3.28Å; T272-T276 PolarHBondContact O-N 3.4Å; T272-T276 PolarHBondContact O-OG1 3.34Å; A273-T276 WeakPolarHBondContact O-CB 3.4Å; A273-T276 PolarHBondContact O-N 3.2Å; Y274-T276 VanDerWaalsContact C-N 3.31Å; Y274-T276 PolarHBondContact O-N 3.47Å; T276-T279 WeakPolarHBondContact O-CB 3.36Å; T276-T279 PolarHBondContact O-N 2.8Å; T276-W280 PolarHBondContact O-N 3.17Å
277	F	95.9	Very high	92.4	Very high	24 Å²	24	14 Å²	14	11%	0.105	7%	0.07	C	C	.	.	H	α-helix	trans	-61.5	-47.6	173.3	165.2	-103.4	0	0	0	112.7	A273 Y274 V275 T279 W280 S281 I318	A273-F277 PolarHBondContact O-N 3.32Å; Y274-F277 AromaticContact CD2-CD1 3.99Å; Y274-F277 HydrophobicContact CD2-CD1 3.99Å; Y274-F277 AromaticContact CE2-CD1 3.76Å; Y274-F277 HydrophobicContact CE2-CD1 3.76Å; Y274-F277 HydrophobicContact CE2-CE1 4.14Å; Y274-F277 WeakPolarHBondContact O-CB 3.19Å; Y274-F277 PolarHBondContact O-N 3.42Å; V275-F277 VanDerWaalsContact C-N 3.33Å; V275-F277 PolarHBondContact O-N 3.34Å; F277-T279 VanDerWaalsContact C-N 3.28Å; F277-T279 PolarHBondContact O-N 3.36Å; F277-W280 AromaticContact CD2-CE3 3.93Å; F277-W280 HydrophobicContact CD2-CE3 3.93Å; F277-W280 HydrophobicContact CD2-CZ3 4.15Å; F277-W280 HydrophobicContact CE2-CE3 4.32Å; F277-W280 HydrophobicContact CE2-CZ3 4.27Å; F277-W280 PolarHBondContact O-N 2.8Å; F277-S281 VanDerWaalsContact O-CB 3.25Å; F277-S281 WeakPolarHBondContact O-CB 3.14Å; F277-S281 PolarHBondContact O-N 2.93Å; F277-I318 HydrophobicContact CD2-CB 4.39Å; F277-I318 HydrophobicContact CD2-CG2 3.76Å; F277-I318 HydrophobicContact CE1-CG2 4.3Å; F277-I318 HydrophobicContact CE2-CB 3.58Å; F277-I318 HydrophobicContact CE2-CD1 4.21Å; F277-I318 HydrophobicContact CE2-CG2 3.33Å; F277-I318 HydrophobicContact CG-CG2 4.42Å; F277-I318 HydrophobicContact CZ-CB 3.93Å; F277-I318 HydrophobicContact CZ-CG2 3.63Å
278	L	95.7	Very high	91.6	Very high	11 Å²	11	17.1 Å²	17.1	6%	0.058	9%	0.086	C	C	.	.	H	α-helix	trans	-61.3	-38.4	177.1	-73.5	179.8	0	0	0	111.7	L172 Y274 V275 S281 G282	L172-L278 HydrophobicContact CD2-CD1 4.34Å; Y274-L278 HydrophobicContact CD1-CD1 3.98Å; Y274-L278 HydrophobicContact CD1-CG 4.25Å; Y274-L278 HydrophobicContact CE1-CD1 3.55Å; Y274-L278 HydrophobicContact CE1-CD2 4.25Å; Y274-L278 HydrophobicContact CE1-CG 3.85Å; Y274-L278 PolarHBondContact O-N 2.93Å; V275-L278 PolarHBondContact O-N 3.34Å; L278-S281 PolarHBondContact O-N 3.32Å; L278-G282 PolarHBondContact O-N 2.94Å
279	T	96.1	Very high	90.6	Very high	4 Å²	4	19.9 Å²	19.9	3%	0.025	11%	0.105	C	C	.	.	H	α-helix	trans	-61.8	-53.1	175	-51.9	0	0	0	0	110.3	L220 I237 N240 V275 T276 F277 S281 G282 L283	L220-T279 HydrophobicContact CD1-CG2 4.14Å; I237-T279 HydrophobicContact CG1-CG2 4.19Å; N240-T279 PolarHBondContact ND2-OG1 2.9Å; V275-T279 WeakPolarHBondContact O-CB 3.32Å; V275-T279 PolarHBondContact O-N 3.17Å; V275-T279 PolarHBondContact O-OG1 3.47Å; T276-T279 WeakPolarHBondContact O-CB 3.36Å; T276-T279 PolarHBondContact O-N 2.8Å; F277-T279 VanDerWaalsContact C-N 3.28Å; F277-T279 PolarHBondContact O-N 3.36Å; T279-S281 VanDerWaalsContact C-N 3.34Å; T279-S281 PolarHBondContact O-N 3.06Å; T279-G282 PolarHBondContact O-N 3.42Å; T279-L283 HydrophobicContact CG2-CD1 4.32Å; T279-L283 HydrophobicContact CG2-CG 4.46Å; T279-L283 WeakPolarHBondContact O-CG 3.49Å; T279-L283 PolarHBondContact O-N 3.44Å
280	W	93.9	Very high	89.9	Confident	79 Å²	79	23.5 Å²	23.5	30%	0.299	13%	0.126	S	C	.	.	H	α-helix	trans	-56	-49.9	176.7	170.8	38.9	0	0	0	111.8	L220 Y224 T276 F277 G282 L283 T284 R314 H315 I318	L220-W280 HydrophobicContact CD1-CB 4.42Å; L220-W280 HydrophobicContact CD2-CB 3.71Å; L220-W280 HydrophobicContact CD2-CG 4.17Å; Y224-W280 AromaticContact CE2-CD1 3.95Å; T276-W280 PolarHBondContact O-N 3.17Å; F277-W280 AromaticContact CD2-CE3 3.93Å; F277-W280 HydrophobicContact CD2-CE3 3.93Å; F277-W280 HydrophobicContact CD2-CZ3 4.15Å; F277-W280 HydrophobicContact CE2-CE3 4.32Å; F277-W280 HydrophobicContact CE2-CZ3 4.27Å; F277-W280 PolarHBondContact O-N 2.8Å; W280-G282 VanDerWaalsContact C-N 3.28Å; W280-G282 PolarHBondContact O-N 2.95Å; W280-L283 PolarHBondContact O-N 3.36Å; W280-T284 PolarHBondContact NE1-OG1 2.98Å; W280-T284 PolarHBondContact O-N 3.27Å; W280-T284 PolarHBondContact O-OG1 2.88Å; W280-T284 VanDerWaalsContact O-OG1 3.14Å; W280-R314 HydrophobicContact CH2-CB 4.34Å; W280-H315 HydrophobicContact CH2-CB 4.32Å; W280-H315 HydrophobicContact CZ2-CB 4.48Å; W280-H315 HydrophobicContact CZ3-CB 4.48Å; W280-I318 HydrophobicContact CH2-CD1 4.04Å; W280-I318 HydrophobicContact CZ3-CD1 3.61Å
281	S	91.4	Very high	89.3	Confident	1 Å²	1	23 Å²	23	1%	0.007	12%	0.124	C	C	.	.	H	α-helix	trans	-61.1	-38.1	179.9	-169.9	0	0	0	0	111.4	F277 L278 T279 H315 R424	F277-S281 VanDerWaalsContact O-CB 3.25Å; F277-S281 WeakPolarHBondContact O-CB 3.14Å; F277-S281 PolarHBondContact O-N 2.93Å; L278-S281 PolarHBondContact O-N 3.32Å; T279-S281 VanDerWaalsContact C-N 3.34Å; T279-S281 PolarHBondContact O-N 3.06Å; S281-H315 PolarHBondContact OG-CD2 3.37Å; S281-H315 VanDerWaalsContact OG-CD2 3.25Å; S281-R424 VanDerWaalsContact C-CD 3.4Å; S281-R424 WeakPolarHBondContact O-CD 2.91Å; S281-R424 PolarHBondContact O-NH1 2.85Å; S281-R424 VanDerWaalsContact OG-CD 3.25Å; S281-R424 WeakPolarHBondContact OG-CD 3.36Å; S281-R424 PolarHBondContact OG-NE 3.2Å; S281-R424 VanDerWaalsContact OG-NE 3.08Å; S281-R424 PolarHBondContact OG-NH1 3.2Å
282	G	90.5	Very high	88.6	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-61.9	-52.5	172.4	0	0	0	0	0	111.8	L278 T279 W280 T284 N285 G286 F421	L278-G282 PolarHBondContact O-N 2.94Å; T279-G282 PolarHBondContact O-N 3.42Å; W280-G282 VanDerWaalsContact C-N 3.28Å; W280-G282 PolarHBondContact O-N 2.95Å; G282-T284 VanDerWaalsContact C-N 3.31Å; G282-T284 PolarHBondContact O-N 2.98Å; G282-N285 WeakPolarHBondContact O-CA 3.29Å; G282-N285 WeakPolarHBondContact O-CB 3.27Å; G282-N285 PolarHBondContact O-N 3.34Å; G282-G286 PolarHBondContact O-N 2.88Å; G282-F421 WeakPolarHBondContact O-CD2 3.3Å
283	L	90.6	Very high	87.7	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-63.2	-32.6	-178.1	-62.8	-174.9	0	0	0	113.4	L220 Y224 N233 L236 I237 T279 W280 N285 G286 F421	L220-L283 HydrophobicContact CD2-CD1 4.02Å; Y224-L283 HydrophobicContact CD1-CB 3.64Å; Y224-L283 HydrophobicContact CD1-CD1 4.44Å; Y224-L283 HydrophobicContact CE1-CB 3.99Å; Y224-L283 HydrophobicContact CG-CB 4.11Å; Y224-L283 HydrophobicContact CG-CD1 4.12Å; N233-L283 HydrophobicContact CB-CD2 4.17Å; N233-L283 WeakPolarHBondContact OD1-CD2 3.16Å; L236-L283 HydrophobicContact CD1-CD2 4.48Å; I237-L283 HydrophobicContact CD1-CD1 3.75Å; I237-L283 HydrophobicContact CG1-CD1 3.78Å; T279-L283 HydrophobicContact CG2-CD1 4.32Å; T279-L283 HydrophobicContact CG2-CG 4.46Å; T279-L283 WeakPolarHBondContact O-CG 3.49Å; T279-L283 PolarHBondContact O-N 3.44Å; W280-L283 PolarHBondContact O-N 3.36Å; L283-N285 PolarHBondContact O-N 3.35Å; L283-G286 WeakPolarHBondContact O-CA 3.29Å; L283-G286 PolarHBondContact O-N 2.87Å; L283-F421 HydrophobicContact CD2-CE2 3.88Å; L283-F421 HydrophobicContact CD2-CZ 4.4Å
284	T	86.6	Confident	86.5	Confident	11 Å²	11	25.1 Å²	25.1	7%	0.067	14%	0.138	C	C	.	.	H	α-helix	trans	-64	-24	172.3	-58.9	0	0	0	0	112.8	Y224 W280 G282 G286 N292	Y224-T284 PolarHBondContact OH-OG1 3.28Å; W280-T284 PolarHBondContact NE1-OG1 2.98Å; W280-T284 PolarHBondContact O-N 3.27Å; W280-T284 PolarHBondContact O-OG1 2.88Å; W280-T284 VanDerWaalsContact O-OG1 3.14Å; G282-T284 VanDerWaalsContact C-N 3.31Å; G282-T284 PolarHBondContact O-N 2.98Å; T284-G286 VanDerWaalsContact C-N 3.33Å; T284-N292 PolarHBondContact O-ND2 3.45Å
285	N	81.3	Confident	85.1	Confident	8 Å²	8	26 Å²	26	4%	0.043	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	1.7	171.3	-77.9	-6.1	0	0	0	113.3	G282 L283 H287 N403 N417 F421 R424	G282-N285 WeakPolarHBondContact O-CA 3.29Å; G282-N285 WeakPolarHBondContact O-CB 3.27Å; G282-N285 PolarHBondContact O-N 3.34Å; L283-N285 PolarHBondContact O-N 3.35Å; N285-H287 PolarHBondContact O-CD2 3.33Å; N285-N403 PolarHBondContact ND2-OD1 3.34Å; N285-N403 PolarHBondContact OD1-ND2 2.87Å; N285-N403 PolarHBondContact OD1-OD1 2.99Å; N285-N417 HydrophobicContact CB-CB 4.46Å; N285-N417 PolarHBondContact ND2-ND2 3.03Å; N285-N417 PolarHBondContact OD1-ND2 3.26Å; N285-F421 HydrophobicContact CB-CB 4.22Å; N285-R424 PolarHBondContact ND2-NH1 3.34Å; N285-R424 PolarHBondContact OD1-NH1 3.45Å
286	G	80.5	Confident	83.1	Confident	9 Å²	9	29.9 Å²	29.9	9%	0.093	16%	0.163	C	C	.	.			trans	-65.7	147.2	177.3	0	0	0	0	0	112	G282 L283 T284 N292 L295	G282-G286 PolarHBondContact O-N 2.88Å; L283-G286 WeakPolarHBondContact O-CA 3.29Å; L283-G286 PolarHBondContact O-N 2.87Å; T284-G286 VanDerWaalsContact C-N 3.33Å; G286-N292 PolarHBondContact O-ND2 3.35Å; G286-L295 WeakPolarHBondContact O-CD1 3.44Å
287	H	72.7	Confident	81.2	Confident	72 Å²	72	34 Å²	34	33%	0.333	18%	0.184	S	C	.	.	S	Bend	trans	-86.8	-21.1	-169.4	-62.9	-176.7	0	0	0	114.5	N285 P289 S416 N417 S418	N285-H287 PolarHBondContact O-CD2 3.33Å; H287-P289 VanDerWaalsContact O-CD 3.24Å; H287-P289 WeakPolarHBondContact O-CD 3.48Å; H287-S416 VanDerWaalsContact CE1-CA 3.48Å; H287-S416 WeakPolarHBondContact CE1-CA 3.26Å; H287-S416 WeakPolarHBondContact NE2-CA 3.25Å; H287-N417 PolarHBondContact NE2-N 3.05Å; H287-S418 PolarHBondContact CE1-N 3.24Å; H287-S418 PolarHBondContact CE1-OG 3.11Å; H287-S418 WeakPolarHBondContact NE2-CA 3.43Å; H287-S418 PolarHBondContact NE2-N 3.35Å
288	D	76.4	Confident	79	Confident	66 Å²	66	35.5 Å²	35.5	35%	0.353	20%	0.195	S	C	.	.			trans	-82.3	111.2	-171.8	-166.9	-22.3	0	0	0	109.8	V290 C291 N292	D288-V290 PolarHBondContact O-N 3.46Å; D288-V290 VanDerWaalsContact OD1-CB 3.3Å; D288-V290 WeakPolarHBondContact OD1-CB 3.46Å; D288-V290 WeakPolarHBondContact OD1-CG2 3.47Å; D288-V290 PolarHBondContact OD1-N 3.36Å; D288-C291 HydrophobicContact CB-CB 4.1Å; D288-C291 CarbonylContact O-C 3.52Å; D288-C291 PolarHBondContact O-N 3.32Å; D288-N292 WeakPolarHBondContact O-CB 3.42Å; D288-N292 PolarHBondContact O-N 3.47Å
289	P	73.8	Confident	76.7	Confident	59 Å²	59	40.4 Å²	40.4	38%	0.383	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-23.8	179.7	28.1	-35.4	0	0	0	112.1	H287 C291 L295 I296	H287-P289 VanDerWaalsContact O-CD 3.24Å; H287-P289 WeakPolarHBondContact O-CD 3.48Å; P289-C291 VanDerWaalsContact C-N 3.27Å; P289-C291 PolarHBondContact O-N 3.32Å; P289-L295 HydrophobicContact CB-CB 4.29Å; P289-L295 HydrophobicContact CB-CD1 4.48Å; P289-I296 VanDerWaalsContact O-CD1 3.26Å; P289-I296 WeakPolarHBondContact O-CD1 3.23Å; P289-I296 VanDerWaalsContact O-CG1 3.24Å; P289-I296 WeakPolarHBondContact O-CG1 3.48Å
290	V	81.8	Confident	74.3	Confident	75 Å²	75	44.5 Å²	44.5	46%	0.455	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-32.6	175.8	-177.1	0	0	0	0	110.9	A227 D288	A227-V290 HydrophobicContact CB-CG1 4.02Å; D288-V290 PolarHBondContact O-N 3.46Å; D288-V290 VanDerWaalsContact OD1-CB 3.3Å; D288-V290 WeakPolarHBondContact OD1-CB 3.46Å; D288-V290 WeakPolarHBondContact OD1-CG2 3.47Å; D288-V290 PolarHBondContact OD1-N 3.36Å
291	C	84.3	Confident	72	Confident	5 Å²	5	45.7 Å²	45.7	3%	0.034	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-8	-174	-54.6	0	0	0	0	114	Y224 C230 N233 D288 P289	Y224-C291 WeakPolarHBondContact CA-O 3.4Å; Y224-C291 VanDerWaalsContact CD1-O 3.32Å; Y224-C291 WeakPolarHBondContact CD1-O 3.44Å; C230-C291 WeakPolarHBondContact CA-SG 3.4Å; C230-C291 HydrophobicContact CB-CB 3.82Å; C230-C291 WeakPolarHBondContact CB-SG 3.44Å; C230-C291 WeakPolarHBondContact SG-CA 3.13Å; C230-C291 WeakPolarHBondContact SG-CB 3.42Å; C230-C291 CovalentContact SG-SG 2.02Å; C230-C291 PolarHBondContact SG-SG 2.85Å; N233-C291 WeakPolarHBondContact ND2-CB 3.39Å; D288-C291 HydrophobicContact CB-CB 4.1Å; D288-C291 CarbonylContact O-C 3.52Å; D288-C291 PolarHBondContact O-N 3.32Å; P289-C291 VanDerWaalsContact C-N 3.27Å; P289-C291 PolarHBondContact O-N 3.32Å
292	N	83.1	Confident	69.6	Low	1 Å²	1	47.7 Å²	47.7	1%	0.005	28%	0.28	C	S	.	.			trans	-124.5	96.7	-179.2	-175.4	-1	0	0	0	110	T284 G286 D288 S294 L295	T284-N292 PolarHBondContact O-ND2 3.45Å; G286-N292 PolarHBondContact O-ND2 3.35Å; D288-N292 WeakPolarHBondContact O-CB 3.42Å; D288-N292 PolarHBondContact O-N 3.47Å; N292-S294 PolarHBondContact O-N 3.48Å; N292-S294 VanDerWaalsContact O-N 3.08Å; N292-S294 WeakPolarHBondContact OD1-CB 3.23Å; N292-S294 PolarHBondContact OD1-N 2.92Å; N292-S294 VanDerWaalsContact OD1-N 3.14Å; N292-S294 PolarHBondContact OD1-OG 2.87Å; N292-S294 VanDerWaalsContact OD1-OG 3.12Å; N292-L295 HydrophobicContact CB-CD1 4.02Å; N292-L295 HydrophobicContact CB-CG 4.17Å; N292-L295 PolarHBondContact O-N 3.45Å
293	P	77.9	Confident	66.9	Low	38 Å²	38	53.7 Å²	53.7	25%	0.247	32%	0.317	C	S	.	.	H	α-helix	trans	-62.3	-20.6	-178.8	24.3	-33.4	0	0	0	113.1	F223 L295 I296 I297	F223-P293 HydrophobicContact CB-CG 4.34Å; F223-P293 WeakPolarHBondContact O-CD 3.41Å; P293-L295 VanDerWaalsContact C-N 3.26Å; P293-L295 PolarHBondContact O-N 3.2Å; P293-I296 PolarHBondContact O-N 3.49Å; P293-I297 WeakPolarHBondContact O-CG1 3.43Å; P293-I297 PolarHBondContact O-N 2.97Å
294	S	72	Confident	64.4	Low	34 Å²	34	63.4 Å²	63.4	24%	0.238	36%	0.363	C	S	.	.	H	α-helix	trans	-65.7	-30.3	177.3	-42.7	0	0	0	0	112	Y224 N292 T298	Y224-S294 PolarHBondContact OH-OG 2.71Å; N292-S294 PolarHBondContact O-N 3.48Å; N292-S294 VanDerWaalsContact O-N 3.08Å; N292-S294 WeakPolarHBondContact OD1-CB 3.23Å; N292-S294 PolarHBondContact OD1-N 2.92Å; N292-S294 VanDerWaalsContact OD1-N 3.14Å; N292-S294 PolarHBondContact OD1-OG 2.87Å; N292-S294 VanDerWaalsContact OD1-OG 3.12Å; S294-T298 PolarHBondContact O-OG1 2.73Å
295	L	66.8	Low	61.9	Low	37 Å²	37	67.1 Å²	67.1	19%	0.194	38%	0.382	C	S	.	.	H	α-helix	trans	-74.4	-37	174.9	-66.3	176.7	0	0	0	111.8	G286 P289 N292 P293 T298 N299 V415	G286-L295 WeakPolarHBondContact O-CD1 3.44Å; P289-L295 HydrophobicContact CB-CB 4.29Å; P289-L295 HydrophobicContact CB-CD1 4.48Å; N292-L295 HydrophobicContact CB-CD1 4.02Å; N292-L295 HydrophobicContact CB-CG 4.17Å; N292-L295 PolarHBondContact O-N 3.45Å; P293-L295 VanDerWaalsContact C-N 3.26Å; P293-L295 PolarHBondContact O-N 3.2Å; L295-T298 WeakPolarHBondContact O-CB 3.33Å; L295-T298 PolarHBondContact O-N 2.97Å; L295-N299 PolarHBondContact O-N 3.46Å; L295-V415 HydrophobicContact CD2-CG1 4.13Å
296	I	57.3	Low	59.8	Low	81 Å²	81	70 Å²	70	42%	0.415	41%	0.413	S	S	.	.	H	α-helix	trans	-64.6	-45.2	179.7	-59.8	175	0	0	0	110.7	P289 P293 T298 N299 S300	P289-I296 VanDerWaalsContact O-CD1 3.26Å; P289-I296 WeakPolarHBondContact O-CD1 3.23Å; P289-I296 VanDerWaalsContact O-CG1 3.24Å; P289-I296 WeakPolarHBondContact O-CG1 3.48Å; P293-I296 PolarHBondContact O-N 3.49Å; I296-T298 PolarHBondContact O-N 3.09Å; I296-N299 PolarHBondContact O-N 3.15Å; I296-N299 VanDerWaalsContact O-N 3.08Å; I296-S300 PolarHBondContact O-N 2.97Å; I296-S300 PolarHBondContact O-OG 2.81Å
297	I	55.6	Low	57.7	Low	99 Å²	99	71.7 Å²	71.7	51%	0.508	42%	0.423	S	S	.	.	H	α-helix	trans	-58.4	-34.4	179.3	-65.3	167.6	0	0	0	111.1	P293 T301	P293-I297 WeakPolarHBondContact O-CG1 3.43Å; P293-I297 PolarHBondContact O-N 2.97Å; I297-T301 PolarHBondContact O-N 3.29Å; I297-T301 PolarHBondContact O-OG1 3.05Å
298	T	51.4	Low	56.6	Low	55 Å²	55	70.7 Å²	70.7	34%	0.337	42%	0.422	S	S	.	.	H	α-helix	trans	-69.8	-41.4	178.1	-51.7	0	0	0	0	111.3	S294 L295 I296 T301 S302	S294-T298 PolarHBondContact O-OG1 2.73Å; L295-T298 WeakPolarHBondContact O-CB 3.33Å; L295-T298 PolarHBondContact O-N 2.97Å; I296-T298 PolarHBondContact O-N 3.09Å; T298-T301 PolarHBondContact O-OG1 2.77Å; T298-S302 PolarHBondContact O-N 2.6Å; T298-S302 PolarHBondContact O-OG 2.8Å
299	N	47.5	Very low	55.2	Low	114 Å²	114	71.9 Å²	71.9	61%	0.61	43%	0.432	S	S	*	.	H	α-helix	trans	-69.3	-35.7	175.9	-73.3	-11.1	0	0	0	112.8	L295 I296 S302	L295-N299 PolarHBondContact O-N 3.46Å; I296-N299 PolarHBondContact O-N 3.15Å; I296-N299 VanDerWaalsContact O-N 3.08Å; N299-S302 WeakPolarHBondContact O-CB 3.48Å; N299-S302 PolarHBondContact O-N 3.13Å
300	S	45	Very low	54.3	Low	91 Å²	91	70.9 Å²	70.9	64%	0.636	42%	0.423	S	S	*	.	H	α-helix	trans	-75.8	-25	-178.3	-51.6	0	0	0	0	114	I296	I296-S300 PolarHBondContact O-N 2.97Å; I296-S300 PolarHBondContact O-OG 2.81Å
301	T	46.3	Very low	53.2	Low	104 Å²	104	73.8 Å²	73.8	64%	0.638	43%	0.43	S	S	*	.	H	α-helix	trans	-90.2	-6.9	174.3	45.3	0	0	0	0	113.2	I297 T298 T303	I297-T301 PolarHBondContact O-N 3.29Å; I297-T301 PolarHBondContact O-OG1 3.05Å; T298-T301 PolarHBondContact O-OG1 2.77Å; T301-T303 VanDerWaalsContact C-N 3.3Å; T301-T303 PolarHBondContact O-N 3.24Å
302	S	39.4	Very low	52.3	Low	43 Å²	43	77.9 Å²	77.9	30%	0.301	45%	0.447	S	S	.	.			trans	-78.3	77.4	170.9	-56.9	0	0	0	0	110	T298 N299 Q304	T298-S302 PolarHBondContact O-N 2.6Å; T298-S302 PolarHBondContact O-OG 2.8Å; N299-S302 WeakPolarHBondContact O-CB 3.48Å; N299-S302 PolarHBondContact O-N 3.13Å; S302-Q304 PolarHBondContact O-N 2.86Å
303	T	34.6	Very low	51.9	Low	125 Å²	125	80 Å²	80	77%	0.767	46%	0.458	S	S	*	.			trans	-61.7	97.3	162.9	40.5	0	0	0	0	109.3	T301 D305	T301-T303 VanDerWaalsContact C-N 3.3Å; T301-T303 PolarHBondContact O-N 3.24Å; T303-D305 PolarHBondContact O-N 3.2Å
304	Q	37.5	Very low	52.1	Low	205 Å²	205	88 Å²	88	96%	0.958	48%	0.484	S	S	*	.	S	Bend	trans	48.1	-9.9	164.1	-71.5	-170.7	-10.5	0	0	120.7	S302	S302-Q304 PolarHBondContact O-N 2.86Å
305	D	33.9	Very low	52.8	Low	89 Å²	89	86.5 Å²	86.5	48%	0.476	47%	0.473	S	S	.	.	S	Bend	trans	-106.9	119.6	173	-91.5	-33.3	0	0	0	107	K79 T303 S307	K79-D305 IonicContact NZ-OD1 3Å; K79-D305 PolarHBondContact NZ-OD1 3.03Å; K79-D305 IonicContact NZ-OD2 2.59Å; K79-D305 PolarHBondContact NZ-OD2 3.37Å; T303-D305 PolarHBondContact O-N 3.2Å; D305-S307 PolarHBondContact O-N 3.42Å
306	G	38.5	Very low	53.7	Low	67 Å²	67	85.1 Å²	85.1	69%	0.691	47%	0.466	S	S	*	.			trans	-68.4	46.7	-173.1	0	0	0	0	0	115.6	L83 V308	L83-G306 WeakPolarHBondContact CD2-O 3.29Å; G306-V308 PolarHBondContact O-N 3.28Å
307	S	37	Very low	55.2	Low	45 Å²	45	82.8 Å²	82.8	32%	0.315	46%	0.458	S	S	.	.			trans	-71.8	110.8	-179.9	60.5	0	0	0	0	111.5	D305 V309	D305-S307 PolarHBondContact O-N 3.42Å; S307-V309 VanDerWaalsContact C-N 3.31Å; S307-V309 PolarHBondContact O-N 3.49Å
308	V	47.8	Very low	56.9	Low	51 Å²	51	81 Å²	81	31%	0.309	45%	0.449	S	S	.	.			trans	-74.7	92.2	163.8	173	0	0	0	0	107.1	G306 L310 L411	G306-V308 PolarHBondContact O-N 3.28Å; V308-L310 PolarHBondContact O-N 3.45Å; V308-L411 HydrophobicContact CB-CD1 4.44Å; V308-L411 HydrophobicContact CB-CD2 3.75Å; V308-L411 HydrophobicContact CB-CG 4.08Å; V308-L411 HydrophobicContact CG2-CD1 4.48Å; V308-L411 HydrophobicContact CG2-CD2 3.23Å; V308-L411 HydrophobicContact CG2-CG 3.61Å
309	V	47.4	Very low	58.9	Low	92 Å²	92	78.6 Å²	78.6	56%	0.558	44%	0.435	S	S	*	.			trans	-72.1	110.4	174.4	180	0	0	0	0	107.6	S307 K311	S307-V309 VanDerWaalsContact C-N 3.31Å; S307-V309 PolarHBondContact O-N 3.49Å; V309-K311 PolarHBondContact O-N 3.46Å
310	L	54.7	Low	61	Low	38 Å²	38	74 Å²	74	20%	0.199	41%	0.41	C	S	.	.			trans	-68.5	85	171.2	-143.3	95.6	0	0	0	109.1	L52 A87 F91 V308	L52-L310 HydrophobicContact CD2-CD2 4Å; A87-L310 HydrophobicContact CB-CD1 4.36Å; F91-L310 HydrophobicContact CD1-CD2 4.15Å; F91-L310 HydrophobicContact CE1-CD1 4.15Å; F91-L310 HydrophobicContact CE1-CD2 3.45Å; F91-L310 VanDerWaalsContact CE1-CD2 3.45Å; F91-L310 HydrophobicContact CE1-CG 4.25Å; F91-L310 HydrophobicContact CE2-CD1 3.59Å; F91-L310 HydrophobicContact CE2-CD2 4.38Å; F91-L310 HydrophobicContact CZ-CD1 3.37Å; F91-L310 HydrophobicContact CZ-CD2 3.59Å; F91-L310 HydrophobicContact CZ-CG 3.89Å; V308-L310 PolarHBondContact O-N 3.45Å
311	K	58.9	Low	63.3	Low	136 Å²	136	75 Å²	75	59%	0.591	41%	0.407	S	S	*	.			trans	-83.1	125.3	-177.9	-162.9	172.9	-175.8	173.2	0	109.5	V309 D313	V309-K311 PolarHBondContact O-N 3.46Å; K311-D313 VanDerWaalsContact C-N 3.33Å; K311-D313 PolarHBondContact O-N 2.89Å
312	F	66.1	Low	65.6	Low	90 Å²	90	71.3 Å²	71.3	40%	0.395	39%	0.385	S	S	.	.			trans	-68.2	95.4	168.7	-171	-101.2	0	0	0	108.6	I316 A317 I320 L401	F312-I316 HydrophobicContact CD2-CG2 4.37Å; F312-I316 HydrophobicContact CE2-CB 4.23Å; F312-I316 HydrophobicContact CE2-CG2 3.7Å; F312-I316 HydrophobicContact CZ-CB 4.42Å; F312-I316 HydrophobicContact CZ-CG2 4.11Å; F312-A317 HydrophobicContact CD1-CB 4.48Å; F312-A317 HydrophobicContact CE1-CB 3.55Å; F312-A317 HydrophobicContact CZ-CB 4.12Å; F312-I320 HydrophobicContact CE2-CD1 4.05Å; F312-I320 HydrophobicContact CZ-CD1 3.8Å; F312-L401 HydrophobicContact CE2-CD2 4.09Å
313	D	73.5	Confident	68.2	Low	45 Å²	45	69.4 Å²	69.4	24%	0.241	37%	0.371	C	S	.	.			trans	-71.1	145.3	-177.5	-76.5	-30.2	0	0	0	111.5	K311 H315 I316 A317	K311-D313 VanDerWaalsContact C-N 3.33Å; K311-D313 PolarHBondContact O-N 2.89Å; D313-H315 WeakPolarHBondContact CB-CE1 3.35Å; D313-H315 VanDerWaalsContact CB-ND1 3.25Å; D313-H315 WeakPolarHBondContact CB-ND1 3.35Å; D313-H315 PolarHBondContact O-N 2.96Å; D313-H315 IonicContact OD2-CE1 2.78Å; D313-H315 PolarHBondContact OD2-CE1 2.96Å; D313-H315 IonicContact OD2-ND1 3.81Å; D313-I316 HydrophobicContact CB-CG1 4.47Å; D313-I316 WeakPolarHBondContact O-CB 3.48Å; D313-I316 PolarHBondContact O-N 3.49Å; D313-A317 PolarHBondContact O-N 2.78Å
314	R	83.3	Confident	71	Confident	207 Å²	207	65.5 Å²	65.5	78%	0.781	35%	0.345	S	S	*	.	H	α-helix	trans	-56.6	-30	-177.3	-59.8	179.8	-173.9	-174.1	1.2	112.9	W280 I316 A317 I318	W280-R314 HydrophobicContact CH2-CB 4.34Å; R314-I316 VanDerWaalsContact C-N 3.34Å; R314-A317 WeakPolarHBondContact O-CB 3.44Å; R314-A317 PolarHBondContact O-N 3.12Å; R314-I318 PolarHBondContact O-N 2.92Å
315	H	85.4	Confident	73.6	Confident	2 Å²	2	60.1 Å²	60.1	1%	0.009	32%	0.318	C	S	.	.	H	α-helix	trans	-68.5	-32.2	178.2	74.5	-98.1	0	0	0	112.5	W280 S281 D313 G319 R424	W280-H315 HydrophobicContact CH2-CB 4.32Å; W280-H315 HydrophobicContact CZ2-CB 4.48Å; W280-H315 HydrophobicContact CZ3-CB 4.48Å; S281-H315 PolarHBondContact OG-CD2 3.37Å; S281-H315 VanDerWaalsContact OG-CD2 3.25Å; D313-H315 WeakPolarHBondContact CB-CE1 3.35Å; D313-H315 VanDerWaalsContact CB-ND1 3.25Å; D313-H315 WeakPolarHBondContact CB-ND1 3.35Å; D313-H315 PolarHBondContact O-N 2.96Å; D313-H315 IonicContact OD2-CE1 2.78Å; D313-H315 PolarHBondContact OD2-CE1 2.96Å; D313-H315 IonicContact OD2-ND1 3.81Å; H315-G319 PolarHBondContact O-N 3.07Å; H315-R424 VanDerWaalsContact CD2-CZ 3.44Å; H315-R424 PolarHBondContact CD2-NH1 2.76Å; H315-R424 PolarHBondContact CD2-NH2 3.06Å; H315-R424 PolarHBondContact NE2-NH1 3.1Å; H315-R424 PolarHBondContact NE2-NH2 3.39Å; H315-R424 VanDerWaalsContact NE2-NH2 3.13Å
316	I	86.6	Confident	76.4	Confident	9 Å²	9	56.1 Å²	56.1	5%	0.046	30%	0.297	C	S	.	.	H	α-helix	trans	-68.1	-43.5	175.9	-57	-179.4	0	0	0	109.3	F312 D313 R314 I318 G319 I320 L401 N403	F312-I316 HydrophobicContact CD2-CG2 4.37Å; F312-I316 HydrophobicContact CE2-CB 4.23Å; F312-I316 HydrophobicContact CE2-CG2 3.7Å; F312-I316 HydrophobicContact CZ-CB 4.42Å; F312-I316 HydrophobicContact CZ-CG2 4.11Å; D313-I316 HydrophobicContact CB-CG1 4.47Å; D313-I316 WeakPolarHBondContact O-CB 3.48Å; D313-I316 PolarHBondContact O-N 3.49Å; R314-I316 VanDerWaalsContact C-N 3.34Å; I316-I318 VanDerWaalsContact C-N 3.34Å; I316-I318 PolarHBondContact O-N 3.19Å; I316-G319 PolarHBondContact O-N 3.44Å; I316-G319 VanDerWaalsContact O-N 3.16Å; I316-I320 HydrophobicContact CG2-CD1 4.14Å; I316-I320 HydrophobicContact CG2-CG1 4.47Å; I316-I320 WeakPolarHBondContact O-CG1 3.36Å; I316-I320 PolarHBondContact O-N 3.25Å; I316-L401 HydrophobicContact CG2-CD2 4.12Å; I316-N403 HydrophobicContact CD1-CB 4.47Å
317	A	88.9	Confident	78.9	Confident	31 Å²	31	53 Å²	53	26%	0.256	27%	0.265	S	S	.	.	H	α-helix	trans	-54.5	-49.3	176	0	0	0	0	0	111.9	F312 D313 R314 G319 I320 I321	F312-A317 HydrophobicContact CD1-CB 4.48Å; F312-A317 HydrophobicContact CE1-CB 3.55Å; F312-A317 HydrophobicContact CZ-CB 4.12Å; D313-A317 PolarHBondContact O-N 2.78Å; R314-A317 WeakPolarHBondContact O-CB 3.44Å; R314-A317 PolarHBondContact O-N 3.12Å; A317-G319 PolarHBondContact O-N 2.85Å; A317-I320 PolarHBondContact O-N 3.46Å; A317-I321 WeakPolarHBondContact O-CG1 3.34Å; A317-I321 PolarHBondContact O-N 3.41Å
318	I	92	Very high	81.4	Confident	63 Å²	63	52.9 Å²	52.9	32%	0.323	26%	0.26	S	S	.	.	H	α-helix	trans	-64.6	-42.1	178.9	-64.4	163.2	0	0	0	110.6	F277 W280 R314 I316 I320 I321 V322	F277-I318 HydrophobicContact CD2-CB 4.39Å; F277-I318 HydrophobicContact CD2-CG2 3.76Å; F277-I318 HydrophobicContact CE1-CG2 4.3Å; F277-I318 HydrophobicContact CE2-CB 3.58Å; F277-I318 HydrophobicContact CE2-CD1 4.21Å; F277-I318 HydrophobicContact CE2-CG2 3.33Å; F277-I318 HydrophobicContact CG-CG2 4.42Å; F277-I318 HydrophobicContact CZ-CB 3.93Å; F277-I318 HydrophobicContact CZ-CG2 3.63Å; W280-I318 HydrophobicContact CH2-CD1 4.04Å; W280-I318 HydrophobicContact CZ3-CD1 3.61Å; R314-I318 PolarHBondContact O-N 2.92Å; I316-I318 VanDerWaalsContact C-N 3.34Å; I316-I318 PolarHBondContact O-N 3.19Å; I318-I320 VanDerWaalsContact C-N 3.31Å; I318-I320 PolarHBondContact O-N 3.39Å; I318-I321 PolarHBondContact O-N 3.25Å; I318-I321 VanDerWaalsContact O-N 3.13Å; I318-V322 HydrophobicContact CG2-CG2 4.42Å; I318-V322 WeakPolarHBondContact O-CG2 3.1Å; I318-V322 PolarHBondContact O-N 2.87Å
319	G	92	Very high	83.3	Confident	3 Å²	3	51.9 Å²	51.9	3%	0.031	25%	0.251	C	S	.	.	H	α-helix	trans	-60.4	-38.3	176.4	0	0	0	0	0	113.5	H315 I316 A317 V322 L323	H315-G319 PolarHBondContact O-N 3.07Å; I316-G319 PolarHBondContact O-N 3.44Å; I316-G319 VanDerWaalsContact O-N 3.16Å; A317-G319 PolarHBondContact O-N 2.85Å; G319-V322 PolarHBondContact O-N 3.32Å; G319-L323 WeakPolarHBondContact O-CB 3.47Å; G319-L323 PolarHBondContact O-N 3.27Å
320	I	92.4	Very high	85.1	Confident	17 Å²	17	47.8 Å²	47.8	9%	0.087	23%	0.227	C	C	.	.	H	α-helix	trans	-66	-41	173.7	-66.1	170.5	0	0	0	111.3	I45 V49 F312 I316 A317 I318 V322 L323 I324 L401	I45-I320 HydrophobicContact CG2-CG2 3.57Å; V49-I320 HydrophobicContact CG2-CD1 3.78Å; F312-I320 HydrophobicContact CE2-CD1 4.05Å; F312-I320 HydrophobicContact CZ-CD1 3.8Å; I316-I320 HydrophobicContact CG2-CD1 4.14Å; I316-I320 HydrophobicContact CG2-CG1 4.47Å; I316-I320 WeakPolarHBondContact O-CG1 3.36Å; I316-I320 PolarHBondContact O-N 3.25Å; A317-I320 PolarHBondContact O-N 3.46Å; I318-I320 VanDerWaalsContact C-N 3.31Å; I318-I320 PolarHBondContact O-N 3.39Å; I320-V322 VanDerWaalsContact C-N 3.33Å; I320-V322 PolarHBondContact O-N 3.21Å; I320-L323 WeakPolarHBondContact O-CB 3.5Å; I320-L323 PolarHBondContact O-N 2.95Å; I320-I324 HydrophobicContact CG2-CD1 3.85Å; I320-I324 HydrophobicContact CG2-CG1 4.29Å; I320-I324 WeakPolarHBondContact O-CG1 3.38Å; I320-I324 PolarHBondContact O-N 3.13Å; I320-L401 HydrophobicContact CD1-CD2 3.52Å; I320-L401 HydrophobicContact CG1-CD2 4.4Å
321	I	93.9	Very high	86.5	Confident	114 Å²	114	46 Å²	46	59%	0.585	22%	0.218	S	C	*	.	H	α-helix	trans	-61.3	-44.9	176.6	-67.7	165.9	0	0	0	110.2	A317 I318 L323 I324 F325	A317-I321 WeakPolarHBondContact O-CG1 3.34Å; A317-I321 PolarHBondContact O-N 3.41Å; I318-I321 PolarHBondContact O-N 3.25Å; I318-I321 VanDerWaalsContact O-N 3.13Å; I321-L323 VanDerWaalsContact C-N 3.27Å; I321-L323 PolarHBondContact O-N 2.88Å; I321-I324 PolarHBondContact O-N 3.39Å; I321-F325 WeakPolarHBondContact O-CB 3.37Å; I321-F325 PolarHBondContact O-N 3.22Å
322	V	93.7	Very high	87.5	Confident	26 Å²	26	43.9 Å²	43.9	16%	0.158	21%	0.212	C	C	.	.	H	α-helix	trans	-63.4	-35.7	176.3	-179.5	0	0	0	0	111.1	L175 Y274 I318 G319 I320 S326	L175-V322 HydrophobicContact CD1-CG1 4.16Å; Y274-V322 HydrophobicContact CE2-CG1 3.82Å; Y274-V322 HydrophobicContact CE2-CG2 4.2Å; I318-V322 HydrophobicContact CG2-CG2 4.42Å; I318-V322 WeakPolarHBondContact O-CG2 3.1Å; I318-V322 PolarHBondContact O-N 2.87Å; G319-V322 PolarHBondContact O-N 3.32Å; I320-V322 VanDerWaalsContact C-N 3.33Å; I320-V322 PolarHBondContact O-N 3.21Å; V322-S326 WeakPolarHBondContact O-CB 3.45Å; V322-S326 PolarHBondContact O-N 3.07Å; V322-S326 PolarHBondContact O-OG 3.03Å
323	L	93.4	Very high	87.7	Confident	2 Å²	2	40.7 Å²	40.7	1%	0.01	20%	0.198	C	C	.	.	H	α-helix	trans	-66.3	-48.1	174.7	175.1	62.3	0	0	0	112.7	I45 Y167 G319 I320 I321 F325 S326 V327 Y396 V397	I45-L323 HydrophobicContact CD1-CD2 4.02Å; I45-L323 HydrophobicContact CD1-CG 4.37Å; Y167-L323 HydrophobicContact CD1-CD1 4.22Å; Y167-L323 HydrophobicContact CE1-CD1 3.27Å; G319-L323 WeakPolarHBondContact O-CB 3.47Å; G319-L323 PolarHBondContact O-N 3.27Å; I320-L323 WeakPolarHBondContact O-CB 3.5Å; I320-L323 PolarHBondContact O-N 2.95Å; I321-L323 VanDerWaalsContact C-N 3.27Å; I321-L323 PolarHBondContact O-N 2.88Å; L323-F325 VanDerWaalsContact C-N 3.25Å; L323-F325 PolarHBondContact O-N 2.92Å; L323-S326 PolarHBondContact O-N 2.8Å; L323-S326 PolarHBondContact O-OG 3.05Å; L323-V327 HydrophobicContact CD1-CG2 4.11Å; L323-V327 WeakPolarHBondContact O-CB 3.47Å; L323-V327 VanDerWaalsContact O-CG2 3.26Å; L323-V327 WeakPolarHBondContact O-CG2 3.25Å; L323-V327 PolarHBondContact O-N 3.3Å; L323-Y396 HydrophobicContact CB-CE1 4.35Å; L323-Y396 HydrophobicContact CD1-CD1 3.77Å; L323-Y396 HydrophobicContact CD1-CE1 4.13Å; L323-Y396 HydrophobicContact CD2-CD1 3.81Å; L323-Y396 HydrophobicContact CD2-CE1 4.13Å; L323-Y396 HydrophobicContact CG-CD1 4.31Å; L323-Y396 HydrophobicContact CG-CE1 4.45Å; L323-V397 HydrophobicContact CD2-CB 4.47Å; L323-V397 HydrophobicContact CD2-CG2 3.38Å
324	I	93.6	Very high	86.8	Confident	44 Å²	44	39.1 Å²	39.1	23%	0.226	19%	0.19	C	C	.	.	H	α-helix	trans	-60.1	-43.3	176.8	-68.6	169.9	0	0	0	109.4	I42 I45 I320 I321 V327 L328	I42-I324 HydrophobicContact CD1-CG2 4.41Å; I42-I324 HydrophobicContact CG1-CG2 4.46Å; I45-I324 HydrophobicContact CD1-CG1 4.02Å; I320-I324 HydrophobicContact CG2-CD1 3.85Å; I320-I324 HydrophobicContact CG2-CG1 4.29Å; I320-I324 WeakPolarHBondContact O-CG1 3.38Å; I320-I324 PolarHBondContact O-N 3.13Å; I321-I324 PolarHBondContact O-N 3.39Å; I324-V327 PolarHBondContact O-N 2.93Å; I324-L328 HydrophobicContact CG2-CD1 3.87Å; I324-L328 HydrophobicContact CG2-CG 4.37Å; I324-L328 WeakPolarHBondContact O-CB 3.29Å; I324-L328 VanDerWaalsContact O-CG 3.26Å; I324-L328 WeakPolarHBondContact O-CG 3.25Å; I324-L328 PolarHBondContact O-N 3.39Å
325	F	92.9	Very high	85.1	Confident	91 Å²	91	31.9 Å²	31.9	40%	0.399	17%	0.171	S	C	.	.	H	α-helix	trans	-59.8	-47.7	175.6	-178.7	-96.4	0	0	0	112	F178 I321 L323 V327 L328 Y329	F178-F325 AromaticContact CD1-CE1 3.84Å; F178-F325 HydrophobicContact CD1-CE1 3.84Å; F178-F325 HydrophobicContact CD1-CZ 4.09Å; F178-F325 HydrophobicContact CD2-CE1 4.12Å; F178-F325 AromaticContact CD2-CZ 3.84Å; F178-F325 HydrophobicContact CD2-CZ 3.84Å; F178-F325 AromaticContact CE1-CE1 3.89Å; F178-F325 HydrophobicContact CE1-CE1 3.89Å; F178-F325 AromaticContact CE1-CZ 3.77Å; F178-F325 HydrophobicContact CE1-CZ 3.77Å; F178-F325 HydrophobicContact CE2-CE1 4.2Å; F178-F325 AromaticContact CE2-CZ 3.52Å; F178-F325 HydrophobicContact CE2-CZ 3.52Å; F178-F325 AromaticContact CG-CE1 3.93Å; F178-F325 HydrophobicContact CG-CE1 3.93Å; F178-F325 HydrophobicContact CG-CZ 4.1Å; F178-F325 HydrophobicContact CZ-CE1 4.05Å; F178-F325 HydrophobicContact CZ-CE2 4.4Å; F178-F325 AromaticContact CZ-CZ 3.44Å; F178-F325 HydrophobicContact CZ-CZ 3.44Å; F178-F325 VanDerWaalsContact CZ-CZ 3.44Å; I321-F325 WeakPolarHBondContact O-CB 3.37Å; I321-F325 PolarHBondContact O-N 3.22Å; L323-F325 VanDerWaalsContact C-N 3.25Å; L323-F325 PolarHBondContact O-N 2.92Å; F325-V327 PolarHBondContact O-N 3.37Å; F325-L328 PolarHBondContact O-N 3.22Å; F325-Y329 VanDerWaalsContact O-CB 3.23Å; F325-Y329 WeakPolarHBondContact O-CB 3.4Å; F325-Y329 PolarHBondContact O-N 3.03Å
326	S	92.2	Very high	83	Confident	5 Å²	5	36.2 Å²	36.2	4%	0.035	20%	0.198	C	C	.	.	H	α-helix	trans	-65.6	-38.5	-179.7	70.9	0	0	0	0	112.7	V322 L323 Y329 S330	V322-S326 WeakPolarHBondContact O-CB 3.45Å; V322-S326 PolarHBondContact O-N 3.07Å; V322-S326 PolarHBondContact O-OG 3.03Å; L323-S326 PolarHBondContact O-N 2.8Å; L323-S326 PolarHBondContact O-OG 3.05Å; S326-Y329 PolarHBondContact O-N 3.06Å; S326-S330 WeakPolarHBondContact O-CB 3.34Å; S326-S330 PolarHBondContact O-N 2.68Å
327	V	90.6	Very high	81	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.006	23%	0.226	C	C	.	.	H	α-helix	trans	-62.3	-51.3	174.8	167.8	0	0	0	0	110.3	S38 L41 Y167 L323 I324 F325 Y329 S330 T331 M390	S38-V327 VanDerWaalsContact OG-CG1 3.24Å; S38-V327 WeakPolarHBondContact OG-CG1 3.37Å; L41-V327 HydrophobicContact CD2-CB 4.43Å; L41-V327 HydrophobicContact CD2-CG1 3.97Å; L41-V327 HydrophobicContact CD2-CG2 3.58Å; Y167-V327 WeakPolarHBondContact OH-CG2 3.47Å; L323-V327 HydrophobicContact CD1-CG2 4.11Å; L323-V327 WeakPolarHBondContact O-CB 3.47Å; L323-V327 VanDerWaalsContact O-CG2 3.26Å; L323-V327 WeakPolarHBondContact O-CG2 3.25Å; L323-V327 PolarHBondContact O-N 3.3Å; I324-V327 PolarHBondContact O-N 2.93Å; F325-V327 PolarHBondContact O-N 3.37Å; V327-Y329 VanDerWaalsContact C-N 3.3Å; V327-Y329 PolarHBondContact O-N 3.5Å; V327-S330 PolarHBondContact O-N 3.16Å; V327-S330 PolarHBondContact O-OG 3.04Å; V327-T331 PolarHBondContact O-N 3.13Å; V327-T331 VanDerWaalsContact O-N 3.15Å; V327-M390 HydrophobicContact CG1-CE 3.87Å; V327-M390 HydrophobicContact CG1-SD 4.34Å
328	L	90.3	Very high	79.1	Confident	43 Å²	43	42 Å²	42	23%	0.225	22%	0.218	C	C	.	.	H	α-helix	trans	-60.7	-42.2	177.1	-70.1	174.3	0	0	0	111.1	M35 I42 I324 F325 S330 T331 L332	M35-L328 HydrophobicContact CE-CD2 4.15Å; I42-L328 HydrophobicContact CD1-CD2 4.02Å; I42-L328 HydrophobicContact CD1-CG 4.44Å; I324-L328 HydrophobicContact CG2-CD1 3.87Å; I324-L328 HydrophobicContact CG2-CG 4.37Å; I324-L328 WeakPolarHBondContact O-CB 3.29Å; I324-L328 VanDerWaalsContact O-CG 3.26Å; I324-L328 WeakPolarHBondContact O-CG 3.25Å; I324-L328 PolarHBondContact O-N 3.39Å; F325-L328 PolarHBondContact O-N 3.22Å; L328-S330 PolarHBondContact O-N 2.86Å; L328-T331 PolarHBondContact O-N 3.24Å; L328-T331 VanDerWaalsContact O-N 3.12Å; L328-T331 PolarHBondContact O-OG1 2.72Å; L328-L332 WeakPolarHBondContact O-CG 3.44Å; L328-L332 PolarHBondContact O-N 3.06Å
329	Y	88.6	Confident	76.8	Confident	30 Å²	30	41.8 Å²	41.8	12%	0.118	22%	0.223	C	C	.	.	H	α-helix	trans	-57.8	-48.1	176.5	-170.5	-111.9	0	0	0	112	F178 T181 F325 S326 V327 T331 L332 R333	F178-Y329 WeakPolarHBondContact CA-OH 3.34Å; F178-Y329 HydrophobicContact CB-CD1 4.22Å; F178-Y329 HydrophobicContact CB-CE1 3.77Å; F178-Y329 HydrophobicContact CB-CE2 4.23Å; F178-Y329 AromaticContact CD2-CD2 3.96Å; F178-Y329 HydrophobicContact CD2-CD2 3.96Å; F178-Y329 AromaticContact CD2-CE2 3.55Å; F178-Y329 HydrophobicContact CD2-CE2 3.55Å; F178-Y329 AromaticContact CD2-CZ 3.9Å; F178-Y329 HydrophobicContact CE2-CE2 4.42Å; F178-Y329 HydrophobicContact CG-CE2 4.34Å; T181-Y329 WeakPolarHBondContact CB-OH 3.48Å; F325-Y329 VanDerWaalsContact O-CB 3.23Å; F325-Y329 WeakPolarHBondContact O-CB 3.4Å; F325-Y329 PolarHBondContact O-N 3.03Å; S326-Y329 PolarHBondContact O-N 3.06Å; V327-Y329 VanDerWaalsContact C-N 3.3Å; V327-Y329 PolarHBondContact O-N 3.5Å; Y329-T331 PolarHBondContact O-N 2.91Å; Y329-L332 PolarHBondContact O-N 2.96Å; Y329-R333 HydrophobicContact CE1-CB 4.45Å; Y329-R333 HydrophobicContact CE1-CG 4.47Å; Y329-R333 VanDerWaalsContact CZ-CD 3.46Å; Y329-R333 VanDerWaalsContact CZ-NH1 3.34Å; Y329-R333 VanDerWaalsContact O-CB 3.31Å; Y329-R333 WeakPolarHBondContact O-CB 3.39Å; Y329-R333 PolarHBondContact O-N 3.08Å; Y329-R333 WeakPolarHBondContact OH-CD 3.4Å; Y329-R333 PolarHBondContact OH-NH1 2.93Å
330	S	85.1	Confident	74.5	Confident	7 Å²	7	42.9 Å²	42.9	5%	0.049	23%	0.231	C	C	.	.	H	α-helix	trans	-59.1	-34.4	177.1	78.2	0	0	0	0	112.7	R34 S326 V327 L328	R34-S330 PolarHBondContact NH1-O 3.4Å; S326-S330 WeakPolarHBondContact O-CB 3.34Å; S326-S330 PolarHBondContact O-N 2.68Å; V327-S330 PolarHBondContact O-N 3.16Å; V327-S330 PolarHBondContact O-OG 3.04Å; L328-S330 PolarHBondContact O-N 2.86Å
331	T	83.5	Confident	72.1	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-74.5	-29.8	175.8	60.4	0	0	0	0	114.1	R34 S38 V327 L328 Y329 Y386	R34-T331 HydrophobicContact CB-CG2 3.98Å; R34-T331 VanDerWaalsContact NH1-C 3.3Å; R34-T331 PolarHBondContact NH1-O 3.37Å; R34-T331 PolarHBondContact NH2-O 2.82Å; R34-T331 WeakPolarHBondContact O-CG2 3.34Å; S38-T331 WeakPolarHBondContact OG-CG2 3.49Å; V327-T331 PolarHBondContact O-N 3.13Å; V327-T331 VanDerWaalsContact O-N 3.15Å; L328-T331 PolarHBondContact O-N 3.24Å; L328-T331 VanDerWaalsContact O-N 3.12Å; L328-T331 PolarHBondContact O-OG1 2.72Å; Y329-T331 PolarHBondContact O-N 2.91Å; T331-Y386 HydrophobicContact CG2-CE2 4.32Å
332	L	79.2	Confident	70	Confident	91 Å²	91	41.9 Å²	41.9	48%	0.476	23%	0.226	S	C	.	.	H	α-helix	trans	-82.3	-29.2	179.1	-63.8	174.4	0	0	0	111.4	L328 Y329 S334	L328-L332 WeakPolarHBondContact O-CG 3.44Å; L328-L332 PolarHBondContact O-N 3.06Å; Y329-L332 PolarHBondContact O-N 2.96Å; L332-S334 PolarHBondContact O-N 2.92Å
333	R	70.7	Confident	67.7	Low	23 Å²	23	48.7 Å²	48.7	9%	0.087	25%	0.254	C	S	.	.			trans	-78.2	9	-167.5	-173.6	151.2	-171.6	171	-0.5	118.3	D177 T181 Y329 S335 T338	D177-R333 PolarHBondContact O-NH1 2.95Å; D177-R333 IonicContact OD1-CZ 2.75Å; D177-R333 IonicContact OD1-NE 2.76Å; D177-R333 IonicContact OD1-NH1 3.59Å; D177-R333 PolarHBondContact OD1-NH1 3.1Å; D177-R333 VanDerWaalsContact OD1-NH1 3.08Å; D177-R333 IonicContact OD1-NH2 3.28Å; D177-R333 PolarHBondContact OD1-NH2 3.03Å; D177-R333 WeakPolarHBondContact OD2-CD 3.44Å; D177-R333 IonicContact OD2-CZ 3.85Å; D177-R333 IonicContact OD2-NE 3.85Å; D177-R333 PolarHBondContact OD2-NE 3.2Å; D177-R333 VanDerWaalsContact OD2-NE 3.13Å; D177-R333 IonicContact OD2-NH1 3.33Å; D177-R333 PolarHBondContact OD2-NH1 3.25Å; D177-R333 IonicContact OD2-NH2 2.82Å; D177-R333 PolarHBondContact OD2-NH2 3.16Å; T181-R333 PolarHBondContact OG1-NH1 3.4Å; T181-R333 PolarHBondContact OG1-NH2 3.46Å; Y329-R333 HydrophobicContact CE1-CB 4.45Å; Y329-R333 HydrophobicContact CE1-CG 4.47Å; Y329-R333 VanDerWaalsContact CZ-CD 3.46Å; Y329-R333 VanDerWaalsContact CZ-NH1 3.34Å; Y329-R333 VanDerWaalsContact O-CB 3.31Å; Y329-R333 WeakPolarHBondContact O-CB 3.39Å; Y329-R333 PolarHBondContact O-N 3.08Å; Y329-R333 WeakPolarHBondContact OH-CD 3.4Å; Y329-R333 PolarHBondContact OH-NH1 2.93Å; R333-S335 PolarHBondContact O-N 3.45Å; R333-T338 VanDerWaalsContact NH2-CB 3.27Å; R333-T338 PolarHBondContact NH2-OG1 3.4Å
334	S	54.7	Low	65.6	Low	13 Å²	13	50.6 Å²	50.6	9%	0.091	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	33.8	-170.4	-167.3	0	0	0	0	116.9	L332	L332-S334 PolarHBondContact O-N 2.92Å
335	S	47.1	Very low	63.5	Low	54 Å²	54	50.1 Å²	50.1	38%	0.378	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-155.6	8.1	-177.3	-53.9	0	0	0	0	117.1	R28 R333	R28-S335 PolarHBondContact NH1-OG 2.87Å; R333-S335 PolarHBondContact O-N 3.45Å
336	T	41.1	Very low	61.1	Low	94 Å²	94	47.5 Å²	47.5	58%	0.577	25%	0.254	S	S	*	.			trans	-118.4	128.3	-173.5	-38.4	0	0	0	0	111.8	T338	T336-T338 PolarHBondContact O-N 3.33Å; T336-T338 PolarHBondContact O-OG1 2.94Å
337	K	45.6	Very low	58.3	Low	147 Å²	147	49.3 Å²	49.3	64%	0.639	27%	0.274	S	S	*	.			trans	-64.9	22.9	-166.4	-64.9	178.5	176.4	174.4	0	117.3	E355	K337-E355 WeakPolarHBondContact CE-OE1 3.12Å; K337-E355 WeakPolarHBondContact CE-OE2 3.25Å; K337-E355 IonicContact NZ-OE1 3.37Å; K337-E355 IonicContact NZ-OE2 3.13Å; K337-E355 PolarHBondContact NZ-OE2 3.39Å
338	T	47.6	Very low	55.5	Low	14 Å²	14	55.2 Å²	55.2	9%	0.086	31%	0.31	C	S	.	.			trans	-80	130.5	-174.7	35.9	0	0	0	0	111.6	E184 R333 T336 A340 G341 K342	E184-T338 WeakPolarHBondContact OE2-CG2 3.44Å; R333-T338 VanDerWaalsContact NH2-CB 3.27Å; R333-T338 PolarHBondContact NH2-OG1 3.4Å; T336-T338 PolarHBondContact O-N 3.33Å; T336-T338 PolarHBondContact O-OG1 2.94Å; T338-A340 PolarHBondContact O-N 3.39Å; T338-A340 VanDerWaalsContact O-N 3.13Å; T338-G341 PolarHBondContact O-N 2.94Å; T338-K342 PolarHBondContact O-N 3.43Å
339	S	44.6	Very low	53	Low	59 Å²	59	61.3 Å²	61.3	41%	0.413	34%	0.337	S	S	.	.	H	α-helix	trans	-51.2	-35.8	-173.4	-52.1	0	0	0	0	114.7	F450	S339-F450 VanDerWaalsContact CA-OXT 3.24Å; S339-F450 WeakPolarHBondContact CA-OXT 3.4Å; S339-F450 VanDerWaalsContact CB-O 3.31Å; S339-F450 WeakPolarHBondContact CB-O 3.46Å; S339-F450 WeakPolarHBondContact CB-OXT 3.5Å; S339-F450 PolarHBondContact OG-O 2.65Å; S339-F450 PolarHBondContact OG-OXT 2.99Å
340	A	43.1	Very low	50.6	Low	25 Å²	25	65.1 Å²	65.1	21%	0.207	36%	0.36	C	S	.	.	H	α-helix	trans	-75.1	-30.8	-179.4	0	0	0	0	0	113.7	D177 T338 F343	D177-A340 HydrophobicContact CB-CB 4.26Å; D177-A340 WeakPolarHBondContact OD1-CB 3.21Å; T338-A340 PolarHBondContact O-N 3.39Å; T338-A340 VanDerWaalsContact O-N 3.13Å; A340-F343 PolarHBondContact O-N 3.33Å
341	G	43.5	Very low	48.5	Very low	14 Å²	14	68.1 Å²	68.1	14%	0.144	38%	0.378	C	S	.	.	H	α-helix	trans	-74	-27.8	176.7	0	0	0	0	0	113.3	D177 T338 F343 L344 I345	D177-G341 PolarHBondContact OD1-N 3Å; T338-G341 PolarHBondContact O-N 2.94Å; G341-F343 PolarHBondContact O-N 2.82Å; G341-L344 PolarHBondContact O-N 3.34Å; G341-I345 PolarHBondContact O-N 3.18Å
342	K	48.9	Very low	46.2	Very low	96 Å²	96	73.1 Å²	73.1	42%	0.417	41%	0.408	S	S	.	.	H	α-helix	trans	-60.5	-28.7	175.7	-70.7	179.5	-174	164.8	0	112.4	T338	T338-K342 PolarHBondContact O-N 3.43Å
343	F	44.4	Very low	43.9	Very low	170 Å²	170	73.7 Å²	73.7	75%	0.746	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-25.7	-176.6	-169.4	-102.9	0	0	0	114.2	A340 G341	A340-F343 PolarHBondContact O-N 3.33Å; G341-F343 PolarHBondContact O-N 2.82Å
344	L	50.1	Low	42.5	Very low	41 Å²	41	74.6 Å²	74.6	22%	0.215	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	-34.3	-173.7	-72.4	-176.3	0	0	0	115	I170 I173 G341	I170-L344 HydrophobicContact CG2-CD1 4.47Å; I173-L344 HydrophobicContact CB-CD1 3.61Å; I173-L344 HydrophobicContact CD1-CD1 3.95Å; I173-L344 HydrophobicContact CD1-CD2 3.95Å; I173-L344 HydrophobicContact CD1-CG 4.25Å; I173-L344 HydrophobicContact CG1-CD1 4.38Å; I173-L344 HydrophobicContact CG2-CD1 3.29Å; I173-L344 HydrophobicContact CG2-CG 3.98Å; G341-L344 PolarHBondContact O-N 3.34Å
345	I	50.4	Low	41.8	Very low	34 Å²	34	78.7 Å²	78.7	17%	0.174	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.8	-26.8	-167.4	-60.3	177.3	0	0	0	111.9	G341 M389	G341-I345 PolarHBondContact O-N 3.18Å; I345-M389 HydrophobicContact CD1-CE 4.33Å; I345-M389 HydrophobicContact CG1-CE 4.38Å; I345-M389 HydrophobicContact CG1-SD 4.24Å
346	S	41.7	Very low	41.2	Very low	36 Å²	36	83.6 Å²	83.6	25%	0.252	46%	0.459	S	S	.	.			trans	-88	113.4	175.4	-162.3	0	0	0	0	110	T348 T351	S346-T348 PolarHBondContact O-N 3.48Å; S346-T351 PolarHBondContact OG-OG1 2.95Å
347	G	34.1	Very low	41	Very low	44 Å²	44	86.3 Å²	86.3	45%	0.454	46%	0.463	S	S	.	.			trans	-55.5	139.6	155.5	0	0	0	0	0	108.9
348	T	31.6	Very low	40.7	Very low	125 Å²	125	83.2 Å²	83.2	77%	0.767	46%	0.459	S	S	*	.	S	Bend	trans	-46.2	134.6	172.4	-14.2	0	0	0	0	110.8	S346 D350	S346-T348 PolarHBondContact O-N 3.48Å; T348-D350 PolarHBondContact O-N 3.41Å
349	E	38.1	Very low	39.9	Very low	170 Å²	170	84.9 Å²	84.9	79%	0.794	48%	0.48	S	S	*	.	S	Bend	trans	77.9	-18.5	158.4	-69.4	174.8	161.3	0	0	122.3
350	D	37.2	Very low	39.3	Very low	110 Å²	110	88.6 Å²	88.6	59%	0.588	50%	0.5	S	S	*	.			trans	-94.4	-9.2	-171.8	-71.7	-26	0	0	0	116.8	T348 T352 L353	T348-D350 PolarHBondContact O-N 3.41Å; D350-T352 VanDerWaalsContact C-N 3.31Å; D350-T352 PolarHBondContact O-N 2.83Å; D350-L353 PolarHBondContact O-N 3.29Å
351	T	40.4	Very low	39.2	Very low	71 Å²	71	93.8 Å²	93.8	44%	0.436	53%	0.525	S	S	.	.	H	α-helix	trans	-74.3	-16.7	-172.5	2.3	0	0	0	0	114.6	S346	S346-T351 PolarHBondContact OG-OG1 2.95Å
352	T	35.8	Very low	39.2	Very low	104 Å²	104	100.2 Å²	100.2	64%	0.638	56%	0.556	S	S	*	*	H	α-helix	trans	-75.2	-24.6	177.4	51.1	0	0	0	0	112.7	D350	D350-T352 VanDerWaalsContact C-N 3.31Å; D350-T352 PolarHBondContact O-N 2.83Å
353	L	31.9	Very low	38.7	Very low	103 Å²	103	102.3 Å²	102.3	54%	0.539	57%	0.571	S	S	.	*	H	α-helix	trans	-84.7	-27.9	178.4	-67.5	175.1	0	0	0	112.9	D350	D350-L353 PolarHBondContact O-N 3.29Å
354	A	39.7	Very low	38.8	Very low	42 Å²	42	98.9 Å²	98.9	35%	0.347	56%	0.561	S	S	.	*	H	α-helix	trans	-70.6	-29.2	179.1	0	0	0	0	0	113.2
355	E	40.4	Very low	38.8	Very low	100 Å²	100	100.6 Å²	100.6	47%	0.467	59%	0.588	S	S	.	*	H	α-helix	trans	-76.5	-31.8	178.5	-73.8	-174	162.5	0	0	112.9	K337 F357 S358	K337-E355 WeakPolarHBondContact CE-OE1 3.12Å; K337-E355 WeakPolarHBondContact CE-OE2 3.25Å; K337-E355 IonicContact NZ-OE1 3.37Å; K337-E355 IonicContact NZ-OE2 3.13Å; K337-E355 PolarHBondContact NZ-OE2 3.39Å; E355-F357 VanDerWaalsContact C-N 3.33Å; E355-F357 PolarHBondContact O-N 3.37Å; E355-S358 PolarHBondContact O-OG 3.22Å
356	Q	35.6	Very low	38.7	Very low	157 Å²	157	107.4 Å²	107.4	73%	0.734	61%	0.612	S	S	*	*	H	α-helix	trans	-73.7	-18.6	-178.5	-81.3	-174	-35.7	0	0	114.5
357	F	35.6	Very low	39.2	Very low	150 Å²	150	113.6 Å²	113.6	66%	0.658	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	10.9	-179.2	-79.2	-82.4	0	0	0	114.2	E355 G359	E355-F357 VanDerWaalsContact C-N 3.33Å; E355-F357 PolarHBondContact O-N 3.37Å; F357-G359 PolarHBondContact O-N 3.44Å
358	S	39.4	Very low	40.2	Very low	82 Å²	82	112.2 Å²	112.2	57%	0.573	63%	0.628	S	S	*	*			trans	-81.7	6.5	178.7	69.8	0	0	0	0	114.8	E355	E355-S358 PolarHBondContact O-OG 3.22Å
359	G	31	Very low	41.5	Very low	50 Å²	50	107.1 Å²	107.1	52%	0.515	60%	0.595	S	S	.	*	S	Bend	trans	-101.2	133.4	171	0	0	0	0	0	110.8	F357	F357-G359 PolarHBondContact O-N 3.44Å
360	T	31.7	Very low	42.6	Very low	136 Å²	136	104.4 Å²	104.4	83%	0.834	58%	0.58	S	S	*	*			trans	70.7	91.5	171	67.4	0	0	0	0	116.5
361	D	41.7	Very low	43.9	Very low	135 Å²	135	102 Å²	102	72%	0.722	57%	0.57	S	S	*	*			trans	-162	115.3	141.1	-91.3	-21.4	0	0	0	110.9
362	D	43.5	Very low	45.4	Very low	149 Å²	149	103.8 Å²	103.8	80%	0.797	57%	0.569	S	S	*	*			trans	63.4	98.1	155.7	-56.6	-28.7	0	0	0	121.9	D364	D362-D364 VanDerWaalsContact C-N 3.33Å; D362-D364 PolarHBondContact O-N 2.9Å; D362-D364 VanDerWaalsContact O-N 3.07Å
363	D	39.4	Very low	47.3	Very low	140 Å²	140	101.4 Å²	101.4	75%	0.749	55%	0.552	S	S	*	*			trans	-64.8	82.8	153.4	-171.6	42.6	0	0	0	110.7	K370	D363-K370 IonicContact OD1-NZ 3.9Å
364	D	45.8	Very low	49.4	Very low	98 Å²	98	98 Å²	98	52%	0.524	53%	0.534	S	S	.	.			trans	-88.8	111	167	-150	17.3	0	0	0	107.7	D362 R366	D362-D364 VanDerWaalsContact C-N 3.33Å; D362-D364 PolarHBondContact O-N 2.9Å; D362-D364 VanDerWaalsContact O-N 3.07Å; D364-R366 PolarHBondContact O-N 3.48Å; D364-R366 IonicContact OD2-CZ 3.45Å; D364-R366 IonicContact OD2-NE 3.93Å; D364-R366 PolarHBondContact OD2-NE 2.91Å; D364-R366 IonicContact OD2-NH2 3.7Å; D364-R366 PolarHBondContact OD2-NH2 2.91Å
365	G	48.9	Very low	51.3	Low	76 Å²	76	96 Å²	96	78%	0.784	52%	0.518	S	S	*	.			trans	-65.5	52.3	-170.3	0	0	0	0	0	116.2
366	R	49.5	Very low	53	Low	178 Å²	178	96 Å²	96	67%	0.672	52%	0.516	S	S	*	.			trans	-98.1	119.4	175.8	-60.9	-175.8	-164.1	173.3	12	109.7	D364 G368	D364-R366 PolarHBondContact O-N 3.48Å; D364-R366 IonicContact OD2-CZ 3.45Å; D364-R366 IonicContact OD2-NE 3.93Å; D364-R366 PolarHBondContact OD2-NE 2.91Å; D364-R366 IonicContact OD2-NH2 3.7Å; D364-R366 PolarHBondContact OD2-NH2 2.91Å; R366-G368 PolarHBondContact O-N 3.36Å
367	D	52.2	Low	54.8	Low	166 Å²	166	94.9 Å²	94.9	89%	0.888	52%	0.515	S	S	*	.			trans	-76.3	43.3	-171.3	-134.1	9.7	0	0	0	113.7
368	G	55.3	Low	56.7	Low	15 Å²	15	88.7 Å²	88.7	16%	0.155	49%	0.493	C	S	.	.	S	Bend	trans	-131.5	174.5	-171.7	0	0	0	0	0	114.1	S18 R366 K370	S18-G368 WeakPolarHBondContact O-CA 3.49Å; R366-G368 PolarHBondContact O-N 3.36Å; G368-K370 PolarHBondContact O-N 2.89Å
369	Q	59.2	Low	58.6	Low	17 Å²	17	86.4 Å²	86.4	8%	0.079	48%	0.476	C	S	.	.			trans	-56.3	115.3	174.3	-172.6	-176.2	9.8	0	0	110.6	S6 P25 V371	S6-Q369 PolarHBondContact OG-NE2 2.91Å; S6-Q369 PolarHBondContact OG-OE1 2.86Å; P25-Q369 PolarHBondContact O-NE2 3.24Å; Q369-V371 PolarHBondContact O-N 2.85Å
370	K	59.5	Low	60.6	Low	113 Å²	113	85.1 Å²	85.1	49%	0.491	46%	0.461	S	S	.	.			trans	-76.3	104.2	177.3	-66.4	-170.7	178.1	-171.2	0	110.1	S26 C27 D363 G368	S26-K370 WeakPolarHBondContact CA-O 3.47Å; S26-K370 WeakPolarHBondContact CB-O 3.35Å; C27-K370 PolarHBondContact N-O 3.47Å; D363-K370 IonicContact OD1-NZ 3.9Å; G368-K370 PolarHBondContact O-N 2.89Å
371	V	65	Low	62.8	Low	61 Å²	61	78.9 Å²	78.9	37%	0.37	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	105.1	166.1	178.9	0	0	0	0	107.9	C27 Q369	C27-V371 VanDerWaalsContact O-CA 3.32Å; C27-V371 WeakPolarHBondContact O-CA 3.29Å; C27-V371 WeakPolarHBondContact O-CG1 3.29Å; Q369-V371 PolarHBondContact O-N 2.85Å
372	W	71.7	Confident	64.9	Low	108 Å²	108	75.3 Å²	75.3	41%	0.409	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	145.6	-179.9	64.2	-83.9	0	0	0	111	R28 S29 N374	R28-W372 HydrophobicContact CG-CZ2 3.75Å; S29-W372 PolarHBondContact N-O 3.31Å; S29-W372 VanDerWaalsContact N-O 3.1Å; W372-N374 HydrophobicContact CD2-CB 4.32Å; W372-N374 HydrophobicContact CE3-CB 3.6Å; W372-N374 HydrophobicContact CH2-CB 3.49Å; W372-N374 VanDerWaalsContact CH2-CB 3.49Å; W372-N374 HydrophobicContact CZ2-CB 4.21Å; W372-N374 VanDerWaalsContact CZ3-CA 3.44Å; W372-N374 HydrophobicContact CZ3-CB 3.14Å; W372-N374 PolarHBondContact O-N 3.35Å
373	D	76.3	Confident	67	Low	54 Å²	54	68.2 Å²	68.2	29%	0.289	37%	0.365	S	S	.	.			trans	-84.4	106.4	177.1	-175.1	1.9	0	0	0	109.7	S118 E375 K376	S118-D373 WeakPolarHBondContact CB-OD2 3.49Å; S118-D373 VanDerWaalsContact OG-CG 3.27Å; S118-D373 PolarHBondContact OG-OD1 2.87Å; S118-D373 PolarHBondContact OG-OD2 3.48Å; D373-E375 VanDerWaalsContact C-N 3.33Å; D373-E375 PolarHBondContact OD1-N 3Å; D373-K376 HydrophobicContact CB-CG 4.22Å
374	N	76.6	Confident	69.4	Low	30 Å²	30	64.4 Å²	64.4	16%	0.16	34%	0.342	C	S	.	.	S	Bend	trans	-92.7	9.3	-179.6	71.4	-71.2	0	0	0	113	R28 S30 W372	R28-N374 HydrophobicContact CG-CB 4.5Å; S30-N374 WeakPolarHBondContact CB-OD1 3.49Å; S30-N374 PolarHBondContact OG-ND2 2.93Å; S30-N374 PolarHBondContact OG-OD1 3.46Å; W372-N374 HydrophobicContact CD2-CB 4.32Å; W372-N374 HydrophobicContact CE3-CB 3.6Å; W372-N374 HydrophobicContact CH2-CB 3.49Å; W372-N374 VanDerWaalsContact CH2-CB 3.49Å; W372-N374 HydrophobicContact CZ2-CB 4.21Å; W372-N374 VanDerWaalsContact CZ3-CA 3.44Å; W372-N374 HydrophobicContact CZ3-CB 3.14Å; W372-N374 PolarHBondContact O-N 3.35Å
375	E	78.2	Confident	71.4	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	34%	0.336	C	S	.	.			trans	-124.4	13.3	-171.4	-64.2	-176.2	137.9	0	0	113.4	S30 S118 D373 N377 G378 A380 Y383	S30-E375 WeakPolarHBondContact CB-OE1 3.33Å; S30-E375 WeakPolarHBondContact CB-OE2 3.5Å; S118-E375 WeakPolarHBondContact CB-O 3.11Å; S118-E375 PolarHBondContact N-O 3.25Å; S118-E375 VanDerWaalsContact OG-C 3.23Å; S118-E375 PolarHBondContact OG-O 3.16Å; D373-E375 VanDerWaalsContact C-N 3.33Å; D373-E375 PolarHBondContact OD1-N 3Å; E375-N377 VanDerWaalsContact C-N 3.35Å; E375-N377 PolarHBondContact O-N 3.39Å; E375-G378 CarbonylContact C-O 3.57Å; E375-G378 VanDerWaalsContact CA-O 3.23Å; E375-G378 WeakPolarHBondContact CA-O 3.24Å; E375-G378 PolarHBondContact O-N 3.17Å; E375-A380 HydrophobicContact CG-CB 4.13Å; E375-A380 WeakPolarHBondContact OE1-CB 3.24Å; E375-A380 PolarHBondContact OE1-N 3.43Å; E375-Y383 WeakPolarHBondContact OE2-CE1 3.19Å; E375-Y383 PolarHBondContact OE2-OH 3.38Å
376	K	76.4	Confident	73.4	Confident	101 Å²	101	60.7 Å²	60.7	44%	0.439	30%	0.301	S	S	.	.	S	Bend	trans	-54.7	-47.2	179.3	-69.8	-176	-179.1	176.8	0	112.6	S117 S118 D373	S117-K376 PolarHBondContact OG-O 2.95Å; S118-K376 WeakPolarHBondContact OG-CA 3.34Å; S118-K376 PolarHBondContact OG-N 3.06Å; D373-K376 HydrophobicContact CB-CG 4.22Å
377	N	73.2	Confident	75.5	Confident	134 Å²	134	52.2 Å²	52.2	72%	0.717	27%	0.269	S	S	*	.	S	Bend	trans	-95.1	-7.8	-175.5	-62.9	-21.8	0	0	0	113.4	E375	E375-N377 VanDerWaalsContact C-N 3.35Å; E375-N377 PolarHBondContact O-N 3.39Å
378	G	75.8	Confident	77.4	Confident	19 Å²	19	48 Å²	48	20%	0.196	24%	0.243	C	C	.	.	S	Bend	trans	172.7	137.8	-176.5	0	0	0	0	0	111.1	H116 E375	H116-G378 CarbonylContact O-C 3.59Å; H116-G378 WeakPolarHBondContact O-CA 3.42Å; E375-G378 CarbonylContact C-O 3.57Å; E375-G378 VanDerWaalsContact CA-O 3.23Å; E375-G378 WeakPolarHBondContact CA-O 3.24Å; E375-G378 PolarHBondContact O-N 3.17Å
379	V	79.3	Confident	79.2	Confident	35 Å²	35	48.1 Å²	48.1	21%	0.212	24%	0.24	C	C	.	.			trans	-67	137.4	176.8	-68.2	0	0	0	0	111.3	V115 H116 Y381 Y383	V115-V379 HydrophobicContact CG1-CG1 4.38Å; H116-V379 PolarHBondContact O-N 3.41Å; V379-Y381 WeakPolarHBondContact CB-O 3.44Å; V379-Y381 WeakPolarHBondContact CG2-O 3.35Å; V379-Y381 PolarHBondContact O-N 3.01Å; V379-Y383 HydrophobicContact CB-CD1 4.48Å; V379-Y383 HydrophobicContact CB-CE1 4.08Å; V379-Y383 HydrophobicContact CG1-CD1 4.32Å; V379-Y383 HydrophobicContact CG1-CE1 3.8Å; V379-Y383 HydrophobicContact CG1-CE2 4.04Å
380	A	73.2	Confident	80.9	Confident	23 Å²	23	47.5 Å²	47.5	19%	0.19	24%	0.237	C	C	.	.	S	Bend	trans	-75.3	-16.9	-179.5	0	0	0	0	0	112.4	E375	E375-A380 HydrophobicContact CG-CB 4.13Å; E375-A380 WeakPolarHBondContact OE1-CB 3.24Å; E375-A380 PolarHBondContact OE1-N 3.43Å
381	Y	78.5	Confident	82.6	Confident	5 Å²	5	42.8 Å²	42.8	2%	0.02	22%	0.217	C	C	.	.	S	Bend	trans	-152	156.5	176.3	68.5	-78.8	0	0	0	109.6	R34 Q126 V379 Y383 Y386	R34-Y381 HydrophobicContact CG-CE1 3.97Å; R34-Y381 HydrophobicContact CG-CE2 4.09Å; R34-Y381 VanDerWaalsContact CG-OH 3.32Å; R34-Y381 WeakPolarHBondContact CG-OH 3.46Å; Q126-Y381 PolarHBondContact NE2-OH 3Å; V379-Y381 WeakPolarHBondContact CB-O 3.44Å; V379-Y381 WeakPolarHBondContact CG2-O 3.35Å; V379-Y381 PolarHBondContact O-N 3.01Å; Y381-Y383 HydrophobicContact CD1-CD1 4.33Å; Y381-Y383 HydrophobicContact CD1-CE1 4.22Å; Y381-Y383 HydrophobicContact CD2-CD1 4.05Å; Y381-Y383 AromaticContact CE1-CD1 3.81Å; Y381-Y383 HydrophobicContact CE1-CD1 3.81Å; Y381-Y383 AromaticContact CE1-CE1 3.59Å; Y381-Y383 HydrophobicContact CE1-CE1 3.59Å; Y381-Y383 AromaticContact CE2-CD1 3.51Å; Y381-Y383 HydrophobicContact CE2-CD1 3.51Å; Y381-Y383 HydrophobicContact CE2-CE1 4.17Å; Y381-Y383 HydrophobicContact CE2-CG 4.42Å; Y381-Y383 HydrophobicContact CG-CD1 4.43Å; Y381-Y383 AromaticContact CZ-CD1 3.37Å; Y381-Y383 AromaticContact CZ-CE1 3.56Å; Y381-Y383 WeakPolarHBondContact O-CD1 3.49Å; Y381-Y383 PolarHBondContact O-N 3.12Å; Y381-Y383 VanDerWaalsContact O-N 3.13Å; Y381-Y386 HydrophobicContact CD2-CG 4.25Å; Y381-Y386 VanDerWaalsContact CE2-CB 3.44Å; Y381-Y386 HydrophobicContact CE2-CD1 4.11Å; Y381-Y386 HydrophobicContact CE2-CD2 4.32Å; Y381-Y386 AromaticContact CE2-CG 3.69Å; Y381-Y386 HydrophobicContact CE2-CG 3.69Å
382	N	84.6	Confident	84	Confident	60 Å²	60	40.2 Å²	40.2	32%	0.321	20%	0.201	S	C	.	.			trans	-73.2	109.5	175.4	-174.1	-26.5	0	0	0	110.5	F384 M385 Y386	N382-F384 VanDerWaalsContact C-N 3.28Å; N382-F384 PolarHBondContact O-N 3.08Å; N382-F384 WeakPolarHBondContact OD1-CB 3.36Å; N382-F384 PolarHBondContact OD1-N 3.03Å; N382-M385 HydrophobicContact CB-CB 4.13Å; N382-M385 HydrophobicContact CB-CG 4.08Å; N382-M385 PolarHBondContact O-N 3.02Å; N382-M385 VanDerWaalsContact O-N 3.16Å; N382-M385 PolarHBondContact OD1-N 3.14Å; N382-Y386 PolarHBondContact O-N 2.87Å; N382-Y386 VanDerWaalsContact O-N 3.08Å
383	Y	87.8	Confident	85.2	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-57.6	-38.5	-178.3	-68.2	-2.1	0	0	0	113.2	M112 V115 A123 Q126 E375 V379 Y381 Y386 H387	M112-Y383 HydrophobicContact SD-CD2 4.11Å; V115-Y383 HydrophobicContact CB-CD2 4.04Å; V115-Y383 HydrophobicContact CG1-CD2 3.79Å; V115-Y383 HydrophobicContact CG1-CE2 3.82Å; A123-Y383 HydrophobicContact CB-CE2 4.03Å; Q126-Y383 HydrophobicContact CB-CD2 4.34Å; Q126-Y383 HydrophobicContact CB-CE2 4.15Å; Q126-Y383 HydrophobicContact CG-CD2 3.92Å; Q126-Y383 HydrophobicContact CG-CE2 3.81Å; Q126-Y383 HydrophobicContact CG-CG 4.41Å; E375-Y383 WeakPolarHBondContact OE2-CE1 3.19Å; E375-Y383 PolarHBondContact OE2-OH 3.38Å; V379-Y383 HydrophobicContact CB-CD1 4.48Å; V379-Y383 HydrophobicContact CB-CE1 4.08Å; V379-Y383 HydrophobicContact CG1-CD1 4.32Å; V379-Y383 HydrophobicContact CG1-CE1 3.8Å; V379-Y383 HydrophobicContact CG1-CE2 4.04Å; Y381-Y383 HydrophobicContact CD1-CD1 4.33Å; Y381-Y383 HydrophobicContact CD1-CE1 4.22Å; Y381-Y383 HydrophobicContact CD2-CD1 4.05Å; Y381-Y383 AromaticContact CE1-CD1 3.81Å; Y381-Y383 HydrophobicContact CE1-CD1 3.81Å; Y381-Y383 AromaticContact CE1-CE1 3.59Å; Y381-Y383 HydrophobicContact CE1-CE1 3.59Å; Y381-Y383 AromaticContact CE2-CD1 3.51Å; Y381-Y383 HydrophobicContact CE2-CD1 3.51Å; Y381-Y383 HydrophobicContact CE2-CE1 4.17Å; Y381-Y383 HydrophobicContact CE2-CG 4.42Å; Y381-Y383 HydrophobicContact CG-CD1 4.43Å; Y381-Y383 AromaticContact CZ-CD1 3.37Å; Y381-Y383 AromaticContact CZ-CE1 3.56Å; Y381-Y383 WeakPolarHBondContact O-CD1 3.49Å; Y381-Y383 PolarHBondContact O-N 3.12Å; Y381-Y383 VanDerWaalsContact O-N 3.13Å; Y383-Y386 PolarHBondContact O-N 3.39Å; Y383-H387 PolarHBondContact O-CD2 3.06Å; Y383-H387 PolarHBondContact O-N 3.14Å
384	F	90.4	Very high	86.1	Confident	59 Å²	59	32.5 Å²	32.5	26%	0.259	17%	0.168	S	C	.	.	H	α-helix	trans	-60.6	-50.6	176.5	167.8	-90.4	0	0	0	110.8	C109 I113 N382 Y386 H387 F388	C109-F384 VanDerWaalsContact O-CD2 3.3Å; C109-F384 WeakPolarHBondContact O-CD2 3.11Å; C109-F384 WeakPolarHBondContact SG-CD2 3.31Å; C109-F384 WeakPolarHBondContact SG-CE2 3.49Å; I113-F384 HydrophobicContact CD1-CD2 4.48Å; I113-F384 HydrophobicContact CD1-CE2 4.35Å; I113-F384 HydrophobicContact CG1-CD2 3.52Å; I113-F384 HydrophobicContact CG1-CE2 3.85Å; N382-F384 VanDerWaalsContact C-N 3.28Å; N382-F384 PolarHBondContact O-N 3.08Å; N382-F384 WeakPolarHBondContact OD1-CB 3.36Å; N382-F384 PolarHBondContact OD1-N 3.03Å; F384-Y386 VanDerWaalsContact C-N 3.31Å; F384-Y386 PolarHBondContact O-N 2.81Å; F384-H387 PolarHBondContact O-N 2.92Å; F384-F388 WeakPolarHBondContact O-CB 3.45Å; F384-F388 PolarHBondContact O-N 3.24Å
385	M	88.5	Confident	87	Confident	83 Å²	83	31.4 Å²	31.4	41%	0.409	16%	0.162	S	C	.	.	H	α-helix	trans	-63.3	-38.7	-177.6	-69.9	-60.4	177.9	0	0	111.7	N382 F388 M389	N382-M385 HydrophobicContact CB-CB 4.13Å; N382-M385 HydrophobicContact CB-CG 4.08Å; N382-M385 PolarHBondContact O-N 3.02Å; N382-M385 VanDerWaalsContact O-N 3.16Å; N382-M385 PolarHBondContact OD1-N 3.14Å; M385-F388 PolarHBondContact O-N 3.06Å; M385-M389 VanDerWaalsContact O-CG 3.26Å; M385-M389 WeakPolarHBondContact O-CG 3.22Å; M385-M389 PolarHBondContact O-N 3.45Å
386	Y	90.6	Very high	87.8	Confident	14 Å²	14	32 Å²	32	6%	0.055	17%	0.165	C	C	.	.	H	α-helix	trans	-59.6	-48.8	175.6	173	-98.4	0	0	0	112.5	R34 F37 T331 Y381 N382 Y383 F384 F388 M389 M390	R34-Y386 WeakPolarHBondContact CA-OH 3.33Å; R34-Y386 HydrophobicContact CB-CE1 4.44Å; R34-Y386 HydrophobicContact CB-CE2 3.96Å; R34-Y386 HydrophobicContact CG-CD1 4.35Å; R34-Y386 HydrophobicContact CG-CD2 4.1Å; R34-Y386 HydrophobicContact CG-CE1 4Å; R34-Y386 HydrophobicContact CG-CE2 3.73Å; R34-Y386 HydrophobicContact CG-CG 4.39Å; R34-Y386 PolarHBondContact O-OH 2.96Å; F37-Y386 HydrophobicContact CB-CE1 3.99Å; F37-Y386 WeakPolarHBondContact CB-OH 3.47Å; F37-Y386 HydrophobicContact CD2-CE1 4.18Å; F37-Y386 HydrophobicContact CG-CE1 4.33Å; T331-Y386 HydrophobicContact CG2-CE2 4.32Å; Y381-Y386 HydrophobicContact CD2-CG 4.25Å; Y381-Y386 VanDerWaalsContact CE2-CB 3.44Å; Y381-Y386 HydrophobicContact CE2-CD1 4.11Å; Y381-Y386 HydrophobicContact CE2-CD2 4.32Å; Y381-Y386 AromaticContact CE2-CG 3.69Å; Y381-Y386 HydrophobicContact CE2-CG 3.69Å; N382-Y386 PolarHBondContact O-N 2.87Å; N382-Y386 VanDerWaalsContact O-N 3.08Å; Y383-Y386 PolarHBondContact O-N 3.39Å; F384-Y386 VanDerWaalsContact C-N 3.31Å; F384-Y386 PolarHBondContact O-N 2.81Å; Y386-F388 VanDerWaalsContact C-N 3.31Å; Y386-F388 PolarHBondContact O-N 3.09Å; Y386-M389 WeakPolarHBondContact O-CB 3.46Å; Y386-M389 PolarHBondContact O-N 3.27Å; Y386-M390 HydrophobicContact CE1-CG 4.12Å; Y386-M390 HydrophobicContact CE2-CE 4.34Å; Y386-M390 HydrophobicContact CE2-CG 4.24Å; Y386-M390 WeakPolarHBondContact O-CG 3.22Å; Y386-M390 PolarHBondContact O-N 3.35Å; Y386-M390 VanDerWaalsContact OH-CE 3.23Å; Y386-M390 WeakPolarHBondContact OH-CE 3.11Å
387	H	93.3	Very high	88.6	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-67.2	-34.6	177.9	-73.5	-58.8	0	0	0	112.5	F37 C109 Q126 Y383 F384 M390 L391	F37-H387 AromaticContact CD1-CE1 3.99Å; F37-H387 AromaticContact CD2-CE1 3.8Å; F37-H387 AromaticContact CE1-CE1 3.75Å; F37-H387 AromaticContact CE2-CE1 3.57Å; F37-H387 AromaticContact CZ-CE1 3.54Å; C109-H387 HydrophobicContact CB-CB 3.87Å; Q126-H387 PolarHBondContact NE2-NE2 2.93Å; Q126-H387 PolarHBondContact OE1-NE2 3.19Å; Y383-H387 PolarHBondContact O-CD2 3.06Å; Y383-H387 PolarHBondContact O-N 3.14Å; F384-H387 PolarHBondContact O-N 2.92Å; H387-M390 PolarHBondContact O-N 3.4Å; H387-L391 WeakPolarHBondContact O-CB 3.4Å; H387-L391 PolarHBondContact O-N 3.44Å
388	F	92.9	Very high	89.5	Confident	77 Å²	77	21 Å²	21	34%	0.338	11%	0.111	S	C	.	.	H	α-helix	trans	-62.6	-42.9	172.8	-174.6	-110.3	0	0	0	112	F384 M385 Y386 M390 L391 L392	F384-F388 WeakPolarHBondContact O-CB 3.45Å; F384-F388 PolarHBondContact O-N 3.24Å; M385-F388 PolarHBondContact O-N 3.06Å; Y386-F388 VanDerWaalsContact C-N 3.31Å; Y386-F388 PolarHBondContact O-N 3.09Å; F388-M390 VanDerWaalsContact C-N 3.34Å; F388-M390 PolarHBondContact O-N 2.87Å; F388-L391 WeakPolarHBondContact O-CB 2.96Å; F388-L391 PolarHBondContact O-N 3.18Å; F388-L392 HydrophobicContact CD1-CD1 4Å; F388-L392 HydrophobicContact CE1-CD1 3.55Å; F388-L392 HydrophobicContact CE1-CG 4.22Å; F388-L392 HydrophobicContact CZ-CD1 3.94Å; F388-L392 HydrophobicContact CZ-CD2 4.34Å; F388-L392 HydrophobicContact CZ-CG 4.24Å; F388-L392 WeakPolarHBondContact O-CG 3.28Å; F388-L392 PolarHBondContact O-N 3.04Å
389	M	92.5	Very high	90.1	Very high	18 Å²	18	20.2 Å²	20.2	9%	0.089	10%	0.102	C	C	.	.	H	α-helix	trans	-61	-42.6	173.5	-69.8	170.5	71.1	0	0	111.7	Y167 I170 L174 I345 M385 Y386 L392 A393	Y167-M389 WeakPolarHBondContact CE2-O 3.5Å; I170-M389 HydrophobicContact CD1-CG 4.28Å; I170-M389 HydrophobicContact CG2-CE 3.59Å; L174-M389 HydrophobicContact CD1-CE 4.42Å; I345-M389 HydrophobicContact CD1-CE 4.33Å; I345-M389 HydrophobicContact CG1-CE 4.38Å; I345-M389 HydrophobicContact CG1-SD 4.24Å; M385-M389 VanDerWaalsContact O-CG 3.26Å; M385-M389 WeakPolarHBondContact O-CG 3.22Å; M385-M389 PolarHBondContact O-N 3.45Å; Y386-M389 WeakPolarHBondContact O-CB 3.46Å; Y386-M389 PolarHBondContact O-N 3.27Å; M389-L392 PolarHBondContact O-N 3.21Å; M389-A393 PolarHBondContact O-N 2.97Å
390	M	94	Very high	90.6	Very high	4 Å²	4	18.9 Å²	18.9	2%	0.02	9%	0.094	C	C	.	.	H	α-helix	trans	-67.3	-36.3	178.4	-67.7	-57.4	-123.2	0	0	113	S38 L41 Y105 V327 Y386 H387 F388 A393 T394	S38-M390 WeakPolarHBondContact OG-CE 3.41Å; L41-M390 HydrophobicContact CD2-CE 4.23Å; L41-M390 HydrophobicContact CD2-SD 3.83Å; Y105-M390 HydrophobicContact CD1-CB 3.57Å; Y105-M390 HydrophobicContact CD1-CG 4.44Å; Y105-M390 HydrophobicContact CD2-CB 4.25Å; Y105-M390 HydrophobicContact CE1-CB 3.67Å; Y105-M390 HydrophobicContact CE1-CG 4.21Å; Y105-M390 HydrophobicContact CE2-CB 4.36Å; Y105-M390 HydrophobicContact CG-CB 3.89Å; V327-M390 HydrophobicContact CG1-CE 3.87Å; V327-M390 HydrophobicContact CG1-SD 4.34Å; Y386-M390 HydrophobicContact CE1-CG 4.12Å; Y386-M390 HydrophobicContact CE2-CE 4.34Å; Y386-M390 HydrophobicContact CE2-CG 4.24Å; Y386-M390 WeakPolarHBondContact O-CG 3.22Å; Y386-M390 PolarHBondContact O-N 3.35Å; Y386-M390 VanDerWaalsContact OH-CE 3.23Å; Y386-M390 WeakPolarHBondContact OH-CE 3.11Å; H387-M390 PolarHBondContact O-N 3.4Å; F388-M390 VanDerWaalsContact C-N 3.34Å; F388-M390 PolarHBondContact O-N 2.87Å; M390-A393 WeakPolarHBondContact O-CB 3.06Å; M390-A393 PolarHBondContact O-N 2.94Å; M390-T394 PolarHBondContact O-N 2.98Å
391	L	95.8	Very high	91.2	Very high	14 Å²	14	18.1 Å²	18.1	7%	0.073	9%	0.086	C	C	.	.	H	α-helix	trans	-61.3	-46.7	170.4	-178.7	168.2	0	0	0	111.2	T102 L106 H387 F388 A393 T394 L395	T102-L391 HydrophobicContact CG2-CD1 4.35Å; T102-L391 HydrophobicContact CG2-CD2 3.75Å; T102-L391 HydrophobicContact CG2-CG 3.61Å; L106-L391 HydrophobicContact CB-CD1 3.66Å; L106-L391 HydrophobicContact CD1-CD1 3.71Å; L106-L391 HydrophobicContact CG-CD1 4.23Å; H387-L391 WeakPolarHBondContact O-CB 3.4Å; H387-L391 PolarHBondContact O-N 3.44Å; F388-L391 WeakPolarHBondContact O-CB 2.96Å; F388-L391 PolarHBondContact O-N 3.18Å; L391-A393 PolarHBondContact O-N 3.26Å; L391-T394 PolarHBondContact O-N 2.94Å; L391-T394 PolarHBondContact O-OG1 3.2Å; L391-L395 HydrophobicContact CD2-CD1 3.81Å; L391-L395 HydrophobicContact CD2-CG 4.4Å; L391-L395 PolarHBondContact O-N 3.46Å
392	L	95.6	Very high	91.3	Very high	7 Å²	7	18 Å²	18	4%	0.037	9%	0.086	C	C	.	.	H	α-helix	trans	-63.9	-34.7	176.2	-69	179.4	0	0	0	111.4	L166 Y167 I170 F388 M389 L395 Y396	L166-L392 HydrophobicContact CB-CD1 4.09Å; L166-L392 HydrophobicContact CB-CD2 4.3Å; L166-L392 HydrophobicContact CD1-CD2 4.22Å; Y167-L392 HydrophobicContact CD2-CB 3.81Å; Y167-L392 HydrophobicContact CG-CB 4.35Å; I170-L392 HydrophobicContact CD1-CD1 3.77Å; F388-L392 HydrophobicContact CD1-CD1 4Å; F388-L392 HydrophobicContact CE1-CD1 3.55Å; F388-L392 HydrophobicContact CE1-CG 4.22Å; F388-L392 HydrophobicContact CZ-CD1 3.94Å; F388-L392 HydrophobicContact CZ-CD2 4.34Å; F388-L392 HydrophobicContact CZ-CG 4.24Å; F388-L392 WeakPolarHBondContact O-CG 3.28Å; F388-L392 PolarHBondContact O-N 3.04Å; M389-L392 PolarHBondContact O-N 3.21Å; L392-L395 PolarHBondContact O-N 2.94Å; L392-Y396 PolarHBondContact O-N 3.19Å
393	A	95	Very high	91	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-61.5	-43.8	175.2	0	0	0	0	0	111.8	L41 Y167 M389 M390 L391 L395 Y396 V397	L41-A393 HydrophobicContact CD1-CB 4.5Å; L41-A393 HydrophobicContact CD2-CB 3.6Å; Y167-A393 HydrophobicContact CD2-CB 3.87Å; Y167-A393 VanDerWaalsContact CD2-N 3.27Å; Y167-A393 HydrophobicContact CE1-CB 4.22Å; Y167-A393 HydrophobicContact CE2-CB 3.34Å; Y167-A393 HydrophobicContact CG-CB 4.48Å; M389-A393 PolarHBondContact O-N 2.97Å; M390-A393 WeakPolarHBondContact O-CB 3.06Å; M390-A393 PolarHBondContact O-N 2.94Å; L391-A393 PolarHBondContact O-N 3.26Å; A393-L395 VanDerWaalsContact C-N 3.31Å; A393-L395 PolarHBondContact O-N 3.25Å; A393-Y396 WeakPolarHBondContact O-CB 3.36Å; A393-Y396 PolarHBondContact O-N 3.45Å; A393-Y396 VanDerWaalsContact O-N 3.17Å; A393-V397 WeakPolarHBondContact O-CG2 3.35Å; A393-V397 PolarHBondContact O-N 3.31Å
394	T	95.9	Very high	90.4	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-63.5	-36.7	177	54.3	0	0	0	0	112.1	L41 T102 Y105 M390 L391 V397 M398	L41-T394 HydrophobicContact CD1-CG2 3.46Å; L41-T394 VanDerWaalsContact CD1-CG2 3.46Å; T102-T394 WeakPolarHBondContact CA-OG1 3.11Å; T102-T394 WeakPolarHBondContact OG1-CB 3.49Å; T102-T394 PolarHBondContact OG1-OG1 2.84Å; Y105-T394 HydrophobicContact CD2-CG2 3.71Å; Y105-T394 HydrophobicContact CE2-CG2 3.65Å; M390-T394 PolarHBondContact O-N 2.98Å; L391-T394 PolarHBondContact O-N 2.94Å; L391-T394 PolarHBondContact O-OG1 3.2Å; T394-V397 PolarHBondContact O-N 2.8Å; T394-M398 PolarHBondContact O-N 3.14Å
395	L	95.5	Very high	89.4	Confident	7 Å²	7	14.7 Å²	14.7	4%	0.037	7%	0.07	C	C	.	.	H	α-helix	trans	-67.3	-37.9	173.7	-65.2	176.7	0	0	0	112	T102 W156 V159 L391 L392 A393 M398 V399	T102-L395 HydrophobicContact CG2-CD1 4.47Å; T102-L395 HydrophobicContact CG2-CD2 4.02Å; T102-L395 HydrophobicContact CG2-CG 4.13Å; W156-L395 HydrophobicContact CH2-CD2 4.03Å; W156-L395 HydrophobicContact CZ2-CD2 3.62Å; V159-L395 HydrophobicContact CG1-CD1 4.26Å; V159-L395 HydrophobicContact CG1-CD2 4.31Å; L391-L395 HydrophobicContact CD2-CD1 3.81Å; L391-L395 HydrophobicContact CD2-CG 4.4Å; L391-L395 PolarHBondContact O-N 3.46Å; L392-L395 PolarHBondContact O-N 2.94Å; A393-L395 VanDerWaalsContact C-N 3.31Å; A393-L395 PolarHBondContact O-N 3.25Å; L395-M398 HydrophobicContact CD2-CE 4.22Å; L395-M398 WeakPolarHBondContact O-CB 3.36Å; L395-M398 PolarHBondContact O-N 2.94Å; L395-V399 PolarHBondContact O-N 2.94Å; L395-V399 VanDerWaalsContact O-N 3.15Å
396	Y	94.4	Very high	88.1	Confident	13 Å²	13	15.7 Å²	15.7	5%	0.051	7%	0.072	C	C	.	.	H	α-helix	trans	-64.5	-44.1	173.8	-179.9	-108.7	0	0	0	112.8	Y167 I168 Q171 L323 L392 A393 M398 V399 M400	Y167-Y396 AromaticContact CD1-CD1 3.72Å; Y167-Y396 HydrophobicContact CD1-CD1 3.72Å; Y167-Y396 HydrophobicContact CD1-CD2 4.4Å; Y167-Y396 AromaticContact CD1-CG 3.63Å; Y167-Y396 HydrophobicContact CD1-CG 3.63Å; Y167-Y396 HydrophobicContact CE1-CD1 4.08Å; Y167-Y396 HydrophobicContact CE1-CG 4.44Å; Y167-Y396 HydrophobicContact CG-CG 4.36Å; I168-Y396 HydrophobicContact CD1-CD2 4.26Å; I168-Y396 HydrophobicContact CD1-CE2 3.79Å; I168-Y396 HydrophobicContact CG1-CD2 3.67Å; I168-Y396 HydrophobicContact CG1-CE2 3.25Å; Q171-Y396 PolarHBondContact OE1-OH 2.85Å; L323-Y396 HydrophobicContact CB-CE1 4.35Å; L323-Y396 HydrophobicContact CD1-CD1 3.77Å; L323-Y396 HydrophobicContact CD1-CE1 4.13Å; L323-Y396 HydrophobicContact CD2-CD1 3.81Å; L323-Y396 HydrophobicContact CD2-CE1 4.13Å; L323-Y396 HydrophobicContact CG-CD1 4.31Å; L323-Y396 HydrophobicContact CG-CE1 4.45Å; L392-Y396 PolarHBondContact O-N 3.19Å; A393-Y396 WeakPolarHBondContact O-CB 3.36Å; A393-Y396 PolarHBondContact O-N 3.45Å; A393-Y396 VanDerWaalsContact O-N 3.17Å; Y396-M398 PolarHBondContact O-N 2.93Å; Y396-V399 HydrophobicContact CD2-CG2 4.43Å; Y396-V399 WeakPolarHBondContact O-CG2 3.48Å; Y396-V399 PolarHBondContact O-N 2.91Å; Y396-M400 VanDerWaalsContact O-CB 3.23Å; Y396-M400 WeakPolarHBondContact O-CB 3.41Å; Y396-M400 PolarHBondContact O-N 2.98Å
397	V	93.4	Very high	86.2	Confident	4 Å²	4	17.5 Å²	17.5	2%	0.024	9%	0.086	C	C	.	.	H	α-helix	trans	-51.7	-48.8	173.3	172.1	0	0	0	0	110.1	L41 I45 L323 A393 T394 M400 L401	L41-V397 HydrophobicContact CD1-CG2 4.41Å; I45-V397 HydrophobicContact CD1-CG2 3.92Å; I45-V397 HydrophobicContact CG1-CB 4.42Å; I45-V397 HydrophobicContact CG1-CG1 3.97Å; I45-V397 HydrophobicContact CG1-CG2 3.47Å; I45-V397 VanDerWaalsContact CG1-CG2 3.47Å; L323-V397 HydrophobicContact CD2-CB 4.47Å; L323-V397 HydrophobicContact CD2-CG2 3.38Å; A393-V397 WeakPolarHBondContact O-CG2 3.35Å; A393-V397 PolarHBondContact O-N 3.31Å; T394-V397 PolarHBondContact O-N 2.8Å; V397-M400 PolarHBondContact O-N 3.22Å; V397-L401 HydrophobicContact CG1-CD1 3.71Å; V397-L401 HydrophobicContact CG1-CG 4.33Å; V397-L401 WeakPolarHBondContact O-CB 3.25Å; V397-L401 VanDerWaalsContact O-CG 3.32Å; V397-L401 WeakPolarHBondContact O-CG 3.4Å; V397-L401 PolarHBondContact O-N 3.45Å
398	M	91.7	Very high	84.2	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-57.8	-57.3	-178.7	-171.8	178.3	73.7	0	0	111.5	V94 Y95 C98 W156 T394 L395 Y396 M400 L401 T402	V94-M398 HydrophobicContact CG1-CG 4.43Å; Y95-M398 HydrophobicContact CD1-CE 3.96Å; Y95-M398 HydrophobicContact CD1-CG 3.85Å; Y95-M398 HydrophobicContact CD1-SD 3.27Å; Y95-M398 WeakPolarHBondContact CD1-SD 3.46Å; Y95-M398 HydrophobicContact CE1-CE 3.81Å; Y95-M398 HydrophobicContact CE1-CG 3.99Å; Y95-M398 HydrophobicContact CE1-SD 3.68Å; Y95-M398 HydrophobicContact CG-CG 4.42Å; Y95-M398 HydrophobicContact CG-SD 4.14Å; C98-M398 HydrophobicContact CB-CB 3.79Å; C98-M398 HydrophobicContact CB-CG 4.05Å; C98-M398 HydrophobicContact CB-SD 4.03Å; W156-M398 HydrophobicContact CG-CE 4.46Å; W156-M398 HydrophobicContact CG-SD 4.28Å; W156-M398 PolarHBondContact NE1-SD 2.9Å; W156-M398 WeakPolarHBondContact O-CE 3.41Å; T394-M398 PolarHBondContact O-N 3.14Å; L395-M398 HydrophobicContact CD2-CE 4.22Å; L395-M398 WeakPolarHBondContact O-CB 3.36Å; L395-M398 PolarHBondContact O-N 2.94Å; Y396-M398 PolarHBondContact O-N 2.93Å; M398-M400 VanDerWaalsContact C-N 3.3Å; M398-M400 PolarHBondContact O-N 3.05Å; M398-L401 PolarHBondContact O-N 3.46Å; M398-T402 VanDerWaalsContact O-CG2 3.32Å; M398-T402 WeakPolarHBondContact O-CG2 3.38Å; M398-T402 PolarHBondContact O-N 3.41Å; M398-T402 PolarHBondContact O-OG1 3.23Å; M398-T402 VanDerWaalsContact O-OG1 3.06Å
399	V	89.4	Confident	81.9	Confident	1 Å²	1	26.8 Å²	26.8	1%	0.006	14%	0.135	C	C	.	.	H	α-helix	trans	-68.3	-29.2	-177.2	-63.6	0	0	0	0	113.3	G160 M161 L395 Y396 N403 W404	G160-V399 WeakPolarHBondContact O-CG1 3.33Å; M161-V399 HydrophobicContact CG-CG1 4.28Å; L395-V399 PolarHBondContact O-N 2.94Å; L395-V399 VanDerWaalsContact O-N 3.15Å; Y396-V399 HydrophobicContact CD2-CG2 4.43Å; Y396-V399 WeakPolarHBondContact O-CG2 3.48Å; Y396-V399 PolarHBondContact O-N 2.91Å; V399-N403 CarbonylContact O-C 3.35Å; V399-N403 PolarHBondContact O-N 3.48Å; V399-W404 HydrophobicContact CB-CD2 4.1Å; V399-W404 HydrophobicContact CB-CE3 4.48Å; V399-W404 HydrophobicContact CB-CG 4.46Å; V399-W404 HydrophobicContact CB-CZ2 4.21Å; V399-W404 HydrophobicContact CG2-CD2 4.23Å; V399-W404 HydrophobicContact CG2-CH2 3.95Å; V399-W404 HydrophobicContact CG2-CZ2 3.44Å; V399-W404 VanDerWaalsContact CG2-CZ2 3.44Å; V399-W404 PolarHBondContact O-N 3.33Å
400	M	88.8	Confident	79.8	Confident	8 Å²	8	29.4 Å²	29.4	4%	0.039	15%	0.15	C	C	.	.	H	α-helix	trans	-69.6	-43.8	176.1	-169.9	64.6	-173.9	0	0	111.3	Y396 V397 M398 N403	Y396-M400 VanDerWaalsContact O-CB 3.23Å; Y396-M400 WeakPolarHBondContact O-CB 3.41Å; Y396-M400 PolarHBondContact O-N 2.98Å; V397-M400 PolarHBondContact O-N 3.22Å; M398-M400 VanDerWaalsContact C-N 3.3Å; M398-M400 PolarHBondContact O-N 3.05Å; M400-N403 PolarHBondContact O-N 2.97Å
401	L	86.8	Confident	77.8	Confident	7 Å²	7	30.6 Å²	30.6	4%	0.037	16%	0.156	C	C	.	.	H	α-helix	trans	-71.1	-33.3	178.1	-74.9	-179.3	0	0	0	112.9	V49 L52 V94 F312 I316 I320 V397 M398 N403	V49-L401 HydrophobicContact CG2-CD1 4.38Å; V49-L401 HydrophobicContact CG2-CD2 3.94Å; L52-L401 HydrophobicContact CD1-CB 4.04Å; L52-L401 HydrophobicContact CD1-CD2 4.05Å; L52-L401 HydrophobicContact CD1-CG 4.46Å; V94-L401 HydrophobicContact CG1-CB 4.13Å; V94-L401 HydrophobicContact CG1-CD1 4.18Å; F312-L401 HydrophobicContact CE2-CD2 4.09Å; I316-L401 HydrophobicContact CG2-CD2 4.12Å; I320-L401 HydrophobicContact CD1-CD2 3.52Å; I320-L401 HydrophobicContact CG1-CD2 4.4Å; V397-L401 HydrophobicContact CG1-CD1 3.71Å; V397-L401 HydrophobicContact CG1-CG 4.33Å; V397-L401 WeakPolarHBondContact O-CB 3.25Å; V397-L401 VanDerWaalsContact O-CG 3.32Å; V397-L401 WeakPolarHBondContact O-CG 3.4Å; V397-L401 PolarHBondContact O-N 3.45Å; M398-L401 PolarHBondContact O-N 3.46Å; L401-N403 PolarHBondContact O-N 3.04Å
402	T	81.1	Confident	75.5	Confident	1 Å²	1	38 Å²	38	1%	0.006	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86	11.7	173.4	68.3	0	0	0	0	112.6	F91 V94 Y95 M398 W404 L405	F91-T402 HydrophobicContact CB-CG2 4.39Å; F91-T402 HydrophobicContact CD1-CG2 3.79Å; F91-T402 HydrophobicContact CE1-CG2 4.34Å; F91-T402 HydrophobicContact CG-CG2 4.28Å; V94-T402 HydrophobicContact CG1-CG2 4.24Å; Y95-T402 HydrophobicContact CD2-CG2 4.31Å; Y95-T402 HydrophobicContact CE2-CG2 3.72Å; M398-T402 VanDerWaalsContact O-CG2 3.32Å; M398-T402 WeakPolarHBondContact O-CG2 3.38Å; M398-T402 PolarHBondContact O-N 3.41Å; M398-T402 PolarHBondContact O-OG1 3.23Å; M398-T402 VanDerWaalsContact O-OG1 3.06Å; T402-W404 PolarHBondContact O-N 3.23Å; T402-W404 VanDerWaalsContact O-N 3.07Å; T402-L405 VanDerWaalsContact O-CB 3.29Å; T402-L405 WeakPolarHBondContact O-CB 3.5Å; T402-L405 WeakPolarHBondContact O-CD1 3.42Å; T402-L405 VanDerWaalsContact O-CG 3.25Å; T402-L405 WeakPolarHBondContact O-CG 3.32Å; T402-L405 PolarHBondContact O-N 3.37Å
403	N	77.9	Confident	73.2	Confident	24 Å²	24	39.8 Å²	39.8	13%	0.128	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.6	38.4	-179.2	-158.9	15.8	0	0	0	114	N285 I316 V399 M400 L401 L405 N417 R424	N285-N403 PolarHBondContact ND2-OD1 3.34Å; N285-N403 PolarHBondContact OD1-ND2 2.87Å; N285-N403 PolarHBondContact OD1-OD1 2.99Å; I316-N403 HydrophobicContact CD1-CB 4.47Å; V399-N403 CarbonylContact O-C 3.35Å; V399-N403 PolarHBondContact O-N 3.48Å; M400-N403 PolarHBondContact O-N 2.97Å; L401-N403 PolarHBondContact O-N 3.04Å; N403-L405 HydrophobicContact CB-CD1 4.46Å; N403-L405 HydrophobicContact CB-CG 4.33Å; N403-L405 PolarHBondContact O-N 3.34Å; N403-N417 PolarHBondContact ND2-ND2 3.27Å; N403-N417 VanDerWaalsContact ND2-ND2 3.18Å; N403-N417 PolarHBondContact O-ND2 3.04Å; N403-N417 PolarHBondContact O-OD1 3.45Å; N403-N417 VanDerWaalsContact O-OD1 3.06Å; N403-N417 PolarHBondContact OD1-ND2 3.06Å; N403-N417 VanDerWaalsContact OD1-ND2 3.1Å; N403-R424 PolarHBondContact OD1-NH2 3.12Å
404	W	76	Confident	71	Confident	7 Å²	7	41.4 Å²	41.4	3%	0.027	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	23.4	-179.7	-63.2	75.2	0	0	0	114.7	M161 S165 I168 V399 T402 A419 V423	M161-W404 HydrophobicContact CB-CE3 4.48Å; M161-W404 HydrophobicContact CB-CZ3 4.12Å; M161-W404 HydrophobicContact CE-CE3 4.14Å; M161-W404 HydrophobicContact CG-CE3 4.14Å; M161-W404 HydrophobicContact CG-CZ3 4.28Å; S165-W404 WeakPolarHBondContact OG-CH2 3.25Å; I168-W404 HydrophobicContact CD1-CH2 4.07Å; I168-W404 HydrophobicContact CD1-CZ2 3.63Å; V399-W404 HydrophobicContact CB-CD2 4.1Å; V399-W404 HydrophobicContact CB-CE3 4.48Å; V399-W404 HydrophobicContact CB-CG 4.46Å; V399-W404 HydrophobicContact CB-CZ2 4.21Å; V399-W404 HydrophobicContact CG2-CD2 4.23Å; V399-W404 HydrophobicContact CG2-CH2 3.95Å; V399-W404 HydrophobicContact CG2-CZ2 3.44Å; V399-W404 VanDerWaalsContact CG2-CZ2 3.44Å; V399-W404 PolarHBondContact O-N 3.33Å; T402-W404 PolarHBondContact O-N 3.23Å; T402-W404 VanDerWaalsContact O-N 3.07Å; W404-A419 HydrophobicContact CB-CB 4.31Å; W404-V423 HydrophobicContact CD2-CG2 4.42Å; W404-V423 HydrophobicContact CE3-CG2 3.97Å; W404-V423 HydrophobicContact CH2-CG1 3.93Å; W404-V423 HydrophobicContact CH2-CG2 4.2Å; W404-V423 HydrophobicContact CZ2-CG1 3.79Å; W404-V423 HydrophobicContact CZ3-CG1 4.39Å; W404-V423 HydrophobicContact CZ3-CG2 3.85Å
405	L	68.1	Low	68.7	Low	20 Å²	20	45.1 Å²	45.1	11%	0.105	23%	0.23	C	C	.	.			trans	-72.8	139.4	-177.6	-67.9	169.2	0	0	0	111.8	F91 M157 T402 N403 L414 N417	F91-L405 HydrophobicContact CE2-CD1 3.66Å; F91-L405 HydrophobicContact CZ-CD1 3.55Å; M157-L405 VanDerWaalsContact SD-O 3.36Å; T402-L405 VanDerWaalsContact O-CB 3.29Å; T402-L405 WeakPolarHBondContact O-CB 3.5Å; T402-L405 WeakPolarHBondContact O-CD1 3.42Å; T402-L405 VanDerWaalsContact O-CG 3.25Å; T402-L405 WeakPolarHBondContact O-CG 3.32Å; T402-L405 PolarHBondContact O-N 3.37Å; N403-L405 HydrophobicContact CB-CD1 4.46Å; N403-L405 HydrophobicContact CB-CG 4.33Å; N403-L405 PolarHBondContact O-N 3.34Å; L405-L414 HydrophobicContact CD1-CD2 4.4Å; L405-L414 WeakPolarHBondContact CD2-O 3.43Å; L405-N417 HydrophobicContact CD2-CB 4.19Å
406	K	60.8	Low	66.6	Low	103 Å²	103	47.7 Å²	47.7	45%	0.448	25%	0.248	S	C	.	.			trans	-87.9	120.9	167.1	-65.6	-178.9	-178.5	178	0	108.8	M157 Q408	M157-K406 HydrophobicContact CE-CG 4.41Å; M157-K406 HydrophobicContact SD-CB 4.28Å; M157-K406 HydrophobicContact SD-CG 4.14Å; K406-Q408 HydrophobicContact CB-CG 4.47Å; K406-Q408 PolarHBondContact O-N 3.27Å
407	P	52.1	Low	65.3	Low	52 Å²	52	47.4 Å²	47.4	34%	0.338	25%	0.248	S	C	.	.			trans	-70.6	89.2	168.3	24.9	-22.4	0	0	0	107.8	T153 N154 M157	T153-P407 HydrophobicContact CG2-CG 4.33Å; N154-P407 WeakPolarHBondContact OD1-CG 3.47Å; M157-P407 WeakPolarHBondContact SD-CD 3.49Å; M157-P407 HydrophobicContact SD-CG 4.24Å
408	Q	50.3	Low	64.5	Low	113 Å²	113	49.9 Å²	49.9	53%	0.528	27%	0.265	S	S	.	.			trans	-106.7	148.1	161.8	-69.7	-172.7	-6.2	0	0	108	K406 D410	K406-Q408 HydrophobicContact CB-CG 4.47Å; K406-Q408 PolarHBondContact O-N 3.27Å; Q408-D410 PolarHBondContact O-N 3.37Å
409	N	43.9	Very low	64	Low	159 Å²	159	51 Å²	51	85%	0.85	28%	0.275	S	S	*	.	S	Bend	trans	-60.6	-7.3	-164.9	-66.3	-17.7	0	0	0	115.8
410	D	49.2	Very low	63.7	Low	74 Å²	74	51 Å²	51	40%	0.396	28%	0.275	S	S	.	.			trans	-106.2	117.5	179	-159.5	-2.1	0	0	0	109.6	Q408 K412 T413 L414	Q408-D410 PolarHBondContact O-N 3.37Å; D410-K412 PolarHBondContact O-N 3.02Å; D410-K412 VanDerWaalsContact O-N 3.1Å; D410-K412 PolarHBondContact OD1-N 2.96Å; D410-T413 WeakPolarHBondContact CB-OG1 3.34Å; D410-T413 WeakPolarHBondContact O-CA 3.49Å; D410-T413 WeakPolarHBondContact O-CB 3.37Å; D410-T413 PolarHBondContact O-N 3.12Å; D410-T413 PolarHBondContact O-OG1 3.45Å; D410-L414 PolarHBondContact O-N 3.44Å
411	L	51.8	Low	63.6	Low	29 Å²	29	51.2 Å²	51.2	15%	0.152	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-23.8	174.4	-154.6	84.3	0	0	0	110.5	L83 N84 V308 T413 L414	L83-L411 HydrophobicContact CD2-CD2 3.79Å; N84-L411 WeakPolarHBondContact OD1-CD1 3.08Å; V308-L411 HydrophobicContact CB-CD1 4.44Å; V308-L411 HydrophobicContact CB-CD2 3.75Å; V308-L411 HydrophobicContact CB-CG 4.08Å; V308-L411 HydrophobicContact CG2-CD1 4.48Å; V308-L411 HydrophobicContact CG2-CD2 3.23Å; V308-L411 HydrophobicContact CG2-CG 3.61Å; L411-T413 VanDerWaalsContact C-N 3.28Å; L411-T413 PolarHBondContact O-N 3.29Å; L411-L414 HydrophobicContact CB-CD1 4.38Å; L411-L414 HydrophobicContact CD1-CD1 3.22Å; L411-L414 HydrophobicContact CD1-CG 4.48Å; L411-L414 HydrophobicContact CG-CD1 3.78Å; L411-L414 WeakPolarHBondContact O-CB 3.28Å; L411-L414 PolarHBondContact O-N 2.03Å
412	K	46.6	Very low	63.8	Low	169 Å²	169	56.3 Å²	56.3	74%	0.735	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-29.5	169.3	-71.3	-177.7	173.4	-177.6	0	113.2	D410	D410-K412 PolarHBondContact O-N 3.02Å; D410-K412 VanDerWaalsContact O-N 3.1Å; D410-K412 PolarHBondContact OD1-N 2.96Å
413	T	47.3	Very low	64.3	Low	44 Å²	44	57.6 Å²	57.6	27%	0.27	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-81.8	-14.4	174.4	-13.1	0	0	0	0	112.9	D410 L411 V415 S416	D410-T413 WeakPolarHBondContact CB-OG1 3.34Å; D410-T413 WeakPolarHBondContact O-CA 3.49Å; D410-T413 WeakPolarHBondContact O-CB 3.37Å; D410-T413 PolarHBondContact O-N 3.12Å; D410-T413 PolarHBondContact O-OG1 3.45Å; L411-T413 VanDerWaalsContact C-N 3.28Å; L411-T413 PolarHBondContact O-N 3.29Å; T413-V415 PolarHBondContact O-N 3.35Å; T413-S416 PolarHBondContact O-N 2.86Å; T413-S416 PolarHBondContact O-OG 3.42Å
414	L	49.1	Very low	65	Low	34 Å²	34	57 Å²	57	18%	0.178	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-65.2	-16.9	170.3	-67.8	172.3	0	0	0	112.5	L405 D410 L411	L405-L414 HydrophobicContact CD1-CD2 4.4Å; L405-L414 WeakPolarHBondContact CD2-O 3.43Å; D410-L414 PolarHBondContact O-N 3.44Å; L411-L414 HydrophobicContact CB-CD1 4.38Å; L411-L414 HydrophobicContact CD1-CD1 3.22Å; L411-L414 HydrophobicContact CD1-CG 4.48Å; L411-L414 HydrophobicContact CG-CD1 3.78Å; L411-L414 WeakPolarHBondContact O-CB 3.28Å; L411-L414 PolarHBondContact O-N 2.03Å
415	V	48.3	Very low	65.9	Low	79 Å²	79	56.7 Å²	56.7	48%	0.479	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-79.3	-21.1	171.5	-175.6	0	0	0	0	111.4	L295 T413 N417	L295-V415 HydrophobicContact CD2-CG1 4.13Å; T413-V415 PolarHBondContact O-N 3.35Å; V415-N417 VanDerWaalsContact C-N 3.33Å; V415-N417 PolarHBondContact O-N 2.97Å
416	S	51.7	Low	67.1	Low	60 Å²	60	58.8 Å²	58.8	42%	0.42	31%	0.311	S	S	.	.			trans	-85	67.9	-177	93.9	0	0	0	0	112.5	H287 T413 S418	H287-S416 VanDerWaalsContact CE1-CA 3.48Å; H287-S416 WeakPolarHBondContact CE1-CA 3.26Å; H287-S416 WeakPolarHBondContact NE2-CA 3.25Å; T413-S416 PolarHBondContact O-N 2.86Å; T413-S416 PolarHBondContact O-OG 3.42Å; S416-S418 VanDerWaalsContact C-N 3.26Å; S416-S418 PolarHBondContact O-N 2.96Å
417	N	66.8	Low	68.8	Low	7 Å²	7	54.5 Å²	54.5	4%	0.037	29%	0.293	C	S	.	.			trans	-81.5	54.1	175.7	-166.8	4.1	0	0	0	114.6	N285 H287 N403 L405 V415 A419 G420 F421	N285-N417 HydrophobicContact CB-CB 4.46Å; N285-N417 PolarHBondContact ND2-ND2 3.03Å; N285-N417 PolarHBondContact OD1-ND2 3.26Å; H287-N417 PolarHBondContact NE2-N 3.05Å; N403-N417 PolarHBondContact ND2-ND2 3.27Å; N403-N417 VanDerWaalsContact ND2-ND2 3.18Å; N403-N417 PolarHBondContact O-ND2 3.04Å; N403-N417 PolarHBondContact O-OD1 3.45Å; N403-N417 VanDerWaalsContact O-OD1 3.06Å; N403-N417 PolarHBondContact OD1-ND2 3.06Å; N403-N417 VanDerWaalsContact OD1-ND2 3.1Å; L405-N417 HydrophobicContact CD2-CB 4.19Å; V415-N417 VanDerWaalsContact C-N 3.33Å; V415-N417 PolarHBondContact O-N 2.97Å; N417-A419 PolarHBondContact O-N 2.91Å; N417-G420 PolarHBondContact O-N 3.12Å; N417-G420 WeakPolarHBondContact OD1-CA 3.38Å; N417-G420 PolarHBondContact OD1-N 3.45Å; N417-F421 PolarHBondContact O-N 3.11Å; N417-F421 VanDerWaalsContact O-N 3.16Å
418	S	76.3	Confident	70.9	Confident	56 Å²	56	52 Å²	52	39%	0.392	28%	0.277	S	S	.	.	H	α-helix	trans	-62.7	-35.7	-178	-67.4	0	0	0	0	111.4	H287 S416 F421 W422	H287-S418 PolarHBondContact CE1-N 3.24Å; H287-S418 PolarHBondContact CE1-OG 3.11Å; H287-S418 WeakPolarHBondContact NE2-CA 3.43Å; H287-S418 PolarHBondContact NE2-N 3.35Å; S416-S418 VanDerWaalsContact C-N 3.26Å; S416-S418 PolarHBondContact O-N 2.96Å; S418-F421 PolarHBondContact O-N 3.42Å; S418-W422 VanDerWaalsContact O-CD1 3.28Å; S418-W422 PolarHBondContact O-N 3.37Å
419	A	81.3	Confident	73.1	Confident	25 Å²	25	50.7 Å²	50.7	21%	0.207	27%	0.268	C	S	.	.	H	α-helix	trans	-63.8	-51.4	-178.9	0	0	0	0	0	110.5	M161 W404 N417 F421 W422 V423	M161-A419 HydrophobicContact CE-CB 3.9Å; W404-A419 HydrophobicContact CB-CB 4.31Å; N417-A419 PolarHBondContact O-N 2.91Å; A419-F421 VanDerWaalsContact C-N 3.3Å; A419-F421 PolarHBondContact O-N 3.13Å; A419-W422 PolarHBondContact O-N 3.4Å; A419-V423 VanDerWaalsContact O-CB 3.27Å; A419-V423 WeakPolarHBondContact O-CB 3.03Å; A419-V423 WeakPolarHBondContact O-CG2 3.13Å; A419-V423 PolarHBondContact O-N 3.46Å
420	G	83.2	Confident	75.6	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.5	-34.9	178.6	0	0	0	0	0	113.3	N417 R424	N417-G420 PolarHBondContact O-N 3.12Å; N417-G420 WeakPolarHBondContact OD1-CA 3.38Å; N417-G420 PolarHBondContact OD1-N 3.45Å; G420-R424 WeakPolarHBondContact O-CD 3.28Å; G420-R424 VanDerWaalsContact O-CG 3.29Å; G420-R424 WeakPolarHBondContact O-CG 3.39Å; G420-R424 PolarHBondContact O-N 2.77Å
421	F	87.9	Confident	77.9	Confident	12 Å²	12	42.1 Å²	42.1	5%	0.053	22%	0.224	C	C	.	.	H	α-helix	trans	-60.3	-59.2	172.7	176.3	-89.9	0	0	0	111.2	L232 L236 G282 L283 N285 N417 S418 A419 R424 I425	L232-F421 HydrophobicContact CD2-CZ 4.31Å; L236-F421 HydrophobicContact CD1-CE1 4.06Å; L236-F421 HydrophobicContact CD1-CE2 4.47Å; L236-F421 HydrophobicContact CD1-CZ 3.49Å; L236-F421 VanDerWaalsContact CD1-CZ 3.49Å; G282-F421 WeakPolarHBondContact O-CD2 3.3Å; L283-F421 HydrophobicContact CD2-CE2 3.88Å; L283-F421 HydrophobicContact CD2-CZ 4.4Å; N285-F421 HydrophobicContact CB-CB 4.22Å; N417-F421 PolarHBondContact O-N 3.11Å; N417-F421 VanDerWaalsContact O-N 3.16Å; S418-F421 PolarHBondContact O-N 3.42Å; A419-F421 VanDerWaalsContact C-N 3.3Å; A419-F421 PolarHBondContact O-N 3.13Å; F421-R424 PolarHBondContact O-N 2.88Å; F421-I425 HydrophobicContact CE1-CG1 4.28Å; F421-I425 HydrophobicContact CZ-CG1 4.38Å; F421-I425 WeakPolarHBondContact O-CG1 3.17Å; F421-I425 PolarHBondContact O-N 3.14Å
422	W	90.8	Very high	80	Confident	114 Å²	114	41.1 Å²	41.1	43%	0.432	22%	0.218	S	C	.	.	H	α-helix	trans	-69.9	-37.3	-173.8	-78	112.1	0	0	0	113.2	S418 A419 R424 I425 V426	S418-W422 VanDerWaalsContact O-CD1 3.28Å; S418-W422 PolarHBondContact O-N 3.37Å; A419-W422 PolarHBondContact O-N 3.4Å; W422-R424 VanDerWaalsContact C-N 3.26Å; W422-R424 PolarHBondContact O-N 3.1Å; W422-I425 HydrophobicContact CE3-CG2 4.47Å; W422-I425 HydrophobicContact CZ3-CG2 4.45Å; W422-I425 PolarHBondContact O-N 2.95Å; W422-V426 WeakPolarHBondContact O-CB 3.32Å; W422-V426 VanDerWaalsContact O-CG2 3.31Å; W422-V426 WeakPolarHBondContact O-CG2 3.46Å; W422-V426 PolarHBondContact O-N 3.43Å
423	V	91	Very high	82.3	Confident	29 Å²	29	35 Å²	35	18%	0.176	20%	0.203	C	C	.	.	H	α-helix	trans	-56.7	-43.8	176.8	166.9	0	0	0	0	110.2	I168 W404 A419 S427	I168-V423 HydrophobicContact CD1-CG1 3.39Å; W404-V423 HydrophobicContact CD2-CG2 4.42Å; W404-V423 HydrophobicContact CE3-CG2 3.97Å; W404-V423 HydrophobicContact CH2-CG1 3.93Å; W404-V423 HydrophobicContact CH2-CG2 4.2Å; W404-V423 HydrophobicContact CZ2-CG1 3.79Å; W404-V423 HydrophobicContact CZ3-CG1 4.39Å; W404-V423 HydrophobicContact CZ3-CG2 3.85Å; A419-V423 VanDerWaalsContact O-CB 3.27Å; A419-V423 WeakPolarHBondContact O-CB 3.03Å; A419-V423 WeakPolarHBondContact O-CG2 3.13Å; A419-V423 PolarHBondContact O-N 3.46Å; V423-S427 WeakPolarHBondContact O-CB 3.24Å; V423-S427 PolarHBondContact O-N 3.08Å; V423-S427 PolarHBondContact O-OG 3.3Å
424	R	92	Very high	84.5	Confident	11 Å²	11	34.5 Å²	34.5	4%	0.042	20%	0.199	C	C	.	.	H	α-helix	trans	-70.4	-40.7	-179.6	-68.4	172.5	178.6	167.4	2.3	112.8	S281 N285 H315 N403 G420 F421 W422 S427 S428	S281-R424 VanDerWaalsContact C-CD 3.4Å; S281-R424 WeakPolarHBondContact O-CD 2.91Å; S281-R424 PolarHBondContact O-NH1 2.85Å; S281-R424 VanDerWaalsContact OG-CD 3.25Å; S281-R424 WeakPolarHBondContact OG-CD 3.36Å; S281-R424 PolarHBondContact OG-NE 3.2Å; S281-R424 VanDerWaalsContact OG-NE 3.08Å; S281-R424 PolarHBondContact OG-NH1 3.2Å; N285-R424 PolarHBondContact ND2-NH1 3.34Å; N285-R424 PolarHBondContact OD1-NH1 3.45Å; H315-R424 VanDerWaalsContact CD2-CZ 3.44Å; H315-R424 PolarHBondContact CD2-NH1 2.76Å; H315-R424 PolarHBondContact CD2-NH2 3.06Å; H315-R424 PolarHBondContact NE2-NH1 3.1Å; H315-R424 PolarHBondContact NE2-NH2 3.39Å; H315-R424 VanDerWaalsContact NE2-NH2 3.13Å; N403-R424 PolarHBondContact OD1-NH2 3.12Å; G420-R424 WeakPolarHBondContact O-CD 3.28Å; G420-R424 VanDerWaalsContact O-CG 3.29Å; G420-R424 WeakPolarHBondContact O-CG 3.39Å; G420-R424 PolarHBondContact O-N 2.77Å; F421-R424 PolarHBondContact O-N 2.88Å; W422-R424 VanDerWaalsContact C-N 3.26Å; W422-R424 PolarHBondContact O-N 3.1Å; R424-S427 PolarHBondContact O-N 2.92Å; R424-S428 PolarHBondContact O-N 3.5Å
425	I	94.5	Very high	86.6	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.8	-49.4	176.4	-64	-60.8	0	0	0	110.9	L236 F421 W422 S427 S428 W429	L236-I425 HydrophobicContact CD1-CD1 4.18Å; L236-I425 HydrophobicContact CD1-CG1 4.25Å; L236-I425 HydrophobicContact CD2-CG2 3.83Å; F421-I425 HydrophobicContact CE1-CG1 4.28Å; F421-I425 HydrophobicContact CZ-CG1 4.38Å; F421-I425 WeakPolarHBondContact O-CG1 3.17Å; F421-I425 PolarHBondContact O-N 3.14Å; W422-I425 HydrophobicContact CE3-CG2 4.47Å; W422-I425 HydrophobicContact CZ3-CG2 4.45Å; W422-I425 PolarHBondContact O-N 2.95Å; I425-S427 VanDerWaalsContact C-N 3.29Å; I425-S427 PolarHBondContact O-N 3.22Å; I425-S428 WeakPolarHBondContact O-CB 3.49Å; I425-S428 PolarHBondContact O-N 2.02Å; I425-S428 VanDerWaalsContact O-N 3.08Å; I425-S428 PolarHBondContact O-OG 3.18Å; I425-W429 HydrophobicContact CG2-CH2 4.03Å; I425-W429 HydrophobicContact CG2-CZ2 3.65Å; I425-W429 PolarHBondContact O-N 3.4Å
426	V	94.9	Very high	88.8	Confident	65 Å²	65	30.7 Å²	30.7	39%	0.394	18%	0.177	S	C	.	.	H	α-helix	trans	-62.4	-40.2	176.8	174.2	0	0	0	0	110.6	W422 S428 W429 V430	W422-V426 WeakPolarHBondContact O-CB 3.32Å; W422-V426 VanDerWaalsContact O-CG2 3.31Å; W422-V426 WeakPolarHBondContact O-CG2 3.46Å; W422-V426 PolarHBondContact O-N 3.43Å; V426-S428 PolarHBondContact O-N 2.97Å; V426-W429 PolarHBondContact O-N 3.03Å; V426-V430 HydrophobicContact CG1-CG2 4.16Å; V426-V430 WeakPolarHBondContact O-CG2 3.48Å; V426-V430 PolarHBondContact O-N 2.96Å
427	S	95.2	Very high	90.7	Very high	12 Å²	12	34.8 Å²	34.8	8%	0.084	18%	0.183	C	C	.	.	H	α-helix	trans	-59.6	-34.3	175.1	-61.2	0	0	0	0	112.6	I168 L172 V423 R424 I425 W429 V430 C431	I168-S427 VanDerWaalsContact CG2-OG 3.29Å; I168-S427 WeakPolarHBondContact CG2-OG 3.49Å; L172-S427 WeakPolarHBondContact CD1-O 3.42Å; V423-S427 WeakPolarHBondContact O-CB 3.24Å; V423-S427 PolarHBondContact O-N 3.08Å; V423-S427 PolarHBondContact O-OG 3.3Å; R424-S427 PolarHBondContact O-N 2.92Å; I425-S427 VanDerWaalsContact C-N 3.29Å; I425-S427 PolarHBondContact O-N 3.22Å; S427-W429 VanDerWaalsContact C-N 3.34Å; S427-W429 PolarHBondContact O-N 3.03Å; S427-V430 PolarHBondContact O-N 2.92Å; S427-C431 VanDerWaalsContact O-CB 3.28Å; S427-C431 WeakPolarHBondContact O-CB 3.5Å; S427-C431 PolarHBondContact O-N 3.46Å
428	S	96.5	Very high	91.7	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.9	-38.2	175	74.7	0	0	0	0	112.5	N240 R424 I425 V426 C431 L432	N240-S428 PolarHBondContact ND2-OG 2.9Å; N240-S428 VanDerWaalsContact ND2-OG 3.13Å; R424-S428 PolarHBondContact O-N 3.5Å; I425-S428 WeakPolarHBondContact O-CB 3.49Å; I425-S428 PolarHBondContact O-N 2.02Å; I425-S428 VanDerWaalsContact O-N 3.08Å; I425-S428 PolarHBondContact O-OG 3.18Å; V426-S428 PolarHBondContact O-N 2.97Å; S428-C431 WeakPolarHBondContact O-CB 3.4Å; S428-C431 PolarHBondContact O-N 2.95Å; S428-L432 WeakPolarHBondContact O-CG 3.24Å; S428-L432 PolarHBondContact O-N 3.22Å; S428-L432 VanDerWaalsContact O-N 3.13Å
429	W	97.2	Very high	92.3	Very high	86 Å²	86	33.2 Å²	33.2	33%	0.326	17%	0.172	S	C	.	.	H	α-helix	trans	-73.4	-39.6	177.1	-57.1	-20.8	0	0	0	111.8	L236 L239 N240 F243 I425 V426 S427 C431 L432 G433	L236-W429 HydrophobicContact CD2-CH2 4.5Å; L236-W429 HydrophobicContact CD2-CZ2 3.98Å; L239-W429 HydrophobicContact CD2-CZ2 3.81Å; N240-W429 PolarHBondContact OD1-NE1 3.5Å; F243-W429 AromaticContact CD2-CD1 3.97Å; F243-W429 AromaticContact CE2-CD1 3.93Å; F243-W429 HydrophobicContact CE2-CG 4.4Å; I425-W429 HydrophobicContact CG2-CH2 4.03Å; I425-W429 HydrophobicContact CG2-CZ2 3.65Å; I425-W429 PolarHBondContact O-N 3.4Å; V426-W429 PolarHBondContact O-N 3.03Å; S427-W429 VanDerWaalsContact C-N 3.34Å; S427-W429 PolarHBondContact O-N 3.03Å; W429-C431 VanDerWaalsContact C-N 3.31Å; W429-C431 PolarHBondContact O-N 3.44Å; W429-L432 PolarHBondContact O-N 3.46Å; W429-G433 PolarHBondContact O-N 3.16Å
430	V	96.6	Very high	92.6	Very high	53 Å²	53	34.4 Å²	34.4	32%	0.321	17%	0.174	S	C	.	.	H	α-helix	trans	-61.7	-41.7	173.7	173.9	0	0	0	0	110.3	L172 V426 S427 G433 I434	L172-V430 HydrophobicContact CD1-CB 4.03Å; L172-V430 HydrophobicContact CD1-CG1 3.8Å; V426-V430 HydrophobicContact CG1-CG2 4.16Å; V426-V430 WeakPolarHBondContact O-CG2 3.48Å; V426-V430 PolarHBondContact O-N 2.96Å; S427-V430 PolarHBondContact O-N 2.92Å; V430-G433 PolarHBondContact O-N 3.03Å; V430-I434 HydrophobicContact CG1-CD1 3.64Å; V430-I434 HydrophobicContact CG1-CG1 4.27Å; V430-I434 WeakPolarHBondContact O-CB 3.31Å; V430-I434 WeakPolarHBondContact O-CD1 3.38Å; V430-I434 VanDerWaalsContact O-CG1 3.23Å; V430-I434 WeakPolarHBondContact O-CG1 3.48Å; V430-I434 PolarHBondContact O-N 3.47Å
431	C	96.6	Very high	92.8	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-58.6	-50.2	176	-172.8	0	0	0	0	111.7	L172 V275 S427 S428 W429 G433 I434 Y435	L172-C431 HydrophobicContact CD1-CB 4.09Å; L172-C431 HydrophobicContact CD2-CB 3.76Å; L172-C431 HydrophobicContact CG-CB 4.39Å; V275-C431 HydrophobicContact CG2-CB 4.48Å; S427-C431 VanDerWaalsContact O-CB 3.28Å; S427-C431 WeakPolarHBondContact O-CB 3.5Å; S427-C431 PolarHBondContact O-N 3.46Å; S428-C431 WeakPolarHBondContact O-CB 3.4Å; S428-C431 PolarHBondContact O-N 2.95Å; W429-C431 VanDerWaalsContact C-N 3.31Å; W429-C431 PolarHBondContact O-N 3.44Å; C431-G433 VanDerWaalsContact C-N 3.34Å; C431-G433 PolarHBondContact O-N 3.09Å; C431-I434 PolarHBondContact O-N 3.2Å; C431-Y435 WeakPolarHBondContact O-CB 3.21Å; C431-Y435 PolarHBondContact O-N 3.02Å
432	L	96	Very high	92.6	Very high	8 Å²	8	35 Å²	35	4%	0.042	18%	0.179	C	C	.	.	H	α-helix	trans	-62.9	-41.6	176.7	-71.1	165.7	0	0	0	111.8	F243 A247 I271 V275 S428 W429 Y435 V436	F243-L432 HydrophobicContact CB-CD1 3.48Å; F243-L432 VanDerWaalsContact CB-CD1 3.48Å; F243-L432 HydrophobicContact CD2-CD1 4.15Å; F243-L432 HydrophobicContact CG-CD1 4.34Å; A247-L432 HydrophobicContact CB-CD2 4.12Å; I271-L432 HydrophobicContact CG2-CD2 4Å; V275-L432 HydrophobicContact CG1-CD1 4.12Å; V275-L432 HydrophobicContact CG2-CD1 4.07Å; V275-L432 HydrophobicContact CG2-CD2 3.92Å; V275-L432 HydrophobicContact CG2-CG 3.71Å; S428-L432 WeakPolarHBondContact O-CG 3.24Å; S428-L432 PolarHBondContact O-N 3.22Å; S428-L432 VanDerWaalsContact O-N 3.13Å; W429-L432 PolarHBondContact O-N 3.46Å; L432-Y435 PolarHBondContact O-N 3.08Å; L432-V436 WeakPolarHBondContact O-CB 2.95Å; L432-V436 VanDerWaalsContact O-CG2 3.3Å; L432-V436 WeakPolarHBondContact O-CG2 3.23Å; L432-V436 PolarHBondContact O-N 3.17Å
433	G	95.4	Very high	92.1	Very high	41 Å²	41	31 Å²	31	42%	0.423	17%	0.17	S	C	.	.	H	α-helix	trans	-60.6	-47.6	176.9	0	0	0	0	0	112.2	W429 V430 C431 W437	W429-G433 PolarHBondContact O-N 3.16Å; V430-G433 PolarHBondContact O-N 3.03Å; C431-G433 VanDerWaalsContact C-N 3.34Å; C431-G433 PolarHBondContact O-N 3.09Å; G433-W437 WeakPolarHBondContact O-CB 3.37Å; G433-W437 PolarHBondContact O-N 3.19Å
434	I	93.5	Very high	91.8	Very high	33 Å²	33	34.7 Å²	34.7	17%	0.169	19%	0.188	C	C	.	.	H	α-helix	trans	-60.4	-48.4	175.7	-67.7	162.1	0	0	0	110.1	V169 L172 I173 V176 V430 C431 W437 T438	V169-I434 HydrophobicContact CG1-CD1 4.48Å; L172-I434 HydrophobicContact CB-CD1 3.99Å; I173-I434 HydrophobicContact CG1-CD1 3.93Å; I173-I434 HydrophobicContact CG1-CG2 4.19Å; V176-I434 HydrophobicContact CB-CG2 4.38Å; V176-I434 HydrophobicContact CG1-CG2 4.39Å; V176-I434 HydrophobicContact CG2-CG2 4.13Å; V430-I434 HydrophobicContact CG1-CD1 3.64Å; V430-I434 HydrophobicContact CG1-CG1 4.27Å; V430-I434 WeakPolarHBondContact O-CB 3.31Å; V430-I434 WeakPolarHBondContact O-CD1 3.38Å; V430-I434 VanDerWaalsContact O-CG1 3.23Å; V430-I434 WeakPolarHBondContact O-CG1 3.48Å; V430-I434 PolarHBondContact O-N 3.47Å; C431-I434 PolarHBondContact O-N 3.2Å; I434-W437 PolarHBondContact O-N 3.02Å; I434-T438 HydrophobicContact CG2-CG2 4.42Å; I434-T438 WeakPolarHBondContact O-CG2 3.38Å; I434-T438 PolarHBondContact O-N 3.31Å
435	Y	93.8	Very high	91.4	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.3	-53.1	179.6	175.2	-112.8	0	0	0	112.3	V176 A247 S251 Q267 S268 I271 C431 L432 W437 T438 L439	V176-Y435 HydrophobicContact CG1-CD2 4.2Å; A247-Y435 HydrophobicContact CB-CD1 4.06Å; A247-Y435 HydrophobicContact CB-CE1 4.08Å; S251-Y435 WeakPolarHBondContact CB-OH 3.28Å; Q267-Y435 HydrophobicContact CB-CE2 4.05Å; Q267-Y435 HydrophobicContact CG-CE2 4.17Å; Q267-Y435 WeakPolarHBondContact CG-OH 3.47Å; S268-Y435 WeakPolarHBondContact CA-OH 3.35Å; S268-Y435 WeakPolarHBondContact CB-OH 3Å; S268-Y435 PolarHBondContact N-OH 3.27Å; I271-Y435 HydrophobicContact CB-CG 4.48Å; I271-Y435 HydrophobicContact CG1-CD1 4.41Å; I271-Y435 HydrophobicContact CG1-CD2 3.78Å; I271-Y435 HydrophobicContact CG1-CE2 4.19Å; I271-Y435 HydrophobicContact CG1-CG 3.9Å; I271-Y435 HydrophobicContact CG2-CD1 4.33Å; I271-Y435 HydrophobicContact CG2-CG 4.27Å; C431-Y435 WeakPolarHBondContact O-CB 3.21Å; C431-Y435 PolarHBondContact O-N 3.02Å; L432-Y435 PolarHBondContact O-N 3.08Å; Y435-W437 VanDerWaalsContact C-N 3.29Å; Y435-W437 PolarHBondContact O-N 3.19Å; Y435-T438 PolarHBondContact O-N 3.21Å; Y435-T438 VanDerWaalsContact O-N 3.1Å; Y435-T438 PolarHBondContact O-OG1 2.9Å; Y435-L439 HydrophobicContact CD1-CD1 4.34Å; Y435-L439 HydrophobicContact CE1-CD1 3.7Å; Y435-L439 HydrophobicContact CE2-CD1 4.17Å; Y435-L439 HydrophobicContact CE2-CG 4.38Å; Y435-L439 PolarHBondContact O-N 2.97Å
436	V	93	Very high	90.3	Very high	33 Å²	33	43 Å²	43	20%	0.2	23%	0.234	C	C	.	.	H	α-helix	trans	-61.5	-39.8	178.9	170.8	0	0	0	0	111	A247 I250 L432 T438 L439 I440	A247-V436 HydrophobicContact CB-CG2 3.9Å; I250-V436 HydrophobicContact CD1-CG1 3.95Å; I250-V436 HydrophobicContact CD1-CG2 4.35Å; L432-V436 WeakPolarHBondContact O-CB 2.95Å; L432-V436 VanDerWaalsContact O-CG2 3.3Å; L432-V436 WeakPolarHBondContact O-CG2 3.23Å; L432-V436 PolarHBondContact O-N 3.17Å; V436-T438 VanDerWaalsContact C-N 3.34Å; V436-T438 PolarHBondContact O-N 3.25Å; V436-L439 PolarHBondContact O-N 3.15Å; V436-I440 HydrophobicContact CG1-CD1 3.46Å; V436-I440 VanDerWaalsContact CG1-CD1 3.46Å; V436-I440 HydrophobicContact CG1-CG1 4.19Å; V436-I440 WeakPolarHBondContact O-CG1 3.39Å; V436-I440 PolarHBondContact O-N 2.73Å
437	W	91.6	Very high	88.9	Confident	146 Å²	146	47.8 Å²	47.8	55%	0.553	26%	0.257	S	S	*	.	H	α-helix	trans	-61	-41.7	174.7	-175.9	-102.3	0	0	0	112.1	G433 I434 Y435 L439 I440 A441 F445	G433-W437 WeakPolarHBondContact O-CB 3.37Å; G433-W437 PolarHBondContact O-N 3.19Å; I434-W437 PolarHBondContact O-N 3.02Å; Y435-W437 VanDerWaalsContact C-N 3.29Å; Y435-W437 PolarHBondContact O-N 3.19Å; W437-L439 PolarHBondContact O-N 3.25Å; W437-I440 PolarHBondContact O-N 2.71Å; W437-A441 HydrophobicContact CD2-CB 4.27Å; W437-A441 HydrophobicContact CG-CB 4.5Å; W437-A441 HydrophobicContact CZ2-CB 4.28Å; W437-A441 WeakPolarHBondContact O-CB 3.16Å; W437-A441 PolarHBondContact O-N 3.32Å; W437-F445 AromaticContact CH2-CE2 3.79Å; W437-F445 HydrophobicContact CH2-CE2 3.79Å; W437-F445 HydrophobicContact CH2-CZ 4.48Å; W437-F445 HydrophobicContact CZ2-CE2 4.09Å
438	T	88.9	Confident	87.2	Confident	30 Å²	30	55.4 Å²	55.4	18%	0.184	28%	0.284	C	S	.	.	H	α-helix	trans	-62	-30.8	176.9	64	0	0	0	0	113	V176 H180 M260 I434 Y435 V436 P442	V176-T438 HydrophobicContact CG1-CG2 4.12Å; H180-T438 PolarHBondContact NE2-OG1 3.48Å; M260-T438 WeakPolarHBondContact CE-O 3.48Å; I434-T438 HydrophobicContact CG2-CG2 4.42Å; I434-T438 WeakPolarHBondContact O-CG2 3.38Å; I434-T438 PolarHBondContact O-N 3.31Å; Y435-T438 PolarHBondContact O-N 3.21Å; Y435-T438 VanDerWaalsContact O-N 3.1Å; Y435-T438 PolarHBondContact O-OG1 2.9Å; V436-T438 VanDerWaalsContact C-N 3.34Å; V436-T438 PolarHBondContact O-N 3.25Å; T438-P442 WeakPolarHBondContact O-CD 3.48Å
439	L	88.2	Confident	85.2	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-79.2	-40.3	177	-63.7	176.3	0	0	0	112.9	I250 V256 M260 Y435 V436 W437	I250-L439 HydrophobicContact CG2-CB 4.32Å; I250-L439 HydrophobicContact CG2-CD1 4.1Å; V256-L439 HydrophobicContact CG1-CB 4.03Å; V256-L439 HydrophobicContact CG1-CD2 4.33Å; M260-L439 HydrophobicContact SD-CD2 4Å; Y435-L439 HydrophobicContact CD1-CD1 4.34Å; Y435-L439 HydrophobicContact CE1-CD1 3.7Å; Y435-L439 HydrophobicContact CE2-CD1 4.17Å; Y435-L439 HydrophobicContact CE2-CG 4.38Å; Y435-L439 PolarHBondContact O-N 2.97Å; V436-L439 PolarHBondContact O-N 3.15Å; W437-L439 PolarHBondContact O-N 3.25Å
440	I	88.7	Confident	82.8	Confident	50 Å²	50	62.3 Å²	62.3	26%	0.256	32%	0.323	S	S	.	.	H	α-helix	trans	-89.4	-31.9	-171.1	-63.7	178.8	0	0	0	112.3	I250 V436 W437 A443 L444	I250-I440 HydrophobicContact CD1-CD1 4.33Å; I250-I440 HydrophobicContact CG2-CD1 4.11Å; I250-I440 HydrophobicContact CG2-CG1 3.94Å; V436-I440 HydrophobicContact CG1-CD1 3.46Å; V436-I440 VanDerWaalsContact CG1-CD1 3.46Å; V436-I440 HydrophobicContact CG1-CG1 4.19Å; V436-I440 WeakPolarHBondContact O-CG1 3.39Å; V436-I440 PolarHBondContact O-N 2.73Å; W437-I440 PolarHBondContact O-N 2.71Å; I440-A443 WeakPolarHBondContact O-CB 3.3Å; I440-A443 PolarHBondContact O-N 3Å; I440-L444 HydrophobicContact CG2-CD1 3.48Å; I440-L444 VanDerWaalsContact CG2-CD1 3.48Å; I440-L444 HydrophobicContact CG2-CG 3.62Å; I440-L444 PolarHBondContact O-N 3.48Å
441	A	87.4	Confident	82.1	Confident	3 Å²	3	62.8 Å²	62.8	3%	0.025	32%	0.323	C	S	.	.	H	α-helix	trans	-56.1	-41.6	-175.5	0	0	0	0	0	113.8	W437 A443 L444 F445 F450	W437-A441 HydrophobicContact CD2-CB 4.27Å; W437-A441 HydrophobicContact CG-CB 4.5Å; W437-A441 HydrophobicContact CZ2-CB 4.28Å; W437-A441 WeakPolarHBondContact O-CB 3.16Å; W437-A441 PolarHBondContact O-N 3.32Å; A441-A443 VanDerWaalsContact C-N 3.26Å; A441-A443 PolarHBondContact O-N 3.39Å; A441-L444 PolarHBondContact O-N 2.73Å; A441-F445 PolarHBondContact O-N 3.2Å; A441-F450 HydrophobicContact CB-CE1 4.22Å; A441-F450 HydrophobicContact CB-CZ 4.07Å; A441-F450 WeakPolarHBondContact O-CE2 3.26Å
442	P	82.8	Confident	81.3	Confident	21 Å²	21	66.1 Å²	66.1	14%	0.136	34%	0.34	C	S	.	.	H	α-helix	trans	-60.8	-31.9	173.8	-25.8	37.3	0	0	0	114.1	H259 M260 T438 F450	H259-P442 HydrophobicContact CB-CB 4.07Å; M260-P442 HydrophobicContact CE-CG 3.94Å; T438-P442 WeakPolarHBondContact O-CD 3.48Å; P442-F450 HydrophobicContact CB-CD2 4.19Å; P442-F450 HydrophobicContact CB-CE2 4.48Å; P442-F450 HydrophobicContact CG-CD2 4.15Å
443	A	81.4	Confident	80.5	Confident	30 Å²	30	69.3 Å²	69.3	25%	0.248	36%	0.356	C	S	.	.	H	α-helix	trans	-81.3	-29.6	178.9	0	0	0	0	0	113.2	I440 A441	I440-A443 WeakPolarHBondContact O-CB 3.3Å; I440-A443 PolarHBondContact O-N 3Å; A441-A443 VanDerWaalsContact C-N 3.26Å; A441-A443 PolarHBondContact O-N 3.39Å
444	L	84.6	Confident	79.6	Confident	106 Å²	106	70.9 Å²	70.9	56%	0.555	35%	0.352	S	S	*	.	H	α-helix	trans	-83.2	-30.2	178	-71.9	179.2	0	0	0	113.4	I440 A441 P446	I440-L444 HydrophobicContact CG2-CD1 3.48Å; I440-L444 VanDerWaalsContact CG2-CD1 3.48Å; I440-L444 HydrophobicContact CG2-CG 3.62Å; I440-L444 PolarHBondContact O-N 3.48Å; A441-L444 PolarHBondContact O-N 2.73Å; L444-P446 VanDerWaalsContact C-CD 3.41Å; L444-P446 WeakPolarHBondContact O-CD 3.07Å
445	F	83.4	Confident	78.7	Confident	99 Å²	99	73.3 Å²	73.3	43%	0.434	36%	0.364	S	S	.	.			trans	-124.7	65.6	-178.6	-55.4	-76	0	0	0	110.6	W437 A441 D447 R448 F450	W437-F445 AromaticContact CH2-CE2 3.79Å; W437-F445 HydrophobicContact CH2-CE2 3.79Å; W437-F445 HydrophobicContact CH2-CZ 4.48Å; W437-F445 HydrophobicContact CZ2-CE2 4.09Å; A441-F445 PolarHBondContact O-N 3.2Å; F445-D447 PolarHBondContact O-N 3.01Å; F445-D447 VanDerWaalsContact O-N 3.13Å; F445-R448 PolarHBondContact O-N 2.94Å; F445-R448 HydrophobicContact CB-CB 4.25Å; F445-F450 HydrophobicContact CB-CE2 4.07Å; F445-F450 HydrophobicContact CB-CZ 3.87Å; F445-F450 HydrophobicContact CD2-CZ 4.3Å; F445-F450 WeakPolarHBondContact O-CE2 3.24Å
446	P	70.1	Confident	77.7	Confident	86 Å²	86	78.2 Å²	78.2	56%	0.558	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-25.8	-176.5	25.5	-35	0	0	0	113.1	L444 R448	L444-P446 VanDerWaalsContact C-CD 3.41Å; L444-P446 WeakPolarHBondContact O-CD 3.07Å; P446-R448 PolarHBondContact O-N 2.9Å
447	D	65.8	Low	76.6	Confident	166 Å²	166	81.4 Å²	81.4	89%	0.888	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-3.7	179.5	-59.1	-39.4	0	0	0	113.9	F445	F445-D447 PolarHBondContact O-N 3.01Å; F445-D447 VanDerWaalsContact O-N 3.13Å
448	R	60.4	Low	75.5	Confident	173 Å²	173	76.5 Å²	76.5	65%	0.653	39%	0.39	S	S	*	.	S	Bend	trans	-104.6	119.2	-179.9	-162.5	176.3	-167.8	-168.2	2.3	109.9	F445 P446 F450	F445-R448 PolarHBondContact O-N 2.94Å; F445-R448 HydrophobicContact CB-CB 4.25Å; P446-R448 PolarHBondContact O-N 2.9Å; R448-F450 HydrophobicContact CB-CD2 4.44Å; R448-F450 HydrophobicContact CB-CE2 3.87Å; R448-F450 HydrophobicContact CB-CZ 3.92Å; R448-F450 HydrophobicContact CG-CE1 4.33Å; R448-F450 HydrophobicContact CG-CE2 4.5Å; R448-F450 HydrophobicContact CG-CZ 4.23Å; R448-F450 WeakPolarHBondContact O-CD2 3.42Å; R448-F450 WeakPolarHBondContact O-CE2 3.46Å; R448-F450 PolarHBondContact O-N 3Å; R448-F450 VanDerWaalsContact O-N 3.14Å
449	I	54.5	Low	74.4	Confident	164 Å²	164	80.3 Å²	80.3	84%	0.841	41%	0.407	S	S	*	.			trans	-70.2	109.3	170.6	-54.2	171.6	0	0	0	107.3
450	F	45.3	Very low	73.1	Confident	66 Å²	66	87.6 Å²	87.6	29%	0.289	44%	0.444	S	S	.	.			trans	-83.9	0	178.2	-70.6	-77.6	0	0	0	111.9	S339 A441 P442 F445 R448	S339-F450 VanDerWaalsContact CA-OXT 3.24Å; S339-F450 WeakPolarHBondContact CA-OXT 3.4Å; S339-F450 VanDerWaalsContact CB-O 3.31Å; S339-F450 WeakPolarHBondContact CB-O 3.46Å; S339-F450 WeakPolarHBondContact CB-OXT 3.5Å; S339-F450 PolarHBondContact OG-O 2.65Å; S339-F450 PolarHBondContact OG-OXT 2.99Å; A441-F450 HydrophobicContact CB-CE1 4.22Å; A441-F450 HydrophobicContact CB-CZ 4.07Å; A441-F450 WeakPolarHBondContact O-CE2 3.26Å; P442-F450 HydrophobicContact CB-CD2 4.19Å; P442-F450 HydrophobicContact CB-CE2 4.48Å; P442-F450 HydrophobicContact CG-CD2 4.15Å; F445-F450 HydrophobicContact CB-CE2 4.07Å; F445-F450 HydrophobicContact CB-CZ 3.87Å; F445-F450 HydrophobicContact CD2-CZ 4.3Å; F445-F450 WeakPolarHBondContact O-CE2 3.24Å; R448-F450 HydrophobicContact CB-CD2 4.44Å; R448-F450 HydrophobicContact CB-CE2 3.87Å; R448-F450 HydrophobicContact CB-CZ 3.92Å; R448-F450 HydrophobicContact CG-CE1 4.33Å; R448-F450 HydrophobicContact CG-CE2 4.5Å; R448-F450 HydrophobicContact CG-CZ 4.23Å; R448-F450 WeakPolarHBondContact O-CD2 3.42Å; R448-F450 WeakPolarHBondContact O-CE2 3.46Å; R448-F450 PolarHBondContact O-N 3Å; R448-F450 VanDerWaalsContact O-N 3.14Å

Retrieved 450 of 450 residues in 157.7 ms (Link to these results)

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