A0A3Q0KV58_SCHMA Loading...

Gtpase activating protein-related

AlphaFold DB , UniProt , Accession A0A3Q0KV58, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 673 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.5	Very low	35.9	Very low	238 Å²	238	141.5 Å²	141.5	100%	1.172	75%	0.753	S	S	*	*				0	138.6	0	-73.6	175.1	172.4	0	0	107.5
2	N	33.8	Very low	38.5	Very low	160 Å²	160	143.3 Å²	143.3	86%	0.856	75%	0.753	S	S	*	*			trans	45.7	90.7	-179.2	-65.4	15.1	0	0	0	115.7	M4	N2-M4 PolarHBondContact O-N 2.82Å
3	E	31	Very low	41.8	Very low	188 Å²	188	136.7 Å²	136.7	88%	0.879	72%	0.722	S	S	*	*			trans	-64.5	125.6	158.7	-61.2	169.8	131.5	0	0	109.1
4	M	31.2	Very low	45	Very low	183 Å²	183	126.9 Å²	126.9	90%	0.901	67%	0.67	S	S	*	*			trans	-96.3	83.1	161.6	-78.9	-172.5	166.7	0	0	108.4	N2	N2-M4 PolarHBondContact O-N 2.82Å
5	S	31.9	Very low	48	Very low	104 Å²	104	126.9 Å²	126.9	73%	0.727	66%	0.659	S	S	*	*			trans	-72.3	127.5	168.2	51.5	0	0	0	0	109.4	G7	S5-G7 PolarHBondContact O-N 3.34Å
6	L	32.2	Very low	50.9	Low	166 Å²	166	119.1 Å²	119.1	87%	0.869	62%	0.618	S	S	*	*			trans	-77.8	59.5	166.7	-80.3	87.2	0	0	0	110.2
7	G	29.1	Very low	53.4	Low	53 Å²	53	117.4 Å²	117.4	55%	0.546	61%	0.605	S	S	.	*	S	Bend	trans	-61.6	173.6	152.2	0	0	0	0	0	110	S5 S9	S5-G7 PolarHBondContact O-N 3.34Å; G7-S9 PolarHBondContact O-N 2.94Å; G7-S9 VanDerWaalsContact O-N 3.08Å
8	R	35.2	Very low	55.7	Low	220 Å²	220	110.8 Å²	110.8	83%	0.83	57%	0.571	S	S	*	*			trans	-51.4	123.4	166.3	-77.6	-179.8	172.3	180	-4.2	108.3	S10	R8-S10 PolarHBondContact O-N 3Å
9	S	41	Very low	57.8	Low	99 Å²	99	107.4 Å²	107.4	69%	0.692	55%	0.551	S	S	*	*			trans	-70.4	82.2	161.7	-172	0	0	0	0	106.9	G7 R11	G7-S9 PolarHBondContact O-N 2.94Å; G7-S9 VanDerWaalsContact O-N 3.08Å; S9-R11 PolarHBondContact O-N 3.38Å
10	S	44.2	Very low	59.5	Low	79 Å²	79	102.3 Å²	102.3	55%	0.552	53%	0.525	S	S	*	.			trans	-68.2	75.7	168.5	53.2	0	0	0	0	107.6	R8 E12	R8-S10 PolarHBondContact O-N 3Å; S10-E12 VanDerWaalsContact C-N 3.29Å; S10-E12 PolarHBondContact O-N 3.31Å
11	R	56.8	Low	60.4	Low	67 Å²	67	98.9 Å²	98.9	25%	0.253	51%	0.511	S	S	.	.			trans	-60.4	95.7	169.4	-66.4	179	177.1	-178.3	-2.4	106.3	S9 V13 V14 P36 I86 S89	S9-R11 PolarHBondContact O-N 3.38Å; R11-V13 PolarHBondContact O-N 2.86Å; R11-V14 HydrophobicContact CB-CG2 4.07Å; R11-P36 WeakPolarHBondContact O-CD 3.46Å; R11-P36 WeakPolarHBondContact O-CG 3.37Å; R11-I86 PolarHBondContact NH1-O 3.05Å; R11-S89 PolarHBondContact NH1-O 3.35Å; R11-S89 PolarHBondContact NH1-OG 3.06Å; R11-S89 PolarHBondContact NH2-O 3.49Å
12	E	67	Low	62.3	Low	163 Å²	163	89.1 Å²	89.1	76%	0.762	47%	0.465	S	S	*	.	S	Bend	trans	-53.1	-29.1	-178.2	-59.7	-177.6	142	0	0	111.8	S10	S10-E12 VanDerWaalsContact C-N 3.29Å; S10-E12 PolarHBondContact O-N 3.31Å
13	V	81.1	Confident	63.7	Low	57 Å²	57	90 Å²	90	35%	0.345	46%	0.463	S	S	.	.			trans	-132.7	134.9	169.9	176	0	0	0	0	110	R11 Y15 A33 I34	R11-V13 PolarHBondContact O-N 2.86Å; V13-Y15 HydrophobicContact CG1-CD1 4.33Å; V13-Y15 HydrophobicContact CG1-CD2 4.35Å; V13-Y15 HydrophobicContact CG1-CE1 4.04Å; V13-Y15 HydrophobicContact CG1-CE2 4.06Å; V13-Y15 HydrophobicContact CG1-CG 4.48Å; V13-A33 HydrophobicContact CG1-CB 3.55Å; V13-I34 CarbonylContact C-O 3.59Å; V13-I34 WeakPolarHBondContact CA-O 3.36Å
14	V	86.9	Confident	64.9	Low	0 Å²	0	85.4 Å²	85.4	0%	0	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	129.6	162.3	175	0	0	0	0	108.4	R11 I34 P36 I86 L94	R11-V14 HydrophobicContact CB-CG2 4.07Å; V14-I34 HydrophobicContact CB-CG1 4.05Å; V14-I34 PolarHBondContact N-O 3.45Å; V14-I34 PolarHBondContact O-N 3.39Å; V14-P36 HydrophobicContact CG2-CB 4.31Å; V14-P36 HydrophobicContact CG2-CG 3.97Å; V14-I86 HydrophobicContact CG1-CG1 4.44Å; V14-I86 HydrophobicContact CG2-CG1 4.31Å; V14-I86 HydrophobicContact CG2-CG2 3.87Å; V14-L94 HydrophobicContact CG1-CB 3.82Å
15	Y	90.5	Very high	66.4	Low	127 Å²	127	79.7 Å²	79.7	50%	0.498	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	119.6	178.9	-69	-78.1	0	0	0	110.4	V13 A33 S92 T93 L94	V13-Y15 HydrophobicContact CG1-CD1 4.33Å; V13-Y15 HydrophobicContact CG1-CD2 4.35Å; V13-Y15 HydrophobicContact CG1-CE1 4.04Å; V13-Y15 HydrophobicContact CG1-CE2 4.06Å; V13-Y15 HydrophobicContact CG1-CG 4.48Å; Y15-A33 HydrophobicContact CD1-CB 4.44Å; Y15-A33 HydrophobicContact CE1-CB 4.4Å; Y15-S92 PolarHBondContact N-O 3.43Å; Y15-T93 CarbonylContact O-C 3.51Å; Y15-T93 WeakPolarHBondContact O-CA 3.1Å; Y15-L94 PolarHBondContact O-N 2.8Å
16	I	93.4	Very high	68.3	Low	2 Å²	2	78.6 Å²	78.6	1%	0.01	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	123.8	176.8	-60.5	-166.9	0	0	0	109.6	A18 K31 F32 I34 L44 L94 L96	I16-A18 HydrophobicContact CG2-CB 4.1Å; I16-K31 VanDerWaalsContact O-CA 3.25Å; I16-K31 WeakPolarHBondContact O-CA 3.46Å; I16-F32 HydrophobicContact CB-CD1 4.35Å; I16-F32 HydrophobicContact CB-CD2 4.43Å; I16-F32 HydrophobicContact CB-CE1 4.1Å; I16-F32 HydrophobicContact CB-CE2 4.19Å; I16-F32 HydrophobicContact CB-CZ 4.02Å; I16-F32 HydrophobicContact CD1-CE2 3.81Å; I16-F32 HydrophobicContact CD1-CZ 3.92Å; I16-F32 HydrophobicContact CG1-CE2 4.36Å; I16-F32 HydrophobicContact CG1-CZ 4.48Å; I16-F32 HydrophobicContact CG2-CD1 4.41Å; I16-F32 HydrophobicContact CG2-CE1 3.78Å; I16-F32 HydrophobicContact CG2-CE2 4.48Å; I16-F32 HydrophobicContact CG2-CZ 3.82Å; I16-F32 PolarHBondContact N-O 3.37Å; I16-F32 PolarHBondContact O-N 3.42Å; I16-F32 VanDerWaalsContact O-N 3.13Å; I16-I34 HydrophobicContact CD1-CD1 3.81Å; I16-I34 HydrophobicContact CD1-CG1 3.95Å; I16-I34 HydrophobicContact CD1-CG2 3.86Å; I16-I34 HydrophobicContact CG1-CG1 4.23Å; I16-I34 HydrophobicContact CG1-CG2 4.45Å; I16-L44 HydrophobicContact CD1-CD1 3.34Å; I16-L44 HydrophobicContact CD1-CD2 4.47Å; I16-L94 WeakPolarHBondContact CA-O 3.48Å; I16-L94 HydrophobicContact CD1-CD2 4.21Å; I16-L94 HydrophobicContact CG1-CB 4.34Å; I16-L94 HydrophobicContact CG1-CD2 4.35Å; I16-L96 HydrophobicContact CD1-CD1 4.31Å; I16-L96 HydrophobicContact CG2-CD1 3.76Å; I16-L96 HydrophobicContact CG2-CG 4.13Å
17	K	93.7	Very high	70.9	Confident	89 Å²	89	73.7 Å²	73.7	39%	0.387	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	91.4	164.2	-176	-171.9	176.3	-173.4	0	107.9	K31 T93 L94 R95 L96	K17-K31 HydrophobicContact CG-CG 4.41Å; K17-T93 HydrophobicContact CB-CG2 4.15Å; K17-L94 PolarHBondContact N-O 3.27Å; K17-R95 WeakPolarHBondContact O-CA 3.38Å; K17-L96 PolarHBondContact O-N 2.9Å
18	A	95.6	Very high	73.7	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	142.3	176.8	0	0	0	0	0	111.2	I16 Y29 K30 L48 F52 L96 I98	I16-A18 HydrophobicContact CG2-CB 4.1Å; A18-Y29 WeakPolarHBondContact O-CA 3.27Å; A18-K30 PolarHBondContact N-O 3.06Å; A18-K30 VanDerWaalsContact N-O 3.08Å; A18-K30 PolarHBondContact O-N 3.42Å; A18-L48 HydrophobicContact CB-CD2 3.75Å; A18-F52 HydrophobicContact CB-CE2 3.54Å; A18-F52 HydrophobicContact CB-CZ 3.69Å; A18-L96 CarbonylContact C-O 3.45Å; A18-L96 WeakPolarHBondContact CA-O 3.33Å; A18-L96 HydrophobicContact CB-CB 4.32Å; A18-I98 HydrophobicContact CB-CD1 4.38Å
19	K	94.3	Very high	76.5	Confident	45 Å²	45	70.5 Å²	70.5	20%	0.196	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	118.2	175.5	169.8	-179.7	159.5	136.8	0	108.2	S21 D27 Q28 Y29 L96 K97 I98	K19-S21 WeakPolarHBondContact CE-OG 3.48Å; K19-D27 VanDerWaalsContact CE-CG 3.45Å; K19-D27 WeakPolarHBondContact CE-OD1 3.16Å; K19-D27 WeakPolarHBondContact CE-OD2 3.37Å; K19-D27 IonicContact NZ-OD1 2.72Å; K19-D27 PolarHBondContact NZ-OD1 3.43Å; K19-D27 IonicContact NZ-OD2 2.97Å; K19-D27 PolarHBondContact NZ-OD2 3.4Å; K19-Q28 CarbonylContact C-O 3.39Å; K19-Q28 WeakPolarHBondContact CA-O 3.42Å; K19-Y29 HydrophobicContact CB-CD1 3.82Å; K19-Y29 HydrophobicContact CB-CE1 3.6Å; K19-Y29 HydrophobicContact CD-CE1 3.77Å; K19-Y29 HydrophobicContact CG-CD1 4.23Å; K19-Y29 HydrophobicContact CG-CE1 3.63Å; K19-L96 PolarHBondContact N-O 2.96Å; K19-K97 CarbonylContact O-C 3.55Å; K19-K97 WeakPolarHBondContact O-CA 3.49Å; K19-I98 PolarHBondContact O-N 3.41Å
20	L	92.7	Very high	79	Confident	6 Å²	6	69 Å²	69	3%	0.031	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	116	165.8	173.3	64.2	0	0	0	108.6	T22 D27 Q28 F52 I98 L100	L20-T22 HydrophobicContact CD2-CG2 4.41Å; L20-T22 HydrophobicContact CG-CG2 4.34Å; L20-D27 WeakPolarHBondContact O-CA 3.4Å; L20-Q28 HydrophobicContact CB-CB 4.38Å; L20-Q28 PolarHBondContact N-O 2.62Å; L20-Q28 PolarHBondContact O-N 3.21Å; L20-F52 HydrophobicContact CB-CD1 3.47Å; L20-F52 VanDerWaalsContact CB-CD1 3.47Å; L20-F52 HydrophobicContact CB-CE1 3.65Å; L20-F52 HydrophobicContact CB-CG 4.05Å; L20-F52 HydrophobicContact CB-CZ 4.36Å; L20-F52 HydrophobicContact CD2-CB 3.91Å; L20-F52 HydrophobicContact CD2-CD1 3.97Å; L20-F52 HydrophobicContact CD2-CG 4.19Å; L20-F52 HydrophobicContact CG-CD1 4.35Å; L20-I98 HydrophobicContact CB-CB 4.42Å; L20-I98 HydrophobicContact CD1-CB 3.9Å; L20-I98 HydrophobicContact CD1-CG2 3.78Å; L20-L100 HydrophobicContact CD1-CD2 3.57Å; L20-L100 HydrophobicContact CD1-CG 3.86Å; L20-L100 HydrophobicContact CD2-CD2 4.5Å
21	S	78.3	Confident	81.3	Confident	31 Å²	31	73.2 Å²	73.2	22%	0.217	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	126.3	168.5	-69.3	0	0	0	0	109.7	K19 D27 I98	K19-S21 WeakPolarHBondContact CE-OG 3.48Å; S21-D27 WeakPolarHBondContact CB-OD1 3.44Å; S21-D27 PolarHBondContact OG-OD1 2.92Å; S21-I98 PolarHBondContact N-O 3.49Å
22	T	69.3	Low	83	Confident	33 Å²	33	71.8 Å²	71.8	20%	0.202	37%	0.365	C	S	.	.			trans	-100.4	158.6	176.1	62.8	0	0	0	0	111.3	L20 S24 G25 T26	L20-T22 HydrophobicContact CD2-CG2 4.41Å; L20-T22 HydrophobicContact CG-CG2 4.34Å; T22-S24 PolarHBondContact O-N 3.43Å; T22-S24 PolarHBondContact OG1-OG 3.25Å; T22-S24 VanDerWaalsContact OG1-OG 3.08Å; T22-G25 PolarHBondContact O-N 3.41Å; T22-T26 PolarHBondContact N-O 3.45Å; T22-T26 PolarHBondContact OG1-N 2.95Å; T22-T26 PolarHBondContact OG1-O 3.43Å; T22-T26 PolarHBondContact OG1-OG1 3.18Å
23	E	61.9	Low	84.1	Confident	178 Å²	178	66.7 Å²	66.7	83%	0.832	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-25.4	178.4	-65.2	174.7	174	0	0	113	G25	E23-G25 PolarHBondContact O-N 2.71Å
24	S	56.5	Low	84.5	Confident	92 Å²	92	64.3 Å²	64.3	64%	0.643	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	8.5	174.4	62.6	0	0	0	0	114.1	T22 T26	T22-S24 PolarHBondContact O-N 3.43Å; T22-S24 PolarHBondContact OG1-OG 3.25Å; T22-S24 VanDerWaalsContact OG1-OG 3.08Å; S24-T26 PolarHBondContact O-N 3.44Å; S24-T26 PolarHBondContact OG-OG1 2.96Å; S24-T26 VanDerWaalsContact OG-OG1 3.09Å
25	G	62.3	Low	84.4	Confident	63 Å²	63	66.7 Å²	66.7	65%	0.649	35%	0.348	S	S	*	.	S	Bend	trans	72.4	0.8	-177.9	0	0	0	0	0	114.4	T22 E23 D27	T22-G25 PolarHBondContact O-N 3.41Å; E23-G25 PolarHBondContact O-N 2.71Å; G25-D27 PolarHBondContact O-N 3.28Å
26	T	72.3	Confident	84	Confident	81 Å²	81	62 Å²	62	50%	0.497	33%	0.334	S	S	.	.			trans	-85.2	111.7	178.9	63.7	0	0	0	0	110.8	T22 S24	T22-T26 PolarHBondContact N-O 3.45Å; T22-T26 PolarHBondContact OG1-N 2.95Å; T22-T26 PolarHBondContact OG1-O 3.43Å; T22-T26 PolarHBondContact OG1-OG1 3.18Å; S24-T26 PolarHBondContact O-N 3.44Å; S24-T26 PolarHBondContact OG-OG1 2.96Å; S24-T26 VanDerWaalsContact OG-OG1 3.09Å
27	D	85.9	Confident	83.3	Confident	62 Å²	62	67.1 Å²	67.1	33%	0.332	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	116.7	173.6	-75.4	-33.8	0	0	0	110.7	K19 L20 S21 G25 Y29	K19-D27 VanDerWaalsContact CE-CG 3.45Å; K19-D27 WeakPolarHBondContact CE-OD1 3.16Å; K19-D27 WeakPolarHBondContact CE-OD2 3.37Å; K19-D27 IonicContact NZ-OD1 2.72Å; K19-D27 PolarHBondContact NZ-OD1 3.43Å; K19-D27 IonicContact NZ-OD2 2.97Å; K19-D27 PolarHBondContact NZ-OD2 3.4Å; L20-D27 WeakPolarHBondContact O-CA 3.4Å; S21-D27 WeakPolarHBondContact CB-OD1 3.44Å; S21-D27 PolarHBondContact OG-OD1 2.92Å; G25-D27 PolarHBondContact O-N 3.28Å; D27-Y29 HydrophobicContact CB-CD2 4.33Å; D27-Y29 HydrophobicContact CB-CE2 3.48Å; D27-Y29 VanDerWaalsContact CB-CE2 3.48Å; D27-Y29 PolarHBondContact OD2-OH 3.19Å; D27-Y29 VanDerWaalsContact OD2-OH 3.08Å
28	Q	88.7	Confident	82.8	Confident	86 Å²	86	69 Å²	69	40%	0.402	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	140.9	166.3	-62.2	-171.8	18.2	0	0	110.3	K19 L20 F52	K19-Q28 CarbonylContact C-O 3.39Å; K19-Q28 WeakPolarHBondContact CA-O 3.42Å; L20-Q28 HydrophobicContact CB-CB 4.38Å; L20-Q28 PolarHBondContact N-O 2.62Å; L20-Q28 PolarHBondContact O-N 3.21Å; Q28-F52 HydrophobicContact CB-CD1 4.02Å; Q28-F52 HydrophobicContact CB-CE1 3.96Å; Q28-F52 WeakPolarHBondContact O-CE1 3.46Å
29	Y	93.5	Very high	82.4	Confident	120 Å²	120	69.5 Å²	69.5	47%	0.471	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	125.9	173.2	-61.5	-93.1	0	0	0	109.8	A18 K19 D27	A18-Y29 WeakPolarHBondContact O-CA 3.27Å; K19-Y29 HydrophobicContact CB-CD1 3.82Å; K19-Y29 HydrophobicContact CB-CE1 3.6Å; K19-Y29 HydrophobicContact CD-CE1 3.77Å; K19-Y29 HydrophobicContact CG-CD1 4.23Å; K19-Y29 HydrophobicContact CG-CE1 3.63Å; D27-Y29 HydrophobicContact CB-CD2 4.33Å; D27-Y29 HydrophobicContact CB-CE2 3.48Å; D27-Y29 VanDerWaalsContact CB-CE2 3.48Å; D27-Y29 PolarHBondContact OD2-OH 3.19Å; D27-Y29 VanDerWaalsContact OD2-OH 3.08Å
30	K	93.5	Very high	82	Confident	67 Å²	67	70.8 Å²	70.8	29%	0.291	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	139.3	166.8	-63.2	-164.6	-169.7	-178.8	0	108.4	A18 C51 F52 D53	A18-K30 PolarHBondContact N-O 3.06Å; A18-K30 VanDerWaalsContact N-O 3.08Å; A18-K30 PolarHBondContact O-N 3.42Å; K30-C51 HydrophobicContact CB-CB 4.39Å; K30-C51 HydrophobicContact CD-CB 3.97Å; K30-F52 HydrophobicContact CB-CE1 4.04Å; K30-F52 HydrophobicContact CB-CE2 3.99Å; K30-F52 HydrophobicContact CB-CZ 3.66Å; K30-F52 HydrophobicContact CD-CD1 4.44Å; K30-F52 VanDerWaalsContact CE-N 3.28Å; K30-F52 HydrophobicContact CG-CD1 4.14Å; K30-F52 HydrophobicContact CG-CE1 3.83Å; K30-F52 HydrophobicContact CG-CE2 4.43Å; K30-F52 HydrophobicContact CG-CZ 3.99Å; K30-F52 VanDerWaalsContact NZ-N 3.11Å; K30-D53 IonicContact NZ-OD2 2.66Å; K30-D53 PolarHBondContact NZ-OD2 3.37Å
31	K	92.3	Very high	81.9	Confident	169 Å²	169	72.9 Å²	72.9	74%	0.735	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.1	138.9	175.9	-64.6	-177.5	-176	178.4	0	109.5	I16 K17	I16-K31 VanDerWaalsContact O-CA 3.25Å; I16-K31 WeakPolarHBondContact O-CA 3.46Å; K17-K31 HydrophobicContact CG-CG 4.41Å
32	F	93.5	Very high	82.4	Confident	36 Å²	36	79.1 Å²	79.1	16%	0.158	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	166.5	173.9	59.1	-81.6	0	0	0	110.7	I16 I34 L44 L47 L48	I16-F32 HydrophobicContact CB-CD1 4.35Å; I16-F32 HydrophobicContact CB-CD2 4.43Å; I16-F32 HydrophobicContact CB-CE1 4.1Å; I16-F32 HydrophobicContact CB-CE2 4.19Å; I16-F32 HydrophobicContact CB-CZ 4.02Å; I16-F32 HydrophobicContact CD1-CE2 3.81Å; I16-F32 HydrophobicContact CD1-CZ 3.92Å; I16-F32 HydrophobicContact CG1-CE2 4.36Å; I16-F32 HydrophobicContact CG1-CZ 4.48Å; I16-F32 HydrophobicContact CG2-CD1 4.41Å; I16-F32 HydrophobicContact CG2-CE1 3.78Å; I16-F32 HydrophobicContact CG2-CE2 4.48Å; I16-F32 HydrophobicContact CG2-CZ 3.82Å; I16-F32 PolarHBondContact N-O 3.37Å; I16-F32 PolarHBondContact O-N 3.42Å; I16-F32 VanDerWaalsContact O-N 3.13Å; F32-I34 HydrophobicContact CD2-CG2 3.79Å; F32-I34 HydrophobicContact CE2-CG2 3.59Å; F32-L44 HydrophobicContact CE2-CD1 4.25Å; F32-L44 HydrophobicContact CZ-CD1 4.04Å; F32-L47 HydrophobicContact CE2-CB 3.86Å; F32-L47 HydrophobicContact CE2-CD1 4.02Å; F32-L47 HydrophobicContact CZ-CB 4.16Å; F32-L48 HydrophobicContact CE1-CD2 3.79Å; F32-L48 HydrophobicContact CZ-CD2 3.67Å; F32-L48 HydrophobicContact CZ-CG 4.22Å
33	A	90.2	Very high	83.4	Confident	56 Å²	56	80.6 Å²	80.6	46%	0.463	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	145.4	175	0	0	0	0	0	110	V13 Y15	V13-A33 HydrophobicContact CG1-CB 3.55Å; Y15-A33 HydrophobicContact CD1-CB 4.44Å; Y15-A33 HydrophobicContact CE1-CB 4.4Å
34	I	89.9	Confident	84.9	Confident	7 Å²	7	72.1 Å²	72.1	4%	0.036	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	148.8	165.6	65.9	160.8	0	0	0	110	V13 V14 I16 F32 T39 L47	V13-I34 CarbonylContact C-O 3.59Å; V13-I34 WeakPolarHBondContact CA-O 3.36Å; V14-I34 HydrophobicContact CB-CG1 4.05Å; V14-I34 PolarHBondContact N-O 3.45Å; V14-I34 PolarHBondContact O-N 3.39Å; I16-I34 HydrophobicContact CD1-CD1 3.81Å; I16-I34 HydrophobicContact CD1-CG1 3.95Å; I16-I34 HydrophobicContact CD1-CG2 3.86Å; I16-I34 HydrophobicContact CG1-CG1 4.23Å; I16-I34 HydrophobicContact CG1-CG2 4.45Å; F32-I34 HydrophobicContact CD2-CG2 3.79Å; F32-I34 HydrophobicContact CE2-CG2 3.59Å; I34-T39 HydrophobicContact CB-CG2 4.05Å; I34-T39 HydrophobicContact CD1-CG2 3.8Å; I34-T39 HydrophobicContact CG2-CG2 4.08Å; I34-L47 HydrophobicContact CG2-CD1 3.76Å
35	D	84.7	Confident	86.6	Confident	50 Å²	50	70 Å²	70	27%	0.267	37%	0.367	S	S	.	.			trans	-90.3	115.6	161.4	166.5	14.1	0	0	0	107.5	N37 I38 T39	D35-N37 PolarHBondContact O-N 2.65Å; D35-N37 VanDerWaalsContact OD1-CB 3.31Å; D35-N37 WeakPolarHBondContact OD1-CB 3.47Å; D35-N37 PolarHBondContact OD1-N 3.43Å; D35-N37 PolarHBondContact OD1-ND2 3.27Å; D35-I38 HydrophobicContact CB-CD1 4.09Å; D35-I38 HydrophobicContact CB-CG1 3.87Å; D35-I38 PolarHBondContact O-N 2.9Å; D35-T39 WeakPolarHBondContact O-CB 3.13Å; D35-T39 PolarHBondContact O-N 2.83Å; D35-T39 VanDerWaalsContact O-N 3.09Å; D35-T39 PolarHBondContact O-OG1 3.07Å
36	P	81.8	Confident	87.9	Confident	29 Å²	29	68.9 Å²	68.9	19%	0.188	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-18.1	-177.4	30.7	-37	0	0	0	113.2	R11 V14 I38 I86	R11-P36 WeakPolarHBondContact O-CD 3.46Å; R11-P36 WeakPolarHBondContact O-CG 3.37Å; V14-P36 HydrophobicContact CG2-CB 4.31Å; V14-P36 HydrophobicContact CG2-CG 3.97Å; P36-I38 VanDerWaalsContact C-N 3.26Å; P36-I38 PolarHBondContact O-N 3.04Å; P36-I86 HydrophobicContact CB-CD1 3.73Å
37	N	79.1	Confident	88.9	Confident	110 Å²	110	67.9 Å²	67.9	59%	0.588	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-15.5	179.6	-54.1	-85.3	0	0	0	112.9	D35	D35-N37 PolarHBondContact O-N 2.65Å; D35-N37 VanDerWaalsContact OD1-CB 3.31Å; D35-N37 WeakPolarHBondContact OD1-CB 3.47Å; D35-N37 PolarHBondContact OD1-N 3.43Å; D35-N37 PolarHBondContact OD1-ND2 3.27Å
38	I	83.4	Confident	89.4	Confident	127 Å²	127	64.9 Å²	64.9	65%	0.651	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.8	-6.4	-179.6	68	178.4	0	0	0	113.9	D35 P36	D35-I38 HydrophobicContact CB-CD1 4.09Å; D35-I38 HydrophobicContact CB-CG1 3.87Å; D35-I38 PolarHBondContact O-N 2.9Å; P36-I38 VanDerWaalsContact C-N 3.26Å; P36-I38 PolarHBondContact O-N 3.04Å
39	T	86.6	Confident	89.6	Confident	12 Å²	12	65.1 Å²	65.1	7%	0.074	33%	0.329	C	S	.	.			trans	-104	88.8	-176.1	-52.7	0	0	0	0	110.2	I34 D35 V43 L44 L47 L82	I34-T39 HydrophobicContact CB-CG2 4.05Å; I34-T39 HydrophobicContact CD1-CG2 3.8Å; I34-T39 HydrophobicContact CG2-CG2 4.08Å; D35-T39 WeakPolarHBondContact O-CB 3.13Å; D35-T39 PolarHBondContact O-N 2.83Å; D35-T39 VanDerWaalsContact O-N 3.09Å; D35-T39 PolarHBondContact O-OG1 3.07Å; T39-V43 HydrophobicContact CG2-CB 4.2Å; T39-V43 HydrophobicContact CG2-CG1 3.99Å; T39-L44 HydrophobicContact CG2-CB 4.18Å; T39-L47 HydrophobicContact CG2-CD1 4.26Å; T39-L82 VanDerWaalsContact O-CD2 3.28Å; T39-L82 WeakPolarHBondContact O-CD2 3.32Å
40	D	86.7	Confident	89.4	Confident	72 Å²	72	67.6 Å²	67.6	39%	0.385	34%	0.342	S	S	.	.			trans	-67.8	168.7	169.5	74.6	36.4	0	0	0	111.7	K42 V43 L44	D40-K42 PolarHBondContact O-N 3.07Å; D40-K42 VanDerWaalsContact OD1-CA 3.31Å; D40-K42 WeakPolarHBondContact OD1-CA 3.34Å; D40-K42 VanDerWaalsContact OD1-CB 3.27Å; D40-K42 WeakPolarHBondContact OD1-CB 3.38Å; D40-K42 PolarHBondContact OD1-N 3.12Å; D40-V43 PolarHBondContact O-N 3.28Å; D40-V43 WeakPolarHBondContact OD1-CG2 3.34Å; D40-V43 PolarHBondContact OD1-N 3.41Å; D40-L44 PolarHBondContact O-N 3.36Å
41	Y	89.5	Confident	89.3	Confident	49 Å²	49	65.7 Å²	65.7	19%	0.192	34%	0.337	C	S	.	.	H	α-helix	trans	-57.6	-34.6	-178.9	163.3	-121.5	0	0	0	113	L44 L45 L76 Q77 D79	Y41-L44 WeakPolarHBondContact O-CB 3.16Å; Y41-L44 PolarHBondContact O-N 3.48Å; Y41-L45 HydrophobicContact CD2-CG 4.16Å; Y41-L45 HydrophobicContact CE1-CD1 3.87Å; Y41-L45 HydrophobicContact CE1-CG 4.45Å; Y41-L45 HydrophobicContact CE2-CD1 3.95Å; Y41-L45 HydrophobicContact CE2-CD2 3.77Å; Y41-L45 HydrophobicContact CE2-CG 3.68Å; Y41-L45 WeakPolarHBondContact O-CG 3.34Å; Y41-L45 PolarHBondContact O-N 3.44Å; Y41-L76 HydrophobicContact CD2-CD2 3.27Å; Y41-L76 HydrophobicContact CE2-CD2 3.53Å; Y41-L76 VanDerWaalsContact CE2-O 3.31Å; Y41-L76 WeakPolarHBondContact CE2-O 3.25Å; Y41-L76 HydrophobicContact CG-CD2 4.28Å; Y41-L76 PolarHBondContact OH-O 2.8Å; Y41-Q77 WeakPolarHBondContact CD1-O 3.4Å; Y41-Q77 WeakPolarHBondContact CE1-O 3.32Å; Y41-D79 WeakPolarHBondContact CB-OD1 3.28Å; Y41-D79 PolarHBondContact N-OD1 3.46Å; Y41-D79 VanDerWaalsContact N-OD1 3.16Å
42	K	88.1	Confident	89.3	Confident	163 Å²	163	58.2 Å²	58.2	71%	0.709	31%	0.305	S	S	*	.	H	α-helix	trans	-76.7	-34	-178.4	172.4	-170.8	171.7	-163.5	0	111.8	D40 G46	D40-K42 PolarHBondContact O-N 3.07Å; D40-K42 VanDerWaalsContact OD1-CA 3.31Å; D40-K42 WeakPolarHBondContact OD1-CA 3.34Å; D40-K42 VanDerWaalsContact OD1-CB 3.27Å; D40-K42 WeakPolarHBondContact OD1-CB 3.38Å; D40-K42 PolarHBondContact OD1-N 3.12Å; K42-G46 PolarHBondContact O-N 3.25Å
43	V	91.5	Very high	89.1	Confident	63 Å²	63	61.9 Å²	61.9	38%	0.382	33%	0.326	S	S	.	.	H	α-helix	trans	-64.6	-43.8	167.5	177.7	0	0	0	0	109.5	T39 D40 L45 G46 L47	T39-V43 HydrophobicContact CG2-CB 4.2Å; T39-V43 HydrophobicContact CG2-CG1 3.99Å; D40-V43 PolarHBondContact O-N 3.28Å; D40-V43 WeakPolarHBondContact OD1-CG2 3.34Å; D40-V43 PolarHBondContact OD1-N 3.41Å; V43-L45 PolarHBondContact O-N 3.23Å; V43-G46 CarbonylContact O-C 3.58Å; V43-G46 WeakPolarHBondContact O-CA 3.41Å; V43-G46 PolarHBondContact O-N 2.74Å; V43-G46 VanDerWaalsContact O-N 3.1Å; V43-L47 HydrophobicContact CG1-CD1 4.24Å; V43-L47 HydrophobicContact CG1-CG 4.43Å; V43-L47 WeakPolarHBondContact O-CG 3.34Å; V43-L47 PolarHBondContact O-N 3.44Å
44	L	93.6	Very high	89	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-59.1	-47	174.6	175	58.7	0	0	0	112	I16 F32 T39 D40 Y41 G46 L47 L48 L76 L82 L96	I16-L44 HydrophobicContact CD1-CD1 3.34Å; I16-L44 HydrophobicContact CD1-CD2 4.47Å; F32-L44 HydrophobicContact CE2-CD1 4.25Å; F32-L44 HydrophobicContact CZ-CD1 4.04Å; T39-L44 HydrophobicContact CG2-CB 4.18Å; D40-L44 PolarHBondContact O-N 3.36Å; Y41-L44 WeakPolarHBondContact O-CB 3.16Å; Y41-L44 PolarHBondContact O-N 3.48Å; L44-G46 VanDerWaalsContact C-N 3.28Å; L44-G46 PolarHBondContact O-N 3.33Å; L44-L47 PolarHBondContact O-N 2.9Å; L44-L47 VanDerWaalsContact O-N 3.15Å; L44-L48 HydrophobicContact CD1-CD1 3.86Å; L44-L48 HydrophobicContact CD1-CD2 4.38Å; L44-L48 HydrophobicContact CD1-CG 3.85Å; L44-L48 HydrophobicContact CG-CD1 3.83Å; L44-L48 HydrophobicContact CG-CG 4.29Å; L44-L48 WeakPolarHBondContact O-CB 3.38Å; L44-L48 VanDerWaalsContact O-CG 3.29Å; L44-L48 WeakPolarHBondContact O-CG 3.34Å; L44-L48 PolarHBondContact O-N 2.9Å; L44-L76 HydrophobicContact CD2-CD1 4.23Å; L44-L82 HydrophobicContact CB-CD2 4.38Å; L44-L82 HydrophobicContact CD2-CD1 3.61Å; L44-L82 HydrophobicContact CD2-CD2 4.09Å; L44-L82 HydrophobicContact CD2-CG 4.45Å; L44-L96 HydrophobicContact CD1-CD1 4.27Å; L44-L96 HydrophobicContact CD2-CD1 4.16Å
45	L	92.3	Very high	88.7	Confident	46 Å²	46	65.6 Å²	65.6	24%	0.241	34%	0.338	C	S	.	.	H	α-helix	trans	-57.2	-41	172.8	-71.7	-178.1	0	0	0	112.1	Y41 V43 L48 R49 F58 V60	Y41-L45 HydrophobicContact CD2-CG 4.16Å; Y41-L45 HydrophobicContact CE1-CD1 3.87Å; Y41-L45 HydrophobicContact CE1-CG 4.45Å; Y41-L45 HydrophobicContact CE2-CD1 3.95Å; Y41-L45 HydrophobicContact CE2-CD2 3.77Å; Y41-L45 HydrophobicContact CE2-CG 3.68Å; Y41-L45 WeakPolarHBondContact O-CG 3.34Å; Y41-L45 PolarHBondContact O-N 3.44Å; V43-L45 PolarHBondContact O-N 3.23Å; L45-L48 PolarHBondContact O-N 3.46Å; L45-R49 VanDerWaalsContact O-CB 3.28Å; L45-R49 WeakPolarHBondContact O-CB 3.25Å; L45-R49 PolarHBondContact O-N 3.41Å; L45-F58 HydrophobicContact CD2-CE2 3.64Å; L45-F58 HydrophobicContact CD2-CZ 4.06Å; L45-V60 HydrophobicContact CD2-CG2 3.75Å
46	G	89.8	Confident	88.5	Confident	41 Å²	41	64.1 Å²	64.1	42%	0.423	33%	0.331	S	S	.	.	H	α-helix	trans	-62	-41.8	174.7	0	0	0	0	0	113.2	K42 V43 L44 R49 K50	K42-G46 PolarHBondContact O-N 3.25Å; V43-G46 CarbonylContact O-C 3.58Å; V43-G46 WeakPolarHBondContact O-CA 3.41Å; V43-G46 PolarHBondContact O-N 2.74Å; V43-G46 VanDerWaalsContact O-N 3.1Å; L44-G46 VanDerWaalsContact C-N 3.28Å; L44-G46 PolarHBondContact O-N 3.33Å; G46-R49 PolarHBondContact O-N 2.96Å; G46-K50 WeakPolarHBondContact O-CB 3.18Å; G46-K50 PolarHBondContact O-N 2.83Å; G46-K50 VanDerWaalsContact O-N 3.07Å
47	L	92.8	Very high	88.5	Confident	59 Å²	59	67.4 Å²	67.4	31%	0.309	35%	0.347	S	S	.	.	H	α-helix	trans	-67	-40.8	175	-69.1	173.7	0	0	0	111.9	F32 I34 T39 V43 L44 R49 K50 C51	F32-L47 HydrophobicContact CE2-CB 3.86Å; F32-L47 HydrophobicContact CE2-CD1 4.02Å; F32-L47 HydrophobicContact CZ-CB 4.16Å; I34-L47 HydrophobicContact CG2-CD1 3.76Å; T39-L47 HydrophobicContact CG2-CD1 4.26Å; V43-L47 HydrophobicContact CG1-CD1 4.24Å; V43-L47 HydrophobicContact CG1-CG 4.43Å; V43-L47 WeakPolarHBondContact O-CG 3.34Å; V43-L47 PolarHBondContact O-N 3.44Å; L44-L47 PolarHBondContact O-N 2.9Å; L44-L47 VanDerWaalsContact O-N 3.15Å; L47-R49 VanDerWaalsContact C-N 3.29Å; L47-R49 PolarHBondContact O-N 2.77Å; L47-K50 PolarHBondContact O-N 2.78Å; L47-C51 WeakPolarHBondContact O-CB 3.32Å; L47-C51 PolarHBondContact O-N 2.94Å; L47-C51 PolarHBondContact O-SG 3.01Å
48	L	95.1	Very high	89	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-70.7	-22.4	176.3	-66.9	170.1	0	0	0	113.4	A18 F32 L44 L45 C51 F58 V60 L96 I98	A18-L48 HydrophobicContact CB-CD2 3.75Å; F32-L48 HydrophobicContact CE1-CD2 3.79Å; F32-L48 HydrophobicContact CZ-CD2 3.67Å; F32-L48 HydrophobicContact CZ-CG 4.22Å; L44-L48 HydrophobicContact CD1-CD1 3.86Å; L44-L48 HydrophobicContact CD1-CD2 4.38Å; L44-L48 HydrophobicContact CD1-CG 3.85Å; L44-L48 HydrophobicContact CG-CD1 3.83Å; L44-L48 HydrophobicContact CG-CG 4.29Å; L44-L48 WeakPolarHBondContact O-CB 3.38Å; L44-L48 VanDerWaalsContact O-CG 3.29Å; L44-L48 WeakPolarHBondContact O-CG 3.34Å; L44-L48 PolarHBondContact O-N 2.9Å; L45-L48 PolarHBondContact O-N 3.46Å; L48-C51 CarbonylContact C-O 3.52Å; L48-C51 CarbonylContact O-C 2.94Å; L48-F58 HydrophobicContact CB-CE2 4.31Å; L48-F58 HydrophobicContact CB-CZ 4.35Å; L48-V60 HydrophobicContact CD1-CG1 4.12Å; L48-V60 HydrophobicContact CD1-CG2 3.85Å; L48-L96 HydrophobicContact CD1-CD1 3.9Å; L48-L96 HydrophobicContact CD2-CD1 4.12Å; L48-I98 HydrophobicContact CB-CD1 4.32Å; L48-I98 HydrophobicContact CD2-CD1 4.06Å
49	R	93.5	Very high	89.2	Confident	91 Å²	91	59 Å²	59	34%	0.343	31%	0.306	S	S	.	.	H	α-helix	trans	-83.6	-29.4	174	-170.4	-178.9	-79.5	-80.6	9.3	113	L45 G46 L47 C51 D53 I54 C56 D57 F58	L45-R49 VanDerWaalsContact O-CB 3.28Å; L45-R49 WeakPolarHBondContact O-CB 3.25Å; L45-R49 PolarHBondContact O-N 3.41Å; G46-R49 PolarHBondContact O-N 2.96Å; L47-R49 VanDerWaalsContact C-N 3.29Å; L47-R49 PolarHBondContact O-N 2.77Å; R49-C51 CarbonylContact C-O 3.6Å; R49-D53 PolarHBondContact O-N 2.67Å; R49-I54 HydrophobicContact CG-CB 4.3Å; R49-I54 WeakPolarHBondContact CG-O 3.34Å; R49-I54 PolarHBondContact NH1-O 3.05Å; R49-I54 PolarHBondContact O-N 2.91Å; R49-I54 VanDerWaalsContact O-N 3.1Å; R49-C56 PolarHBondContact NH1-O 3.44Å; R49-C56 PolarHBondContact NH2-O 3.33Å; R49-C56 VanDerWaalsContact NH2-O 3.15Å; R49-D57 IonicContact NH2-OD1 3.29Å; R49-D57 PolarHBondContact NH2-OD1 3.1Å; R49-F58 HydrophobicContact CB-CE1 4.01Å; R49-F58 HydrophobicContact CB-CZ 4.2Å; R49-F58 HydrophobicContact CG-CE1 4.25Å
50	K	89.9	Confident	89.5	Confident	172 Å²	172	58.8 Å²	58.8	75%	0.748	30%	0.304	S	S	*	.	H	α-helix	trans	-88.5	-33.7	175.8	-173.6	179.9	177.6	-176.3	0	112.7	G46 L47	G46-K50 WeakPolarHBondContact O-CB 3.18Å; G46-K50 PolarHBondContact O-N 2.83Å; G46-K50 VanDerWaalsContact O-N 3.07Å; L47-K50 PolarHBondContact O-N 2.78Å
51	C	91.4	Very high	89.7	Confident	26 Å²	26	56 Å²	56	18%	0.176	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	157.8	145.3	-64.3	0	0	0	0	108.2	K30 L47 L48 R49 D53	K30-C51 HydrophobicContact CB-CB 4.39Å; K30-C51 HydrophobicContact CD-CB 3.97Å; L47-C51 WeakPolarHBondContact O-CB 3.32Å; L47-C51 PolarHBondContact O-N 2.94Å; L47-C51 PolarHBondContact O-SG 3.01Å; L48-C51 CarbonylContact C-O 3.52Å; L48-C51 CarbonylContact O-C 2.94Å; R49-C51 CarbonylContact C-O 3.6Å; C51-D53 PolarHBondContact O-N 3.46Å
52	F	92.3	Very high	89.8	Confident	13 Å²	13	54.2 Å²	54.2	6%	0.057	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	55	-8.5	178.8	-52.8	-77.1	0	0	0	118.5	A18 L20 Q28 K30 I54 I98	A18-F52 HydrophobicContact CB-CE2 3.54Å; A18-F52 HydrophobicContact CB-CZ 3.69Å; L20-F52 HydrophobicContact CB-CD1 3.47Å; L20-F52 VanDerWaalsContact CB-CD1 3.47Å; L20-F52 HydrophobicContact CB-CE1 3.65Å; L20-F52 HydrophobicContact CB-CG 4.05Å; L20-F52 HydrophobicContact CB-CZ 4.36Å; L20-F52 HydrophobicContact CD2-CB 3.91Å; L20-F52 HydrophobicContact CD2-CD1 3.97Å; L20-F52 HydrophobicContact CD2-CG 4.19Å; L20-F52 HydrophobicContact CG-CD1 4.35Å; Q28-F52 HydrophobicContact CB-CD1 4.02Å; Q28-F52 HydrophobicContact CB-CE1 3.96Å; Q28-F52 WeakPolarHBondContact O-CE1 3.46Å; K30-F52 HydrophobicContact CB-CE1 4.04Å; K30-F52 HydrophobicContact CB-CE2 3.99Å; K30-F52 HydrophobicContact CB-CZ 3.66Å; K30-F52 HydrophobicContact CD-CD1 4.44Å; K30-F52 VanDerWaalsContact CE-N 3.28Å; K30-F52 HydrophobicContact CG-CD1 4.14Å; K30-F52 HydrophobicContact CG-CE1 3.83Å; K30-F52 HydrophobicContact CG-CE2 4.43Å; K30-F52 HydrophobicContact CG-CZ 3.99Å; K30-F52 VanDerWaalsContact NZ-N 3.11Å; F52-I54 VanDerWaalsContact C-N 3.3Å; F52-I54 HydrophobicContact CB-CD1 3.79Å; F52-I54 HydrophobicContact CB-CG1 3.61Å; F52-I54 PolarHBondContact O-N 2.91Å; F52-I98 HydrophobicContact CD2-CD1 3.43Å; F52-I98 VanDerWaalsContact CD2-CD1 3.43Å; F52-I98 HydrophobicContact CE2-CD1 3.42Å; F52-I98 VanDerWaalsContact CE2-CD1 3.42Å; F52-I98 HydrophobicContact CG-CD1 4.19Å; F52-I98 HydrophobicContact CZ-CD1 4.15Å
53	D	88.9	Confident	89.7	Confident	113 Å²	113	47.3 Å²	47.3	60%	0.604	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.1	38.2	168.4	-51.5	-88	0	0	0	112	K30 R49 C51 N55	K30-D53 IonicContact NZ-OD2 2.66Å; K30-D53 PolarHBondContact NZ-OD2 3.37Å; R49-D53 PolarHBondContact O-N 2.67Å; C51-D53 PolarHBondContact O-N 3.46Å; D53-N55 PolarHBondContact O-N 2.96Å
54	I	88.6	Confident	89.2	Confident	13 Å²	13	44.4 Å²	44.4	7%	0.067	24%	0.237	C	C	.	.			trans	-78.1	116.3	-165.7	-54.5	175.4	0	0	0	111.8	R49 F52 F58 I98 L100	R49-I54 HydrophobicContact CG-CB 4.3Å; R49-I54 WeakPolarHBondContact CG-O 3.34Å; R49-I54 PolarHBondContact NH1-O 3.05Å; R49-I54 PolarHBondContact O-N 2.91Å; R49-I54 VanDerWaalsContact O-N 3.1Å; F52-I54 VanDerWaalsContact C-N 3.3Å; F52-I54 HydrophobicContact CB-CD1 3.79Å; F52-I54 HydrophobicContact CB-CG1 3.61Å; F52-I54 PolarHBondContact O-N 2.91Å; I54-F58 HydrophobicContact CB-CD1 4.33Å; I54-F58 HydrophobicContact CB-CE1 4.42Å; I54-F58 HydrophobicContact CD1-CD1 4.09Å; I54-F58 HydrophobicContact CD1-CE1 4.26Å; I54-F58 HydrophobicContact CD1-CG 4.31Å; I54-F58 HydrophobicContact CG2-CD1 3.69Å; I54-F58 HydrophobicContact CG2-CE1 4.23Å; I54-F58 HydrophobicContact CG2-CG 4.5Å; I54-I98 HydrophobicContact CD1-CD1 4.39Å; I54-I98 HydrophobicContact CD1-CG2 3.97Å; I54-L100 HydrophobicContact CD1-CD2 4.06Å; I54-L100 HydrophobicContact CG1-CD2 4.29Å; I54-L100 HydrophobicContact CG2-CD2 3.73Å
55	N	82.6	Confident	88.2	Confident	127 Å²	127	47 Å²	47	68%	0.679	25%	0.25	S	C	*	.			trans	-113.3	29.3	-178.9	62.7	31.9	0	0	0	113.5	D53 K103	D53-N55 PolarHBondContact O-N 2.96Å; N55-K103 VanDerWaalsContact O-CE 3.27Å; N55-K103 WeakPolarHBondContact O-CE 3.49Å; N55-K103 PolarHBondContact O-NZ 2.87Å; N55-K103 PolarHBondContact OD1-NZ 3.35Å
56	C	80.5	Confident	86.9	Confident	19 Å²	19	47.7 Å²	47.7	13%	0.128	25%	0.254	C	S	.	.	S	Bend	trans	-135.1	-177.9	169.6	65.9	0	0	0	0	109.8	R49 K103	R49-C56 PolarHBondContact NH1-O 3.44Å; R49-C56 PolarHBondContact NH2-O 3.33Å; R49-C56 VanDerWaalsContact NH2-O 3.15Å; C56-K103 HydrophobicContact CB-CD 4.41Å; C56-K103 VanDerWaalsContact CB-CE 3.43Å; C56-K103 HydrophobicContact CB-CG 4.04Å
57	D	81.7	Confident	85.3	Confident	99 Å²	99	54.1 Å²	54.1	53%	0.529	27%	0.273	S	S	.	.			trans	-80.4	157.8	165	-82.1	-12.3	0	0	0	111.9	R49 K101	R49-D57 IonicContact NH2-OD1 3.29Å; R49-D57 PolarHBondContact NH2-OD1 3.1Å; D57-K101 HydrophobicContact CB-CB 4.35Å; D57-K101 HydrophobicContact CB-CD 3.99Å; D57-K101 HydrophobicContact CB-CG 4.36Å; D57-K101 PolarHBondContact O-N 2.88Å
58	F	90.2	Very high	83.8	Confident	23 Å²	23	59.3 Å²	59.3	10%	0.101	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	162.7	-178.8	59.9	-89.5	0	0	0	110.6	L45 L48 R49 I54 V60 I98 T99 L100	L45-F58 HydrophobicContact CD2-CE2 3.64Å; L45-F58 HydrophobicContact CD2-CZ 4.06Å; L48-F58 HydrophobicContact CB-CE2 4.31Å; L48-F58 HydrophobicContact CB-CZ 4.35Å; R49-F58 HydrophobicContact CB-CE1 4.01Å; R49-F58 HydrophobicContact CB-CZ 4.2Å; R49-F58 HydrophobicContact CG-CE1 4.25Å; I54-F58 HydrophobicContact CB-CD1 4.33Å; I54-F58 HydrophobicContact CB-CE1 4.42Å; I54-F58 HydrophobicContact CD1-CD1 4.09Å; I54-F58 HydrophobicContact CD1-CE1 4.26Å; I54-F58 HydrophobicContact CD1-CG 4.31Å; I54-F58 HydrophobicContact CG2-CD1 3.69Å; I54-F58 HydrophobicContact CG2-CE1 4.23Å; I54-F58 HydrophobicContact CG2-CG 4.5Å; F58-V60 HydrophobicContact CD2-CG2 3.75Å; F58-V60 HydrophobicContact CE2-CG2 3.62Å; F58-I98 HydrophobicContact CB-CG2 3.88Å; F58-I98 HydrophobicContact CD2-CG2 3.67Å; F58-I98 HydrophobicContact CE2-CG2 4.43Å; F58-I98 HydrophobicContact CG-CG2 4Å; F58-T99 CarbonylContact C-O 3.55Å; F58-T99 WeakPolarHBondContact CA-O 3.42Å; F58-T99 VanDerWaalsContact CB-O 3.31Å; F58-T99 WeakPolarHBondContact CB-O 3.48Å; F58-L100 HydrophobicContact CB-CD2 4.13Å
59	S	87.4	Confident	82.2	Confident	38 Å²	38	61.4 Å²	61.4	27%	0.266	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	154.1	165.3	60.1	0	0	0	0	110.2	I98 T99	S59-I98 WeakPolarHBondContact O-CA 3.32Å; S59-T99 PolarHBondContact N-O 2.81Å; S59-T99 PolarHBondContact O-N 3.13Å
60	V	92.9	Very high	80.7	Confident	7 Å²	7	63.7 Å²	63.7	4%	0.042	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	139.4	176	-174.9	0	0	0	0	108.8	L45 L48 F58 L76 L96 K97	L45-V60 HydrophobicContact CD2-CG2 3.75Å; L48-V60 HydrophobicContact CD1-CG1 4.12Å; L48-V60 HydrophobicContact CD1-CG2 3.85Å; F58-V60 HydrophobicContact CD2-CG2 3.75Å; F58-V60 HydrophobicContact CE2-CG2 3.62Å; V60-L76 HydrophobicContact CB-CB 4.3Å; V60-L76 HydrophobicContact CG1-CB 4.07Å; V60-L76 HydrophobicContact CG1-CD1 4.43Å; V60-L76 PolarHBondContact O-N 2.9Å; V60-L96 HydrophobicContact CG1-CB 4.29Å; V60-L96 HydrophobicContact CG1-CD1 4.18Å; V60-L96 HydrophobicContact CG1-CD2 4.19Å; V60-L96 HydrophobicContact CG1-CG 4.46Å; V60-K97 CarbonylContact C-O 3.29Å; V60-K97 WeakPolarHBondContact CA-O 3.29Å
61	C	91.1	Very high	80.2	Confident	14 Å²	14	61.4 Å²	61.4	10%	0.095	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	147.2	168.7	-57.3	0	0	0	0	109.2	Y73 L74 L96 K97	C61-Y73 HydrophobicContact CB-CD1 4.09Å; C61-L74 CarbonylContact C-O 3.51Å; C61-L74 WeakPolarHBondContact CA-O 3.25Å; C61-L74 VanDerWaalsContact CB-O 3.23Å; C61-L74 WeakPolarHBondContact CB-O 3.45Å; C61-L96 CarbonylContact O-C 3.59Å; C61-L96 VanDerWaalsContact O-CA 3.31Å; C61-L96 WeakPolarHBondContact O-CA 3.49Å; C61-K97 PolarHBondContact N-O 3.41Å; C61-K97 PolarHBondContact O-N 3.25Å
62	Y	91.5	Very high	79.1	Confident	11 Å²	11	62 Å²	62	4%	0.043	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	152.1	169.6	64.9	-83.9	0	0	0	111.4	A64 Y73 L74 P75 L76 D81 R95	Y62-A64 HydrophobicContact CD2-CB 4.34Å; Y62-A64 HydrophobicContact CE2-CB 4.07Å; Y62-Y73 CarbonylContact O-C 3.52Å; Y62-Y73 VanDerWaalsContact O-CA 3.28Å; Y62-Y73 WeakPolarHBondContact O-CA 3.34Å; Y62-L74 HydrophobicContact CD1-CB 4.03Å; Y62-L74 WeakPolarHBondContact CD1-O 3.35Å; Y62-L74 HydrophobicContact CD2-CB 4.47Å; Y62-L74 HydrophobicContact CE1-CB 3.6Å; Y62-L74 HydrophobicContact CE1-CD1 4.41Å; Y62-L74 HydrophobicContact CE2-CB 4.08Å; Y62-L74 HydrophobicContact CE2-CD1 3.89Å; Y62-L74 HydrophobicContact CG-CB 4.47Å; Y62-L74 PolarHBondContact N-O 2.86Å; Y62-L74 PolarHBondContact O-N 3.09Å; Y62-L74 WeakPolarHBondContact OH-CD1 3.49Å; Y62-P75 WeakPolarHBondContact CE1-O 3.01Å; Y62-L76 HydrophobicContact CD1-CB 4.01Å; Y62-L76 HydrophobicContact CD1-CD1 4.24Å; Y62-L76 HydrophobicContact CD1-CG 4.12Å; Y62-D81 HydrophobicContact CE1-CB 4.23Å; Y62-R95 WeakPolarHBondContact CA-O 3.43Å
63	L	87.1	Confident	78.7	Confident	18 Å²	18	66.6 Å²	66.6	9%	0.094	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	118.1	170	-163.6	80.1	0	0	0	109.6	Q71 F72 Y73 R95	L63-Q71 HydrophobicContact CD1-CB 4.18Å; L63-Q71 HydrophobicContact CD2-CB 4.31Å; L63-Q71 HydrophobicContact CD2-CG 4.47Å; L63-Q71 HydrophobicContact CG-CB 4.4Å; L63-F72 WeakPolarHBondContact CA-O 3.42Å; L63-Y73 HydrophobicContact CB-CD1 4.42Å; L63-Y73 HydrophobicContact CB-CE1 4.07Å; L63-Y73 HydrophobicContact CD1-CD1 4.15Å; L63-Y73 HydrophobicContact CD1-CD2 3.96Å; L63-Y73 HydrophobicContact CD1-CE1 3.83Å; L63-Y73 HydrophobicContact CD1-CE2 3.62Å; L63-Y73 HydrophobicContact CD1-CG 4.22Å; L63-R95 HydrophobicContact CB-CB 3.92Å; L63-R95 PolarHBondContact N-O 3.48Å
64	A	80.5	Confident	78.2	Confident	2 Å²	2	62.9 Å²	62.9	2%	0.017	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	161.9	166.9	0	0	0	0	0	110.2	Y62 F72 L74	Y62-A64 HydrophobicContact CD2-CB 4.34Å; Y62-A64 HydrophobicContact CE2-CB 4.07Å; A64-F72 HydrophobicContact CB-CD2 4.16Å; A64-F72 HydrophobicContact CB-CE1 4.11Å; A64-F72 HydrophobicContact CB-CE2 3.66Å; A64-F72 HydrophobicContact CB-CZ 3.62Å; A64-F72 PolarHBondContact N-O 2.86Å; A64-F72 PolarHBondContact O-N 3.29Å; A64-F72 VanDerWaalsContact O-N 3.08Å; A64-L74 HydrophobicContact CB-CD1 3.91Å; A64-L74 HydrophobicContact CB-CG 4.27Å
65	I	71.7	Confident	77.9	Confident	56 Å²	56	65.3 Å²	65.3	29%	0.287	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	136.9	175.8	-46.4	-176.4	0	0	0	107	E70 Q71	I65-E70 VanDerWaalsContact CA-O 3.31Å; I65-E70 WeakPolarHBondContact CA-O 3.47Å; I65-Q71 HydrophobicContact CG1-CG 4.29Å
66	D	65	Low	78.1	Confident	59 Å²	59	59.3 Å²	59.3	32%	0.316	30%	0.303	S	S	.	.			trans	-89.3	-175	176.3	69.4	10.2	0	0	0	113	F68 G69 E70 F72	D66-F68 PolarHBondContact O-N 2.89Å; D66-F68 WeakPolarHBondContact OD1-CA 3.22Å; D66-F68 PolarHBondContact OD1-N 3.44Å; D66-G69 PolarHBondContact O-N 3.01Å; D66-G69 PolarHBondContact OD1-N 3.47Å; D66-E70 PolarHBondContact N-O 3.01Å; D66-E70 PolarHBondContact OD1-N 3.45Å; D66-F72 HydrophobicContact CB-CE1 3.98Å
67	E	56.1	Low	78.2	Confident	176 Å²	176	62 Å²	62	82%	0.822	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-14.8	178.5	65.1	-165.4	156.4	0	0	114.3
68	F	61	Low	78	Confident	169 Å²	169	59 Å²	59	74%	0.741	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-13.8	176.2	-54.1	-70.8	0	0	0	112.6	D66	D66-F68 PolarHBondContact O-N 2.89Å; D66-F68 WeakPolarHBondContact OD1-CA 3.22Å; D66-F68 PolarHBondContact OD1-N 3.44Å
69	G	62.8	Low	77.2	Confident	43 Å²	43	60.3 Å²	60.3	44%	0.443	31%	0.308	S	S	.	.			trans	96.3	6.3	-179.2	0	0	0	0	0	114.4	D66	D66-G69 PolarHBondContact O-N 3.01Å; D66-G69 PolarHBondContact OD1-N 3.47Å
70	E	61.6	Low	76.7	Confident	140 Å²	140	67.3 Å²	67.3	65%	0.654	33%	0.329	S	S	*	.			trans	-71.2	141.5	175.9	-66.9	-147.6	156.1	0	0	111.3	I65 D66	I65-E70 VanDerWaalsContact CA-O 3.31Å; I65-E70 WeakPolarHBondContact CA-O 3.47Å; D66-E70 PolarHBondContact N-O 3.01Å; D66-E70 PolarHBondContact OD1-N 3.45Å
71	Q	78.3	Confident	76.3	Confident	123 Å²	123	68.4 Å²	68.4	58%	0.575	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.1	120.4	-173	-61.7	179.9	31.7	0	0	110.6	L63 I65	L63-Q71 HydrophobicContact CD1-CB 4.18Å; L63-Q71 HydrophobicContact CD2-CB 4.31Å; L63-Q71 HydrophobicContact CD2-CG 4.47Å; L63-Q71 HydrophobicContact CG-CB 4.4Å; I65-Q71 HydrophobicContact CG1-CG 4.29Å
72	F	69.9	Low	76.1	Confident	39 Å²	39	67.9 Å²	67.9	17%	0.171	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	158.9	-178.2	58.7	-80.1	0	0	0	111.4	L63 A64 D66 L74 W283	L63-F72 WeakPolarHBondContact CA-O 3.42Å; A64-F72 HydrophobicContact CB-CD2 4.16Å; A64-F72 HydrophobicContact CB-CE1 4.11Å; A64-F72 HydrophobicContact CB-CE2 3.66Å; A64-F72 HydrophobicContact CB-CZ 3.62Å; A64-F72 PolarHBondContact N-O 2.86Å; A64-F72 PolarHBondContact O-N 3.29Å; A64-F72 VanDerWaalsContact O-N 3.08Å; D66-F72 HydrophobicContact CB-CE1 3.98Å; F72-L74 HydrophobicContact CD2-CD2 4.21Å; F72-L74 HydrophobicContact CD2-CG 4Å; F72-L74 HydrophobicContact CE2-CD1 3.89Å; F72-L74 HydrophobicContact CE2-CD2 3.96Å; F72-L74 HydrophobicContact CE2-CG 3.71Å; F72-W283 HydrophobicContact CD2-CH2 4.04Å; F72-W283 HydrophobicContact CD2-CZ3 4.24Å; F72-W283 AromaticContact CE2-CH2 3.72Å; F72-W283 HydrophobicContact CE2-CH2 3.72Å; F72-W283 HydrophobicContact CE2-CZ3 4.33Å
73	Y	84	Confident	75.6	Confident	109 Å²	109	72 Å²	72	43%	0.427	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	126.5	178.2	-77.1	-80.8	0	0	0	111	C61 Y62 L63 K97	C61-Y73 HydrophobicContact CB-CD1 4.09Å; Y62-Y73 CarbonylContact O-C 3.52Å; Y62-Y73 VanDerWaalsContact O-CA 3.28Å; Y62-Y73 WeakPolarHBondContact O-CA 3.34Å; L63-Y73 HydrophobicContact CB-CD1 4.42Å; L63-Y73 HydrophobicContact CB-CE1 4.07Å; L63-Y73 HydrophobicContact CD1-CD1 4.15Å; L63-Y73 HydrophobicContact CD1-CD2 3.96Å; L63-Y73 HydrophobicContact CD1-CE1 3.83Å; L63-Y73 HydrophobicContact CD1-CE2 3.62Å; L63-Y73 HydrophobicContact CD1-CG 4.22Å; Y73-K97 HydrophobicContact CD1-CB 3.97Å; Y73-K97 HydrophobicContact CE1-CB 3.59Å
74	L	77.8	Confident	75.1	Confident	36 Å²	36	72.1 Å²	72.1	19%	0.188	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	144	171	-73.7	177.3	0	0	0	110.4	C61 Y62 A64 F72 W283	C61-L74 CarbonylContact C-O 3.51Å; C61-L74 WeakPolarHBondContact CA-O 3.25Å; C61-L74 VanDerWaalsContact CB-O 3.23Å; C61-L74 WeakPolarHBondContact CB-O 3.45Å; Y62-L74 HydrophobicContact CD1-CB 4.03Å; Y62-L74 WeakPolarHBondContact CD1-O 3.35Å; Y62-L74 HydrophobicContact CD2-CB 4.47Å; Y62-L74 HydrophobicContact CE1-CB 3.6Å; Y62-L74 HydrophobicContact CE1-CD1 4.41Å; Y62-L74 HydrophobicContact CE2-CB 4.08Å; Y62-L74 HydrophobicContact CE2-CD1 3.89Å; Y62-L74 HydrophobicContact CG-CB 4.47Å; Y62-L74 PolarHBondContact N-O 2.86Å; Y62-L74 PolarHBondContact O-N 3.09Å; Y62-L74 WeakPolarHBondContact OH-CD1 3.49Å; A64-L74 HydrophobicContact CB-CD1 3.91Å; A64-L74 HydrophobicContact CB-CG 4.27Å; F72-L74 HydrophobicContact CD2-CD2 4.21Å; F72-L74 HydrophobicContact CD2-CG 4Å; F72-L74 HydrophobicContact CE2-CD1 3.89Å; F72-L74 HydrophobicContact CE2-CD2 3.96Å; F72-L74 HydrophobicContact CE2-CG 3.71Å; L74-W283 HydrophobicContact CD2-CE3 4.05Å; L74-W283 HydrophobicContact CD2-CH2 3.68Å; L74-W283 HydrophobicContact CD2-CZ2 4.38Å; L74-W283 HydrophobicContact CD2-CZ3 3.48Å; L74-W283 VanDerWaalsContact CD2-CZ3 3.48Å
75	P	81.9	Confident	75.2	Confident	64 Å²	64	72 Å²	72	42%	0.416	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	143	170.7	-22.7	34	0	0	0	111.9	Y62 Q77	Y62-P75 WeakPolarHBondContact CE1-O 3.01Å; P75-Q77 HydrophobicContact CB-CG 3.87Å
76	L	87.8	Confident	75.7	Confident	1 Å²	1	70.2 Å²	70.2	1%	0.005	35%	0.347	C	S	.	.			trans	-113.5	100.3	170.5	-154.4	167.5	0	0	0	107.1	Y41 L44 V60 Y62 D81 L82 L96	Y41-L76 HydrophobicContact CD2-CD2 3.27Å; Y41-L76 HydrophobicContact CE2-CD2 3.53Å; Y41-L76 VanDerWaalsContact CE2-O 3.31Å; Y41-L76 WeakPolarHBondContact CE2-O 3.25Å; Y41-L76 HydrophobicContact CG-CD2 4.28Å; Y41-L76 PolarHBondContact OH-O 2.8Å; L44-L76 HydrophobicContact CD2-CD1 4.23Å; V60-L76 HydrophobicContact CB-CB 4.3Å; V60-L76 HydrophobicContact CG1-CB 4.07Å; V60-L76 HydrophobicContact CG1-CD1 4.43Å; V60-L76 PolarHBondContact O-N 2.9Å; Y62-L76 HydrophobicContact CD1-CB 4.01Å; Y62-L76 HydrophobicContact CD1-CD1 4.24Å; Y62-L76 HydrophobicContact CD1-CG 4.12Å; L76-D81 HydrophobicContact CD2-CB 4.36Å; L76-D81 HydrophobicContact CG-CB 4.09Å; L76-L82 HydrophobicContact CD1-CD1 4.42Å; L76-L82 HydrophobicContact CD2-CB 4.22Å; L76-L96 HydrophobicContact CD1-CD2 3.68Å
77	Q	81.5	Confident	76.1	Confident	75 Å²	75	73.2 Å²	73.2	35%	0.35	37%	0.367	S	S	.	.			trans	-121.6	-11.1	-168.8	-61.9	-172.9	-3.8	0	0	113.9	Y41 P75 D81	Y41-Q77 WeakPolarHBondContact CD1-O 3.4Å; Y41-Q77 WeakPolarHBondContact CE1-O 3.32Å; P75-Q77 HydrophobicContact CB-CG 3.87Å; Q77-D81 WeakPolarHBondContact CA-OD2 3.34Å; Q77-D81 PolarHBondContact N-OD2 2.95Å
78	S	78.1	Confident	76.8	Confident	35 Å²	35	67.5 Å²	67.5	25%	0.245	35%	0.345	C	S	.	.	S	Bend	trans	-152.1	171.4	-173.1	70.6	0	0	0	0	112.5	W80 D81 L82	S78-W80 PolarHBondContact O-N 3.34Å; S78-W80 PolarHBondContact OG-N 3.32Å; S78-D81 WeakPolarHBondContact CB-OD2 3.4Å; S78-D81 PolarHBondContact N-OD2 3.19Å; S78-D81 PolarHBondContact O-N 2.98Å; S78-D81 VanDerWaalsContact OG-CG 3.23Å; S78-D81 PolarHBondContact OG-N 3.02Å; S78-D81 PolarHBondContact OG-OD2 3.09Å; S78-L82 PolarHBondContact O-N 2.9Å; S78-L82 VanDerWaalsContact O-N 3.1Å
79	D	73.8	Confident	77.2	Confident	51 Å²	51	59.8 Å²	59.8	27%	0.273	31%	0.312	S	S	.	.	H	α-helix	trans	-60	-33.5	172	-43.7	-54.4	0	0	0	111.8	Y41 L82 D83 R473	Y41-D79 WeakPolarHBondContact CB-OD1 3.28Å; Y41-D79 PolarHBondContact N-OD1 3.46Å; Y41-D79 VanDerWaalsContact N-OD1 3.16Å; D79-L82 WeakPolarHBondContact O-CB 3.25Å; D79-L82 PolarHBondContact O-N 2.98Å; D79-D83 PolarHBondContact O-N 3.13Å; D79-R473 IonicContact OD2-CZ 3.66Å; D79-R473 IonicContact OD2-NE 3.66Å; D79-R473 IonicContact OD2-NH2 2.8Å; D79-R473 PolarHBondContact OD2-NH2 2.86Å
80	W	76.9	Confident	77.2	Confident	185 Å²	185	59.6 Å²	59.6	70%	0.701	30%	0.303	S	S	*	.	H	α-helix	trans	-70	-36.2	179.5	-166.9	87.7	0	0	0	111.7	S78 L82 D83 A84	S78-W80 PolarHBondContact O-N 3.34Å; S78-W80 PolarHBondContact OG-N 3.32Å; W80-L82 VanDerWaalsContact C-N 3.32Å; W80-D83 PolarHBondContact O-N 3.39Å; W80-A84 HydrophobicContact CZ3-CB 4.49Å; W80-A84 VanDerWaalsContact O-CB 3.25Å; W80-A84 WeakPolarHBondContact O-CB 3.46Å; W80-A84 PolarHBondContact O-N 2.9Å
81	D	83.1	Confident	77.4	Confident	30 Å²	30	58.8 Å²	58.8	16%	0.16	30%	0.304	C	S	.	.	H	α-helix	trans	-68.9	-34	172.2	-50.7	-53.9	0	0	0	111.4	Y62 L76 Q77 S78 S85	Y62-D81 HydrophobicContact CE1-CB 4.23Å; L76-D81 HydrophobicContact CD2-CB 4.36Å; L76-D81 HydrophobicContact CG-CB 4.09Å; Q77-D81 WeakPolarHBondContact CA-OD2 3.34Å; Q77-D81 PolarHBondContact N-OD2 2.95Å; S78-D81 WeakPolarHBondContact CB-OD2 3.4Å; S78-D81 PolarHBondContact N-OD2 3.19Å; S78-D81 PolarHBondContact O-N 2.98Å; S78-D81 VanDerWaalsContact OG-CG 3.23Å; S78-D81 PolarHBondContact OG-N 3.02Å; S78-D81 PolarHBondContact OG-OD2 3.09Å; D81-S85 WeakPolarHBondContact O-CB 3.46Å; D81-S85 PolarHBondContact O-N 3.47Å; D81-S85 PolarHBondContact O-OG 3.17Å
82	L	87.1	Confident	77	Confident	4 Å²	4	54.8 Å²	54.8	2%	0.021	29%	0.29	C	S	.	.	H	α-helix	trans	-63.7	-51.4	172.9	-179	50.8	0	0	0	110.5	T39 L44 L76 S78 D79 W80 A84 S85 I86 L94	T39-L82 VanDerWaalsContact O-CD2 3.28Å; T39-L82 WeakPolarHBondContact O-CD2 3.32Å; L44-L82 HydrophobicContact CB-CD2 4.38Å; L44-L82 HydrophobicContact CD2-CD1 3.61Å; L44-L82 HydrophobicContact CD2-CD2 4.09Å; L44-L82 HydrophobicContact CD2-CG 4.45Å; L76-L82 HydrophobicContact CD1-CD1 4.42Å; L76-L82 HydrophobicContact CD2-CB 4.22Å; S78-L82 PolarHBondContact O-N 2.9Å; S78-L82 VanDerWaalsContact O-N 3.1Å; D79-L82 WeakPolarHBondContact O-CB 3.25Å; D79-L82 PolarHBondContact O-N 2.98Å; W80-L82 VanDerWaalsContact C-N 3.32Å; L82-A84 PolarHBondContact O-N 2.8Å; L82-S85 PolarHBondContact O-N 3.5Å; L82-S85 VanDerWaalsContact O-N 3.17Å; L82-S85 PolarHBondContact O-OG 2.9Å; L82-I86 HydrophobicContact CD1-CD1 3.88Å; L82-I86 HydrophobicContact CD1-CG1 4.2Å; L82-I86 HydrophobicContact CG-CD1 3.9Å; L82-I86 WeakPolarHBondContact O-CD1 3.44Å; L82-I86 VanDerWaalsContact O-CG1 3.28Å; L82-I86 WeakPolarHBondContact O-CG1 3.49Å; L82-I86 PolarHBondContact O-N 3.42Å; L82-L94 HydrophobicContact CD1-CD2 3.86Å
83	D	80.7	Confident	77.7	Confident	96 Å²	96	55 Å²	55	51%	0.513	29%	0.294	S	S	.	.	H	α-helix	trans	-56.9	-48	175.3	-79	-26.8	0	0	0	111.9	D79 W80 S85 I86 V87	D79-D83 PolarHBondContact O-N 3.13Å; W80-D83 PolarHBondContact O-N 3.39Å; D83-S85 VanDerWaalsContact C-N 3.32Å; D83-S85 PolarHBondContact O-N 2.87Å; D83-I86 PolarHBondContact O-N 3.29Å; D83-I86 VanDerWaalsContact O-N 3.17Å; D83-V87 WeakPolarHBondContact O-CG2 3.45Å; D83-V87 PolarHBondContact O-N 2.84Å
84	A	77.1	Confident	78	Confident	22 Å²	22	49.8 Å²	49.8	18%	0.182	27%	0.274	C	S	.	.	H	α-helix	trans	-60.6	-39.9	176.4	0	0	0	0	0	112.2	W80 L82 V87 T88	W80-A84 HydrophobicContact CZ3-CB 4.49Å; W80-A84 VanDerWaalsContact O-CB 3.25Å; W80-A84 WeakPolarHBondContact O-CB 3.46Å; W80-A84 PolarHBondContact O-N 2.9Å; L82-A84 PolarHBondContact O-N 2.8Å; A84-V87 PolarHBondContact O-N 2.96Å; A84-T88 WeakPolarHBondContact O-CB 3.35Å; A84-T88 WeakPolarHBondContact O-CG2 3.45Å; A84-T88 PolarHBondContact O-N 3.27Å; A84-T88 PolarHBondContact O-OG1 2.95Å
85	S	82.8	Confident	78.6	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-67.6	-33.7	175.7	80.1	0	0	0	0	113	D81 L82 D83 T88 S89 L94	D81-S85 WeakPolarHBondContact O-CB 3.46Å; D81-S85 PolarHBondContact O-N 3.47Å; D81-S85 PolarHBondContact O-OG 3.17Å; L82-S85 PolarHBondContact O-N 3.5Å; L82-S85 VanDerWaalsContact O-N 3.17Å; L82-S85 PolarHBondContact O-OG 2.9Å; D83-S85 VanDerWaalsContact C-N 3.32Å; D83-S85 PolarHBondContact O-N 2.87Å; S85-T88 WeakPolarHBondContact CA-OG1 3.31Å; S85-T88 PolarHBondContact O-OG1 3.38Å; S85-S89 VanDerWaalsContact O-CB 3.22Å; S85-S89 WeakPolarHBondContact O-CB 3.43Å; S85-S89 PolarHBondContact O-N 3.2Å; S85-S89 PolarHBondContact O-OG 2.93Å; S85-L94 WeakPolarHBondContact OG-CD1 3.48Å
86	I	81.4	Confident	79.3	Confident	18 Å²	18	48.8 Å²	48.8	9%	0.092	26%	0.259	C	S	.	.	H	α-helix	trans	-69.3	-45.1	174.8	-67.8	158.2	0	0	0	109.6	R11 V14 P36 L82 D83 S89 L94	R11-I86 PolarHBondContact NH1-O 3.05Å; V14-I86 HydrophobicContact CG1-CG1 4.44Å; V14-I86 HydrophobicContact CG2-CG1 4.31Å; V14-I86 HydrophobicContact CG2-CG2 3.87Å; P36-I86 HydrophobicContact CB-CD1 3.73Å; L82-I86 HydrophobicContact CD1-CD1 3.88Å; L82-I86 HydrophobicContact CD1-CG1 4.2Å; L82-I86 HydrophobicContact CG-CD1 3.9Å; L82-I86 WeakPolarHBondContact O-CD1 3.44Å; L82-I86 VanDerWaalsContact O-CG1 3.28Å; L82-I86 WeakPolarHBondContact O-CG1 3.49Å; L82-I86 PolarHBondContact O-N 3.42Å; D83-I86 PolarHBondContact O-N 3.29Å; D83-I86 VanDerWaalsContact O-N 3.17Å; I86-S89 PolarHBondContact O-N 3.4Å; I86-S89 PolarHBondContact O-OG 2.85Å; I86-L94 HydrophobicContact CG1-CD2 4.49Å
87	V	73.3	Confident	79.5	Confident	121 Å²	121	51.7 Å²	51.7	73%	0.733	27%	0.272	S	S	*	.	H	α-helix	trans	-64.1	-43.1	177.8	172.5	0	0	0	0	112.1	D83 A84 S89	D83-V87 WeakPolarHBondContact O-CG2 3.45Å; D83-V87 PolarHBondContact O-N 2.84Å; A84-V87 PolarHBondContact O-N 2.96Å; V87-S89 VanDerWaalsContact C-N 3.34Å
88	T	70.7	Confident	80.1	Confident	56 Å²	56	48.1 Å²	48.1	34%	0.344	26%	0.255	S	S	.	.	H	α-helix	trans	-78.4	-13.2	179.7	52.6	0	0	0	0	114	A84 S85 S90	A84-T88 WeakPolarHBondContact O-CB 3.35Å; A84-T88 WeakPolarHBondContact O-CG2 3.45Å; A84-T88 PolarHBondContact O-N 3.27Å; A84-T88 PolarHBondContact O-OG1 2.95Å; S85-T88 WeakPolarHBondContact CA-OG1 3.31Å; S85-T88 PolarHBondContact O-OG1 3.38Å; T88-S90 PolarHBondContact O-N 2.95Å
89	S	71.3	Confident	80.5	Confident	8 Å²	8	48.2 Å²	48.2	6%	0.056	25%	0.254	C	S	.	.			trans	-72	116	179.4	63.4	0	0	0	0	113.5	R11 S85 I86 V87	R11-S89 PolarHBondContact NH1-O 3.35Å; R11-S89 PolarHBondContact NH1-OG 3.06Å; R11-S89 PolarHBondContact NH2-O 3.49Å; S85-S89 VanDerWaalsContact O-CB 3.22Å; S85-S89 WeakPolarHBondContact O-CB 3.43Å; S85-S89 PolarHBondContact O-N 3.2Å; S85-S89 PolarHBondContact O-OG 2.93Å; I86-S89 PolarHBondContact O-N 3.4Å; I86-S89 PolarHBondContact O-OG 2.85Å; V87-S89 VanDerWaalsContact C-N 3.34Å
90	S	61	Low	81.2	Confident	38 Å²	38	48.7 Å²	48.7	27%	0.266	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-59	148.1	164.6	63	0	0	0	0	111.4	T88 S92 T93	T88-S90 PolarHBondContact O-N 2.95Å; S90-S92 PolarHBondContact O-N 3.05Å; S90-S92 VanDerWaalsContact O-N 3.12Å; S90-T93 PolarHBondContact O-N 2.76Å
91	D	67.2	Low	81.1	Confident	123 Å²	123	45.3 Å²	45.3	66%	0.658	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	55.1	32.2	168.8	-41	-42.2	0	0	0	115.1	T93	D91-T93 PolarHBondContact O-N 2.97Å; D91-T93 PolarHBondContact O-OG1 3.28Å
92	S	69	Low	80.2	Confident	40 Å²	40	48.5 Å²	48.5	28%	0.28	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	55.4	12.8	-174.9	69.7	0	0	0	0	115.5	Y15 S90	Y15-S92 PolarHBondContact N-O 3.43Å; S90-S92 PolarHBondContact O-N 3.05Å; S90-S92 VanDerWaalsContact O-N 3.12Å
93	T	84.5	Confident	78.4	Confident	42 Å²	42	54.5 Å²	54.5	26%	0.258	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	94.5	-168	-58.6	0	0	0	0	111	Y15 K17 S90 D91 R95	Y15-T93 CarbonylContact O-C 3.51Å; Y15-T93 WeakPolarHBondContact O-CA 3.1Å; K17-T93 HydrophobicContact CB-CG2 4.15Å; S90-T93 PolarHBondContact O-N 2.76Å; D91-T93 PolarHBondContact O-N 2.97Å; D91-T93 PolarHBondContact O-OG1 3.28Å; T93-R95 HydrophobicContact CG2-CG 4.45Å; T93-R95 PolarHBondContact O-N 3.16Å
94	L	90	Very high	76.5	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.005	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	112.6	174.1	175.3	54.7	0	0	0	110.1	V14 Y15 I16 K17 L82 S85 I86 L96	V14-L94 HydrophobicContact CG1-CB 3.82Å; Y15-L94 PolarHBondContact O-N 2.8Å; I16-L94 WeakPolarHBondContact CA-O 3.48Å; I16-L94 HydrophobicContact CD1-CD2 4.21Å; I16-L94 HydrophobicContact CG1-CB 4.34Å; I16-L94 HydrophobicContact CG1-CD2 4.35Å; K17-L94 PolarHBondContact N-O 3.27Å; L82-L94 HydrophobicContact CD1-CD2 3.86Å; S85-L94 WeakPolarHBondContact OG-CD1 3.48Å; I86-L94 HydrophobicContact CG1-CD2 4.49Å; L94-L96 HydrophobicContact CD1-CD2 3.7Å; L94-L96 HydrophobicContact CD1-CG 4.44Å; L94-L96 HydrophobicContact CD2-CD1 4.49Å; L94-L96 HydrophobicContact CD2-CD2 4.12Å; L94-L96 HydrophobicContact CD2-CG 4.45Å; L94-L96 HydrophobicContact CG-CD2 3.74Å; L94-L96 HydrophobicContact CG-CG 4.01Å
95	R	91.9	Very high	74.6	Confident	77 Å²	77	59.3 Å²	59.3	29%	0.291	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	115.4	-179.6	-57.1	174.3	-167.2	171.5	6.2	109.1	K17 Y62 L63 T93	K17-R95 WeakPolarHBondContact O-CA 3.38Å; Y62-R95 WeakPolarHBondContact CA-O 3.43Å; L63-R95 HydrophobicContact CB-CB 3.92Å; L63-R95 PolarHBondContact N-O 3.48Å; T93-R95 HydrophobicContact CG2-CG 4.45Å; T93-R95 PolarHBondContact O-N 3.16Å
96	L	95.4	Very high	72	Confident	2 Å²	2	66.7 Å²	66.7	1%	0.01	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	140.4	-177.4	-59.5	-178	0	0	0	111.5	I16 K17 A18 K19 L44 L48 V60 C61 L76 L94	I16-L96 HydrophobicContact CD1-CD1 4.31Å; I16-L96 HydrophobicContact CG2-CD1 3.76Å; I16-L96 HydrophobicContact CG2-CG 4.13Å; K17-L96 PolarHBondContact O-N 2.9Å; A18-L96 CarbonylContact C-O 3.45Å; A18-L96 WeakPolarHBondContact CA-O 3.33Å; A18-L96 HydrophobicContact CB-CB 4.32Å; K19-L96 PolarHBondContact N-O 2.96Å; L44-L96 HydrophobicContact CD1-CD1 4.27Å; L44-L96 HydrophobicContact CD2-CD1 4.16Å; L48-L96 HydrophobicContact CD1-CD1 3.9Å; L48-L96 HydrophobicContact CD2-CD1 4.12Å; V60-L96 HydrophobicContact CG1-CB 4.29Å; V60-L96 HydrophobicContact CG1-CD1 4.18Å; V60-L96 HydrophobicContact CG1-CD2 4.19Å; V60-L96 HydrophobicContact CG1-CG 4.46Å; C61-L96 CarbonylContact O-C 3.59Å; C61-L96 VanDerWaalsContact O-CA 3.31Å; C61-L96 WeakPolarHBondContact O-CA 3.49Å; L76-L96 HydrophobicContact CD1-CD2 3.68Å; L94-L96 HydrophobicContact CD1-CD2 3.7Å; L94-L96 HydrophobicContact CD1-CG 4.44Å; L94-L96 HydrophobicContact CD2-CD1 4.49Å; L94-L96 HydrophobicContact CD2-CD2 4.12Å; L94-L96 HydrophobicContact CD2-CG 4.45Å; L94-L96 HydrophobicContact CG-CD2 3.74Å; L94-L96 HydrophobicContact CG-CG 4.01Å
97	K	92.6	Very high	69.7	Low	62 Å²	62	73.2 Å²	73.2	27%	0.27	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	126.5	166.3	-177.5	-177.3	175.7	-172.9	0	109	K19 V60 C61 Y73	K19-K97 CarbonylContact O-C 3.55Å; K19-K97 WeakPolarHBondContact O-CA 3.49Å; V60-K97 CarbonylContact C-O 3.29Å; V60-K97 WeakPolarHBondContact CA-O 3.29Å; C61-K97 PolarHBondContact N-O 3.41Å; C61-K97 PolarHBondContact O-N 3.25Å; Y73-K97 HydrophobicContact CD1-CB 3.97Å; Y73-K97 HydrophobicContact CE1-CB 3.59Å
98	I	93.7	Very high	67.4	Low	0 Å²	0	76 Å²	76	0%	0	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	133.8	174	-50.4	168.6	0	0	0	107.7	A18 K19 L20 S21 L48 F52 I54 F58 S59	A18-I98 HydrophobicContact CB-CD1 4.38Å; K19-I98 PolarHBondContact O-N 3.41Å; L20-I98 HydrophobicContact CB-CB 4.42Å; L20-I98 HydrophobicContact CD1-CB 3.9Å; L20-I98 HydrophobicContact CD1-CG2 3.78Å; S21-I98 PolarHBondContact N-O 3.49Å; L48-I98 HydrophobicContact CB-CD1 4.32Å; L48-I98 HydrophobicContact CD2-CD1 4.06Å; F52-I98 HydrophobicContact CD2-CD1 3.43Å; F52-I98 VanDerWaalsContact CD2-CD1 3.43Å; F52-I98 HydrophobicContact CE2-CD1 3.42Å; F52-I98 VanDerWaalsContact CE2-CD1 3.42Å; F52-I98 HydrophobicContact CG-CD1 4.19Å; F52-I98 HydrophobicContact CZ-CD1 4.15Å; I54-I98 HydrophobicContact CD1-CD1 4.39Å; I54-I98 HydrophobicContact CD1-CG2 3.97Å; F58-I98 HydrophobicContact CB-CG2 3.88Å; F58-I98 HydrophobicContact CD2-CG2 3.67Å; F58-I98 HydrophobicContact CE2-CG2 4.43Å; F58-I98 HydrophobicContact CG-CG2 4Å; S59-I98 WeakPolarHBondContact O-CA 3.32Å
99	T	87.9	Confident	65.3	Low	37 Å²	37	79.9 Å²	79.9	23%	0.227	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	125.3	171.5	-45.1	0	0	0	0	108	F58 S59	F58-T99 CarbonylContact C-O 3.55Å; F58-T99 WeakPolarHBondContact CA-O 3.42Å; F58-T99 VanDerWaalsContact CB-O 3.31Å; F58-T99 WeakPolarHBondContact CB-O 3.48Å; S59-T99 PolarHBondContact N-O 2.81Å; S59-T99 PolarHBondContact O-N 3.13Å
100	L	87.3	Confident	63.2	Low	60 Å²	60	91.3 Å²	91.3	31%	0.314	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	143.1	173.9	-54.5	-171.3	0	0	0	109.4	L20 I54 F58	L20-L100 HydrophobicContact CD1-CD2 3.57Å; L20-L100 HydrophobicContact CD1-CG 3.86Å; L20-L100 HydrophobicContact CD2-CD2 4.5Å; I54-L100 HydrophobicContact CD1-CD2 4.06Å; I54-L100 HydrophobicContact CG1-CD2 4.29Å; I54-L100 HydrophobicContact CG2-CD2 3.73Å; F58-L100 HydrophobicContact CB-CD2 4.13Å
101	K	74.7	Confident	61.4	Low	114 Å²	114	95.9 Å²	95.9	50%	0.496	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-81.5	135	164.5	-62.2	-170.8	-174.8	178.6	0	107.9	D57 K103	D57-K101 HydrophobicContact CB-CB 4.35Å; D57-K101 HydrophobicContact CB-CD 3.99Å; D57-K101 HydrophobicContact CB-CG 4.36Å; D57-K101 PolarHBondContact O-N 2.88Å; K101-K103 PolarHBondContact O-N 3.07Å
102	P	64.9	Low	59.6	Low	97 Å²	97	97.2 Å²	97.2	63%	0.63	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-52.9	135.1	174	-27.3	35.3	0	0	0	111.1	V104	P102-V104 PolarHBondContact O-N 3.17Å
103	K	48.8	Very low	57.4	Low	131 Å²	131	102.4 Å²	102.4	57%	0.57	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-73	120.6	165.5	-68.5	-169.7	-177.9	-174.8	0	107	N55 C56 K101 S105	N55-K103 VanDerWaalsContact O-CE 3.27Å; N55-K103 WeakPolarHBondContact O-CE 3.49Å; N55-K103 PolarHBondContact O-NZ 2.87Å; N55-K103 PolarHBondContact OD1-NZ 3.35Å; C56-K103 HydrophobicContact CB-CD 4.41Å; C56-K103 VanDerWaalsContact CB-CE 3.43Å; C56-K103 HydrophobicContact CB-CG 4.04Å; K101-K103 PolarHBondContact O-N 3.07Å; K103-S105 PolarHBondContact O-N 3.49Å
104	V	41.7	Very low	54.6	Low	121 Å²	121	107.2 Å²	107.2	73%	0.733	54%	0.542	S	S	*	.			trans	-75	80.8	170.6	-175.8	0	0	0	0	107.8	P102 L107	P102-V104 PolarHBondContact O-N 3.17Å; V104-L107 HydrophobicContact CG1-CD1 4.02Å
105	S	36.3	Very low	51.4	Low	98 Å²	98	112.5 Å²	112.5	69%	0.685	58%	0.576	S	S	*	*			trans	-68.5	127.8	161.7	-74.2	0	0	0	0	108.1	K103	K103-S105 PolarHBondContact O-N 3.49Å
106	D	28.8	Very low	48.1	Very low	155 Å²	155	115.1 Å²	115.1	83%	0.829	61%	0.606	S	S	*	*			trans	102	42.4	175.6	-54.5	-6	0	0	0	117.2
107	L	33.3	Very low	44.8	Very low	155 Å²	155	118.3 Å²	118.3	81%	0.812	64%	0.639	S	S	*	*			trans	-116	131.2	137.7	-81.5	91.2	0	0	0	109.6	V104	V104-L107 HydrophobicContact CG1-CD1 4.02Å
108	Q	24.5	Very low	41.6	Very low	180 Å²	180	121.2 Å²	121.2	84%	0.841	66%	0.662	S	S	*	*			trans	-77.7	161.8	-171.3	-69.4	172.6	-15.2	0	0	113
109	D	26.4	Very low	38.2	Very low	137 Å²	137	129.7 Å²	129.7	73%	0.733	70%	0.702	S	S	*	*			trans	-55.6	139.4	-174.4	-53.4	-77.5	0	0	0	113.9
110	W	26.8	Very low	35.1	Very low	248 Å²	248	133.2 Å²	133.2	94%	0.939	73%	0.727	S	S	*	*			trans	-128.8	101.2	151.6	-82.7	94.1	0	0	0	108.2	I112	W110-I112 PolarHBondContact O-N 3.12Å
111	D	23.7	Very low	32.1	Very low	134 Å²	134	138.8 Å²	138.8	72%	0.717	76%	0.756	S	S	*	*			trans	-57.6	129.3	-175.5	-72.5	-70.2	0	0	0	113
112	I	29.1	Very low	29.4	Very low	151 Å²	151	138.3 Å²	138.3	77%	0.774	77%	0.767	S	S	*	*			trans	-124.1	88.8	159.6	-58	-177.8	0	0	0	107.9	W110 I114	W110-I112 PolarHBondContact O-N 3.12Å; I112-I114 PolarHBondContact O-N 3.11Å
113	I	24.3	Very low	27.4	Very low	149 Å²	149	145 Å²	145	76%	0.764	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-64.9	116.5	174.2	-59.1	173.9	0	0	0	108.4	P115	I113-P115 WeakPolarHBondContact O-CD 3.31Å
114	I	24.9	Very low	26	Very low	143 Å²	143	148.1 Å²	148.1	73%	0.733	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-89.2	117.4	176.7	-58.1	176.7	0	0	0	109.2	I112 S116	I112-I114 PolarHBondContact O-N 3.11Å; I114-S116 PolarHBondContact O-N 2.75Å
115	P	23.1	Very low	25	Very low	112 Å²	112	152.8 Å²	152.8	73%	0.727	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-66.9	131.6	175.8	-21	34.7	0	0	0	111.9	I113 G117	I113-P115 WeakPolarHBondContact O-CD 3.31Å; P115-G117 PolarHBondContact O-N 2.89Å
116	S	22.7	Very low	24.2	Very low	131 Å²	131	156 Å²	156	92%	0.916	79%	0.794	S	S	*	*			trans	-69.5	113.6	178.2	-65.7	0	0	0	0	111.3	I114	I114-S116 PolarHBondContact O-N 2.75Å
117	G	26.1	Very low	23.9	Very low	69 Å²	69	152.1 Å²	152.1	71%	0.711	78%	0.779	S	S	*	*			trans	-143.6	46.7	-160.9	0	0	0	0	0	118.2	P115	P115-G117 PolarHBondContact O-N 2.89Å
118	V	24.1	Very low	23.4	Very low	123 Å²	123	151.6 Å²	151.6	75%	0.745	77%	0.772	S	S	*	*			trans	60.3	101.8	150.8	-175	0	0	0	0	119.5
119	Q	23.8	Very low	23.4	Very low	179 Å²	179	148.9 Å²	148.9	84%	0.836	76%	0.763	S	S	*	*			trans	62.2	117.7	133.2	-59.5	175.8	4.7	0	0	122.6
120	S	21.3	Very low	23.1	Very low	110 Å²	110	148.3 Å²	148.3	77%	0.769	76%	0.761	S	S	*	*			trans	-41.5	156.1	151.9	55.8	0	0	0	0	118.1
121	I	24.1	Very low	23	Very low	177 Å²	177	142.8 Å²	142.8	91%	0.908	76%	0.755	S	S	*	*			trans	-143	155.3	137.5	-104.5	156.9	0	0	0	109.5
122	S	19.5	Very low	22.9	Very low	105 Å²	105	145.4 Å²	145.4	73%	0.734	76%	0.76	S	S	*	*			trans	-133.4	143.2	-170.3	170.8	0	0	0	0	112.9
123	R	21.7	Very low	22.6	Very low	238 Å²	238	146.2 Å²	146.2	90%	0.898	77%	0.765	S	S	*	*			trans	-176.1	160.3	156.5	-96.9	142.4	-172.7	-168.3	3.7	111.6
124	R	20	Very low	22.4	Very low	195 Å²	195	146.3 Å²	146.3	74%	0.736	77%	0.767	S	S	*	*			cis	178.1	113.9	-41.6	166.1	-177.8	151.6	151.6	-4.7	110.5
125	R	19.7	Very low	22.3	Very low	219 Å²	219	147.9 Å²	147.9	83%	0.826	78%	0.776	S	S	*	*			trans	58	177.4	164.6	-63.7	173.3	166.8	156.3	-4.6	113.3
126	K	21.1	Very low	22.2	Very low	166 Å²	166	148 Å²	148	72%	0.722	78%	0.775	S	S	*	*			cis	-154.5	161.3	11.7	-135.6	-142.5	145.7	-146.9	0	104.5
127	S	21.7	Very low	22.2	Very low	74 Å²	74	152 Å²	152	52%	0.517	78%	0.776	S	S	.	*			cis	165.6	-176.7	-15.8	52.7	0	0	0	0	109.1
128	Q	23.3	Very low	22.2	Very low	144 Å²	144	155.9 Å²	155.9	67%	0.673	78%	0.781	S	S	*	*			trans	78.4	152.3	163.7	-63.1	-173.1	-103.5	0	0	115.7
129	N	23.3	Very low	22.2	Very low	122 Å²	122	155.2 Å²	155.2	65%	0.652	77%	0.773	S	S	*	*			cis	-150.3	175.7	-2.7	-131.7	47.2	0	0	0	113.8
130	D	21.8	Very low	22.4	Very low	126 Å²	126	156.7 Å²	156.7	67%	0.674	78%	0.777	S	S	*	*			trans	-70.3	167	-178.5	-39.2	-97.2	0	0	0	116.4
131	T	24.4	Very low	22.7	Very low	132 Å²	132	159.8 Å²	159.8	81%	0.81	78%	0.777	S	S	*	*			trans	168.6	100.8	130.8	-69.3	0	0	0	0	108.3
132	K	20.6	Very low	22.8	Very low	189 Å²	189	153.9 Å²	153.9	82%	0.822	76%	0.76	S	S	*	*				54.3	115.7	80.2	-79.2	-161	173.2	-166	0	116.4
133	N	23.8	Very low	23.3	Very low	168 Å²	168	153.1 Å²	153.1	90%	0.898	75%	0.752	S	S	*	*			trans	-158.6	143.9	141.1	-104.5	-17.5	0	0	0	109.9
134	D	19.9	Very low	24.1	Very low	151 Å²	151	145.2 Å²	145.2	81%	0.807	73%	0.733	S	S	*	*			trans	-90.2	154.8	176.4	-65.1	-74.2	0	0	0	111.5
135	L	23.1	Very low	25.2	Very low	175 Å²	175	142.3 Å²	142.3	92%	0.916	73%	0.731	S	S	*	*			trans	-163.9	146.3	133.1	-106.8	170.6	0	0	0	110.2
136	T	20.6	Very low	26.5	Very low	114 Å²	114	137.6 Å²	137.6	70%	0.699	72%	0.717	S	S	*	*			trans	-110.6	144	-168.4	50	0	0	0	0	112.6
137	F	22.8	Very low	27.8	Very low	216 Å²	216	131.8 Å²	131.8	95%	0.947	70%	0.698	S	S	*	*			trans	-142.4	154.3	161.9	-119.9	-91.7	0	0	0	110.9
138	N	26.1	Very low	29.4	Very low	150 Å²	150	131.8 Å²	131.8	80%	0.802	69%	0.689	S	S	*	*			trans	-90.1	159.3	-155.4	-78.9	-27.4	0	0	0	116.6
139	D	24	Very low	31	Very low	110 Å²	110	126.8 Å²	126.8	59%	0.588	67%	0.667	S	S	*	*			trans	-41.5	132.8	170.6	-83.8	-41.3	0	0	0	115	K141	D139-K141 HydrophobicContact CB-CG 4.47Å; D139-K141 VanDerWaalsContact CG-NZ 3.28Å; D139-K141 VanDerWaalsContact OD1-CE 3.22Å; D139-K141 WeakPolarHBondContact OD1-CE 3.21Å; D139-K141 IonicContact OD1-NZ 2.83Å; D139-K141 PolarHBondContact OD1-NZ 2.69Å; D139-K141 WeakPolarHBondContact OD2-CE 3.19Å; D139-K141 IonicContact OD2-NZ 3.31Å; D139-K141 PolarHBondContact OD2-NZ 3.19Å
140	F	28.3	Very low	32.7	Very low	209 Å²	209	122 Å²	122	92%	0.917	64%	0.642	S	S	*	*			trans	-123.4	101.6	144.5	-98.4	-87.4	0	0	0	109.4	G142	F140-G142 PolarHBondContact O-N 2.93Å
141	K	26.2	Very low	35	Very low	176 Å²	176	120.5 Å²	120.5	77%	0.765	63%	0.631	S	S	*	*			trans	-87.9	90	-176.9	-78.5	165.7	172.5	148.1	0	111.1	D139	D139-K141 HydrophobicContact CB-CG 4.47Å; D139-K141 VanDerWaalsContact CG-NZ 3.28Å; D139-K141 VanDerWaalsContact OD1-CE 3.22Å; D139-K141 WeakPolarHBondContact OD1-CE 3.21Å; D139-K141 IonicContact OD1-NZ 2.83Å; D139-K141 PolarHBondContact OD1-NZ 2.69Å; D139-K141 WeakPolarHBondContact OD2-CE 3.19Å; D139-K141 IonicContact OD2-NZ 3.31Å; D139-K141 PolarHBondContact OD2-NZ 3.19Å
142	G	27.2	Very low	37.2	Very low	53 Å²	53	120.7 Å²	120.7	55%	0.546	62%	0.617	S	S	.	*	S	Bend	trans	-141.2	167.8	168.5	0	0	0	0	0	111.4	F140 S144	F140-G142 PolarHBondContact O-N 2.93Å; G142-S144 PolarHBondContact O-N 3.28Å
143	P	30.7	Very low	39.6	Very low	88 Å²	88	112 Å²	112	57%	0.571	58%	0.579	S	S	*	*	S	Bend	trans	-58.9	139.1	168.7	27.2	-33.3	0	0	0	109	Q148	P143-Q148 HydrophobicContact CG-CG 4.15Å; P143-Q148 PolarHBondContact O-NE2 3.15Å
144	S	38.4	Very low	42	Very low	72 Å²	72	109 Å²	109	50%	0.503	56%	0.56	S	S	.	*			trans	-54.4	145.4	-172.1	60.5	0	0	0	0	112	G142 F146 S147 Q148	G142-S144 PolarHBondContact O-N 3.28Å; S144-F146 PolarHBondContact O-N 3.48Å; S144-F146 VanDerWaalsContact O-N 3.14Å; S144-S147 WeakPolarHBondContact O-CB 3.26Å; S144-S147 PolarHBondContact O-N 3.41Å; S144-S147 PolarHBondContact OG-N 3.4Å; S144-Q148 PolarHBondContact O-N 2.82Å; S144-Q148 VanDerWaalsContact O-N 3.13Å
145	L	42.4	Very low	44.9	Very low	134 Å²	134	107.2 Å²	107.2	70%	0.702	55%	0.545	S	S	*	.	H	α-helix	trans	-49.5	-42.4	177.4	-75.2	166.8	0	0	0	111.2	S147 Q148 I149	L145-S147 PolarHBondContact O-N 2.97Å; L145-Q148 PolarHBondContact O-N 3.39Å; L145-Q148 VanDerWaalsContact O-N 3.14Å; L145-I149 HydrophobicContact CB-CD1 4.5Å; L145-I149 WeakPolarHBondContact O-CB 3.12Å; L145-I149 VanDerWaalsContact O-CG1 3.3Å; L145-I149 WeakPolarHBondContact O-CG1 3.5Å; L145-I149 PolarHBondContact O-N 3Å
146	F	47.5	Very low	47.3	Very low	121 Å²	121	99.9 Å²	99.9	53%	0.531	51%	0.508	S	S	.	.	H	α-helix	trans	-49.7	-50.9	171.5	-177.4	-94.8	0	0	0	113.6	S144 Q148 I149 T150 Q638	S144-F146 PolarHBondContact O-N 3.48Å; S144-F146 VanDerWaalsContact O-N 3.14Å; F146-Q148 VanDerWaalsContact C-N 3.34Å; F146-Q148 PolarHBondContact O-N 2.94Å; F146-I149 PolarHBondContact O-N 2.72Å; F146-T150 WeakPolarHBondContact O-CB 3.13Å; F146-T150 PolarHBondContact O-N 3.35Å; F146-T150 PolarHBondContact O-OG1 3.04Å; F146-Q638 HydrophobicContact CE2-CG 4.46Å
147	S	47.7	Very low	49.8	Very low	44 Å²	44	95 Å²	95	31%	0.308	48%	0.477	S	S	.	.	H	α-helix	trans	-65.8	-36.5	179.5	-174.5	0	0	0	0	112.1	S144 L145 Q151	S144-S147 WeakPolarHBondContact O-CB 3.26Å; S144-S147 PolarHBondContact O-N 3.41Å; S144-S147 PolarHBondContact OG-N 3.4Å; L145-S147 PolarHBondContact O-N 2.97Å; S147-Q151 WeakPolarHBondContact O-CB 3.41Å; S147-Q151 WeakPolarHBondContact O-CG 3.38Å; S147-Q151 PolarHBondContact O-N 3.16Å; S147-Q151 VanDerWaalsContact O-N 3.16Å
148	Q	56.2	Low	52.3	Low	73 Å²	73	87.3 Å²	87.3	34%	0.341	45%	0.454	S	S	.	.	H	α-helix	trans	-68.6	-45.4	177.1	-60.4	-173	44.4	0	0	112	P143 S144 L145 F146 Q151 R152	P143-Q148 HydrophobicContact CG-CG 4.15Å; P143-Q148 PolarHBondContact O-NE2 3.15Å; S144-Q148 PolarHBondContact O-N 2.82Å; S144-Q148 VanDerWaalsContact O-N 3.13Å; L145-Q148 PolarHBondContact O-N 3.39Å; L145-Q148 VanDerWaalsContact O-N 3.14Å; F146-Q148 VanDerWaalsContact C-N 3.34Å; F146-Q148 PolarHBondContact O-N 2.94Å; Q148-Q151 PolarHBondContact O-N 2.72Å; Q148-R152 WeakPolarHBondContact O-CG 3.41Å; Q148-R152 PolarHBondContact O-N 2.92Å; Q148-R152 VanDerWaalsContact O-N 3.14Å
149	I	56.2	Low	54.6	Low	39 Å²	39	84.9 Å²	84.9	20%	0.2	44%	0.441	C	S	.	.	H	α-helix	trans	-63.1	-48.6	178.5	-69.9	165.8	0	0	0	110.4	L145 F146 Q151 R152 F153	L145-I149 HydrophobicContact CB-CD1 4.5Å; L145-I149 WeakPolarHBondContact O-CB 3.12Å; L145-I149 VanDerWaalsContact O-CG1 3.3Å; L145-I149 WeakPolarHBondContact O-CG1 3.5Å; L145-I149 PolarHBondContact O-N 3Å; F146-I149 PolarHBondContact O-N 2.72Å; I149-Q151 PolarHBondContact O-N 2.76Å; I149-R152 WeakPolarHBondContact O-CB 3.27Å; I149-R152 PolarHBondContact O-N 2.84Å; I149-F153 HydrophobicContact CG2-CD2 3.67Å; I149-F153 HydrophobicContact CG2-CE2 3.37Å; I149-F153 HydrophobicContact CG2-CZ 4.47Å; I149-F153 WeakPolarHBondContact O-CD2 3.49Å; I149-F153 PolarHBondContact O-N 2.65Å
150	T	57.7	Low	56.3	Low	23 Å²	23	80.8 Å²	80.8	14%	0.141	42%	0.419	C	S	.	.	H	α-helix	trans	-54	-50.9	177	-51.4	0	0	0	0	111.2	F146 R152 F153 E154 Q642	F146-T150 WeakPolarHBondContact O-CB 3.13Å; F146-T150 PolarHBondContact O-N 3.35Å; F146-T150 PolarHBondContact O-OG1 3.04Å; T150-R152 PolarHBondContact O-N 3.39Å; T150-F153 PolarHBondContact O-N 2.89Å; T150-E154 WeakPolarHBondContact O-CG 3.25Å; T150-E154 PolarHBondContact O-N 3.48Å; T150-Q642 PolarHBondContact OG1-NE2 3.24Å
151	Q	71	Confident	58	Low	93 Å²	93	77 Å²	77	44%	0.435	40%	0.399	S	S	.	.	H	α-helix	trans	-65.8	-23.3	179.3	-76.9	-168.1	28.1	0	0	114	S147 Q148 I149 K155	S147-Q151 WeakPolarHBondContact O-CB 3.41Å; S147-Q151 WeakPolarHBondContact O-CG 3.38Å; S147-Q151 PolarHBondContact O-N 3.16Å; S147-Q151 VanDerWaalsContact O-N 3.16Å; Q148-Q151 PolarHBondContact O-N 2.72Å; I149-Q151 PolarHBondContact O-N 2.76Å; Q151-K155 VanDerWaalsContact O-CB 3.3Å; Q151-K155 WeakPolarHBondContact O-CB 3.33Å; Q151-K155 WeakPolarHBondContact O-CD 3.29Å; Q151-K155 WeakPolarHBondContact O-CE 3.33Å; Q151-K155 WeakPolarHBondContact O-CG 3.47Å; Q151-K155 PolarHBondContact O-N 2.95Å
152	R	69.9	Low	59.8	Low	136 Å²	136	76.8 Å²	76.8	51%	0.513	40%	0.398	S	S	.	.	H	α-helix	trans	-73.8	-52.3	171.9	-71	176	-166.4	-176.9	5.7	110.2	Q148 I149 T150 E154 K155 T156 E629	Q148-R152 WeakPolarHBondContact O-CG 3.41Å; Q148-R152 PolarHBondContact O-N 2.92Å; Q148-R152 VanDerWaalsContact O-N 3.14Å; I149-R152 WeakPolarHBondContact O-CB 3.27Å; I149-R152 PolarHBondContact O-N 2.84Å; T150-R152 PolarHBondContact O-N 3.39Å; R152-E154 VanDerWaalsContact C-N 3.33Å; R152-E154 PolarHBondContact O-N 3.49Å; R152-K155 PolarHBondContact O-N 3.24Å; R152-T156 WeakPolarHBondContact O-CB 3.4Å; R152-T156 PolarHBondContact O-N 3.32Å; R152-T156 PolarHBondContact O-OG1 3.31Å; R152-E629 WeakPolarHBondContact CB-OE2 3.46Å
153	F	72.4	Confident	60.8	Low	8 Å²	8	78.6 Å²	78.6	4%	0.035	41%	0.408	C	S	.	.	H	α-helix	trans	-55.4	-45.6	177.1	-75.4	-59.6	0	0	0	112.7	I149 T150 T156 V157 V625 E629 I630 D635 F639	I149-F153 HydrophobicContact CG2-CD2 3.67Å; I149-F153 HydrophobicContact CG2-CE2 3.37Å; I149-F153 HydrophobicContact CG2-CZ 4.47Å; I149-F153 WeakPolarHBondContact O-CD2 3.49Å; I149-F153 PolarHBondContact O-N 2.65Å; T150-F153 PolarHBondContact O-N 2.89Å; F153-T156 PolarHBondContact O-N 2.93Å; F153-V157 VanDerWaalsContact O-CB 3.28Å; F153-V157 WeakPolarHBondContact O-CB 3.09Å; F153-V157 WeakPolarHBondContact O-CG2 3.37Å; F153-V157 PolarHBondContact O-N 2.91Å; F153-V625 HydrophobicContact CD1-CG1 4.04Å; F153-E629 HydrophobicContact CD1-CB 3.77Å; F153-E629 HydrophobicContact CD1-CG 3.99Å; F153-E629 HydrophobicContact CE1-CB 3.43Å; F153-E629 VanDerWaalsContact CE1-CB 3.43Å; F153-E629 HydrophobicContact CE1-CG 4.18Å; F153-E629 HydrophobicContact CZ-CB 4.21Å; F153-I630 HydrophobicContact CE1-CD1 3.81Å; F153-I630 HydrophobicContact CZ-CD1 3.67Å; F153-D635 HydrophobicContact CZ-CB 4.25Å; F153-F639 HydrophobicContact CB-CD2 4.06Å; F153-F639 HydrophobicContact CB-CE2 4.31Å; F153-F639 HydrophobicContact CD1-CB 4.45Å; F153-F639 AromaticContact CD1-CD2 3.3Å; F153-F639 HydrophobicContact CD1-CD2 3.3Å; F153-F639 AromaticContact CD1-CE2 3.76Å; F153-F639 HydrophobicContact CD1-CE2 3.76Å; F153-F639 HydrophobicContact CD1-CG 4.13Å; F153-F639 HydrophobicContact CD2-CD2 4.19Å; F153-F639 HydrophobicContact CE1-CB 4Å; F153-F639 AromaticContact CE1-CD2 3.62Å; F153-F639 HydrophobicContact CE1-CD2 3.62Å; F153-F639 HydrophobicContact CE1-CE2 4.33Å; F153-F639 AromaticContact CE1-CG 3.97Å; F153-F639 HydrophobicContact CE1-CG 3.97Å; F153-F639 HydrophobicContact CE2-CB 4.11Å; F153-F639 HydrophobicContact CE2-CD2 4.44Å; F153-F639 AromaticContact CG-CD2 3.62Å; F153-F639 HydrophobicContact CG-CD2 3.62Å; F153-F639 HydrophobicContact CG-CE2 4.22Å; F153-F639 HydrophobicContact CZ-CB 3.82Å; F153-F639 HydrophobicContact CZ-CD2 4.19Å; F153-F639 HydrophobicContact CZ-CG 4.31Å
154	E	74.5	Confident	61.5	Low	105 Å²	105	78 Å²	78	49%	0.491	40%	0.4	S	S	.	.	H	α-helix	trans	-64.3	-43.8	178.8	-69.6	-177.6	145.5	0	0	112.3	T150 R152 A158	T150-E154 WeakPolarHBondContact O-CG 3.25Å; T150-E154 PolarHBondContact O-N 3.48Å; R152-E154 VanDerWaalsContact C-N 3.33Å; R152-E154 PolarHBondContact O-N 3.49Å; E154-A158 VanDerWaalsContact O-CB 3.26Å; E154-A158 WeakPolarHBondContact O-CB 3.33Å; E154-A158 PolarHBondContact O-N 3.02Å
155	K	79.1	Confident	61.3	Low	112 Å²	112	77.3 Å²	77.3	49%	0.487	40%	0.404	S	S	.	.	H	α-helix	trans	-66.1	-40	176.5	-71.5	167.5	-158.4	162.9	0	111.6	Q151 R152 A158 N159	Q151-K155 VanDerWaalsContact O-CB 3.3Å; Q151-K155 WeakPolarHBondContact O-CB 3.33Å; Q151-K155 WeakPolarHBondContact O-CD 3.29Å; Q151-K155 WeakPolarHBondContact O-CE 3.33Å; Q151-K155 WeakPolarHBondContact O-CG 3.47Å; Q151-K155 PolarHBondContact O-N 2.95Å; R152-K155 PolarHBondContact O-N 3.24Å; K155-A158 PolarHBondContact O-N 2.89Å; K155-N159 WeakPolarHBondContact O-CB 3.31Å; K155-N159 PolarHBondContact O-N 3.07Å; K155-N159 PolarHBondContact O-ND2 2.86Å; K155-N159 VanDerWaalsContact O-ND2 3.16Å
156	T	74.7	Confident	61	Low	22 Å²	22	76 Å²	76	14%	0.135	40%	0.396	C	S	.	.	H	α-helix	trans	-75.8	-37.8	-179.5	-64.7	0	0	0	0	111.3	R152 F153 A158 N159 V160 V625 L628 E629	R152-T156 WeakPolarHBondContact O-CB 3.4Å; R152-T156 PolarHBondContact O-N 3.32Å; R152-T156 PolarHBondContact O-OG1 3.31Å; F153-T156 PolarHBondContact O-N 2.93Å; T156-A158 VanDerWaalsContact C-N 3.35Å; T156-A158 PolarHBondContact O-N 2.89Å; T156-N159 PolarHBondContact O-N 3.14Å; T156-V160 HydrophobicContact CG2-CG2 4Å; T156-V160 WeakPolarHBondContact O-CA 3.42Å; T156-V160 WeakPolarHBondContact O-CB 3.46Å; T156-V160 WeakPolarHBondContact O-CG2 3.4Å; T156-V160 PolarHBondContact O-N 2.84Å; T156-V625 HydrophobicContact CG2-CG1 4.36Å; T156-V625 HydrophobicContact CG2-CG2 4.47Å; T156-L628 HydrophobicContact CG2-CB 4.4Å; T156-L628 HydrophobicContact CG2-CD1 4.09Å; T156-E629 VanDerWaalsContact CB-OE1 3.28Å; T156-E629 WeakPolarHBondContact CB-OE1 3.49Å; T156-E629 HydrophobicContact CG2-CG 3.93Å; T156-E629 PolarHBondContact OG1-OE1 2.8Å
157	V	71.9	Confident	60.2	Low	11 Å²	11	75.1 Å²	75.1	7%	0.067	40%	0.4	C	S	.	.	H	α-helix	trans	-59.8	-44.2	168	170.5	0	0	0	0	110.9	F153 R161 Y622 V625 F639	F153-V157 VanDerWaalsContact O-CB 3.28Å; F153-V157 WeakPolarHBondContact O-CB 3.09Å; F153-V157 WeakPolarHBondContact O-CG2 3.37Å; F153-V157 PolarHBondContact O-N 2.91Å; V157-R161 HydrophobicContact CG1-CG 4.49Å; V157-R161 VanDerWaalsContact O-CB 3.26Å; V157-R161 WeakPolarHBondContact O-CB 3.45Å; V157-R161 WeakPolarHBondContact O-CG 3.34Å; V157-R161 PolarHBondContact O-N 3.19Å; V157-Y622 HydrophobicContact CG2-CE1 4.44Å; V157-V625 HydrophobicContact CG2-CG1 3.88Å; V157-V625 HydrophobicContact CG2-CG2 3.94Å; V157-F639 HydrophobicContact CG2-CE2 3.92Å; V157-F639 HydrophobicContact CG2-CZ 4.24Å
158	A	76	Confident	59.7	Low	54 Å²	54	78.5 Å²	78.5	45%	0.446	41%	0.413	S	S	.	.	H	α-helix	trans	-68.1	-42.6	178	0	0	0	0	0	112.7	E154 K155 T156 R161 K162	E154-A158 VanDerWaalsContact O-CB 3.26Å; E154-A158 WeakPolarHBondContact O-CB 3.33Å; E154-A158 PolarHBondContact O-N 3.02Å; K155-A158 PolarHBondContact O-N 2.89Å; T156-A158 VanDerWaalsContact C-N 3.35Å; T156-A158 PolarHBondContact O-N 2.89Å; A158-R161 PolarHBondContact O-N 2.8Å; A158-K162 VanDerWaalsContact O-CB 3.31Å; A158-K162 WeakPolarHBondContact O-CB 3.4Å; A158-K162 PolarHBondContact O-N 2.73Å
159	N	73.8	Confident	58.8	Low	99 Å²	99	82.8 Å²	82.8	53%	0.529	44%	0.438	S	S	.	.	H	α-helix	trans	-68.3	-41.4	177.4	-73.5	-24.8	0	0	0	111.4	K155 T156 K162 A163	K155-N159 WeakPolarHBondContact O-CB 3.31Å; K155-N159 PolarHBondContact O-N 3.07Å; K155-N159 PolarHBondContact O-ND2 2.86Å; K155-N159 VanDerWaalsContact O-ND2 3.16Å; T156-N159 PolarHBondContact O-N 3.14Å; N159-K162 CarbonylContact O-C 3.56Å; N159-K162 PolarHBondContact O-N 3.38Å; N159-K162 VanDerWaalsContact O-N 3.12Å; N159-A163 WeakPolarHBondContact O-CB 3.47Å; N159-A163 PolarHBondContact O-N 3.13Å
160	V	60.5	Low	58	Low	24 Å²	24	82 Å²	82	15%	0.145	44%	0.439	C	S	.	.	H	α-helix	trans	-64.4	-45.9	174.1	168.8	0	0	0	0	109.9	T156 K162 A163 I164 E624 V625 L628	T156-V160 HydrophobicContact CG2-CG2 4Å; T156-V160 WeakPolarHBondContact O-CA 3.42Å; T156-V160 WeakPolarHBondContact O-CB 3.46Å; T156-V160 WeakPolarHBondContact O-CG2 3.4Å; T156-V160 PolarHBondContact O-N 2.84Å; V160-K162 PolarHBondContact O-N 3.14Å; V160-K162 VanDerWaalsContact O-N 3.11Å; V160-A163 PolarHBondContact O-N 2.95Å; V160-I164 HydrophobicContact CG1-CD1 3.45Å; V160-I164 VanDerWaalsContact CG1-CD1 3.45Å; V160-I164 HydrophobicContact CG1-CG1 3.9Å; V160-I164 WeakPolarHBondContact O-CA 3.41Å; V160-I164 WeakPolarHBondContact O-CB 3.47Å; V160-I164 WeakPolarHBondContact O-CG1 3.32Å; V160-I164 PolarHBondContact O-N 3.36Å; V160-E624 HydrophobicContact CG1-CB 4.08Å; V160-E624 HydrophobicContact CG2-CB 4.29Å; V160-V625 HydrophobicContact CB-CG2 4.11Å; V160-V625 HydrophobicContact CG1-CG2 4.18Å; V160-V625 HydrophobicContact CG2-CG2 4.04Å; V160-L628 HydrophobicContact CG2-CD1 4.32Å
161	R	63.3	Low	57.2	Low	129 Å²	129	85.2 Å²	85.2	49%	0.487	46%	0.456	S	S	.	.	H	α-helix	trans	-60.6	-19.2	172.3	-75	172.9	176.9	-174.3	-2.1	114	V157 A158	V157-R161 HydrophobicContact CG1-CG 4.49Å; V157-R161 VanDerWaalsContact O-CB 3.26Å; V157-R161 WeakPolarHBondContact O-CB 3.45Å; V157-R161 WeakPolarHBondContact O-CG 3.34Å; V157-R161 PolarHBondContact O-N 3.19Å; A158-R161 PolarHBondContact O-N 2.8Å
162	K	64.3	Low	55.7	Low	173 Å²	173	87.4 Å²	87.4	75%	0.752	47%	0.47	S	S	*	.	H	α-helix	trans	-98.9	-30.8	179	-171.5	-179.6	179.1	-177	0	113.6	A158 N159 V160 G165	A158-K162 VanDerWaalsContact O-CB 3.31Å; A158-K162 WeakPolarHBondContact O-CB 3.4Å; A158-K162 PolarHBondContact O-N 2.73Å; N159-K162 CarbonylContact O-C 3.56Å; N159-K162 PolarHBondContact O-N 3.38Å; N159-K162 VanDerWaalsContact O-N 3.12Å; V160-K162 PolarHBondContact O-N 3.14Å; V160-K162 VanDerWaalsContact O-N 3.11Å; K162-G165 PolarHBondContact O-N 2.78Å
163	A	49.4	Very low	54.3	Low	91 Å²	91	87.5 Å²	87.5	75%	0.752	48%	0.478	S	S	*	.	H	α-helix	trans	-89	-38.8	179.6	0	0	0	0	0	111.4	N159 V160 G165	N159-A163 WeakPolarHBondContact O-CB 3.47Å; N159-A163 PolarHBondContact O-N 3.13Å; V160-A163 PolarHBondContact O-N 2.95Å; A163-G165 PolarHBondContact O-N 3.25Å
164	I	44.8	Very low	53.3	Low	76 Å²	76	89.7 Å²	89.7	39%	0.39	49%	0.488	S	S	.	.	S	Bend	trans	-72.5	56.1	150.5	-45	-177.8	0	0	0	107.8	V160 I166 E624	V160-I164 HydrophobicContact CG1-CD1 3.45Å; V160-I164 VanDerWaalsContact CG1-CD1 3.45Å; V160-I164 HydrophobicContact CG1-CG1 3.9Å; V160-I164 WeakPolarHBondContact O-CA 3.41Å; V160-I164 WeakPolarHBondContact O-CB 3.47Å; V160-I164 WeakPolarHBondContact O-CG1 3.32Å; V160-I164 PolarHBondContact O-N 3.36Å; I164-I166 HydrophobicContact CG2-CB 3.92Å; I164-I166 HydrophobicContact CG2-CD1 3.66Å; I164-I166 HydrophobicContact CG2-CG1 3.62Å; I164-I166 PolarHBondContact O-N 3.18Å; I164-E624 HydrophobicContact CD1-CG 3.91Å
165	G	34.3	Very low	52	Low	57 Å²	57	91.4 Å²	91.4	59%	0.588	50%	0.496	S	S	*	.			trans	-70.8	29.7	160.6	0	0	0	0	0	111.4	K162 A163 V167	K162-G165 PolarHBondContact O-N 2.78Å; A163-G165 PolarHBondContact O-N 3.25Å; G165-V167 VanDerWaalsContact C-N 3.28Å; G165-V167 PolarHBondContact O-N 3.06Å
166	I	35.4	Very low	50.8	Low	105 Å²	105	89.1 Å²	89.1	54%	0.538	49%	0.491	S	S	.	.			trans	-70.7	95.5	167.1	-50.1	-179.9	0	0	0	105	I164 M168	I164-I166 HydrophobicContact CG2-CB 3.92Å; I164-I166 HydrophobicContact CG2-CD1 3.66Å; I164-I166 HydrophobicContact CG2-CG1 3.62Å; I164-I166 PolarHBondContact O-N 3.18Å; I166-M168 HydrophobicContact CG2-CE 3.91Å; I166-M168 HydrophobicContact CG2-CG 4.12Å; I166-M168 PolarHBondContact O-N 3.18Å
167	V	31.9	Very low	50	Low	103 Å²	103	95 Å²	95	62%	0.624	52%	0.52	S	S	*	.			trans	-53	95.7	142.7	177.5	0	0	0	0	105.2	G165 D169	G165-V167 VanDerWaalsContact C-N 3.28Å; G165-V167 PolarHBondContact O-N 3.06Å; V167-D169 PolarHBondContact O-N 3.43Å
168	M	37.2	Very low	50.1	Low	116 Å²	116	99.3 Å²	99.3	57%	0.571	54%	0.539	S	S	*	.			trans	-62.5	123.3	158.8	-67.3	-107.1	81.7	0	0	103.9	I166 G170 D171	I166-M168 HydrophobicContact CG2-CE 3.91Å; I166-M168 HydrophobicContact CG2-CG 4.12Å; I166-M168 PolarHBondContact O-N 3.18Å; M168-G170 CarbonylContact O-C 3.57Å; M168-G170 PolarHBondContact O-N 3.45Å; M168-D171 PolarHBondContact O-N 2.92Å
169	D	36.5	Very low	50.7	Low	163 Å²	163	100.7 Å²	100.7	87%	0.872	54%	0.544	S	S	*	.	S	Bend	trans	-49	105.5	-169.8	-86.2	-50.9	0	0	0	111.4	V167	V167-D169 PolarHBondContact O-N 3.43Å
170	G	39.4	Very low	51.6	Low	22 Å²	22	97.9 Å²	97.9	23%	0.227	53%	0.531	C	S	.	.			trans	81.4	75	-171	0	0	0	0	0	116.2	M168 D172 M173	M168-G170 CarbonylContact O-C 3.57Å; M168-G170 PolarHBondContact O-N 3.45Å; G170-D172 PolarHBondContact O-N 3.29Å; G170-M173 WeakPolarHBondContact O-CA 3.47Å; G170-M173 WeakPolarHBondContact O-CB 3.3Å; G170-M173 PolarHBondContact O-N 3.48Å
171	D	40.3	Very low	53.2	Low	90 Å²	90	96.8 Å²	96.8	48%	0.481	52%	0.524	S	S	.	.	G	3₁₀ helix	trans	-56.1	-33.2	148.1	-94.7	-32.5	0	0	0	109.8	M168 M173 F174	M168-D171 PolarHBondContact O-N 2.92Å; D171-M173 PolarHBondContact O-N 2.96Å; D171-F174 WeakPolarHBondContact O-CD2 3.48Å; D171-F174 WeakPolarHBondContact OD1-CE2 3.17Å
172	D	40	Very low	54.7	Low	140 Å²	140	91.6 Å²	91.6	75%	0.749	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-70.8	-0.4	168.8	-70.3	-39.2	0	0	0	114.4	G170 H175	G170-D172 PolarHBondContact O-N 3.29Å; D172-H175 PolarHBondContact O-CD2 3.22Å; D172-H175 PolarHBondContact O-NE2 2.65Å
173	M	41.5	Very low	56	Low	138 Å²	138	86.7 Å²	86.7	68%	0.68	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-104.5	0.6	179.9	-67.8	-91.8	75.7	0	0	114.1	G170 D171 H175	G170-M173 WeakPolarHBondContact O-CA 3.47Å; G170-M173 WeakPolarHBondContact O-CB 3.3Å; G170-M173 PolarHBondContact O-N 3.48Å; D171-M173 PolarHBondContact O-N 2.96Å; M173-H175 PolarHBondContact O-N 3.27Å
174	F	51.5	Low	58	Low	54 Å²	54	86.9 Å²	86.9	24%	0.237	48%	0.482	C	S	.	.			trans	-72.7	19	174.2	-66.5	-61.6	0	0	0	114.6	D171 R651 Y654	D171-F174 WeakPolarHBondContact O-CD2 3.48Å; D171-F174 WeakPolarHBondContact OD1-CE2 3.17Å; F174-R651 HydrophobicContact CZ-CG 4.4Å; F174-Y654 HydrophobicContact CD1-CD1 4.16Å; F174-Y654 HydrophobicContact CD1-CD2 4.08Å; F174-Y654 AromaticContact CD1-CG 3.81Å; F174-Y654 HydrophobicContact CD1-CG 3.81Å; F174-Y654 AromaticContact CE1-CD1 3.63Å; F174-Y654 HydrophobicContact CE1-CD1 3.63Å; F174-Y654 HydrophobicContact CE1-CD2 4.32Å; F174-Y654 HydrophobicContact CE1-CE1 4.08Å; F174-Y654 AromaticContact CE1-CG 3.78Å; F174-Y654 HydrophobicContact CE1-CG 3.78Å
175	H	46.9	Very low	60.4	Low	141 Å²	141	85.7 Å²	85.7	65%	0.653	48%	0.475	S	S	*	.			trans	-64.3	141.5	172.3	-64.9	-36.2	0	0	0	111.5	D172 M173 I177	D172-H175 PolarHBondContact O-CD2 3.22Å; D172-H175 PolarHBondContact O-NE2 2.65Å; M173-H175 PolarHBondContact O-N 3.27Å; H175-I177 PolarHBondContact O-N 2.94Å
176	T	52.6	Low	63.1	Low	63 Å²	63	83.4 Å²	83.4	39%	0.387	45%	0.449	S	S	.	.			trans	-64.3	130.1	163.1	52.4	0	0	0	0	108.2	H178	T176-H178 CarbonylContact C-O 3.58Å; T176-H178 WeakPolarHBondContact CB-O 3.27Å; T176-H178 PolarHBondContact O-N 2.76Å; T176-H178 PolarHBondContact OG1-O 3.45Å
177	I	58.5	Low	65.8	Low	146 Å²	146	86.2 Å²	86.2	75%	0.749	45%	0.452	S	S	*	.	S	Bend	trans	-55.4	-31.9	-174.5	-60	170.1	0	0	0	111	H175	H175-I177 PolarHBondContact O-N 2.94Å
178	H	74.9	Confident	68.8	Low	102 Å²	102	87.1 Å²	87.1	47%	0.472	45%	0.453	S	S	.	.	S	Bend	trans	-124.5	158.4	169.3	-58.3	-40.9	0	0	0	110.5	T176 N209	T176-H178 CarbonylContact C-O 3.58Å; T176-H178 WeakPolarHBondContact CB-O 3.27Å; T176-H178 PolarHBondContact O-N 2.76Å; T176-H178 PolarHBondContact OG1-O 3.45Å; H178-N209 PolarHBondContact N-OD1 2.94Å; H178-N209 PolarHBondContact O-OD1 2.97Å
179	P	87.2	Confident	71.4	Confident	82 Å²	82	82.4 Å²	82.4	53%	0.532	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-61	161.6	168.3	28.1	-36.3	0	0	0	111.2
180	P	93.4	Very high	74	Confident	41 Å²	41	76.4 Å²	76.4	27%	0.266	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-52.4	151.3	171.9	-23.4	33.7	0	0	0	112.3	S182 N209 G210 E212	P180-S182 PolarHBondContact O-N 3.48Å; P180-S182 VanDerWaalsContact O-N 3.1Å; P180-N209 VanDerWaalsContact CA-O 3.32Å; P180-N209 WeakPolarHBondContact CA-O 3.27Å; P180-G210 WeakPolarHBondContact CA-O 3.4Å; P180-E212 HydrophobicContact CB-CG 4.24Å
181	I	95	Very high	76.4	Confident	0 Å²	0	77.2 Å²	77.2	0%	0	40%	0.396	C	S	.	.	B	Isolated β-bridge	trans	-60.4	119.3	-178.8	-58.4	179.6	0	0	0	109.4	Q185 M186 Y189 F202 D205 V206 G210 L211 E212 L215	I181-Q185 HydrophobicContact CG2-CB 3.88Å; I181-M186 HydrophobicContact CG2-CB 4.44Å; I181-Y189 HydrophobicContact CD1-CE2 4.05Å; I181-Y189 HydrophobicContact CG2-CE2 3.91Å; I181-F202 HydrophobicContact CD1-CD2 4.07Å; I181-F202 HydrophobicContact CD1-CE2 4.17Å; I181-D205 HydrophobicContact CD1-CB 3.64Å; I181-D205 HydrophobicContact CG1-CB 4.1Å; I181-V206 HydrophobicContact CD1-CB 4.47Å; I181-V206 HydrophobicContact CD1-CG2 3.57Å; I181-G210 PolarHBondContact N-O 3.1Å; I181-L211 HydrophobicContact CB-CD2 4.25Å; I181-L211 HydrophobicContact CD1-CD2 4.4Å; I181-E212 WeakPolarHBondContact O-CB 3.45Å; I181-E212 PolarHBondContact O-N 3.35Å; I181-L215 HydrophobicContact CB-CD2 4.12Å; I181-L215 HydrophobicContact CG2-CD2 3.64Å; I181-L215 VanDerWaalsContact O-CD2 3.25Å; I181-L215 WeakPolarHBondContact O-CD2 3.49Å
182	S	94.1	Very high	78.8	Confident	20 Å²	20	81.3 Å²	81.3	14%	0.14	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-87.6	163.5	174.7	64.2	0	0	0	0	113.3	P180 T184 Q185 M186 E212	P180-S182 PolarHBondContact O-N 3.48Å; P180-S182 VanDerWaalsContact O-N 3.1Å; S182-T184 PolarHBondContact O-N 2.94Å; S182-T184 PolarHBondContact OG-N 2.9Å; S182-Q185 PolarHBondContact O-N 3.45Å; S182-Q185 VanDerWaalsContact O-N 3.09Å; S182-Q185 PolarHBondContact OG-N 3.04Å; S182-Q185 PolarHBondContact OG-OE1 3.46Å; S182-M186 WeakPolarHBondContact O-CB 3.39Å; S182-M186 PolarHBondContact O-N 3.47Å; S182-E212 WeakPolarHBondContact CA-OE2 3.47Å; S182-E212 VanDerWaalsContact CB-CD 3.48Å; S182-E212 VanDerWaalsContact CB-OE2 3.25Å; S182-E212 WeakPolarHBondContact CB-OE2 3.41Å
183	D	91.4	Very high	81.1	Confident	70 Å²	70	78.9 Å²	78.9	37%	0.374	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-16.2	170.5	-75.9	-75.5	0	0	0	113.4	R187 S214	D183-R187 VanDerWaalsContact O-CZ 3.31Å; D183-R187 PolarHBondContact O-NE 3.22Å; D183-R187 PolarHBondContact O-NH2 2.77Å; D183-S214 WeakPolarHBondContact OD2-CB 3.42Å; D183-S214 PolarHBondContact OD2-OG 3.33Å
184	T	92.4	Very high	83.2	Confident	96 Å²	96	72.9 Å²	72.9	59%	0.589	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-47	172.6	-60.7	0	0	0	0	111.7	S182 M186 R187	S182-T184 PolarHBondContact O-N 2.94Å; S182-T184 PolarHBondContact OG-N 2.9Å; T184-M186 VanDerWaalsContact C-N 3.3Å; T184-M186 PolarHBondContact O-N 2.83Å; T184-R187 PolarHBondContact O-N 2.78Å
185	Q	93.2	Very high	85	Confident	51 Å²	51	74.6 Å²	74.6	24%	0.238	38%	0.383	C	S	.	.	H	α-helix	trans	-63.2	-37.4	173.8	-73.8	151.1	-69	0	0	111.5	I181 S182 R187 L188 Y189	I181-Q185 HydrophobicContact CG2-CB 3.88Å; S182-Q185 PolarHBondContact O-N 3.45Å; S182-Q185 VanDerWaalsContact O-N 3.09Å; S182-Q185 PolarHBondContact OG-N 3.04Å; S182-Q185 PolarHBondContact OG-OE1 3.46Å; Q185-R187 PolarHBondContact O-N 3.43Å; Q185-R187 VanDerWaalsContact O-N 3.13Å; Q185-L188 VanDerWaalsContact O-CB 3.28Å; Q185-L188 WeakPolarHBondContact O-CB 3.43Å; Q185-L188 PolarHBondContact O-N 2.77Å; Q185-Y189 WeakPolarHBondContact O-CE2 3.33Å
186	M	92.5	Very high	86.9	Confident	8 Å²	8	68.5 Å²	68.5	4%	0.039	36%	0.355	C	S	.	.	H	α-helix	trans	-55.3	-34.8	179.6	-167.6	70	-152.9	0	0	113.1	I181 S182 T184 L188 Y189 M190 F202 L215 I222	I181-M186 HydrophobicContact CG2-CB 4.44Å; S182-M186 WeakPolarHBondContact O-CB 3.39Å; S182-M186 PolarHBondContact O-N 3.47Å; T184-M186 VanDerWaalsContact C-N 3.3Å; T184-M186 PolarHBondContact O-N 2.83Å; M186-L188 VanDerWaalsContact C-N 3.3Å; M186-L188 PolarHBondContact O-N 3.06Å; M186-Y189 PolarHBondContact O-N 3.03Å; M186-Y189 HydrophobicContact SD-CD2 4.22Å; M186-M190 HydrophobicContact CE-CE 3.46Å; M186-M190 VanDerWaalsContact CE-CE 3.46Å; M186-M190 HydrophobicContact CG-CE 4.04Å; M186-F202 HydrophobicContact CE-CD2 3.76Å; M186-F202 HydrophobicContact CE-CE2 3.62Å; M186-F202 HydrophobicContact CE-CG 4.43Å; M186-F202 HydrophobicContact CE-CZ 4.18Å; M186-F202 HydrophobicContact SD-CD2 3.79Å; M186-F202 HydrophobicContact SD-CE2 3.49Å; M186-F202 WeakPolarHBondContact SD-CE2 3.28Å; M186-F202 HydrophobicContact SD-CZ 4.44Å; M186-L215 HydrophobicContact CB-CD1 4.05Å; M186-L215 HydrophobicContact CB-CD2 3.95Å; M186-L215 HydrophobicContact CG-CD1 3.71Å; M186-L215 HydrophobicContact CG-CD2 4.16Å; M186-L215 HydrophobicContact SD-CD1 4.01Å; M186-L215 HydrophobicContact SD-CD2 3.87Å; M186-L215 HydrophobicContact SD-CG 4.38Å; M186-I222 HydrophobicContact CE-CD1 3.46Å; M186-I222 VanDerWaalsContact CE-CD1 3.46Å
187	R	92	Very high	88.7	Confident	164 Å²	164	70 Å²	70	62%	0.619	36%	0.36	S	S	*	.	H	α-helix	trans	-70.9	-23.3	177.9	-81.8	171.8	-82.1	-173.1	-2.2	113.1	D183 T184 Q185 Y189 M190	D183-R187 VanDerWaalsContact O-CZ 3.31Å; D183-R187 PolarHBondContact O-NE 3.22Å; D183-R187 PolarHBondContact O-NH2 2.77Å; T184-R187 PolarHBondContact O-N 2.78Å; Q185-R187 PolarHBondContact O-N 3.43Å; Q185-R187 VanDerWaalsContact O-N 3.13Å; R187-Y189 PolarHBondContact O-N 3.18Å; R187-M190 PolarHBondContact O-N 2.72Å
188	L	94.3	Very high	90.3	Very high	123 Å²	123	69.7 Å²	69.7	64%	0.644	35%	0.35	S	S	*	.	H	α-helix	trans	-69.7	-22.9	175.6	-54.7	177.9	0	0	0	112.4	Q185 M186 M190 Y198	Q185-L188 VanDerWaalsContact O-CB 3.28Å; Q185-L188 WeakPolarHBondContact O-CB 3.43Å; Q185-L188 PolarHBondContact O-N 2.77Å; M186-L188 VanDerWaalsContact C-N 3.3Å; M186-L188 PolarHBondContact O-N 3.06Å; L188-M190 VanDerWaalsContact C-N 3.32Å; L188-Y198 WeakPolarHBondContact O-CD2 3.5Å
189	Y	92.5	Very high	91.1	Very high	16 Å²	16	66.3 Å²	66.3	6%	0.063	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-0.5	176.5	-46	-61	0	0	0	113.8	I181 Q185 M186 R187 I196 I197 Y198 Q201 F202 D205	I181-Y189 HydrophobicContact CD1-CE2 4.05Å; I181-Y189 HydrophobicContact CG2-CE2 3.91Å; Q185-Y189 WeakPolarHBondContact O-CE2 3.33Å; M186-Y189 PolarHBondContact O-N 3.03Å; M186-Y189 HydrophobicContact SD-CD2 4.22Å; R187-Y189 PolarHBondContact O-N 3.18Å; Y189-I196 CarbonylContact O-C 3.52Å; Y189-I196 WeakPolarHBondContact O-CA 3.4Å; Y189-I197 WeakPolarHBondContact O-CG1 3.44Å; Y189-I197 PolarHBondContact O-N 3.16Å; Y189-Y198 PolarHBondContact O-N 2.77Å; Y189-Q201 HydrophobicContact CD1-CB 4.48Å; Y189-Q201 HydrophobicContact CD1-CG 4.31Å; Y189-Q201 HydrophobicContact CE1-CB 4.44Å; Y189-Q201 HydrophobicContact CE1-CG 3.87Å; Y189-F202 HydrophobicContact CD1-CB 4.25Å; Y189-F202 HydrophobicContact CD2-CB 4.06Å; Y189-F202 AromaticContact CD2-CD2 3.82Å; Y189-F202 HydrophobicContact CD2-CD2 3.82Å; Y189-F202 HydrophobicContact CD2-CG 4.4Å; Y189-F202 HydrophobicContact CE2-CD2 4.01Å; Y189-F202 HydrophobicContact CG-CB 3.94Å; Y189-D205 WeakPolarHBondContact CE1-OD2 3.28Å; Y189-D205 VanDerWaalsContact OH-CB 3.32Å; Y189-D205 WeakPolarHBondContact OH-CB 3.33Å; Y189-D205 VanDerWaalsContact OH-CG 3.28Å; Y189-D205 PolarHBondContact OH-OD2 2.89Å
190	M	90.7	Very high	91.4	Very high	38 Å²	38	65.9 Å²	65.9	19%	0.187	33%	0.329	C	S	.	.	B	Isolated β-bridge	trans	-119.7	155.2	-171.4	-64.1	-168.2	-170.4	0	0	114.6	M186 R187 L188 R195 I196	M186-M190 HydrophobicContact CE-CE 3.46Å; M186-M190 VanDerWaalsContact CE-CE 3.46Å; M186-M190 HydrophobicContact CG-CE 4.04Å; R187-M190 PolarHBondContact O-N 2.72Å; L188-M190 VanDerWaalsContact C-N 3.32Å; M190-R195 CarbonylContact C-O 3.4Å; M190-R195 WeakPolarHBondContact CA-O 3.28Å; M190-R195 WeakPolarHBondContact CB-O 3.48Å; M190-I196 HydrophobicContact CE-CG1 4.22Å; M190-I196 HydrophobicContact CG-CG1 4.39Å
191	D	90.1	Very high	91.3	Very high	39 Å²	39	67.9 Å²	67.9	21%	0.209	34%	0.335	C	S	.	.			trans	-79.6	171.7	162.8	82.5	-13.3	0	0	0	111.7	N193 G194 R195 I197	D191-N193 PolarHBondContact O-N 2.77Å; D191-N193 VanDerWaalsContact OD1-C 3.25Å; D191-N193 VanDerWaalsContact OD1-CA 3.29Å; D191-N193 WeakPolarHBondContact OD1-CA 3.31Å; D191-N193 VanDerWaalsContact OD1-CB 3.32Å; D191-N193 WeakPolarHBondContact OD1-CB 3.36Å; D191-N193 PolarHBondContact OD1-N 3.43Å; D191-N193 PolarHBondContact OD2-ND2 3.46Å; D191-G194 WeakPolarHBondContact O-CA 3.27Å; D191-G194 PolarHBondContact O-N 2.94Å; D191-G194 PolarHBondContact OD1-N 2.77Å; D191-R195 PolarHBondContact N-O 3.42Å; D191-R195 WeakPolarHBondContact OD1-CB 3.41Å; D191-R195 PolarHBondContact OD1-N 3.38Å; D191-R195 IonicContact OD2-CZ 2.75Å; D191-R195 IonicContact OD2-NH1 2.92Å; D191-R195 PolarHBondContact OD2-NH1 3.28Å; D191-I197 HydrophobicContact CB-CG2 4.08Å
192	D	89.8	Confident	91.3	Very high	175 Å²	175	67.9 Å²	67.9	94%	0.936	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-17.6	177	-64.1	-53.5	0	0	0	113.8
193	N	88.9	Confident	91.3	Very high	89 Å²	89	67.1 Å²	67.1	48%	0.476	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-2.5	175.5	-47.9	-84.5	0	0	0	112.3	D191 R195 T232 G233	D191-N193 PolarHBondContact O-N 2.77Å; D191-N193 VanDerWaalsContact OD1-C 3.25Å; D191-N193 VanDerWaalsContact OD1-CA 3.29Å; D191-N193 WeakPolarHBondContact OD1-CA 3.31Å; D191-N193 VanDerWaalsContact OD1-CB 3.32Å; D191-N193 WeakPolarHBondContact OD1-CB 3.36Å; D191-N193 PolarHBondContact OD1-N 3.43Å; D191-N193 PolarHBondContact OD2-ND2 3.46Å; N193-R195 PolarHBondContact ND2-NH1 3.3Å; N193-R195 VanDerWaalsContact ND2-NH1 3.13Å; N193-T232 HydrophobicContact CB-CG2 3.62Å; N193-T232 CarbonylContact O-C 3.37Å; N193-T232 WeakPolarHBondContact O-CA 3.43Å; N193-T232 VanDerWaalsContact O-CB 3.27Å; N193-T232 WeakPolarHBondContact O-CB 3.4Å; N193-G233 PolarHBondContact O-N 2.8Å
194	G	86.4	Confident	91.5	Very high	13 Å²	13	64.8 Å²	64.8	13%	0.134	32%	0.316	C	S	.	.			trans	78.1	15.3	-176.4	0	0	0	0	0	115.5	D191 R236	D191-G194 WeakPolarHBondContact O-CA 3.27Å; D191-G194 PolarHBondContact O-N 2.94Å; D191-G194 PolarHBondContact OD1-N 2.77Å; G194-R236 VanDerWaalsContact O-CZ 3.22Å; G194-R236 PolarHBondContact O-NH1 2.57Å; G194-R236 PolarHBondContact O-NH2 3.47Å
195	R	87.7	Confident	91.6	Very high	89 Å²	89	61.4 Å²	61.4	34%	0.336	29%	0.294	S	S	.	.			trans	-69.7	145.9	168.5	-59.3	-172.9	-176.7	90.1	-1.1	110	M190 D191 N193 I197 T231 T232	M190-R195 CarbonylContact C-O 3.4Å; M190-R195 WeakPolarHBondContact CA-O 3.28Å; M190-R195 WeakPolarHBondContact CB-O 3.48Å; D191-R195 PolarHBondContact N-O 3.42Å; D191-R195 WeakPolarHBondContact OD1-CB 3.41Å; D191-R195 PolarHBondContact OD1-N 3.38Å; D191-R195 IonicContact OD2-CZ 2.75Å; D191-R195 IonicContact OD2-NH1 2.92Å; D191-R195 PolarHBondContact OD2-NH1 3.28Å; N193-R195 PolarHBondContact ND2-NH1 3.3Å; N193-R195 VanDerWaalsContact ND2-NH1 3.13Å; R195-I197 PolarHBondContact O-N 3.18Å; R195-T231 WeakPolarHBondContact CA-O 3.31Å; R195-T232 HydrophobicContact CG-CG2 3.89Å
196	I	88	Confident	91.7	Very high	14 Å²	14	59 Å²	59	7%	0.072	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-90.8	95.5	-178	-54	164.9	0	0	0	109.1	Y189 M190 L199 I222 A229	Y189-I196 CarbonylContact O-C 3.52Å; Y189-I196 WeakPolarHBondContact O-CA 3.4Å; M190-I196 HydrophobicContact CE-CG1 4.22Å; M190-I196 HydrophobicContact CG-CG1 4.39Å; I196-L199 HydrophobicContact CB-CD1 4.28Å; I196-L199 HydrophobicContact CD1-CD1 4.39Å; I196-L199 HydrophobicContact CG2-CB 4.1Å; I196-L199 HydrophobicContact CG2-CD1 3.73Å; I196-I222 HydrophobicContact CD1-CB 4.31Å; I196-I222 HydrophobicContact CD1-CD1 3.49Å; I196-I222 VanDerWaalsContact CD1-CD1 3.49Å; I196-I222 HydrophobicContact CD1-CG1 3.64Å; I196-I222 HydrophobicContact CD1-CG2 3.66Å; I196-A229 PolarHBondContact N-O 2.92Å
197	I	90.1	Very high	91.9	Very high	94 Å²	94	58.7 Å²	58.7	48%	0.482	28%	0.282	S	S	.	.	S	Bend	trans	-81.2	-28	-176.5	54.2	171.4	0	0	0	112.9	Y189 D191 R195	Y189-I197 WeakPolarHBondContact O-CG1 3.44Å; Y189-I197 PolarHBondContact O-N 3.16Å; D191-I197 HydrophobicContact CB-CG2 4.08Å; R195-I197 PolarHBondContact O-N 3.18Å
198	Y	92.2	Very high	91.9	Very high	140 Å²	140	53.4 Å²	53.4	55%	0.549	27%	0.265	S	S	.	.	S	Bend	trans	-110.5	52.6	178.9	-60.9	-64.8	0	0	0	111.9	L188 Y189 N200 Q201 F202	L188-Y198 WeakPolarHBondContact O-CD2 3.5Å; Y189-Y198 PolarHBondContact O-N 2.77Å; Y198-N200 PolarHBondContact O-N 2.87Å; Y198-Q201 PolarHBondContact O-N 3.38Å; Y198-F202 PolarHBondContact O-N 2.97Å
199	L	91.7	Very high	91.8	Very high	31 Å²	31	47.8 Å²	47.8	16%	0.162	24%	0.236	C	C	.	.	H	α-helix	trans	-59.1	-43.7	-171.5	-172.7	68.4	0	0	0	114	I196 F202 Y203 I222 A229	I196-L199 HydrophobicContact CB-CD1 4.28Å; I196-L199 HydrophobicContact CD1-CD1 4.39Å; I196-L199 HydrophobicContact CG2-CB 4.1Å; I196-L199 HydrophobicContact CG2-CD1 3.73Å; L199-F202 PolarHBondContact O-N 3.49Å; L199-Y203 HydrophobicContact CD1-CE1 4.09Å; L199-Y203 HydrophobicContact CD1-CE2 4.14Å; L199-Y203 HydrophobicContact CD2-CE2 4.01Å; L199-Y203 HydrophobicContact CG-CD2 4.33Å; L199-Y203 HydrophobicContact CG-CE1 4.49Å; L199-Y203 HydrophobicContact CG-CE2 3.65Å; L199-Y203 WeakPolarHBondContact O-CD2 3.36Å; L199-Y203 PolarHBondContact O-N 2.57Å; L199-I222 HydrophobicContact CD1-CG2 3.95Å; L199-A229 HydrophobicContact CD1-CB 4.14Å; L199-A229 HydrophobicContact CD2-CB 3.68Å
200	N	92.3	Very high	92	Very high	73 Å²	73	47 Å²	47	39%	0.39	23%	0.233	S	C	.	.	H	α-helix	trans	-66.1	-38.6	177.9	-73.8	-0.9	0	0	0	111.8	Y198 Y203 L204 N426	Y198-N200 PolarHBondContact O-N 2.87Å; N200-Y203 PolarHBondContact O-N 3.08Å; N200-L204 WeakPolarHBondContact O-CB 3.26Å; N200-L204 PolarHBondContact O-N 3.13Å; N200-N426 PolarHBondContact OD1-ND2 2.98Å
201	Q	92.9	Very high	92.2	Very high	83 Å²	83	45.3 Å²	45.3	39%	0.388	23%	0.225	S	C	.	.	H	α-helix	trans	-66.1	-41.8	176.1	-174.6	60.9	41.2	0	0	111.2	Y189 Y198 Y203 L204 D205	Y189-Q201 HydrophobicContact CD1-CB 4.48Å; Y189-Q201 HydrophobicContact CD1-CG 4.31Å; Y189-Q201 HydrophobicContact CE1-CB 4.44Å; Y189-Q201 HydrophobicContact CE1-CG 3.87Å; Y198-Q201 PolarHBondContact O-N 3.38Å; Q201-Y203 VanDerWaalsContact C-N 3.33Å; Q201-Y203 PolarHBondContact O-N 2.99Å; Q201-L204 WeakPolarHBondContact O-CB 3.17Å; Q201-L204 PolarHBondContact O-N 3.14Å; Q201-L204 VanDerWaalsContact O-N 3.17Å; Q201-D205 VanDerWaalsContact NE2-CG 3.28Å; Q201-D205 PolarHBondContact NE2-OD1 3.34Å; Q201-D205 PolarHBondContact NE2-OD2 3.29Å; Q201-D205 PolarHBondContact O-N 3.34Å
202	F	94.2	Very high	92.5	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-56.6	-46.2	172.3	167.6	-103.1	0	0	0	111.5	I181 M186 Y189 Y198 L199 L204 D205 V206 L211 I222 L223	I181-F202 HydrophobicContact CD1-CD2 4.07Å; I181-F202 HydrophobicContact CD1-CE2 4.17Å; M186-F202 HydrophobicContact CE-CD2 3.76Å; M186-F202 HydrophobicContact CE-CE2 3.62Å; M186-F202 HydrophobicContact CE-CG 4.43Å; M186-F202 HydrophobicContact CE-CZ 4.18Å; M186-F202 HydrophobicContact SD-CD2 3.79Å; M186-F202 HydrophobicContact SD-CE2 3.49Å; M186-F202 WeakPolarHBondContact SD-CE2 3.28Å; M186-F202 HydrophobicContact SD-CZ 4.44Å; Y189-F202 HydrophobicContact CD1-CB 4.25Å; Y189-F202 HydrophobicContact CD2-CB 4.06Å; Y189-F202 AromaticContact CD2-CD2 3.82Å; Y189-F202 HydrophobicContact CD2-CD2 3.82Å; Y189-F202 HydrophobicContact CD2-CG 4.4Å; Y189-F202 HydrophobicContact CE2-CD2 4.01Å; Y189-F202 HydrophobicContact CG-CB 3.94Å; Y198-F202 PolarHBondContact O-N 2.97Å; L199-F202 PolarHBondContact O-N 3.49Å; F202-L204 PolarHBondContact O-N 2.92Å; F202-D205 PolarHBondContact O-N 3.4Å; F202-V206 HydrophobicContact CD2-CG2 4.14Å; F202-V206 HydrophobicContact CE1-CG2 4.21Å; F202-V206 HydrophobicContact CE2-CG2 3.61Å; F202-V206 HydrophobicContact CZ-CG2 3.65Å; F202-V206 VanDerWaalsContact O-CG2 3.32Å; F202-V206 WeakPolarHBondContact O-CG2 3.43Å; F202-V206 PolarHBondContact O-N 3.18Å; F202-L211 HydrophobicContact CE2-CD2 4.14Å; F202-L211 HydrophobicContact CZ-CD2 4.39Å; F202-I222 HydrophobicContact CD1-CG2 3.92Å; F202-I222 HydrophobicContact CE1-CB 3.88Å; F202-I222 HydrophobicContact CE1-CD1 4.34Å; F202-I222 HydrophobicContact CE1-CG2 3.52Å; F202-I222 HydrophobicContact CZ-CB 4.37Å; F202-I222 HydrophobicContact CZ-CD1 4.25Å; F202-I222 HydrophobicContact CZ-CG2 4.42Å; F202-L223 HydrophobicContact CE1-CD2 4.33Å; F202-L223 HydrophobicContact CE1-CG 4.45Å
203	Y	95	Very high	92.7	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.016	22%	0.219	C	C	.	.	H	α-helix	trans	-63.5	-40.7	175.4	-61.1	-35.1	0	0	0	112.4	L199 N200 Q201 V206 Y207 I222 L223 A419 C422	L199-Y203 HydrophobicContact CD1-CE1 4.09Å; L199-Y203 HydrophobicContact CD1-CE2 4.14Å; L199-Y203 HydrophobicContact CD2-CE2 4.01Å; L199-Y203 HydrophobicContact CG-CD2 4.33Å; L199-Y203 HydrophobicContact CG-CE1 4.49Å; L199-Y203 HydrophobicContact CG-CE2 3.65Å; L199-Y203 WeakPolarHBondContact O-CD2 3.36Å; L199-Y203 PolarHBondContact O-N 2.57Å; N200-Y203 PolarHBondContact O-N 3.08Å; Q201-Y203 VanDerWaalsContact C-N 3.33Å; Q201-Y203 PolarHBondContact O-N 2.99Å; Y203-V206 PolarHBondContact O-N 3.46Å; Y203-Y207 WeakPolarHBondContact O-CB 3.43Å; Y203-Y207 PolarHBondContact O-N 3.32Å; Y203-I222 HydrophobicContact CE1-CG2 4.16Å; Y203-L223 HydrophobicContact CD1-CD2 3.88Å; Y203-L223 HydrophobicContact CE1-CD2 4.22Å; Y203-A419 WeakPolarHBondContact O-CB 3.3Å; Y203-C422 HydrophobicContact CD1-CB 4.09Å; Y203-C422 HydrophobicContact CD2-CB 3.68Å; Y203-C422 HydrophobicContact CE1-CB 4.02Å; Y203-C422 HydrophobicContact CE2-CB 3.6Å; Y203-C422 HydrophobicContact CG-CB 3.93Å
204	L	93.9	Very high	92.9	Very high	21 Å²	21	43.5 Å²	43.5	11%	0.11	21%	0.211	C	C	.	.	H	α-helix	trans	-60.9	-46.7	177.4	-170.8	63.3	0	0	0	112	N200 Q201 F202 Y207 L208 L423 F671 F672	N200-L204 WeakPolarHBondContact O-CB 3.26Å; N200-L204 PolarHBondContact O-N 3.13Å; Q201-L204 WeakPolarHBondContact O-CB 3.17Å; Q201-L204 PolarHBondContact O-N 3.14Å; Q201-L204 VanDerWaalsContact O-N 3.17Å; F202-L204 PolarHBondContact O-N 2.92Å; L204-Y207 PolarHBondContact O-N 3.33Å; L204-L208 HydrophobicContact CG-CD1 4.38Å; L204-L208 WeakPolarHBondContact O-CG 3.28Å; L204-L208 PolarHBondContact O-N 3.37Å; L204-L423 HydrophobicContact CD1-CD1 4.32Å; L204-F671 HydrophobicContact CD1-CB 4.08Å; L204-F671 WeakPolarHBondContact CD2-O 3.17Å; L204-F672 HydrophobicContact CD1-CD1 3.78Å; L204-F672 HydrophobicContact CD1-CE1 3.45Å; L204-F672 VanDerWaalsContact CD1-CE1 3.45Å; L204-F672 HydrophobicContact CD1-CZ 4.21Å
205	D	94.8	Very high	93.3	Very high	25 Å²	25	43 Å²	43	13%	0.134	21%	0.205	C	C	.	.	H	α-helix	trans	-70.2	-32.3	179.6	-72.9	-38.6	0	0	0	112.5	I181 Y189 Q201 F202 N209	I181-D205 HydrophobicContact CD1-CB 3.64Å; I181-D205 HydrophobicContact CG1-CB 4.1Å; Y189-D205 WeakPolarHBondContact CE1-OD2 3.28Å; Y189-D205 VanDerWaalsContact OH-CB 3.32Å; Y189-D205 WeakPolarHBondContact OH-CB 3.33Å; Y189-D205 VanDerWaalsContact OH-CG 3.28Å; Y189-D205 PolarHBondContact OH-OD2 2.89Å; Q201-D205 VanDerWaalsContact NE2-CG 3.28Å; Q201-D205 PolarHBondContact NE2-OD1 3.34Å; Q201-D205 PolarHBondContact NE2-OD2 3.29Å; Q201-D205 PolarHBondContact O-N 3.34Å; F202-D205 PolarHBondContact O-N 3.4Å; D205-N209 WeakPolarHBondContact O-CA 3.37Å; D205-N209 WeakPolarHBondContact O-CB 3.16Å; D205-N209 PolarHBondContact O-N 3.09Å; D205-N209 PolarHBondContact O-ND2 3.08Å
206	V	96.3	Very high	93.7	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-67.9	-47.3	170.5	173.3	0	0	0	0	110.4	I181 F202 Y203 L208 G210 L211 L223 E415 A419	I181-V206 HydrophobicContact CD1-CB 4.47Å; I181-V206 HydrophobicContact CD1-CG2 3.57Å; F202-V206 HydrophobicContact CD2-CG2 4.14Å; F202-V206 HydrophobicContact CE1-CG2 4.21Å; F202-V206 HydrophobicContact CE2-CG2 3.61Å; F202-V206 HydrophobicContact CZ-CG2 3.65Å; F202-V206 VanDerWaalsContact O-CG2 3.32Å; F202-V206 WeakPolarHBondContact O-CG2 3.43Å; F202-V206 PolarHBondContact O-N 3.18Å; Y203-V206 PolarHBondContact O-N 3.46Å; V206-L208 VanDerWaalsContact C-N 3.28Å; V206-L208 PolarHBondContact O-N 3.4Å; V206-G210 WeakPolarHBondContact O-CA 3.48Å; V206-G210 PolarHBondContact O-N 3.04Å; V206-L211 HydrophobicContact CG1-CG 4.41Å; V206-L211 HydrophobicContact CG2-CD2 3.65Å; V206-L211 HydrophobicContact CG2-CG 4.12Å; V206-L223 HydrophobicContact CB-CD2 4.39Å; V206-L223 HydrophobicContact CG1-CD1 3.93Å; V206-L223 HydrophobicContact CG1-CD2 4.03Å; V206-E415 HydrophobicContact CG1-CB 4.08Å; V206-E415 WeakPolarHBondContact CG1-O 3.35Å; V206-A419 HydrophobicContact CB-CB 4.08Å; V206-A419 HydrophobicContact CG1-CB 3.89Å
207	Y	95.5	Very high	94.1	Very high	2 Å²	2	44 Å²	44	1%	0.008	21%	0.211	C	C	.	.	H	α-helix	trans	-54.2	-47.7	177.9	166.5	-101.7	0	0	0	110.6	Y203 L204 A420 L423 F610 K657 F660 N661 F672	Y203-Y207 WeakPolarHBondContact O-CB 3.43Å; Y203-Y207 PolarHBondContact O-N 3.32Å; L204-Y207 PolarHBondContact O-N 3.33Å; Y207-A420 HydrophobicContact CD2-CB 3.84Å; Y207-A420 HydrophobicContact CE2-CB 4Å; Y207-L423 HydrophobicContact CG-CD1 4.47Å; Y207-F610 HydrophobicContact CE2-CD2 4.06Å; Y207-F610 HydrophobicContact CE2-CE1 4.35Å; Y207-F610 AromaticContact CE2-CE2 3.67Å; Y207-F610 HydrophobicContact CE2-CE2 3.67Å; Y207-F610 AromaticContact CE2-CZ 3.82Å; Y207-F610 HydrophobicContact CE2-CZ 3.82Å; Y207-K657 HydrophobicContact CE1-CG 4.39Å; Y207-K657 HydrophobicContact CE2-CG 4.13Å; Y207-K657 WeakPolarHBondContact O-CE 3.44Å; Y207-K657 PolarHBondContact O-NZ 2.85Å; Y207-K657 WeakPolarHBondContact OH-CG 3.45Å; Y207-F660 HydrophobicContact CE2-CD1 4.32Å; Y207-N661 PolarHBondContact OH-OD1 2.84Å; Y207-F672 HydrophobicContact CD1-CE1 4.35Å; Y207-F672 HydrophobicContact CD1-CZ 4.25Å; Y207-F672 HydrophobicContact CE1-CE1 4.11Å; Y207-F672 AromaticContact CE1-CZ 3.68Å; Y207-F672 HydrophobicContact CE1-CZ 3.68Å
208	L	93	Very high	94.2	Very high	52 Å²	52	41.4 Å²	41.4	27%	0.272	20%	0.199	S	C	.	.	H	α-helix	trans	-69.5	-62.8	177.7	-67.5	174.3	0	0	0	111.8	L204 V206 R412 K657 F672	L204-L208 HydrophobicContact CG-CD1 4.38Å; L204-L208 WeakPolarHBondContact O-CG 3.28Å; L204-L208 PolarHBondContact O-N 3.37Å; V206-L208 VanDerWaalsContact C-N 3.28Å; V206-L208 PolarHBondContact O-N 3.4Å; L208-R412 PolarHBondContact O-NH2 2.84Å; L208-K657 PolarHBondContact O-NZ 2.94Å; L208-F672 HydrophobicContact CD2-CE1 4.1Å
209	N	92.8	Very high	94.3	Very high	5 Å²	5	34.8 Å²	34.8	3%	0.027	17%	0.173	C	C	.	.	H	α-helix	trans	-105.7	-15.4	-158.5	-51.1	-57.5	0	0	0	114.4	H178 P180 D205 R412	H178-N209 PolarHBondContact N-OD1 2.94Å; H178-N209 PolarHBondContact O-OD1 2.97Å; P180-N209 VanDerWaalsContact CA-O 3.32Å; P180-N209 WeakPolarHBondContact CA-O 3.27Å; D205-N209 WeakPolarHBondContact O-CA 3.37Å; D205-N209 WeakPolarHBondContact O-CB 3.16Å; D205-N209 PolarHBondContact O-N 3.09Å; D205-N209 PolarHBondContact O-ND2 3.08Å; N209-R412 PolarHBondContact O-NH1 3.44Å; N209-R412 PolarHBondContact O-NH2 2.83Å
210	G	94.9	Very high	94.6	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.165	C	C	.	.			trans	73.3	-172.6	-178	0	0	0	0	0	113.4	P180 I181 V206 E415	P180-G210 WeakPolarHBondContact CA-O 3.4Å; I181-G210 PolarHBondContact N-O 3.1Å; V206-G210 WeakPolarHBondContact O-CA 3.48Å; V206-G210 PolarHBondContact O-N 3.04Å; G210-E415 WeakPolarHBondContact CA-OE2 3.48Å
211	L	96.5	Very high	94.7	Very high	3 Å²	3	31.8 Å²	31.8	2%	0.016	15%	0.154	C	C	.	.	B	Isolated β-bridge	trans	-109.1	144.5	-178.7	-62.6	169.3	0	0	0	112	I181 F202 V206 L215 R216 L223 E415	I181-L211 HydrophobicContact CB-CD2 4.25Å; I181-L211 HydrophobicContact CD1-CD2 4.4Å; F202-L211 HydrophobicContact CE2-CD2 4.14Å; F202-L211 HydrophobicContact CZ-CD2 4.39Å; V206-L211 HydrophobicContact CG1-CG 4.41Å; V206-L211 HydrophobicContact CG2-CD2 3.65Å; V206-L211 HydrophobicContact CG2-CG 4.12Å; L211-L215 HydrophobicContact CD2-CD2 3.84Å; L211-L215 HydrophobicContact CD2-CG 4.17Å; L211-R216 HydrophobicContact CB-CG 4.05Å; L211-L223 HydrophobicContact CD1-CD1 4.23Å; L211-E415 HydrophobicContact CD1-CG 4.11Å; L211-E415 HydrophobicContact CG-CG 4.41Å; L211-E415 PolarHBondContact N-OE2 3.02Å
212	E	95.8	Very high	94.7	Very high	78 Å²	78	28.4 Å²	28.4	36%	0.364	14%	0.138	S	C	.	.			trans	-61.6	147	160.9	-75.5	-170.1	156.1	0	0	110.7	P180 I181 S182 S214 L215 R216	P180-E212 HydrophobicContact CB-CG 4.24Å; I181-E212 WeakPolarHBondContact O-CB 3.45Å; I181-E212 PolarHBondContact O-N 3.35Å; S182-E212 WeakPolarHBondContact CA-OE2 3.47Å; S182-E212 VanDerWaalsContact CB-CD 3.48Å; S182-E212 VanDerWaalsContact CB-OE2 3.25Å; S182-E212 WeakPolarHBondContact CB-OE2 3.41Å; E212-S214 PolarHBondContact O-N 2.94Å; E212-L215 PolarHBondContact O-N 3.33Å; E212-R216 PolarHBondContact O-N 2.95Å; E212-R216 VanDerWaalsContact O-N 3.13Å
213	H	94.1	Very high	94.7	Very high	142 Å²	142	28.4 Å²	28.4	66%	0.657	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-37.2	-177.5	-179.5	101.8	0	0	0	112.7	L215	H213-L215 PolarHBondContact O-N 2.91Å
214	S	92.9	Very high	94.7	Very high	44 Å²	44	28.3 Å²	28.3	31%	0.308	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-38	175.3	54.8	0	0	0	0	112.7	D183 E212 K217	D183-S214 WeakPolarHBondContact OD2-CB 3.42Å; D183-S214 PolarHBondContact OD2-OG 3.33Å; E212-S214 PolarHBondContact O-N 2.94Å; S214-K217 WeakPolarHBondContact O-CE 3.46Å; S214-K217 PolarHBondContact O-NZ 3.15Å
215	L	94.7	Very high	94.6	Very high	2 Å²	2	28.5 Å²	28.5	1%	0.01	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-24.8	-169.8	-175.5	61.7	0	0	0	112.8	I181 M186 L211 E212 H213 K217 V218 G219	I181-L215 HydrophobicContact CB-CD2 4.12Å; I181-L215 HydrophobicContact CG2-CD2 3.64Å; I181-L215 VanDerWaalsContact O-CD2 3.25Å; I181-L215 WeakPolarHBondContact O-CD2 3.49Å; M186-L215 HydrophobicContact CB-CD1 4.05Å; M186-L215 HydrophobicContact CB-CD2 3.95Å; M186-L215 HydrophobicContact CG-CD1 3.71Å; M186-L215 HydrophobicContact CG-CD2 4.16Å; M186-L215 HydrophobicContact SD-CD1 4.01Å; M186-L215 HydrophobicContact SD-CD2 3.87Å; M186-L215 HydrophobicContact SD-CG 4.38Å; L211-L215 HydrophobicContact CD2-CD2 3.84Å; L211-L215 HydrophobicContact CD2-CG 4.17Å; E212-L215 PolarHBondContact O-N 3.33Å; H213-L215 PolarHBondContact O-N 2.91Å; L215-K217 VanDerWaalsContact C-N 3.26Å; L215-K217 PolarHBondContact O-N 2.95Å; L215-K217 VanDerWaalsContact O-N 3.09Å; L215-V218 HydrophobicContact CD1-CB 4.16Å; L215-V218 WeakPolarHBondContact O-CA 3.48Å; L215-V218 PolarHBondContact O-N 3.48Å; L215-G219 PolarHBondContact O-N 3Å
216	R	96.8	Very high	94.4	Very high	27 Å²	27	27.5 Å²	27.5	10%	0.102	14%	0.136	C	C	.	.	H	α-helix	trans	-42.9	-48.2	-179.3	-72.8	-172.7	175.9	143.8	9.3	113.6	L211 E212 V218 G219 W220 V330 D408 L411 E415	L211-R216 HydrophobicContact CB-CG 4.05Å; E212-R216 PolarHBondContact O-N 2.95Å; E212-R216 VanDerWaalsContact O-N 3.13Å; R216-V218 PolarHBondContact O-N 3.34Å; R216-V218 VanDerWaalsContact O-N 3.16Å; R216-G219 PolarHBondContact O-N 3.21Å; R216-W220 WeakPolarHBondContact O-CB 3.15Å; R216-W220 PolarHBondContact O-N 3.34Å; R216-V330 HydrophobicContact CB-CG1 3.62Å; R216-V330 HydrophobicContact CB-CG2 4.46Å; R216-D408 IonicContact NH1-OD1 2.67Å; R216-D408 PolarHBondContact NH1-OD1 3Å; R216-L411 VanDerWaalsContact NH1-CD1 3.27Å; R216-E415 WeakPolarHBondContact CD-OE1 3.46Å; R216-E415 WeakPolarHBondContact CG-OE1 3.39Å; R216-E415 IonicContact CZ-OE1 3.25Å; R216-E415 IonicContact NE-OE1 2.72Å; R216-E415 PolarHBondContact NE-OE1 2.83Å; R216-E415 IonicContact NH2-OE1 2.72Å
217	K	95.2	Very high	93.9	Very high	99 Å²	99	28 Å²	28	43%	0.43	14%	0.14	S	C	.	.	H	α-helix	trans	-54.9	-34.8	178.9	69.6	-156.9	175	-152.9	0	114	S214 L215 R221 V330 Q331	S214-K217 WeakPolarHBondContact O-CE 3.46Å; S214-K217 PolarHBondContact O-NZ 3.15Å; L215-K217 VanDerWaalsContact C-N 3.26Å; L215-K217 PolarHBondContact O-N 2.95Å; L215-K217 VanDerWaalsContact O-N 3.09Å; K217-R221 WeakPolarHBondContact O-CG 3.47Å; K217-R221 PolarHBondContact O-NE 3.2Å; K217-R221 PolarHBondContact O-NH1 3.03Å; K217-R221 VanDerWaalsContact O-NH1 3.08Å; K217-V330 WeakPolarHBondContact CB-O 3.46Å; K217-Q331 PolarHBondContact O-NE2 3.05Å; K217-Q331 PolarHBondContact O-OE1 3.07Å
218	V	92.6	Very high	93.3	Very high	39 Å²	39	28.1 Å²	28.1	24%	0.236	14%	0.14	C	C	.	.	H	α-helix	trans	-85.4	-50.6	176.1	-175.6	0	0	0	0	110.3	L215 R216 W220 R221 I222	L215-V218 HydrophobicContact CD1-CB 4.16Å; L215-V218 WeakPolarHBondContact O-CA 3.48Å; L215-V218 PolarHBondContact O-N 3.48Å; R216-V218 PolarHBondContact O-N 3.34Å; R216-V218 VanDerWaalsContact O-N 3.16Å; V218-W220 PolarHBondContact O-N 3.33Å; V218-R221 PolarHBondContact O-N 3.07Å; V218-R221 VanDerWaalsContact O-N 3.13Å; V218-I222 HydrophobicContact CG1-CD1 4.1Å; V218-I222 WeakPolarHBondContact O-CG1 3.49Å; V218-I222 PolarHBondContact O-N 2.89Å
219	G	94.6	Very high	92.6	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-59.4	-43.1	-177.3	0	0	0	0	0	113	L215 R216 R221 I222 L223	L215-G219 PolarHBondContact O-N 3Å; R216-G219 PolarHBondContact O-N 3.21Å; G219-R221 VanDerWaalsContact C-N 3.32Å; G219-R221 PolarHBondContact O-N 3.39Å; G219-I222 WeakPolarHBondContact O-CA 3.45Å; G219-I222 WeakPolarHBondContact O-CB 3.46Å; G219-I222 PolarHBondContact O-N 2.77Å; G219-L223 WeakPolarHBondContact O-CG 3.47Å; G219-L223 PolarHBondContact O-N 3.21Å
220	W	97.2	Very high	92	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-62.3	-37	176.2	-74.2	27.1	0	0	0	112.3	R216 V218 I222 L223 L224 P326 L327 V330 L411 F414 E415 W418	R216-W220 WeakPolarHBondContact O-CB 3.15Å; R216-W220 PolarHBondContact O-N 3.34Å; V218-W220 PolarHBondContact O-N 3.33Å; W220-I222 PolarHBondContact O-N 3.02Å; W220-L223 PolarHBondContact O-N 2.95Å; W220-L224 VanDerWaalsContact O-CB 3.24Å; W220-L224 WeakPolarHBondContact O-CB 3.43Å; W220-L224 WeakPolarHBondContact O-CG 3.46Å; W220-L224 PolarHBondContact O-N 3.47Å; W220-P326 HydrophobicContact CH2-CB 4.2Å; W220-P326 HydrophobicContact CZ3-CB 4.28Å; W220-L327 HydrophobicContact CE3-CD2 3.82Å; W220-L327 HydrophobicContact CZ3-CD2 3.84Å; W220-V330 HydrophobicContact CD2-CB 4.24Å; W220-V330 HydrophobicContact CD2-CG1 3.69Å; W220-V330 HydrophobicContact CD2-CG2 4.26Å; W220-V330 HydrophobicContact CE3-CB 3.81Å; W220-V330 HydrophobicContact CE3-CG1 3.68Å; W220-V330 HydrophobicContact CE3-CG2 4Å; W220-V330 HydrophobicContact CG-CG1 4.05Å; W220-V330 HydrophobicContact CH2-CB 4.43Å; W220-V330 HydrophobicContact CH2-CG2 3.75Å; W220-V330 HydrophobicContact CZ2-CG2 3.96Å; W220-V330 HydrophobicContact CZ3-CB 3.9Å; W220-V330 HydrophobicContact CZ3-CG1 4.27Å; W220-V330 HydrophobicContact CZ3-CG2 3.73Å; W220-L411 HydrophobicContact CH2-CB 4.38Å; W220-L411 HydrophobicContact CH2-CD2 3.51Å; W220-L411 HydrophobicContact CH2-CG 4.49Å; W220-L411 HydrophobicContact CZ2-CB 3.94Å; W220-L411 HydrophobicContact CZ2-CD2 3.94Å; W220-L411 HydrophobicContact CZ2-CG 4.48Å; W220-F414 AromaticContact CH2-CD2 3.83Å; W220-F414 HydrophobicContact CH2-CD2 3.83Å; W220-F414 HydrophobicContact CZ2-CB 4.47Å; W220-F414 HydrophobicContact CZ2-CD2 4.32Å; W220-E415 PolarHBondContact NE1-OE1 2.72Å; W220-W418 HydrophobicContact CD2-CH2 4.42Å; W220-W418 AromaticContact CD2-CZ3 3.73Å; W220-W418 HydrophobicContact CD2-CZ3 3.73Å; W220-W418 HydrophobicContact CE3-CH2 4.05Å; W220-W418 AromaticContact CE3-CZ3 3.77Å; W220-W418 HydrophobicContact CE3-CZ3 3.77Å; W220-W418 HydrophobicContact CG-CZ3 4.14Å; W220-W418 HydrophobicContact CH2-CH2 4.23Å; W220-W418 HydrophobicContact CH2-CZ3 4.34Å; W220-W418 HydrophobicContact CZ2-CZ3 4.35Å; W220-W418 AromaticContact CZ3-CH2 3.96Å; W220-W418 HydrophobicContact CZ3-CH2 3.96Å; W220-W418 HydrophobicContact CZ3-CZ3 4.1Å
221	R	94.3	Very high	91.6	Very high	41 Å²	41	29.2 Å²	29.2	16%	0.155	15%	0.149	C	C	.	.	H	α-helix	trans	-68.4	-19.7	174.3	-71.3	-169.3	-52.4	-109.9	6.7	113.1	K217 V218 G219 V226	K217-R221 WeakPolarHBondContact O-CG 3.47Å; K217-R221 PolarHBondContact O-NE 3.2Å; K217-R221 PolarHBondContact O-NH1 3.03Å; K217-R221 VanDerWaalsContact O-NH1 3.08Å; V218-R221 PolarHBondContact O-N 3.07Å; V218-R221 VanDerWaalsContact O-N 3.13Å; G219-R221 VanDerWaalsContact C-N 3.32Å; G219-R221 PolarHBondContact O-N 3.39Å; R221-V226 HydrophobicContact CB-CB 3.89Å; R221-V226 HydrophobicContact CB-CG1 4.46Å; R221-V226 HydrophobicContact CB-CG2 4.34Å; R221-V226 HydrophobicContact CG-CB 4.02Å; R221-V226 HydrophobicContact CG-CG1 4.14Å; R221-V226 HydrophobicContact CG-CG2 4.28Å; R221-V226 WeakPolarHBondContact O-CB 3.5Å; R221-V226 PolarHBondContact O-N 3.11Å
222	I	92.7	Very high	91.2	Very high	12 Å²	12	29.8 Å²	29.8	6%	0.062	15%	0.153	C	C	.	.	H	α-helix	trans	-85.3	-52.6	172.2	-58.8	160.8	0	0	0	109.3	M186 I196 L199 F202 Y203 V218 G219 W220 L224 S225	M186-I222 HydrophobicContact CE-CD1 3.46Å; M186-I222 VanDerWaalsContact CE-CD1 3.46Å; I196-I222 HydrophobicContact CD1-CB 4.31Å; I196-I222 HydrophobicContact CD1-CD1 3.49Å; I196-I222 VanDerWaalsContact CD1-CD1 3.49Å; I196-I222 HydrophobicContact CD1-CG1 3.64Å; I196-I222 HydrophobicContact CD1-CG2 3.66Å; L199-I222 HydrophobicContact CD1-CG2 3.95Å; F202-I222 HydrophobicContact CD1-CG2 3.92Å; F202-I222 HydrophobicContact CE1-CB 3.88Å; F202-I222 HydrophobicContact CE1-CD1 4.34Å; F202-I222 HydrophobicContact CE1-CG2 3.52Å; F202-I222 HydrophobicContact CZ-CB 4.37Å; F202-I222 HydrophobicContact CZ-CD1 4.25Å; F202-I222 HydrophobicContact CZ-CG2 4.42Å; Y203-I222 HydrophobicContact CE1-CG2 4.16Å; V218-I222 HydrophobicContact CG1-CD1 4.1Å; V218-I222 WeakPolarHBondContact O-CG1 3.49Å; V218-I222 PolarHBondContact O-N 2.89Å; G219-I222 WeakPolarHBondContact O-CA 3.45Å; G219-I222 WeakPolarHBondContact O-CB 3.46Å; G219-I222 PolarHBondContact O-N 2.77Å; W220-I222 PolarHBondContact O-N 3.02Å; I222-L224 VanDerWaalsContact C-N 3.27Å; I222-L224 PolarHBondContact O-N 2.87Å; I222-S225 PolarHBondContact O-N 2.94Å
223	L	95.3	Very high	90.7	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-55	-39.1	178.3	-67.1	168	0	0	0	113.1	F202 Y203 V206 L211 G219 W220 R347 W418 A419 C422	F202-L223 HydrophobicContact CE1-CD2 4.33Å; F202-L223 HydrophobicContact CE1-CG 4.45Å; Y203-L223 HydrophobicContact CD1-CD2 3.88Å; Y203-L223 HydrophobicContact CE1-CD2 4.22Å; V206-L223 HydrophobicContact CB-CD2 4.39Å; V206-L223 HydrophobicContact CG1-CD1 3.93Å; V206-L223 HydrophobicContact CG1-CD2 4.03Å; L211-L223 HydrophobicContact CD1-CD1 4.23Å; G219-L223 WeakPolarHBondContact O-CG 3.47Å; G219-L223 PolarHBondContact O-N 3.21Å; W220-L223 PolarHBondContact O-N 2.95Å; L223-R347 PolarHBondContact O-NH1 3.27Å; L223-R347 PolarHBondContact O-NH2 2.84Å; L223-W418 HydrophobicContact CB-CB 4.22Å; L223-W418 HydrophobicContact CB-CE3 4.47Å; L223-A419 HydrophobicContact CD2-CB 3.89Å; L223-C422 PolarHBondContact O-SG 2.85Å
224	L	94.5	Very high	90.4	Very high	2 Å²	2	28.8 Å²	28.8	1%	0.01	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-10.9	178.5	-68.7	173.1	0	0	0	113.6	W220 I222 V226 L327 A343 L344 R347 W418	W220-L224 VanDerWaalsContact O-CB 3.24Å; W220-L224 WeakPolarHBondContact O-CB 3.43Å; W220-L224 WeakPolarHBondContact O-CG 3.46Å; W220-L224 PolarHBondContact O-N 3.47Å; I222-L224 VanDerWaalsContact C-N 3.27Å; I222-L224 PolarHBondContact O-N 2.87Å; L224-V226 HydrophobicContact CB-CG2 3.88Å; L224-L327 HydrophobicContact CD1-CD2 3.77Å; L224-A343 HydrophobicContact CB-CB 4.11Å; L224-L344 HydrophobicContact CD2-CB 4.13Å; L224-L344 HydrophobicContact CD2-CD1 4.04Å; L224-R347 VanDerWaalsContact CA-NH2 3.34Å; L224-R347 PolarHBondContact O-NE 3.12Å; L224-R347 PolarHBondContact O-NH2 3.25Å; L224-W418 HydrophobicContact CD1-CE3 4.48Å; L224-W418 HydrophobicContact CD1-CH2 4.23Å; L224-W418 HydrophobicContact CD1-CZ3 3.99Å; L224-W418 HydrophobicContact CD2-CD2 3.78Å; L224-W418 HydrophobicContact CD2-CE3 3.8Å; L224-W418 HydrophobicContact CD2-CG 4.39Å; L224-W418 HydrophobicContact CD2-CH2 4.15Å; L224-W418 HydrophobicContact CD2-CZ2 4.13Å; L224-W418 HydrophobicContact CD2-CZ3 3.98Å; L224-W418 HydrophobicContact CG-CD2 4.44Å; L224-W418 HydrophobicContact CG-CE3 3.95Å; L224-W418 HydrophobicContact CG-CH2 4.46Å; L224-W418 HydrophobicContact CG-CZ3 3.97Å
225	S	91.5	Very high	90.2	Very high	26 Å²	26	30 Å²	30	18%	0.182	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	67.4	-165.8	-57.9	0	0	0	0	112	I222 N436 Y442	I222-S225 PolarHBondContact O-N 2.94Å; S225-N436 PolarHBondContact OG-ND2 3.27Å; S225-Y442 PolarHBondContact O-OH 3.08Å
226	V	91.6	Very high	90	Very high	4 Å²	4	31.5 Å²	31.5	2%	0.024	16%	0.163	C	C	.	.	S	Bend	trans	-99.4	-16	171.8	-175.4	0	0	0	0	111.7	R221 L224 L240 L339 A343 Y442 L443	R221-V226 HydrophobicContact CB-CB 3.89Å; R221-V226 HydrophobicContact CB-CG1 4.46Å; R221-V226 HydrophobicContact CB-CG2 4.34Å; R221-V226 HydrophobicContact CG-CB 4.02Å; R221-V226 HydrophobicContact CG-CG1 4.14Å; R221-V226 HydrophobicContact CG-CG2 4.28Å; R221-V226 WeakPolarHBondContact O-CB 3.5Å; R221-V226 PolarHBondContact O-N 3.11Å; L224-V226 HydrophobicContact CB-CG2 3.88Å; V226-L240 HydrophobicContact CG1-CD2 4.05Å; V226-L339 HydrophobicContact CG1-CB 3.84Å; V226-A343 HydrophobicContact CG2-CB 3.63Å; V226-Y442 WeakPolarHBondContact CA-OH 3.13Å; V226-Y442 PolarHBondContact N-OH 3.3Å; V226-Y442 PolarHBondContact O-OH 3.27Å; V226-L443 HydrophobicContact CG1-CD2 4.08Å
227	C	86	Confident	89.7	Confident	11 Å²	11	37.9 Å²	37.9	7%	0.074	19%	0.192	C	C	.	.	S	Bend	trans	-129.9	150.6	156.4	-64.6	0	0	0	0	111	R236 Y442	C227-R236 HydrophobicContact CB-CB 4.43Å; C227-R236 HydrophobicContact CB-CG 3.67Å; C227-Y442 WeakPolarHBondContact CA-OH 3.15Å; C227-Y442 PolarHBondContact N-OH 3.03Å; C227-Y442 PolarHBondContact O-OH 3.24Å
228	P	83.5	Confident	89.4	Confident	3 Å²	3	38.3 Å²	38.3	2%	0.019	20%	0.195	C	C	.	.			trans	-60.6	142.7	171.5	-18.7	31.2	0	0	0	111	D230 T231 N436 K438 Y442	P228-D230 VanDerWaalsContact C-N 3.3Å; P228-D230 VanDerWaalsContact CB-OD1 3.22Å; P228-D230 WeakPolarHBondContact CB-OD1 3.45Å; P228-D230 PolarHBondContact O-N 3.27Å; P228-T231 HydrophobicContact CB-CG2 4.06Å; P228-T231 HydrophobicContact CG-CG2 4.07Å; P228-T231 WeakPolarHBondContact O-CB 3.44Å; P228-T231 PolarHBondContact O-N 3Å; P228-T231 PolarHBondContact O-OG1 3.09Å; P228-N436 WeakPolarHBondContact CB-O 3.25Å; P228-K438 HydrophobicContact CB-CG 4.45Å; P228-K438 HydrophobicContact CG-CG 4.48Å; P228-Y442 HydrophobicContact CB-CE2 4.4Å; P228-Y442 HydrophobicContact CG-CD1 4.01Å; P228-Y442 HydrophobicContact CG-CD2 3.74Å; P228-Y442 HydrophobicContact CG-CE1 4.02Å; P228-Y442 HydrophobicContact CG-CE2 3.75Å; P228-Y442 HydrophobicContact CG-CG 3.89Å
229	A	77.1	Confident	89.3	Confident	17 Å²	17	39.3 Å²	39.3	14%	0.14	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-23.7	-172.5	0	0	0	0	0	114.3	I196 L199 T231	I196-A229 PolarHBondContact N-O 2.92Å; L199-A229 HydrophobicContact CD1-CB 4.14Å; L199-A229 HydrophobicContact CD2-CB 3.68Å; A229-T231 VanDerWaalsContact C-N 3.27Å; A229-T231 PolarHBondContact O-N 3.18Å
230	D	80.2	Confident	89.2	Confident	63 Å²	63	40.3 Å²	40.3	34%	0.337	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-1.6	178.2	70.9	-26.5	0	0	0	113.9	P228 K438	P228-D230 VanDerWaalsContact C-N 3.3Å; P228-D230 VanDerWaalsContact CB-OD1 3.22Å; P228-D230 WeakPolarHBondContact CB-OD1 3.45Å; P228-D230 PolarHBondContact O-N 3.27Å; D230-K438 VanDerWaalsContact CG-CE 3.48Å; D230-K438 PolarHBondContact O-NZ 3.24Å; D230-K438 WeakPolarHBondContact OD1-CE 3.34Å; D230-K438 VanDerWaalsContact OD2-CD 3.3Å; D230-K438 WeakPolarHBondContact OD2-CD 3.34Å; D230-K438 WeakPolarHBondContact OD2-CE 3.47Å; D230-K438 WeakPolarHBondContact OD2-CG 3.38Å; D230-K438 IonicContact OD2-NZ 3.19Å
231	T	86.2	Confident	89.1	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.221	C	C	.	.			trans	-75.5	138.2	175.5	52.9	0	0	0	0	112.4	R195 P228 A229 E235 R236 L239 K438	R195-T231 WeakPolarHBondContact CA-O 3.31Å; P228-T231 HydrophobicContact CB-CG2 4.06Å; P228-T231 HydrophobicContact CG-CG2 4.07Å; P228-T231 WeakPolarHBondContact O-CB 3.44Å; P228-T231 PolarHBondContact O-N 3Å; P228-T231 PolarHBondContact O-OG1 3.09Å; A229-T231 VanDerWaalsContact C-N 3.27Å; A229-T231 PolarHBondContact O-N 3.18Å; T231-E235 WeakPolarHBondContact CA-OE2 3.38Å; T231-E235 HydrophobicContact CG2-CB 4.02Å; T231-R236 PolarHBondContact O-NH1 3.21Å; T231-R236 WeakPolarHBondContact OG1-CG 3.3Å; T231-L239 HydrophobicContact CG2-CD1 3.71Å; T231-K438 VanDerWaalsContact CG2-CE 3.49Å; T231-K438 HydrophobicContact CG2-CG 4.38Å
232	T	89	Confident	89.1	Confident	16 Å²	16	44.5 Å²	44.5	10%	0.098	23%	0.229	C	C	.	.			trans	-66.4	164.7	163.8	60.2	0	0	0	0	111.1	N193 R195 Q234 E235 R236	N193-T232 HydrophobicContact CB-CG2 3.62Å; N193-T232 CarbonylContact O-C 3.37Å; N193-T232 WeakPolarHBondContact O-CA 3.43Å; N193-T232 VanDerWaalsContact O-CB 3.27Å; N193-T232 WeakPolarHBondContact O-CB 3.4Å; R195-T232 HydrophobicContact CG-CG2 3.89Å; T232-Q234 PolarHBondContact O-N 2.85Å; T232-E235 WeakPolarHBondContact CB-OE2 3.46Å; T232-E235 WeakPolarHBondContact CG2-OE2 3.12Å; T232-E235 PolarHBondContact N-OE2 3.26Å; T232-E235 PolarHBondContact O-N 3.16Å; T232-E235 WeakPolarHBondContact OG1-CB 3.33Å; T232-E235 VanDerWaalsContact OG1-CG 3.25Å; T232-E235 WeakPolarHBondContact OG1-CG 3.48Å; T232-E235 PolarHBondContact OG1-N 2.84Å; T232-E235 VanDerWaalsContact OG1-N 3.1Å; T232-E235 PolarHBondContact OG1-OE2 3.25Å; T232-R236 WeakPolarHBondContact O-CG 3.38Å; T232-R236 PolarHBondContact O-N 3.15Å
233	G	85.3	Confident	89.1	Confident	31 Å²	31	45.8 Å²	45.8	32%	0.32	23%	0.234	S	C	.	.	H	α-helix	trans	-57.8	-34.7	173.6	0	0	0	0	0	113.2	N193 F237	N193-G233 PolarHBondContact O-N 2.8Å; G233-F237 PolarHBondContact O-N 2.9Å; G233-F237 VanDerWaalsContact O-N 3.12Å
234	Q	86.8	Confident	89.2	Confident	167 Å²	167	46.9 Å²	46.9	78%	0.78	24%	0.243	S	C	*	.	H	α-helix	trans	-71.6	-44.6	176.3	-66.5	-177.2	-5	0	0	112.2	T232 R236 F237 H238	T232-Q234 PolarHBondContact O-N 2.85Å; Q234-R236 VanDerWaalsContact C-N 3.33Å; Q234-R236 PolarHBondContact O-N 3.19Å; Q234-F237 PolarHBondContact O-N 3.39Å; Q234-H238 PolarHBondContact O-N 3.48Å
235	E	89.3	Confident	89.3	Confident	69 Å²	69	51.8 Å²	51.8	32%	0.322	27%	0.266	S	S	.	.	H	α-helix	trans	-60.9	-41.4	174.6	-73.7	168	124.5	0	0	111.3	T231 T232 F237 H238 L239 K438	T231-E235 WeakPolarHBondContact CA-OE2 3.38Å; T231-E235 HydrophobicContact CG2-CB 4.02Å; T232-E235 WeakPolarHBondContact CB-OE2 3.46Å; T232-E235 WeakPolarHBondContact CG2-OE2 3.12Å; T232-E235 PolarHBondContact N-OE2 3.26Å; T232-E235 PolarHBondContact O-N 3.16Å; T232-E235 WeakPolarHBondContact OG1-CB 3.33Å; T232-E235 VanDerWaalsContact OG1-CG 3.25Å; T232-E235 WeakPolarHBondContact OG1-CG 3.48Å; T232-E235 PolarHBondContact OG1-N 2.84Å; T232-E235 VanDerWaalsContact OG1-N 3.1Å; T232-E235 PolarHBondContact OG1-OE2 3.25Å; E235-F237 PolarHBondContact O-N 3.21Å; E235-H238 PolarHBondContact O-N 3.5Å; E235-L239 WeakPolarHBondContact O-CB 3.23Å; E235-L239 VanDerWaalsContact O-CG 3.25Å; E235-L239 WeakPolarHBondContact O-CG 3.21Å; E235-L239 PolarHBondContact O-N 3.24Å; E235-K438 WeakPolarHBondContact OE1-CE 3.44Å; E235-K438 IonicContact OE1-NZ 2.76Å; E235-K438 PolarHBondContact OE1-NZ 3.01Å; E235-K438 IonicContact OE2-NZ 2.89Å; E235-K438 PolarHBondContact OE2-NZ 2.87Å
236	R	90.3	Very high	89.5	Confident	35 Å²	35	54.7 Å²	54.7	13%	0.132	28%	0.277	C	S	.	.	H	α-helix	trans	-59.6	-46.6	174	-70.8	-160.7	-66.1	-85.5	4.5	112.3	G194 C227 T231 T232 Q234 H238 L239 L240	G194-R236 VanDerWaalsContact O-CZ 3.22Å; G194-R236 PolarHBondContact O-NH1 2.57Å; G194-R236 PolarHBondContact O-NH2 3.47Å; C227-R236 HydrophobicContact CB-CB 4.43Å; C227-R236 HydrophobicContact CB-CG 3.67Å; T231-R236 PolarHBondContact O-NH1 3.21Å; T231-R236 WeakPolarHBondContact OG1-CG 3.3Å; T232-R236 WeakPolarHBondContact O-CG 3.38Å; T232-R236 PolarHBondContact O-N 3.15Å; Q234-R236 VanDerWaalsContact C-N 3.33Å; Q234-R236 PolarHBondContact O-N 3.19Å; R236-H238 PolarHBondContact O-N 3.06Å; R236-L239 PolarHBondContact O-N 2.87Å; R236-L240 WeakPolarHBondContact O-CB 3.45Å; R236-L240 WeakPolarHBondContact O-CG 3.38Å; R236-L240 PolarHBondContact O-N 3.48Å
237	F	89.5	Confident	89.8	Confident	160 Å²	160	54.7 Å²	54.7	70%	0.702	28%	0.276	S	S	*	.	H	α-helix	trans	-58.7	-47.7	178.6	-178.8	-93.8	0	0	0	111.4	G233 Q234 E235 L240 D241	G233-F237 PolarHBondContact O-N 2.9Å; G233-F237 VanDerWaalsContact O-N 3.12Å; Q234-F237 PolarHBondContact O-N 3.39Å; E235-F237 PolarHBondContact O-N 3.21Å; F237-L240 PolarHBondContact O-N 2.65Å; F237-D241 PolarHBondContact O-N 2.93Å
238	H	90.5	Very high	90.4	Very high	109 Å²	109	56.8 Å²	56.8	51%	0.505	29%	0.294	S	S	.	.	H	α-helix	trans	-66.8	-40.5	179.9	-175	43.7	0	0	0	113.4	Q234 E235 R236 D241 I242	Q234-H238 PolarHBondContact O-N 3.48Å; E235-H238 PolarHBondContact O-N 3.5Å; R236-H238 PolarHBondContact O-N 3.06Å; H238-D241 PolarHBondContact O-N 2.88Å; H238-I242 VanDerWaalsContact CE1-CD1 3.49Å; H238-I242 WeakPolarHBondContact CE1-CD1 3.36Å; H238-I242 WeakPolarHBondContact O-CG1 3.48Å; H238-I242 PolarHBondContact O-N 3.44Å
239	L	90.4	Very high	91	Very high	59 Å²	59	60.4 Å²	60.4	31%	0.309	32%	0.317	S	S	.	.	H	α-helix	trans	-64.2	-41.5	175.7	-74.1	169.8	0	0	0	111.9	T231 E235 R236 K243	T231-L239 HydrophobicContact CG2-CD1 3.71Å; E235-L239 WeakPolarHBondContact O-CB 3.23Å; E235-L239 VanDerWaalsContact O-CG 3.25Å; E235-L239 WeakPolarHBondContact O-CG 3.21Å; E235-L239 PolarHBondContact O-N 3.24Å; R236-L239 PolarHBondContact O-N 2.87Å; L239-K243 VanDerWaalsContact O-CB 3.25Å; L239-K243 WeakPolarHBondContact O-CB 3.49Å; L239-K243 WeakPolarHBondContact O-CG 3.35Å; L239-K243 PolarHBondContact O-N 3.32Å
240	L	92.5	Very high	92	Very high	21 Å²	21	60.7 Å²	60.7	11%	0.11	32%	0.316	C	S	.	.	H	α-helix	trans	-66.2	-39.5	177	-69.9	172.8	0	0	0	111.9	V226 R236 F237 K243 A244 L336 L339	V226-L240 HydrophobicContact CG1-CD2 4.05Å; R236-L240 WeakPolarHBondContact O-CB 3.45Å; R236-L240 WeakPolarHBondContact O-CG 3.38Å; R236-L240 PolarHBondContact O-N 3.48Å; F237-L240 PolarHBondContact O-N 2.65Å; L240-K243 PolarHBondContact O-N 2.88Å; L240-A244 VanDerWaalsContact O-CB 3.26Å; L240-A244 WeakPolarHBondContact O-CB 3.41Å; L240-A244 PolarHBondContact O-N 3.24Å; L240-L336 HydrophobicContact CB-CD2 4.01Å; L240-L336 HydrophobicContact CD1-CD2 4.1Å; L240-L336 HydrophobicContact CD2-CD2 3.87Å; L240-L336 HydrophobicContact CG-CD2 4.21Å; L240-L339 HydrophobicContact CD2-CD1 3.86Å
241	D	94.5	Very high	92.9	Very high	68 Å²	68	59.7 Å²	59.7	36%	0.364	31%	0.308	S	S	.	.	H	α-helix	trans	-61.5	-52.3	174.5	174.8	45.6	0	0	0	112.1	F237 H238 K243 A244 Q245	F237-D241 PolarHBondContact O-N 2.93Å; H238-D241 PolarHBondContact O-N 2.88Å; D241-K243 VanDerWaalsContact C-N 3.29Å; D241-K243 PolarHBondContact O-N 3.13Å; D241-A244 PolarHBondContact O-N 3.25Å; D241-A244 VanDerWaalsContact O-N 3.12Å; D241-Q245 WeakPolarHBondContact O-CG 3.31Å; D241-Q245 PolarHBondContact O-N 3.13Å; D241-Q245 PolarHBondContact OD1-NE2 3.4Å; D241-Q245 PolarHBondContact OD2-NE2 3.39Å
242	I	94.3	Very high	93.4	Very high	61 Å²	61	63.2 Å²	63.2	31%	0.313	33%	0.325	S	S	.	.	H	α-helix	trans	-56	-45.1	175.4	-71	168.4	0	0	0	111.1	H238 A244 Q245 Q246	H238-I242 VanDerWaalsContact CE1-CD1 3.49Å; H238-I242 WeakPolarHBondContact CE1-CD1 3.36Å; H238-I242 WeakPolarHBondContact O-CG1 3.48Å; H238-I242 PolarHBondContact O-N 3.44Å; I242-A244 VanDerWaalsContact C-N 3.35Å; I242-Q245 PolarHBondContact O-N 3.01Å; I242-Q246 WeakPolarHBondContact O-CG 3.32Å; I242-Q246 PolarHBondContact O-N 2.98Å
243	K	93.9	Very high	93.8	Very high	39 Å²	39	65.5 Å²	65.5	17%	0.17	34%	0.336	C	S	.	.	H	α-helix	trans	-69.1	-31.7	-179.5	-72.1	-78.2	-176.5	179.9	0	112.3	L239 L240 D241 Q246 Y247 L339 Y442 L443 L445	L239-K243 VanDerWaalsContact O-CB 3.25Å; L239-K243 WeakPolarHBondContact O-CB 3.49Å; L239-K243 WeakPolarHBondContact O-CG 3.35Å; L239-K243 PolarHBondContact O-N 3.32Å; L240-K243 PolarHBondContact O-N 2.88Å; D241-K243 VanDerWaalsContact C-N 3.29Å; D241-K243 PolarHBondContact O-N 3.13Å; K243-Q246 PolarHBondContact O-N 3.35Å; K243-Y247 PolarHBondContact O-N 2.94Å; K243-L339 HydrophobicContact CB-CD1 3.46Å; K243-L339 VanDerWaalsContact CB-CD1 3.46Å; K243-L339 HydrophobicContact CB-CD2 3.68Å; K243-L339 HydrophobicContact CB-CG 4.21Å; K243-Y442 WeakPolarHBondContact CE-O 3.24Å; K243-Y442 PolarHBondContact NZ-O 3.31Å; K243-L443 PolarHBondContact NZ-O 3.09Å; K243-L445 HydrophobicContact CD-CD1 3.85Å; K243-L445 HydrophobicContact CD-CG 4.29Å
244	A	96	Very high	94.3	Very high	24 Å²	24	64 Å²	64	20%	0.198	32%	0.321	C	S	.	.	H	α-helix	trans	-70.3	-38.8	172.8	0	0	0	0	0	112.3	L240 D241 I242 Y247 A248 A335	L240-A244 VanDerWaalsContact O-CB 3.26Å; L240-A244 WeakPolarHBondContact O-CB 3.41Å; L240-A244 PolarHBondContact O-N 3.24Å; D241-A244 PolarHBondContact O-N 3.25Å; D241-A244 VanDerWaalsContact O-N 3.12Å; I242-A244 VanDerWaalsContact C-N 3.35Å; A244-Y247 WeakPolarHBondContact O-CB 3.47Å; A244-Y247 PolarHBondContact O-N 2.88Å; A244-A248 PolarHBondContact O-N 2.85Å; A244-A335 HydrophobicContact CB-CB 3.62Å
245	Q	97	Very high	94.8	Very high	105 Å²	105	56.5 Å²	56.5	49%	0.491	29%	0.286	S	S	.	.	H	α-helix	trans	-65.4	-38.7	172.6	-65.9	169.8	27.7	0	0	111.6	D241 I242 A248 T249	D241-Q245 WeakPolarHBondContact O-CG 3.31Å; D241-Q245 PolarHBondContact O-N 3.13Å; D241-Q245 PolarHBondContact OD1-NE2 3.4Å; D241-Q245 PolarHBondContact OD2-NE2 3.39Å; I242-Q245 PolarHBondContact O-N 3.01Å; Q245-A248 PolarHBondContact O-N 2.82Å; Q245-T249 PolarHBondContact O-N 2.82Å; Q245-T249 VanDerWaalsContact O-N 3.11Å; Q245-T249 PolarHBondContact O-OG1 2.74Å; Q245-T249 VanDerWaalsContact O-OG1 3.09Å
246	Q	95.8	Very high	95.1	Very high	86 Å²	86	57.5 Å²	57.5	40%	0.402	29%	0.289	S	S	.	.	H	α-helix	trans	-60.8	-46.2	170.5	-72.8	175.4	3.5	0	0	111.5	I242 K243 A248 T249 L250 L445	I242-Q246 WeakPolarHBondContact O-CG 3.32Å; I242-Q246 PolarHBondContact O-N 2.98Å; K243-Q246 PolarHBondContact O-N 3.35Å; Q246-A248 PolarHBondContact O-N 3.17Å; Q246-T249 PolarHBondContact O-N 3.26Å; Q246-L250 WeakPolarHBondContact O-CG 3.32Å; Q246-L250 PolarHBondContact O-N 2.98Å; Q246-L445 HydrophobicContact CB-CD1 4Å
247	Y	97.5	Very high	95.4	Very high	5 Å²	5	57.1 Å²	57.1	2%	0.02	29%	0.29	C	S	.	.	H	α-helix	trans	-58.3	-46.2	175	172.3	-116.9	0	0	0	112.7	K243 A244 T249 L250 K251 D302 I303 T306 E334 A335 Y338	K243-Y247 PolarHBondContact O-N 2.94Å; A244-Y247 WeakPolarHBondContact O-CB 3.47Å; A244-Y247 PolarHBondContact O-N 2.88Å; Y247-T249 VanDerWaalsContact C-N 3.29Å; Y247-T249 PolarHBondContact O-N 3.29Å; Y247-L250 PolarHBondContact O-N 3.13Å; Y247-K251 HydrophobicContact CE1-CD 4.3Å; Y247-K251 HydrophobicContact CE2-CB 4.5Å; Y247-K251 WeakPolarHBondContact O-CB 3.41Å; Y247-K251 PolarHBondContact O-N 2.95Å; Y247-D302 VanDerWaalsContact OH-C 3.29Å; Y247-D302 PolarHBondContact OH-O 3.32Å; Y247-I303 WeakPolarHBondContact OH-CA 3.42Å; Y247-I303 PolarHBondContact OH-N 3.26Å; Y247-T306 HydrophobicContact CD2-CG2 3.91Å; Y247-T306 HydrophobicContact CE2-CG2 3.69Å; Y247-E334 HydrophobicContact CE1-CG 4.04Å; Y247-E334 WeakPolarHBondContact CE1-OE1 3.44Å; Y247-E334 PolarHBondContact OH-OE1 3.08Å; Y247-A335 HydrophobicContact CD1-CB 3.69Å; Y247-A335 HydrophobicContact CE1-CB 4.34Å; Y247-Y338 AromaticContact CD2-CD1 3.15Å; Y247-Y338 HydrophobicContact CD2-CD1 3.15Å; Y247-Y338 AromaticContact CD2-CD2 3.67Å; Y247-Y338 HydrophobicContact CD2-CD2 3.67Å; Y247-Y338 AromaticContact CD2-CE1 3.48Å; Y247-Y338 HydrophobicContact CD2-CE1 3.48Å; Y247-Y338 VanDerWaalsContact CD2-CE1 3.48Å; Y247-Y338 AromaticContact CD2-CE2 3.96Å; Y247-Y338 HydrophobicContact CD2-CE2 3.96Å; Y247-Y338 AromaticContact CD2-CG 3.24Å; Y247-Y338 HydrophobicContact CD2-CG 3.24Å; Y247-Y338 AromaticContact CD2-CZ 3.87Å; Y247-Y338 AromaticContact CE2-CD1 3.74Å; Y247-Y338 HydrophobicContact CE2-CD1 3.74Å; Y247-Y338 AromaticContact CE2-CD2 3.32Å; Y247-Y338 HydrophobicContact CE2-CD2 3.32Å; Y247-Y338 HydrophobicContact CE2-CE1 4.17Å; Y247-Y338 AromaticContact CE2-CE2 3.8Å; Y247-Y338 HydrophobicContact CE2-CE2 3.8Å; Y247-Y338 AromaticContact CE2-CG 3.27Å; Y247-Y338 HydrophobicContact CE2-CG 3.27Å; Y247-Y338 AromaticContact CG-CD1 3.69Å; Y247-Y338 HydrophobicContact CG-CD1 3.69Å; Y247-Y338 HydrophobicContact CG-CE1 4.26Å; Y247-Y338 AromaticContact CG-CG 3.95Å; Y247-Y338 HydrophobicContact CG-CG 3.95Å
248	A	98	Very high	95.7	Very high	54 Å²	54	49.9 Å²	49.9	45%	0.446	26%	0.258	S	S	.	.	H	α-helix	trans	-57.7	-42.1	177.7	0	0	0	0	0	111.9	A244 Q245 Q246 K251 E252	A244-A248 PolarHBondContact O-N 2.85Å; Q245-A248 PolarHBondContact O-N 2.82Å; Q246-A248 PolarHBondContact O-N 3.17Å; A248-K251 PolarHBondContact O-N 2.97Å; A248-E252 WeakPolarHBondContact O-CB 3.4Å; A248-E252 PolarHBondContact O-N 3.26Å
249	T	97.7	Very high	95.8	Very high	80 Å²	80	47.3 Å²	47.3	49%	0.491	25%	0.249	S	C	.	.	H	α-helix	trans	-63.6	-47.5	175	-58.3	0	0	0	0	112.3	Q245 Q246 Y247 K251 E252 N253	Q245-T249 PolarHBondContact O-N 2.82Å; Q245-T249 VanDerWaalsContact O-N 3.11Å; Q245-T249 PolarHBondContact O-OG1 2.74Å; Q245-T249 VanDerWaalsContact O-OG1 3.09Å; Q246-T249 PolarHBondContact O-N 3.26Å; Y247-T249 VanDerWaalsContact C-N 3.29Å; Y247-T249 PolarHBondContact O-N 3.29Å; T249-K251 VanDerWaalsContact C-N 3.31Å; T249-K251 PolarHBondContact O-N 3.02Å; T249-E252 PolarHBondContact O-N 3.26Å; T249-N253 PolarHBondContact O-N 3.3Å; T249-N253 PolarHBondContact O-ND2 3.29Å
250	L	97.5	Very high	95.9	Very high	23 Å²	23	50.5 Å²	50.5	12%	0.12	26%	0.264	C	S	.	.	H	α-helix	trans	-58.7	-44.6	176	-66.6	173.3	0	0	0	111.1	Q246 Y247 N253 W254 T306 H310 L445 T446	Q246-L250 WeakPolarHBondContact O-CG 3.32Å; Q246-L250 PolarHBondContact O-N 2.98Å; Y247-L250 PolarHBondContact O-N 3.13Å; L250-N253 PolarHBondContact O-N 2.86Å; L250-W254 VanDerWaalsContact O-CD1 3.27Å; L250-W254 PolarHBondContact O-N 3.18Å; L250-T306 HydrophobicContact CB-CG2 3.65Å; L250-H310 PolarHBondContact O-NE2 3.45Å; L250-L445 HydrophobicContact CD1-CB 4.01Å; L250-T446 HydrophobicContact CD1-CG2 3.72Å; L250-T446 HydrophobicContact CD2-CG2 3.5Å; L250-T446 HydrophobicContact CG-CG2 4.28Å
251	K	98	Very high	95.9	Very high	41 Å²	41	51.7 Å²	51.7	18%	0.178	28%	0.282	C	S	.	.	H	α-helix	trans	-62.1	-43.9	178	-174.6	169.1	81.2	153.7	0	112.7	Y247 A248 T249 N253 W254 K255 D302 T306 E334	Y247-K251 HydrophobicContact CE1-CD 4.3Å; Y247-K251 HydrophobicContact CE2-CB 4.5Å; Y247-K251 WeakPolarHBondContact O-CB 3.41Å; Y247-K251 PolarHBondContact O-N 2.95Å; A248-K251 PolarHBondContact O-N 2.97Å; T249-K251 VanDerWaalsContact C-N 3.31Å; T249-K251 PolarHBondContact O-N 3.02Å; K251-N253 VanDerWaalsContact C-N 3.34Å; K251-W254 HydrophobicContact CG-CZ2 4.49Å; K251-K255 HydrophobicContact CG-CD 4.34Å; K251-K255 VanDerWaalsContact O-CG 3.3Å; K251-K255 WeakPolarHBondContact O-CG 3.44Å; K251-K255 PolarHBondContact O-N 3.25Å; K251-D302 HydrophobicContact CD-CB 3.75Å; K251-D302 WeakPolarHBondContact CD-OD2 3.4Å; K251-D302 IonicContact NZ-OD2 3.41Å; K251-D302 PolarHBondContact NZ-OD2 3.28Å; K251-T306 HydrophobicContact CB-CG2 4.43Å; K251-E334 VanDerWaalsContact CD-OE1 3.28Å; K251-E334 WeakPolarHBondContact CD-OE1 3.26Å; K251-E334 WeakPolarHBondContact CE-OE1 3.33Å; K251-E334 IonicContact NZ-OE1 2.68Å; K251-E334 PolarHBondContact NZ-OE1 3.12Å; K251-E334 IonicContact NZ-OE2 2.68Å; K251-E334 PolarHBondContact NZ-OE2 3.32Å
252	E	97.5	Very high	95.9	Very high	75 Å²	75	53.1 Å²	53.1	35%	0.35	29%	0.289	S	S	.	.	H	α-helix	trans	-66.3	-37.4	178.7	-153.1	-160.2	-175.9	0	0	111.8	A248 T249 K255 K256	A248-E252 WeakPolarHBondContact O-CB 3.4Å; A248-E252 PolarHBondContact O-N 3.26Å; T249-E252 PolarHBondContact O-N 3.26Å; E252-K255 PolarHBondContact O-N 2.94Å; E252-K256 HydrophobicContact CG-CD 4.29Å; E252-K256 WeakPolarHBondContact O-CG 3.47Å; E252-K256 PolarHBondContact O-N 3.2Å; E252-K256 WeakPolarHBondContact OE1-CE 3.39Å; E252-K256 IonicContact OE1-NZ 3.36Å; E252-K256 PolarHBondContact OE1-NZ 2.59Å; E252-K256 IonicContact OE2-NZ 3.34Å; E252-K256 PolarHBondContact OE2-NZ 3.33Å
253	N	96.5	Very high	95.8	Very high	64 Å²	64	50.9 Å²	50.9	34%	0.342	28%	0.277	S	S	.	.	H	α-helix	trans	-60.5	-53.6	-178.5	-74.2	-24.1	0	0	0	112.8	T249 L250 K251 K255 K256 L257	T249-N253 PolarHBondContact O-N 3.3Å; T249-N253 PolarHBondContact O-ND2 3.29Å; L250-N253 PolarHBondContact O-N 2.86Å; K251-N253 VanDerWaalsContact C-N 3.34Å; N253-K255 VanDerWaalsContact C-N 3.32Å; N253-K255 PolarHBondContact O-N 2.97Å; N253-K256 PolarHBondContact O-N 3.06Å; N253-L257 WeakPolarHBondContact O-CG 3.45Å; N253-L257 PolarHBondContact O-N 3.19Å; N253-L257 VanDerWaalsContact O-N 3.08Å
254	W	96.4	Very high	95.8	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-69	-31.6	-179.5	71.1	-101.8	0	0	0	112.4	L250 K251 L257 Y258 L271 F301 A305 T306 I309 I482	L250-W254 VanDerWaalsContact O-CD1 3.27Å; L250-W254 PolarHBondContact O-N 3.18Å; K251-W254 HydrophobicContact CG-CZ2 4.49Å; W254-L257 PolarHBondContact O-N 3.32Å; W254-Y258 PolarHBondContact O-N 3.29Å; W254-L271 HydrophobicContact CE3-CD1 4.23Å; W254-L271 HydrophobicContact CE3-CD2 4.15Å; W254-L271 HydrophobicContact CH2-CD2 4.35Å; W254-L271 HydrophobicContact CZ3-CD1 4.04Å; W254-L271 HydrophobicContact CZ3-CD2 3.83Å; W254-F301 HydrophobicContact CH2-CD1 4.39Å; W254-F301 AromaticContact CH2-CE1 3.76Å; W254-F301 HydrophobicContact CH2-CE1 3.76Å; W254-F301 HydrophobicContact CH2-CZ 4.41Å; W254-F301 HydrophobicContact CZ3-CE1 4.37Å; W254-A305 HydrophobicContact CH2-CB 3.56Å; W254-A305 HydrophobicContact CZ2-CB 3.4Å; W254-A305 HydrophobicContact CZ3-CB 4.18Å; W254-T306 PolarHBondContact NE1-OG1 2.82Å; W254-I309 HydrophobicContact CB-CB 4.45Å; W254-I309 HydrophobicContact CB-CG2 3.85Å; W254-I482 HydrophobicContact CH2-CD1 4.39Å; W254-I482 HydrophobicContact CH2-CG1 4.12Å; W254-I482 HydrophobicContact CZ3-CD1 3.82Å; W254-I482 HydrophobicContact CZ3-CG1 4.05Å
255	K	98	Very high	95.4	Very high	9 Å²	9	54.9 Å²	54.9	4%	0.039	30%	0.299	C	S	.	.	H	α-helix	trans	-66.1	-38	174	-70.8	-171.7	177.2	-162.1	0	112.7	K251 E252 N253 Y258 V259 D302 I482 Y486	K251-K255 HydrophobicContact CG-CD 4.34Å; K251-K255 VanDerWaalsContact O-CG 3.3Å; K251-K255 WeakPolarHBondContact O-CG 3.44Å; K251-K255 PolarHBondContact O-N 3.25Å; E252-K255 PolarHBondContact O-N 2.94Å; N253-K255 VanDerWaalsContact C-N 3.32Å; N253-K255 PolarHBondContact O-N 2.97Å; K255-Y258 WeakPolarHBondContact O-CB 3.21Å; K255-Y258 PolarHBondContact O-N 3.1Å; K255-V259 WeakPolarHBondContact O-CG2 3.42Å; K255-V259 PolarHBondContact O-N 2.72Å; K255-D302 WeakPolarHBondContact CE-OD1 3.43Å; K255-D302 IonicContact NZ-OD1 2.76Å; K255-D302 PolarHBondContact NZ-OD1 3Å; K255-D302 IonicContact NZ-OD2 2.68Å; K255-D302 PolarHBondContact NZ-OD2 3.48Å; K255-I482 HydrophobicContact CD-CG1 3.93Å; K255-I482 HydrophobicContact CG-CD1 4.12Å; K255-I482 HydrophobicContact CG-CG1 3.89Å; K255-I482 PolarHBondContact NZ-O 3.04Å; K255-Y486 HydrophobicContact CB-CD1 3.58Å; K255-Y486 HydrophobicContact CB-CD2 4.25Å; K255-Y486 HydrophobicContact CB-CE1 3.76Å; K255-Y486 HydrophobicContact CB-CE2 4.42Å; K255-Y486 HydrophobicContact CB-CG 3.83Å; K255-Y486 HydrophobicContact CD-CD2 3.72Å; K255-Y486 HydrophobicContact CD-CE2 3.84Å; K255-Y486 HydrophobicContact CD-CG 4.1Å; K255-Y486 HydrophobicContact CG-CG 4.42Å
256	K	96.3	Very high	95.1	Very high	90 Å²	90	53.9 Å²	53.9	39%	0.391	29%	0.294	S	S	.	.	H	α-helix	trans	-61.5	-47.4	170.4	-76.6	168.4	175.5	167	0	111.2	E252 N253 Y258 V259 M260	E252-K256 HydrophobicContact CG-CD 4.29Å; E252-K256 WeakPolarHBondContact O-CG 3.47Å; E252-K256 PolarHBondContact O-N 3.2Å; E252-K256 WeakPolarHBondContact OE1-CE 3.39Å; E252-K256 IonicContact OE1-NZ 3.36Å; E252-K256 PolarHBondContact OE1-NZ 2.59Å; E252-K256 IonicContact OE2-NZ 3.34Å; E252-K256 PolarHBondContact OE2-NZ 3.33Å; N253-K256 PolarHBondContact O-N 3.06Å; K256-Y258 VanDerWaalsContact C-N 3.3Å; K256-Y258 PolarHBondContact O-N 3.31Å; K256-V259 PolarHBondContact O-N 2.94Å; K256-M260 WeakPolarHBondContact O-CB 3.45Å; K256-M260 WeakPolarHBondContact O-CG 2.94Å; K256-M260 PolarHBondContact O-N 3.09Å
257	L	95.2	Very high	95	Very high	27 Å²	27	51.2 Å²	51.2	14%	0.141	28%	0.282	C	S	.	.	H	α-helix	trans	-59.1	-38.6	177.1	-66.7	172.1	0	0	0	112.6	N253 W254 G261 L262 M263 Y453	N253-L257 WeakPolarHBondContact O-CG 3.45Å; N253-L257 PolarHBondContact O-N 3.19Å; N253-L257 VanDerWaalsContact O-N 3.08Å; W254-L257 PolarHBondContact O-N 3.32Å; L257-G261 PolarHBondContact O-N 2.96Å; L257-L262 HydrophobicContact CD2-CB 3.83Å; L257-L262 HydrophobicContact CD2-CD1 4.19Å; L257-L262 PolarHBondContact O-N 3.44Å; L257-M263 HydrophobicContact CB-CG 3.8Å; L257-Y453 HydrophobicContact CD1-CD1 3.87Å; L257-Y453 HydrophobicContact CD1-CE1 3.47Å; L257-Y453 VanDerWaalsContact CD1-CE1 3.47Å; L257-Y453 HydrophobicContact CD1-CE2 4.47Å
258	Y	95.5	Very high	94.9	Very high	7 Å²	7	52 Å²	52	3%	0.027	29%	0.286	C	S	.	.	H	α-helix	trans	-59.3	-53	174.8	-179.8	-101.9	0	0	0	112	W254 K255 K256 M260 G261 M263 L268 L271 Y470 I478 N479 I482 V488	W254-Y258 PolarHBondContact O-N 3.29Å; K255-Y258 WeakPolarHBondContact O-CB 3.21Å; K255-Y258 PolarHBondContact O-N 3.1Å; K256-Y258 VanDerWaalsContact C-N 3.3Å; K256-Y258 PolarHBondContact O-N 3.31Å; Y258-M260 PolarHBondContact O-N 3.26Å; Y258-G261 PolarHBondContact O-N 3.02Å; Y258-M263 VanDerWaalsContact CA-SD 3.54Å; Y258-M263 VanDerWaalsContact CB-SD 3.55Å; Y258-M263 HydrophobicContact CD2-SD 3.99Å; Y258-M263 HydrophobicContact CG-SD 4.28Å; Y258-L268 HydrophobicContact CD2-CD2 3.96Å; Y258-L268 HydrophobicContact CE2-CD2 4.09Å; Y258-L271 HydrophobicContact CD2-CD1 3.77Å; Y258-L271 HydrophobicContact CE2-CD1 4.27Å; Y258-Y470 WeakPolarHBondContact CE2-OH 3.28Å; Y258-Y470 PolarHBondContact OH-OH 3.2Å; Y258-I478 HydrophobicContact CE1-CG2 3.99Å; Y258-I478 HydrophobicContact CE2-CD1 4.26Å; Y258-I478 HydrophobicContact CE2-CG2 3.76Å; Y258-I478 VanDerWaalsContact CZ-CG2 3.47Å; Y258-I478 WeakPolarHBondContact OH-CG2 3.36Å; Y258-N479 PolarHBondContact OH-OD1 2.68Å; Y258-I482 HydrophobicContact CD1-CD1 3.34Å; Y258-I482 HydrophobicContact CE1-CD1 3.83Å; Y258-I482 HydrophobicContact CG-CD1 3.77Å; Y258-V488 HydrophobicContact CD1-CG2 3.71Å; Y258-V488 HydrophobicContact CE1-CB 4.01Å; Y258-V488 HydrophobicContact CE1-CG2 3.43Å; Y258-V488 VanDerWaalsContact CE1-CG2 3.43Å
259	V	93.8	Very high	94.6	Very high	55 Å²	55	51.4 Å²	51.4	33%	0.333	28%	0.278	S	S	.	.	H	α-helix	trans	-60	-49	179.8	176.6	0	0	0	0	111.1	K255 K256 G261 Y486 K493	K255-V259 WeakPolarHBondContact O-CG2 3.42Å; K255-V259 PolarHBondContact O-N 2.72Å; K256-V259 PolarHBondContact O-N 2.94Å; V259-G261 PolarHBondContact O-N 2.77Å; V259-Y486 VanDerWaalsContact CG2-CA 3.44Å; V259-Y486 HydrophobicContact CG2-CD1 4.02Å; V259-Y486 HydrophobicContact CG2-CG 4.46Å; V259-Y486 WeakPolarHBondContact CG2-O 3.04Å; V259-K493 PolarHBondContact O-NZ 3.34Å
260	M	93	Very high	94.5	Very high	126 Å²	126	48 Å²	48	62%	0.621	26%	0.258	S	S	*	.	H	α-helix	trans	-60.9	-29.4	177.9	-64.5	169.1	80.3	0	0	111.3	K256 Y258 L262 K493	K256-M260 WeakPolarHBondContact O-CB 3.45Å; K256-M260 WeakPolarHBondContact O-CG 2.94Å; K256-M260 PolarHBondContact O-N 3.09Å; Y258-M260 PolarHBondContact O-N 3.26Å; M260-L262 HydrophobicContact CB-CD1 3.98Å; M260-L262 HydrophobicContact CB-CG 3.91Å; M260-L262 HydrophobicContact CE-CD1 3.76Å; M260-L262 HydrophobicContact SD-CD1 4.28Å; M260-K493 PolarHBondContact O-NZ 2.92Å; M260-K493 VanDerWaalsContact O-NZ 3.14Å
261	G	91.3	Very high	94.4	Very high	46 Å²	46	46.9 Å²	46.9	47%	0.474	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.4	33.3	-176	0	0	0	0	0	112.4	L257 Y258 V259	L257-G261 PolarHBondContact O-N 2.96Å; Y258-G261 PolarHBondContact O-N 3.02Å; V259-G261 PolarHBondContact O-N 2.77Å
262	L	94.5	Very high	94.2	Very high	99 Å²	99	45.2 Å²	45.2	52%	0.518	25%	0.245	S	C	.	.			trans	-101.4	5.2	-179.4	-63	178.3	0	0	0	112.9	L257 M260	L257-L262 HydrophobicContact CD2-CB 3.83Å; L257-L262 HydrophobicContact CD2-CD1 4.19Å; L257-L262 PolarHBondContact O-N 3.44Å; M260-L262 HydrophobicContact CB-CD1 3.98Å; M260-L262 HydrophobicContact CB-CG 3.91Å; M260-L262 HydrophobicContact CE-CD1 3.76Å; M260-L262 HydrophobicContact SD-CD1 4.28Å
263	M	93	Very high	94	Very high	13 Å²	13	43 Å²	43	6%	0.064	24%	0.238	C	C	.	.			trans	-78.1	144.9	173.5	-62.8	-176.8	83.7	0	0	111.2	L257 Y258 Q267 L268 L271 I309	L257-M263 HydrophobicContact CB-CG 3.8Å; Y258-M263 VanDerWaalsContact CA-SD 3.54Å; Y258-M263 VanDerWaalsContact CB-SD 3.55Å; Y258-M263 HydrophobicContact CD2-SD 3.99Å; Y258-M263 HydrophobicContact CG-SD 4.28Å; M263-Q267 VanDerWaalsContact CA-OE1 3.29Å; M263-Q267 HydrophobicContact CB-CB 4.06Å; M263-Q267 HydrophobicContact CE-CB 3.84Å; M263-L268 HydrophobicContact CB-CD2 4Å; M263-L268 HydrophobicContact CB-CG 4.12Å; M263-L268 HydrophobicContact SD-CD2 4.4Å; M263-L271 HydrophobicContact CE-CD1 3.61Å; M263-L271 HydrophobicContact CE-CG 4.07Å; M263-L271 HydrophobicContact SD-CD1 3.77Å; M263-I309 HydrophobicContact CE-CD1 3.51Å; M263-I309 HydrophobicContact CE-CG1 4.07Å
264	S	92.3	Very high	94	Very high	58 Å²	58	40 Å²	40	41%	0.406	22%	0.222	S	C	.	.			trans	-75.2	164.8	176	72.4	0	0	0	0	112.6	H266 Q267 L268	S264-H266 VanDerWaalsContact C-N 3.28Å; S264-H266 PolarHBondContact O-N 3.08Å; S264-Q267 WeakPolarHBondContact O-CB 3.5Å; S264-Q267 PolarHBondContact O-N 3.29Å; S264-Q267 WeakPolarHBondContact OG-CG 3.44Å; S264-Q267 PolarHBondContact OG-N 3.44Å; S264-L268 PolarHBondContact O-N 3.29Å
265	E	89.7	Confident	94	Very high	90 Å²	90	40 Å²	40	42%	0.421	22%	0.222	S	C	.	.	H	α-helix	trans	-55.4	-42.9	176.6	-169.9	170	-170.8	0	0	112.4	Q267 L268 S269 W467	E265-Q267 VanDerWaalsContact C-N 3.32Å; E265-Q267 PolarHBondContact O-N 2.89Å; E265-L268 PolarHBondContact O-N 3.44Å; E265-S269 VanDerWaalsContact O-CB 3.3Å; E265-S269 WeakPolarHBondContact O-CB 3.25Å; E265-S269 PolarHBondContact O-N 3.45Å; E265-W467 HydrophobicContact CB-CE3 4.29Å; E265-W467 HydrophobicContact CB-CZ3 3.73Å; E265-W467 HydrophobicContact CG-CE3 3.98Å; E265-W467 HydrophobicContact CG-CZ3 3.95Å
266	H	89.8	Confident	93.6	Very high	83 Å²	83	42.1 Å²	42.1	38%	0.384	23%	0.233	S	C	.	.	H	α-helix	trans	-60.8	-40.2	176	-176.7	-90.5	0	0	0	112.2	S264 T270	S264-H266 VanDerWaalsContact C-N 3.28Å; S264-H266 PolarHBondContact O-N 3.08Å; H266-T270 VanDerWaalsContact O-CB 3.3Å; H266-T270 WeakPolarHBondContact O-CB 3.4Å; H266-T270 PolarHBondContact O-N 2.86Å; H266-T270 PolarHBondContact O-OG1 3.25Å
267	Q	94.5	Very high	93.5	Very high	31 Å²	31	38.7 Å²	38.7	15%	0.145	22%	0.219	C	C	.	.	H	α-helix	trans	-69.5	-39.9	177.8	-71.9	175.9	-28	0	0	112	M263 S264 E265 T270 L271 I309	M263-Q267 VanDerWaalsContact CA-OE1 3.29Å; M263-Q267 HydrophobicContact CB-CB 4.06Å; M263-Q267 HydrophobicContact CE-CB 3.84Å; S264-Q267 WeakPolarHBondContact O-CB 3.5Å; S264-Q267 PolarHBondContact O-N 3.29Å; S264-Q267 WeakPolarHBondContact OG-CG 3.44Å; S264-Q267 PolarHBondContact OG-N 3.44Å; E265-Q267 VanDerWaalsContact C-N 3.32Å; E265-Q267 PolarHBondContact O-N 2.89Å; Q267-T270 WeakPolarHBondContact O-CB 3.45Å; Q267-T270 PolarHBondContact O-N 2.79Å; Q267-L271 WeakPolarHBondContact O-CG 3.36Å; Q267-L271 PolarHBondContact O-N 3.47Å; Q267-I309 HydrophobicContact CB-CD1 3.67Å; Q267-I309 HydrophobicContact CG-CD1 3.67Å
268	L	94.8	Very high	93.5	Very high	21 Å²	21	37.5 Å²	37.5	11%	0.11	21%	0.213	C	C	.	.	H	α-helix	trans	-67.1	-41.8	175	-66.8	175.5	0	0	0	112.1	Y258 M263 S264 E265 T270 L271 A272 W467 Y470	Y258-L268 HydrophobicContact CD2-CD2 3.96Å; Y258-L268 HydrophobicContact CE2-CD2 4.09Å; M263-L268 HydrophobicContact CB-CD2 4Å; M263-L268 HydrophobicContact CB-CG 4.12Å; M263-L268 HydrophobicContact SD-CD2 4.4Å; S264-L268 PolarHBondContact O-N 3.29Å; E265-L268 PolarHBondContact O-N 3.44Å; L268-T270 VanDerWaalsContact C-N 3.32Å; L268-T270 PolarHBondContact O-N 2.96Å; L268-L271 PolarHBondContact O-N 3.36Å; L268-A272 WeakPolarHBondContact O-CB 3.38Å; L268-A272 PolarHBondContact O-N 2.76Å; L268-W467 HydrophobicContact CD1-CZ3 4.34Å; L268-Y470 HydrophobicContact CB-CD1 4.4Å; L268-Y470 HydrophobicContact CB-CD2 3.9Å; L268-Y470 HydrophobicContact CB-CE1 4.43Å; L268-Y470 HydrophobicContact CB-CE2 3.94Å; L268-Y470 HydrophobicContact CB-CG 4.13Å; L268-Y470 HydrophobicContact CD1-CD1 4.09Å; L268-Y470 HydrophobicContact CD1-CE1 4Å; L268-Y470 HydrophobicContact CD2-CE1 4.32Å; L268-Y470 HydrophobicContact CD2-CE2 4.43Å; L268-Y470 HydrophobicContact CG-CE1 4.49Å
269	S	92.2	Very high	93.3	Very high	41 Å²	41	39.8 Å²	39.8	29%	0.287	23%	0.228	S	C	.	.	H	α-helix	trans	-63.1	-37	173	-177	0	0	0	0	112.4	E265 A272 S273	E265-S269 VanDerWaalsContact O-CB 3.3Å; E265-S269 WeakPolarHBondContact O-CB 3.25Å; E265-S269 PolarHBondContact O-N 3.45Å; S269-A272 PolarHBondContact O-N 3.24Å; S269-S273 WeakPolarHBondContact O-CB 3.22Å; S269-S273 PolarHBondContact O-N 3.19Å; S269-S273 PolarHBondContact O-OG 3.06Å
270	T	93.9	Very high	93.1	Very high	9 Å²	9	44.2 Å²	44.2	6%	0.055	24%	0.238	C	C	.	.	H	α-helix	trans	-61.4	-51.2	171.8	-63.8	0	0	0	0	110.9	H266 Q267 L268 A272 S273 I274 C308	H266-T270 VanDerWaalsContact O-CB 3.3Å; H266-T270 WeakPolarHBondContact O-CB 3.4Å; H266-T270 PolarHBondContact O-N 2.86Å; H266-T270 PolarHBondContact O-OG1 3.25Å; Q267-T270 WeakPolarHBondContact O-CB 3.45Å; Q267-T270 PolarHBondContact O-N 2.79Å; L268-T270 VanDerWaalsContact C-N 3.32Å; L268-T270 PolarHBondContact O-N 2.96Å; T270-A272 VanDerWaalsContact C-N 3.33Å; T270-A272 PolarHBondContact O-N 3.04Å; T270-S273 PolarHBondContact O-N 3.38Å; T270-I274 HydrophobicContact CG2-CD1 3.8Å; T270-I274 VanDerWaalsContact O-CG1 3.27Å; T270-I274 WeakPolarHBondContact O-CG1 3.39Å; T270-I274 PolarHBondContact O-N 2.78Å; T270-C308 HydrophobicContact CG2-CB 3.74Å
271	L	96.6	Very high	93.1	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.1	-40.3	176.8	-68	-175.1	0	0	0	112.4	W254 Y258 M263 Q267 L268 S275 F301 A305 I309 I478	W254-L271 HydrophobicContact CE3-CD1 4.23Å; W254-L271 HydrophobicContact CE3-CD2 4.15Å; W254-L271 HydrophobicContact CH2-CD2 4.35Å; W254-L271 HydrophobicContact CZ3-CD1 4.04Å; W254-L271 HydrophobicContact CZ3-CD2 3.83Å; Y258-L271 HydrophobicContact CD2-CD1 3.77Å; Y258-L271 HydrophobicContact CE2-CD1 4.27Å; M263-L271 HydrophobicContact CE-CD1 3.61Å; M263-L271 HydrophobicContact CE-CG 4.07Å; M263-L271 HydrophobicContact SD-CD1 3.77Å; Q267-L271 WeakPolarHBondContact O-CG 3.36Å; Q267-L271 PolarHBondContact O-N 3.47Å; L268-L271 PolarHBondContact O-N 3.36Å; L271-S275 VanDerWaalsContact O-CB 3.3Å; L271-S275 WeakPolarHBondContact O-CB 3.12Å; L271-S275 PolarHBondContact O-N 2.68Å; L271-S275 PolarHBondContact O-OG 3.31Å; L271-F301 HydrophobicContact CD2-CZ 4.19Å; L271-A305 HydrophobicContact CD2-CB 3.52Å; L271-I309 HydrophobicContact CD2-CG1 4.5Å; L271-I478 HydrophobicContact CB-CD1 3.75Å; L271-I478 HydrophobicContact CB-CG1 4.26Å
272	A	93.9	Very high	93.1	Very high	5 Å²	5	37.7 Å²	37.7	4%	0.041	20%	0.195	C	C	.	.	H	α-helix	trans	-60.5	-49.5	176.7	0	0	0	0	0	111.2	L268 S269 T270 I274 S275 I276 Y470 D474	L268-A272 WeakPolarHBondContact O-CB 3.38Å; L268-A272 PolarHBondContact O-N 2.76Å; S269-A272 PolarHBondContact O-N 3.24Å; T270-A272 VanDerWaalsContact C-N 3.33Å; T270-A272 PolarHBondContact O-N 3.04Å; A272-I274 PolarHBondContact O-N 3.15Å; A272-S275 PolarHBondContact O-N 2.92Å; A272-S275 VanDerWaalsContact O-N 3.14Å; A272-S275 PolarHBondContact O-OG 3.43Å; A272-I276 WeakPolarHBondContact O-CG1 3.3Å; A272-I276 PolarHBondContact O-N 3.26Å; A272-Y470 HydrophobicContact CB-CD2 4.4Å; A272-D474 HydrophobicContact CB-CB 3.78Å
273	S	92.8	Very high	92.8	Very high	29 Å²	29	37 Å²	37	20%	0.203	19%	0.186	C	C	.	.	H	α-helix	trans	-58.4	-47.7	178.7	-56.9	0	0	0	0	112.1	S269 T270 S275 I276 D277	S269-S273 WeakPolarHBondContact O-CB 3.22Å; S269-S273 PolarHBondContact O-N 3.19Å; S269-S273 PolarHBondContact O-OG 3.06Å; T270-S273 PolarHBondContact O-N 3.38Å; S273-S275 VanDerWaalsContact C-N 3.34Å; S273-S275 PolarHBondContact O-N 2.96Å; S273-I276 PolarHBondContact O-N 2.86Å; S273-D277 PolarHBondContact O-N 3.41Å
274	I	96.8	Very high	92.6	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-60.6	-44.6	176	-63.5	164.5	0	0	0	110.4	T270 A272 I276 D277 V278 F301 L304 A305 C308 Y316	T270-I274 HydrophobicContact CG2-CD1 3.8Å; T270-I274 VanDerWaalsContact O-CG1 3.27Å; T270-I274 WeakPolarHBondContact O-CG1 3.39Å; T270-I274 PolarHBondContact O-N 2.78Å; A272-I274 PolarHBondContact O-N 3.15Å; I274-I276 PolarHBondContact O-N 3.17Å; I274-D277 PolarHBondContact O-N 3.3Å; I274-V278 HydrophobicContact CG2-CG1 3.92Å; I274-V278 WeakPolarHBondContact O-CG1 3.48Å; I274-V278 WeakPolarHBondContact O-CG2 3.45Å; I274-V278 PolarHBondContact O-N 3.09Å; I274-F301 HydrophobicContact CB-CD2 4.44Å; I274-F301 HydrophobicContact CB-CE2 4.43Å; I274-F301 HydrophobicContact CG2-CD2 3.75Å; I274-F301 HydrophobicContact CG2-CE2 4.19Å; I274-L304 HydrophobicContact CD1-CB 4.19Å; I274-L304 HydrophobicContact CG1-CB 4.35Å; I274-L304 HydrophobicContact CG2-CB 3.64Å; I274-L304 HydrophobicContact CG2-CD1 3.98Å; I274-L304 HydrophobicContact CG2-CG 4.48Å; I274-A305 HydrophobicContact CD1-CB 4.44Å; I274-C308 HydrophobicContact CD1-CB 4.19Å; I274-Y316 HydrophobicContact CD1-CD2 4.1Å; I274-Y316 HydrophobicContact CD1-CG 4.15Å; I274-Y316 HydrophobicContact CG1-CD1 3.88Å; I274-Y316 HydrophobicContact CG1-CD2 3.49Å; I274-Y316 VanDerWaalsContact CG1-CD2 3.49Å; I274-Y316 HydrophobicContact CG1-CE1 4.18Å; I274-Y316 HydrophobicContact CG1-CE2 3.8Å; I274-Y316 HydrophobicContact CG1-CG 3.53Å
275	S	95.2	Very high	92.5	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.9	-30.2	-176.8	77.9	0	0	0	0	113.3	L271 A272 S273 L477	L271-S275 VanDerWaalsContact O-CB 3.3Å; L271-S275 WeakPolarHBondContact O-CB 3.12Å; L271-S275 PolarHBondContact O-N 2.68Å; L271-S275 PolarHBondContact O-OG 3.31Å; A272-S275 PolarHBondContact O-N 2.92Å; A272-S275 VanDerWaalsContact O-N 3.14Å; A272-S275 PolarHBondContact O-OG 3.43Å; S273-S275 VanDerWaalsContact C-N 3.34Å; S273-S275 PolarHBondContact O-N 2.96Å; S275-L477 WeakPolarHBondContact O-CD2 3.1Å
276	I	91.5	Very high	92.6	Very high	54 Å²	54	45 Å²	45	28%	0.277	22%	0.219	S	C	.	.	H	α-helix	trans	-78.8	-39.4	177.5	-66.9	166.3	0	0	0	112	A272 S273 I274 V279 R280 L477	A272-I276 WeakPolarHBondContact O-CG1 3.3Å; A272-I276 PolarHBondContact O-N 3.26Å; S273-I276 PolarHBondContact O-N 2.86Å; I274-I276 PolarHBondContact O-N 3.17Å; I276-V279 VanDerWaalsContact O-CG2 3.29Å; I276-V279 WeakPolarHBondContact O-CG2 3.38Å; I276-R280 VanDerWaalsContact CG2-CZ 3.44Å; I276-R280 VanDerWaalsContact CG2-NH1 3.28Å; I276-R280 WeakPolarHBondContact O-CD 3.36Å; I276-R280 WeakPolarHBondContact O-CG 3.46Å; I276-L477 HydrophobicContact CG1-CD2 3.84Å
277	D	92.8	Very high	92.7	Very high	19 Å²	19	42.9 Å²	42.9	10%	0.102	21%	0.207	C	C	.	.	H	α-helix	trans	-79.2	-35.5	-177.2	-80.4	-19.1	0	0	0	113	S273 I274 V279 R280 T281 Y316	S273-D277 PolarHBondContact O-N 3.41Å; I274-D277 PolarHBondContact O-N 3.3Å; D277-V279 VanDerWaalsContact C-N 3.33Å; D277-V279 PolarHBondContact O-N 2.99Å; D277-R280 CarbonylContact O-C 3.6Å; D277-R280 WeakPolarHBondContact O-CB 3.33Å; D277-R280 PolarHBondContact O-N 2.92Å; D277-T281 PolarHBondContact O-N 3.05Å; D277-T281 PolarHBondContact O-OG1 2.64Å; D277-Y316 VanDerWaalsContact CB-OH 3.25Å; D277-Y316 WeakPolarHBondContact CB-OH 3.45Å; D277-Y316 WeakPolarHBondContact OD2-CE1 3.45Å; D277-Y316 PolarHBondContact OD2-OH 2.82Å
278	V	94.8	Very high	92.6	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.012	20%	0.203	C	C	.	.	H	α-helix	trans	-65.7	-32.8	-178.5	-63.6	0	0	0	0	113.4	I274 R280 T281 V297 L300 F301 L304 L481	I274-V278 HydrophobicContact CG2-CG1 3.92Å; I274-V278 WeakPolarHBondContact O-CG1 3.48Å; I274-V278 WeakPolarHBondContact O-CG2 3.45Å; I274-V278 PolarHBondContact O-N 3.09Å; V278-R280 PolarHBondContact O-N 3.24Å; V278-T281 PolarHBondContact O-N 2.73Å; V278-V297 HydrophobicContact CB-CG1 4.19Å; V278-V297 HydrophobicContact CG2-CG1 3.98Å; V278-L300 HydrophobicContact CB-CD2 4.13Å; V278-L300 HydrophobicContact CB-CG 4.3Å; V278-L300 HydrophobicContact CG1-CB 4.35Å; V278-L300 HydrophobicContact CG1-CD2 4.08Å; V278-L300 HydrophobicContact CG1-CG 3.84Å; V278-F301 HydrophobicContact CG2-CB 4.19Å; V278-F301 HydrophobicContact CG2-CD2 4.4Å; V278-L304 HydrophobicContact CG1-CD1 3.56Å; V278-L481 HydrophobicContact CG2-CD1 3.74Å
279	V	91.1	Very high	92.1	Very high	54 Å²	54	47.4 Å²	47.4	33%	0.327	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-9.9	174.7	-61.7	0	0	0	0	113.1	I276 D277 V297 L477	I276-V279 VanDerWaalsContact O-CG2 3.29Å; I276-V279 WeakPolarHBondContact O-CG2 3.38Å; D277-V279 VanDerWaalsContact C-N 3.33Å; D277-V279 PolarHBondContact O-N 2.99Å; V279-V297 HydrophobicContact CG1-CG1 4.07Å; V279-L477 HydrophobicContact CG1-CD1 4.31Å
280	R	90.5	Very high	91.4	Very high	148 Å²	148	48 Å²	48	56%	0.558	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.8	-16.6	176.4	-63.2	169.8	176	169.7	-3.2	113.3	I276 D277 V278 D282	I276-R280 VanDerWaalsContact CG2-CZ 3.44Å; I276-R280 VanDerWaalsContact CG2-NH1 3.28Å; I276-R280 WeakPolarHBondContact O-CD 3.36Å; I276-R280 WeakPolarHBondContact O-CG 3.46Å; D277-R280 CarbonylContact O-C 3.6Å; D277-R280 WeakPolarHBondContact O-CB 3.33Å; D277-R280 PolarHBondContact O-N 2.92Å; V278-R280 PolarHBondContact O-N 3.24Å; R280-D282 PolarHBondContact O-N 3.48Å
281	T	93.3	Very high	90.5	Very high	9 Å²	9	52 Å²	52	6%	0.055	25%	0.25	C	S	.	.	S	Bend	trans	-79.8	120.6	-175.2	-59	0	0	0	0	109.5	D277 V278 W283 L300 S321	D277-T281 PolarHBondContact O-N 3.05Å; D277-T281 PolarHBondContact O-OG1 2.64Å; V278-T281 PolarHBondContact O-N 2.73Å; T281-W283 PolarHBondContact O-N 3Å; T281-L300 HydrophobicContact CG2-CD2 4.08Å; T281-S321 VanDerWaalsContact OG1-CB 3.25Å; T281-S321 WeakPolarHBondContact OG1-CB 3.22Å; T281-S321 PolarHBondContact OG1-OG 2.96Å
282	D	92.2	Very high	89.7	Confident	26 Å²	26	54.6 Å²	54.6	14%	0.139	28%	0.277	C	S	.	.	S	Bend	trans	50.8	26.2	173.2	-55	-26.7	0	0	0	115.4	R280 K284 E285 Y288 S325 K402 F407	R280-D282 PolarHBondContact O-N 3.48Å; D282-K284 PolarHBondContact O-N 2.93Å; D282-E285 HydrophobicContact CB-CG 3.94Å; D282-E285 WeakPolarHBondContact O-CB 3.47Å; D282-E285 WeakPolarHBondContact O-CG 3.24Å; D282-E285 PolarHBondContact O-N 3Å; D282-Y288 HydrophobicContact CB-CD2 4.03Å; D282-Y288 HydrophobicContact CB-CE2 4.09Å; D282-S325 WeakPolarHBondContact OD2-CB 3.27Å; D282-S325 PolarHBondContact OD2-OG 3.15Å; D282-K402 WeakPolarHBondContact OD1-CE 3.46Å; D282-K402 IonicContact OD1-NZ 2.68Å; D282-K402 PolarHBondContact OD1-NZ 3.43Å; D282-K402 IonicContact OD2-NZ 2.72Å; D282-K402 PolarHBondContact OD2-NZ 2.9Å; D282-F407 HydrophobicContact CB-CE2 4.41Å
283	W	88.1	Confident	89.3	Confident	86 Å²	86	56 Å²	56	33%	0.326	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-16.9	-175.6	73.7	-89.3	0	0	0	114.5	F72 L74 T281 R289	F72-W283 HydrophobicContact CD2-CH2 4.04Å; F72-W283 HydrophobicContact CD2-CZ3 4.24Å; F72-W283 AromaticContact CE2-CH2 3.72Å; F72-W283 HydrophobicContact CE2-CH2 3.72Å; F72-W283 HydrophobicContact CE2-CZ3 4.33Å; L74-W283 HydrophobicContact CD2-CE3 4.05Å; L74-W283 HydrophobicContact CD2-CH2 3.68Å; L74-W283 HydrophobicContact CD2-CZ2 4.38Å; L74-W283 HydrophobicContact CD2-CZ3 3.48Å; L74-W283 VanDerWaalsContact CD2-CZ3 3.48Å; T281-W283 PolarHBondContact O-N 3Å; W283-R289 WeakPolarHBondContact O-CA 3.49Å; W283-R289 WeakPolarHBondContact O-CB 3.48Å
284	K	87.4	Confident	89.2	Confident	139 Å²	139	58.1 Å²	58.1	60%	0.604	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-23.8	175.4	-66.1	-169	178.3	-171.4	0	112.9	D282 R289	D282-K284 PolarHBondContact O-N 2.93Å; K284-R289 WeakPolarHBondContact O-CD 3.43Å
285	E	90.7	Very high	89.1	Confident	68 Å²	68	62.2 Å²	62.2	32%	0.318	31%	0.309	S	S	.	.	S	Bend	trans	-72.6	136.6	-179.1	-54.5	-51.6	135.9	0	0	110.3	D282 Y287 Y288 R289 F407	D282-E285 HydrophobicContact CB-CG 3.94Å; D282-E285 WeakPolarHBondContact O-CB 3.47Å; D282-E285 WeakPolarHBondContact O-CG 3.24Å; D282-E285 PolarHBondContact O-N 3Å; E285-Y287 PolarHBondContact O-N 3.03Å; E285-Y288 PolarHBondContact O-N 3.36Å; E285-R289 WeakPolarHBondContact O-CB 3.15Å; E285-R289 PolarHBondContact O-N 3.11Å; E285-F407 HydrophobicContact CG-CB 4.23Å; E285-F407 HydrophobicContact CG-CD2 3.85Å; E285-F407 HydrophobicContact CG-CE2 4.42Å; E285-F407 HydrophobicContact CG-CG 3.99Å
286	D	91	Very high	89.1	Confident	121 Å²	121	64.4 Å²	64.4	65%	0.647	32%	0.318	S	S	*	.	H	α-helix	trans	-59.4	-25.3	-174.3	-76.5	-27	0	0	0	113.4	Y288 N293	D286-Y288 PolarHBondContact O-N 3.48Å; D286-N293 PolarHBondContact O-ND2 3.38Å
287	Y	93.1	Very high	89.3	Confident	38 Å²	38	62.7 Å²	62.7	15%	0.149	31%	0.309	C	S	.	.	H	α-helix	trans	-57.5	-33.4	172.1	-170.4	-90.8	0	0	0	113.2	E285 N293 R296 L328 V329	E285-Y287 PolarHBondContact O-N 3.03Å; Y287-N293 VanDerWaalsContact O-CB 3.22Å; Y287-N293 WeakPolarHBondContact O-CB 3.46Å; Y287-N293 VanDerWaalsContact O-CG 3.28Å; Y287-N293 PolarHBondContact O-ND2 2.73Å; Y287-N293 VanDerWaalsContact O-ND2 3.12Å; Y287-R296 HydrophobicContact CD1-CB 4.08Å; Y287-R296 HydrophobicContact CD1-CG 4.03Å; Y287-R296 HydrophobicContact CE1-CB 3.77Å; Y287-R296 HydrophobicContact CE1-CG 3.69Å; Y287-R296 WeakPolarHBondContact O-CG 3.22Å; Y287-R296 PolarHBondContact OH-NE 2.83Å; Y287-R296 PolarHBondContact OH-NH1 2.84Å; Y287-R296 VanDerWaalsContact OH-NH1 3.14Å; Y287-L328 HydrophobicContact CE1-CD2 4.41Å; Y287-L328 HydrophobicContact CE1-CG 4.04Å; Y287-L328 PolarHBondContact OH-O 2.84Å; Y287-V329 HydrophobicContact CD1-CG2 3.63Å; Y287-V329 HydrophobicContact CD2-CB 4.48Å; Y287-V329 HydrophobicContact CD2-CG1 4.12Å; Y287-V329 HydrophobicContact CD2-CG2 4.26Å; Y287-V329 HydrophobicContact CE1-CG2 3.97Å; Y287-V329 HydrophobicContact CG-CB 4.45Å; Y287-V329 HydrophobicContact CG-CG1 4.3Å; Y287-V329 HydrophobicContact CG-CG2 3.77Å
288	Y	92.3	Very high	89.5	Confident	11 Å²	11	63 Å²	63	4%	0.043	31%	0.313	C	S	.	.	H	α-helix	trans	-106.9	-33.4	178.6	-64.2	-73.3	0	0	0	113.3	D282 E285 D286 S290 R296 V297 L300 S325 L328 V329	D282-Y288 HydrophobicContact CB-CD2 4.03Å; D282-Y288 HydrophobicContact CB-CE2 4.09Å; E285-Y288 PolarHBondContact O-N 3.36Å; D286-Y288 PolarHBondContact O-N 3.48Å; Y288-S290 PolarHBondContact O-N 3Å; Y288-R296 HydrophobicContact CD1-CB 3.84Å; Y288-R296 HydrophobicContact CE1-CB 3.94Å; Y288-V297 HydrophobicContact CD1-CG2 4.07Å; Y288-L300 HydrophobicContact CE1-CB 4.49Å; Y288-L300 HydrophobicContact CE1-CD2 4.33Å; Y288-S325 WeakPolarHBondContact CE2-OG 3.4Å; Y288-S325 WeakPolarHBondContact OH-CA 3.11Å; Y288-S325 PolarHBondContact OH-O 2.98Å; Y288-S325 PolarHBondContact OH-OG 2.75Å; Y288-L328 HydrophobicContact CE1-CD2 4.34Å; Y288-V329 HydrophobicContact CE2-CG2 3.87Å
289	R	84.5	Confident	89.7	Confident	136 Å²	136	64.3 Å²	64.3	51%	0.513	32%	0.319	S	S	.	.	H	α-helix	trans	-63.5	-29.6	-167.7	-169.7	-177.7	-177.3	-172.6	6	115.6	W283 K284 E285	W283-R289 WeakPolarHBondContact O-CA 3.49Å; W283-R289 WeakPolarHBondContact O-CB 3.48Å; K284-R289 WeakPolarHBondContact O-CD 3.43Å; E285-R289 WeakPolarHBondContact O-CB 3.15Å; E285-R289 PolarHBondContact O-N 3.11Å
290	S	77.5	Confident	90.1	Very high	55 Å²	55	61.8 Å²	61.8	39%	0.385	30%	0.303	S	S	.	.	S	Bend	trans	-74.4	149	-173.1	100.2	0	0	0	0	112.7	Y288 G292 N293	Y288-S290 PolarHBondContact O-N 3Å; S290-G292 PolarHBondContact O-N 2.95Å; S290-G292 VanDerWaalsContact O-N 3.16Å; S290-G292 PolarHBondContact OG-N 3.44Å; S290-N293 WeakPolarHBondContact O-CA 3.4Å; S290-N293 WeakPolarHBondContact O-CB 3.29Å; S290-N293 PolarHBondContact O-N 3.08Å; S290-N293 PolarHBondContact OG-N 2.94Å; S290-N293 PolarHBondContact OG-ND2 2.78Å; S290-N293 PolarHBondContact OG-OD1 3.25Å
291	V	73.9	Confident	90.4	Very high	92 Å²	92	54.7 Å²	54.7	56%	0.558	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-61.6	-26.5	179.5	-178.2	0	0	0	0	112.4	N293	V291-N293 VanDerWaalsContact C-N 3.32Å
292	G	80.3	Confident	90.7	Very high	54 Å²	54	54.7 Å²	54.7	56%	0.557	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-74.1	-22.2	172.4	0	0	0	0	0	113.6	S290 H294 H295	S290-G292 PolarHBondContact O-N 2.95Å; S290-G292 VanDerWaalsContact O-N 3.16Å; S290-G292 PolarHBondContact OG-N 3.44Å; G292-H294 PolarHBondContact O-N 3.3Å; G292-H295 PolarHBondContact O-CE1 3.01Å; G292-H295 PolarHBondContact O-ND1 3.43Å
293	N	86.7	Confident	91	Very high	36 Å²	36	53.5 Å²	53.5	19%	0.193	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-89.3	9.5	-171.5	-67.1	-14	0	0	0	114.5	D286 Y287 S290 V291 H295 R296	D286-N293 PolarHBondContact O-ND2 3.38Å; Y287-N293 VanDerWaalsContact O-CB 3.22Å; Y287-N293 WeakPolarHBondContact O-CB 3.46Å; Y287-N293 VanDerWaalsContact O-CG 3.28Å; Y287-N293 PolarHBondContact O-ND2 2.73Å; Y287-N293 VanDerWaalsContact O-ND2 3.12Å; S290-N293 WeakPolarHBondContact O-CA 3.4Å; S290-N293 WeakPolarHBondContact O-CB 3.29Å; S290-N293 PolarHBondContact O-N 3.08Å; S290-N293 PolarHBondContact OG-N 2.94Å; S290-N293 PolarHBondContact OG-ND2 2.78Å; S290-N293 PolarHBondContact OG-OD1 3.25Å; V291-N293 VanDerWaalsContact C-N 3.32Å; N293-H295 PolarHBondContact O-N 2.98Å; N293-H295 VanDerWaalsContact O-N 3.09Å; N293-R296 HydrophobicContact CB-CG 4.16Å; N293-R296 WeakPolarHBondContact O-CA 3.4Å; N293-R296 VanDerWaalsContact O-CB 3.29Å; N293-R296 WeakPolarHBondContact O-CB 3.48Å; N293-R296 PolarHBondContact O-N 3.47Å
294	H	89.7	Confident	91.5	Very high	72 Å²	72	49.4 Å²	49.4	33%	0.333	26%	0.255	S	S	.	.	H	α-helix	trans	-52.4	-33.1	169.1	-174.5	86.3	0	0	0	112	G292 R296 V297 C298 S480	G292-H294 PolarHBondContact O-N 3.3Å; H294-R296 VanDerWaalsContact C-N 3.25Å; H294-R296 PolarHBondContact O-N 3.39Å; H294-V297 WeakPolarHBondContact O-CB 3.43Å; H294-V297 PolarHBondContact O-N 3.34Å; H294-C298 PolarHBondContact O-N 3.46Å; H294-S480 PolarHBondContact NE2-O 3.41Å
295	H	94.3	Very high	92	Very high	87 Å²	87	42.8 Å²	42.8	40%	0.403	23%	0.226	S	C	.	.	H	α-helix	trans	-61.4	-28.6	174	75.2	-86.2	0	0	0	113.6	G292 N293 C298 Q299	G292-H295 PolarHBondContact O-CE1 3.01Å; G292-H295 PolarHBondContact O-ND1 3.43Å; N293-H295 PolarHBondContact O-N 2.98Å; N293-H295 VanDerWaalsContact O-N 3.09Å; H295-C298 WeakPolarHBondContact O-CB 3.36Å; H295-C298 PolarHBondContact O-N 3.45Å; H295-Q299 WeakPolarHBondContact O-CG 3.43Å; H295-Q299 PolarHBondContact O-N 2.9Å
296	R	96.3	Very high	92.4	Very high	46 Å²	46	39.6 Å²	39.6	17%	0.174	21%	0.211	C	C	.	.	H	α-helix	trans	-70.6	-32.4	173.3	-59.7	-53	-163.4	170.3	8.1	112	Y287 Y288 N293 H294 Q299 L300 L328 S332	Y287-R296 HydrophobicContact CD1-CB 4.08Å; Y287-R296 HydrophobicContact CD1-CG 4.03Å; Y287-R296 HydrophobicContact CE1-CB 3.77Å; Y287-R296 HydrophobicContact CE1-CG 3.69Å; Y287-R296 WeakPolarHBondContact O-CG 3.22Å; Y287-R296 PolarHBondContact OH-NE 2.83Å; Y287-R296 PolarHBondContact OH-NH1 2.84Å; Y287-R296 VanDerWaalsContact OH-NH1 3.14Å; Y288-R296 HydrophobicContact CD1-CB 3.84Å; Y288-R296 HydrophobicContact CE1-CB 3.94Å; N293-R296 HydrophobicContact CB-CG 4.16Å; N293-R296 WeakPolarHBondContact O-CA 3.4Å; N293-R296 VanDerWaalsContact O-CB 3.29Å; N293-R296 WeakPolarHBondContact O-CB 3.48Å; N293-R296 PolarHBondContact O-N 3.47Å; H294-R296 VanDerWaalsContact C-N 3.25Å; H294-R296 PolarHBondContact O-N 3.39Å; R296-Q299 PolarHBondContact O-N 3.04Å; R296-L300 PolarHBondContact O-N 3.5Å; R296-L328 WeakPolarHBondContact O-CD2 3.44Å; R296-S332 PolarHBondContact NH1-O 3.1Å; R296-S332 PolarHBondContact NH2-O 2.95Å
297	V	95.6	Very high	92.7	Very high	17 Å²	17	34 Å²	34	10%	0.103	18%	0.181	C	C	.	.	H	α-helix	trans	-71.6	-38.6	172.8	-169.2	0	0	0	0	110.6	V278 V279 Y288 H294 Q299 L300 F301 L481	V278-V297 HydrophobicContact CB-CG1 4.19Å; V278-V297 HydrophobicContact CG2-CG1 3.98Å; V279-V297 HydrophobicContact CG1-CG1 4.07Å; Y288-V297 HydrophobicContact CD1-CG2 4.07Å; H294-V297 WeakPolarHBondContact O-CB 3.43Å; H294-V297 PolarHBondContact O-N 3.34Å; V297-Q299 VanDerWaalsContact C-N 3.35Å; V297-Q299 PolarHBondContact O-N 3.48Å; V297-L300 PolarHBondContact O-N 2.78Å; V297-F301 WeakPolarHBondContact O-CB 3.46Å; V297-F301 PolarHBondContact O-N 3.25Å; V297-L481 HydrophobicContact CB-CD2 4.39Å; V297-L481 HydrophobicContact CG1-CD2 3.86Å
298	C	97	Very high	92.8	Very high	25 Å²	25	32.2 Å²	32.2	17%	0.169	17%	0.174	C	C	.	.	H	α-helix	trans	-58.8	-42.6	168.3	-65.2	0	0	0	0	112.4	H294 H295 F301 D302 L481	H294-C298 PolarHBondContact O-N 3.46Å; H295-C298 WeakPolarHBondContact O-CB 3.36Å; H295-C298 PolarHBondContact O-N 3.45Å; C298-F301 WeakPolarHBondContact O-CB 3.25Å; C298-F301 PolarHBondContact O-N 3.02Å; C298-D302 WeakPolarHBondContact O-CB 3.28Å; C298-D302 PolarHBondContact O-N 3.46Å; C298-L481 WeakPolarHBondContact CB-O 3.48Å; C298-L481 PolarHBondContact SG-O 3.14Å
299	Q	98.4	Very high	93	Very high	31 Å²	31	32 Å²	32	15%	0.145	17%	0.173	C	C	.	.	H	α-helix	trans	-63	-42.7	175.6	-75.8	179.5	-33	0	0	112	H295 R296 V297 D302 I303 L328 E334	H295-Q299 WeakPolarHBondContact O-CG 3.43Å; H295-Q299 PolarHBondContact O-N 2.9Å; R296-Q299 PolarHBondContact O-N 3.04Å; V297-Q299 VanDerWaalsContact C-N 3.35Å; V297-Q299 PolarHBondContact O-N 3.48Å; Q299-D302 PolarHBondContact O-N 2.79Å; Q299-I303 WeakPolarHBondContact O-CD1 3.27Å; Q299-I303 VanDerWaalsContact O-CG1 3.25Å; Q299-I303 WeakPolarHBondContact O-CG1 3.44Å; Q299-I303 PolarHBondContact O-N 3.16Å; Q299-L328 HydrophobicContact CB-CD1 4.12Å; Q299-L328 HydrophobicContact CB-CD2 3.72Å; Q299-E334 HydrophobicContact CB-CB 4.36Å; Q299-E334 HydrophobicContact CB-CG 3.9Å; Q299-E334 HydrophobicContact CG-CB 3.96Å; Q299-E334 HydrophobicContact CG-CG 3.82Å
300	L	98.5	Very high	93.5	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-64.6	-40.5	176.4	-172	61.4	0	0	0	112	V278 T281 Y288 R296 V297 L304 A324 L328	V278-L300 HydrophobicContact CB-CD2 4.13Å; V278-L300 HydrophobicContact CB-CG 4.3Å; V278-L300 HydrophobicContact CG1-CB 4.35Å; V278-L300 HydrophobicContact CG1-CD2 4.08Å; V278-L300 HydrophobicContact CG1-CG 3.84Å; T281-L300 HydrophobicContact CG2-CD2 4.08Å; Y288-L300 HydrophobicContact CE1-CB 4.49Å; Y288-L300 HydrophobicContact CE1-CD2 4.33Å; R296-L300 PolarHBondContact O-N 3.5Å; V297-L300 PolarHBondContact O-N 2.78Å; L300-L304 HydrophobicContact CD1-CD1 4.34Å; L300-L304 HydrophobicContact CG-CD1 4.22Å; L300-L304 WeakPolarHBondContact O-CD1 3.34Å; L300-L304 WeakPolarHBondContact O-CG 3.17Å; L300-L304 PolarHBondContact O-N 3.37Å; L300-A324 HydrophobicContact CD1-CB 3.73Å; L300-L328 HydrophobicContact CB-CD2 3.95Å
301	F	98.5	Very high	94.2	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-58.6	-50.1	171.5	179.3	-105.4	0	0	0	111.5	W254 L271 I274 V278 V297 C298 I303 L304 A305 I478 L481 I482	W254-F301 HydrophobicContact CH2-CD1 4.39Å; W254-F301 AromaticContact CH2-CE1 3.76Å; W254-F301 HydrophobicContact CH2-CE1 3.76Å; W254-F301 HydrophobicContact CH2-CZ 4.41Å; W254-F301 HydrophobicContact CZ3-CE1 4.37Å; L271-F301 HydrophobicContact CD2-CZ 4.19Å; I274-F301 HydrophobicContact CB-CD2 4.44Å; I274-F301 HydrophobicContact CB-CE2 4.43Å; I274-F301 HydrophobicContact CG2-CD2 3.75Å; I274-F301 HydrophobicContact CG2-CE2 4.19Å; V278-F301 HydrophobicContact CG2-CB 4.19Å; V278-F301 HydrophobicContact CG2-CD2 4.4Å; V297-F301 WeakPolarHBondContact O-CB 3.46Å; V297-F301 PolarHBondContact O-N 3.25Å; C298-F301 WeakPolarHBondContact O-CB 3.25Å; C298-F301 PolarHBondContact O-N 3.02Å; F301-I303 PolarHBondContact O-N 3.49Å; F301-L304 PolarHBondContact O-N 2.97Å; F301-A305 WeakPolarHBondContact O-CB 3.43Å; F301-A305 PolarHBondContact O-N 2.87Å; F301-I478 HydrophobicContact CZ-CG1 4.34Å; F301-I478 HydrophobicContact CZ-CG2 4Å; F301-L481 HydrophobicContact CB-CB 4.12Å; F301-L481 HydrophobicContact CB-CD1 4.24Å; F301-L481 HydrophobicContact CD1-CB 3.71Å; F301-L481 HydrophobicContact CD2-CB 4.21Å; F301-L481 HydrophobicContact CD2-CD1 3.72Å; F301-L481 HydrophobicContact CE1-CB 4.15Å; F301-L481 HydrophobicContact CE2-CD1 4.28Å; F301-L481 HydrophobicContact CG-CB 3.75Å; F301-L481 HydrophobicContact CG-CD1 3.98Å; F301-L481 HydrophobicContact CG-CG 4.45Å; F301-I482 HydrophobicContact CE1-CB 4.12Å; F301-I482 HydrophobicContact CE1-CG1 4.36Å
302	D	98.7	Very high	94.9	Very high	9 Å²	9	21.5 Å²	21.5	5%	0.048	12%	0.123	C	C	.	.	H	α-helix	trans	-64.2	-37	-177.3	-83.7	1.7	0	0	0	113.1	Y247 K251 K255 C298 Q299 T306 E334	Y247-D302 VanDerWaalsContact OH-C 3.29Å; Y247-D302 PolarHBondContact OH-O 3.32Å; K251-D302 HydrophobicContact CD-CB 3.75Å; K251-D302 WeakPolarHBondContact CD-OD2 3.4Å; K251-D302 IonicContact NZ-OD2 3.41Å; K251-D302 PolarHBondContact NZ-OD2 3.28Å; K255-D302 WeakPolarHBondContact CE-OD1 3.43Å; K255-D302 IonicContact NZ-OD1 2.76Å; K255-D302 PolarHBondContact NZ-OD1 3Å; K255-D302 IonicContact NZ-OD2 2.68Å; K255-D302 PolarHBondContact NZ-OD2 3.48Å; C298-D302 WeakPolarHBondContact O-CB 3.28Å; C298-D302 PolarHBondContact O-N 3.46Å; Q299-D302 PolarHBondContact O-N 2.79Å; D302-T306 VanDerWaalsContact O-CB 3.27Å; D302-T306 WeakPolarHBondContact O-CB 3.42Å; D302-T306 PolarHBondContact O-N 3.31Å; D302-T306 VanDerWaalsContact O-N 3.09Å; D302-T306 PolarHBondContact O-OG1 3.38Å; D302-E334 VanDerWaalsContact CB-OE1 3.28Å; D302-E334 WeakPolarHBondContact CB-OE1 3.22Å
303	I	98.8	Very high	95.2	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.005	13%	0.126	C	C	.	.	H	α-helix	trans	-63.1	-54	174.7	-71.5	161.9	0	0	0	110.5	Y247 Q299 F301 Y307 A324 L328 E334 A337 Y338 F341	Y247-I303 WeakPolarHBondContact OH-CA 3.42Å; Y247-I303 PolarHBondContact OH-N 3.26Å; Q299-I303 WeakPolarHBondContact O-CD1 3.27Å; Q299-I303 VanDerWaalsContact O-CG1 3.25Å; Q299-I303 WeakPolarHBondContact O-CG1 3.44Å; Q299-I303 PolarHBondContact O-N 3.16Å; F301-I303 PolarHBondContact O-N 3.49Å; I303-Y307 WeakPolarHBondContact O-CB 3.4Å; I303-Y307 PolarHBondContact O-N 3.13Å; I303-A324 HydrophobicContact CG2-CB 4.42Å; I303-L328 HydrophobicContact CD1-CB 4.18Å; I303-L328 HydrophobicContact CD1-CD1 3.99Å; I303-L328 HydrophobicContact CD1-CD2 4.18Å; I303-L328 HydrophobicContact CD1-CG 4.33Å; I303-E334 HydrophobicContact CD1-CG 4.19Å; I303-E334 HydrophobicContact CG1-CG 4Å; I303-A337 HydrophobicContact CD1-CB 3.62Å; I303-Y338 HydrophobicContact CG2-CD2 4.28Å; I303-F341 HydrophobicContact CG2-CB 4.23Å; I303-F341 HydrophobicContact CG2-CD1 4.07Å; I303-F341 HydrophobicContact CG2-CG 4.26Å
304	L	98.6	Very high	95.3	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-66.4	-45.8	-177	-68.9	166.3	0	0	0	111.6	I274 V278 L300 F301 T306 Y307 C308 Y316 M320 A324 F341	I274-L304 HydrophobicContact CD1-CB 4.19Å; I274-L304 HydrophobicContact CG1-CB 4.35Å; I274-L304 HydrophobicContact CG2-CB 3.64Å; I274-L304 HydrophobicContact CG2-CD1 3.98Å; I274-L304 HydrophobicContact CG2-CG 4.48Å; V278-L304 HydrophobicContact CG1-CD1 3.56Å; L300-L304 HydrophobicContact CD1-CD1 4.34Å; L300-L304 HydrophobicContact CG-CD1 4.22Å; L300-L304 WeakPolarHBondContact O-CD1 3.34Å; L300-L304 WeakPolarHBondContact O-CG 3.17Å; L300-L304 PolarHBondContact O-N 3.37Å; F301-L304 PolarHBondContact O-N 2.97Å; L304-T306 PolarHBondContact O-N 3.42Å; L304-Y307 PolarHBondContact O-N 2.93Å; L304-C308 WeakPolarHBondContact O-CB 3.42Å; L304-C308 PolarHBondContact O-N 3.44Å; L304-C308 PolarHBondContact O-SG 2.68Å; L304-Y316 HydrophobicContact CD1-CE2 4.45Å; L304-Y316 HydrophobicContact CD2-CE2 4.35Å; L304-M320 HydrophobicContact CD2-CB 4.1Å; L304-A324 HydrophobicContact CD2-CB 3.77Å; L304-A324 HydrophobicContact CG-CB 4.17Å; L304-F341 HydrophobicContact CD2-CE1 4.02Å; L304-F341 HydrophobicContact CD2-CE2 4.49Å; L304-F341 HydrophobicContact CD2-CZ 3.78Å
305	A	98.4	Very high	95.3	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-59.9	-47.4	178.8	0	0	0	0	0	111.4	W254 L271 I274 F301 Y307 C308 I309	W254-A305 HydrophobicContact CH2-CB 3.56Å; W254-A305 HydrophobicContact CZ2-CB 3.4Å; W254-A305 HydrophobicContact CZ3-CB 4.18Å; L271-A305 HydrophobicContact CD2-CB 3.52Å; I274-A305 HydrophobicContact CD1-CB 4.44Å; F301-A305 WeakPolarHBondContact O-CB 3.43Å; F301-A305 PolarHBondContact O-N 2.87Å; A305-Y307 VanDerWaalsContact C-N 3.3Å; A305-Y307 PolarHBondContact O-N 3.47Å; A305-C308 PolarHBondContact O-N 3.45Å; A305-I309 WeakPolarHBondContact O-CB 3.46Å; A305-I309 WeakPolarHBondContact O-CG1 3.44Å; A305-I309 PolarHBondContact O-N 2.84Å; A305-I309 VanDerWaalsContact O-N 3.08Å
306	T	98.4	Very high	95.2	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-63.6	-37.1	177.2	-48.7	0	0	0	0	111.5	Y247 L250 K251 W254 D302 L304 H310 Y338	Y247-T306 HydrophobicContact CD2-CG2 3.91Å; Y247-T306 HydrophobicContact CE2-CG2 3.69Å; L250-T306 HydrophobicContact CB-CG2 3.65Å; K251-T306 HydrophobicContact CB-CG2 4.43Å; W254-T306 PolarHBondContact NE1-OG1 2.82Å; D302-T306 VanDerWaalsContact O-CB 3.27Å; D302-T306 WeakPolarHBondContact O-CB 3.42Å; D302-T306 PolarHBondContact O-N 3.31Å; D302-T306 VanDerWaalsContact O-N 3.09Å; D302-T306 PolarHBondContact O-OG1 3.38Å; L304-T306 PolarHBondContact O-N 3.42Å; T306-H310 PolarHBondContact O-CD2 2.86Å; T306-H310 VanDerWaalsContact O-CD2 3.27Å; T306-H310 PolarHBondContact O-N 2.98Å; T306-Y338 HydrophobicContact CG2-CE2 4Å
307	Y	97.7	Very high	94.9	Very high	4 Å²	4	15.8 Å²	15.8	2%	0.016	9%	0.088	C	C	.	.	H	α-helix	trans	-66.2	-54.9	177.7	-173.6	-91.4	0	0	0	111.5	I303 L304 A305 I309 H310 H311 I314 M320 Y338 F341 M345	I303-Y307 WeakPolarHBondContact O-CB 3.4Å; I303-Y307 PolarHBondContact O-N 3.13Å; L304-Y307 PolarHBondContact O-N 2.93Å; A305-Y307 VanDerWaalsContact C-N 3.3Å; A305-Y307 PolarHBondContact O-N 3.47Å; Y307-I309 VanDerWaalsContact C-N 3.34Å; Y307-I309 PolarHBondContact O-N 3.29Å; Y307-H310 PolarHBondContact O-N 2.87Å; Y307-H311 AromaticContact CD2-CE1 3.53Å; Y307-H311 AromaticContact CD2-ND1 3.5Å; Y307-H311 HydrophobicContact CE1-CB 4.04Å; Y307-H311 AromaticContact CE1-ND1 3.97Å; Y307-H311 AromaticContact CE2-CE1 3.28Å; Y307-H311 WeakPolarHBondContact CE2-CE1 3.46Å; Y307-H311 AromaticContact CE2-CG 3.88Å; Y307-H311 AromaticContact CE2-ND1 3.37Å; Y307-H311 WeakPolarHBondContact CE2-ND1 3.38Å; Y307-H311 AromaticContact CE2-NE2 3.75Å; Y307-H311 AromaticContact CG-ND1 3.84Å; Y307-H311 AromaticContact CZ-CE1 3.9Å; Y307-H311 AromaticContact CZ-CG 3.67Å; Y307-H311 AromaticContact CZ-ND1 3.6Å; Y307-H311 PolarHBondContact O-N 3.1Å; Y307-H311 PolarHBondContact O-ND1 3.35Å; Y307-I314 HydrophobicContact CE1-CD1 4.19Å; Y307-I314 VanDerWaalsContact OH-CD1 3.22Å; Y307-I314 WeakPolarHBondContact OH-CD1 2.94Å; Y307-M320 HydrophobicContact CD1-CE 3.71Å; Y307-M320 HydrophobicContact CE1-CE 3.93Å; Y307-Y338 HydrophobicContact CD2-CE2 4.44Å; Y307-F341 AromaticContact CD1-CE1 3.83Å; Y307-F341 HydrophobicContact CD1-CE1 3.83Å; Y307-F341 AromaticContact CD2-CD1 3.95Å; Y307-F341 HydrophobicContact CD2-CD1 3.95Å; Y307-F341 HydrophobicContact CD2-CE1 4.03Å; Y307-F341 AromaticContact CG-CD1 3.89Å; Y307-F341 HydrophobicContact CG-CD1 3.89Å; Y307-F341 AromaticContact CG-CE1 3.55Å; Y307-F341 HydrophobicContact CG-CE1 3.55Å; Y307-M345 HydrophobicContact CE1-CB 4.3Å; Y307-M345 HydrophobicContact CE1-CE 4.06Å; Y307-M345 HydrophobicContact CE1-CG 4.08Å; Y307-M345 HydrophobicContact CE2-CB 3.93Å; Y307-M345 HydrophobicContact CE2-CG 4.16Å; Y307-M345 WeakPolarHBondContact OH-CB 3.45Å
308	C	95.7	Very high	94.3	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.007	11%	0.114	C	C	.	.	H	α-helix	trans	-70.6	-29.2	-169.9	-56.5	0	0	0	0	112.7	T270 I274 L304 A305 G315	T270-C308 HydrophobicContact CG2-CB 3.74Å; I274-C308 HydrophobicContact CD1-CB 4.19Å; L304-C308 WeakPolarHBondContact O-CB 3.42Å; L304-C308 PolarHBondContact O-N 3.44Å; L304-C308 PolarHBondContact O-SG 2.68Å; A305-C308 PolarHBondContact O-N 3.45Å; C308-G315 WeakPolarHBondContact CB-O 3.37Å; C308-G315 PolarHBondContact SG-O 3.04Å
309	I	95.8	Very high	93.9	Very high	6 Å²	6	20.6 Å²	20.6	3%	0.031	11%	0.108	C	C	.	.	H	α-helix	trans	-73.6	-30.5	174.7	-63.8	-65.2	0	0	0	112.1	W254 M263 Q267 L271 A305 Y307	W254-I309 HydrophobicContact CB-CB 4.45Å; W254-I309 HydrophobicContact CB-CG2 3.85Å; M263-I309 HydrophobicContact CE-CD1 3.51Å; M263-I309 HydrophobicContact CE-CG1 4.07Å; Q267-I309 HydrophobicContact CB-CD1 3.67Å; Q267-I309 HydrophobicContact CG-CD1 3.67Å; L271-I309 HydrophobicContact CD2-CG1 4.5Å; A305-I309 WeakPolarHBondContact O-CB 3.46Å; A305-I309 WeakPolarHBondContact O-CG1 3.44Å; A305-I309 PolarHBondContact O-N 2.84Å; A305-I309 VanDerWaalsContact O-N 3.08Å; Y307-I309 VanDerWaalsContact C-N 3.34Å; Y307-I309 PolarHBondContact O-N 3.29Å
310	H	94.6	Very high	93.7	Very high	2 Å²	2	19.1 Å²	19.1	1%	0.009	10%	0.101	C	C	.	.	H	α-helix	trans	-98	-4.2	-179.4	-72.7	-64.9	0	0	0	115.2	L250 T306 Y307 P312 T446 D447 S450 Y453	L250-H310 PolarHBondContact O-NE2 3.45Å; T306-H310 PolarHBondContact O-CD2 2.86Å; T306-H310 VanDerWaalsContact O-CD2 3.27Å; T306-H310 PolarHBondContact O-N 2.98Å; Y307-H310 PolarHBondContact O-N 2.87Å; H310-P312 VanDerWaalsContact C-CD 3.44Å; H310-T446 HydrophobicContact CB-CG2 3.82Å; H310-D447 PolarHBondContact O-N 3.34Å; H310-S450 PolarHBondContact ND1-OG 3.07Å; H310-Y453 PolarHBondContact CE1-OH 3.08Å; H310-Y453 VanDerWaalsContact CE1-OH 3.29Å
311	H	91.8	Very high	93.6	Very high	6 Å²	6	19.2 Å²	19.2	3%	0.028	10%	0.102	C	C	.	.			trans	-126	62.2	171	-53.9	83.5	0	0	0	110.5	Y307 N313 I314 G315 L445 D447	Y307-H311 AromaticContact CD2-CE1 3.53Å; Y307-H311 AromaticContact CD2-ND1 3.5Å; Y307-H311 HydrophobicContact CE1-CB 4.04Å; Y307-H311 AromaticContact CE1-ND1 3.97Å; Y307-H311 AromaticContact CE2-CE1 3.28Å; Y307-H311 WeakPolarHBondContact CE2-CE1 3.46Å; Y307-H311 AromaticContact CE2-CG 3.88Å; Y307-H311 AromaticContact CE2-ND1 3.37Å; Y307-H311 WeakPolarHBondContact CE2-ND1 3.38Å; Y307-H311 AromaticContact CE2-NE2 3.75Å; Y307-H311 AromaticContact CG-ND1 3.84Å; Y307-H311 AromaticContact CZ-CE1 3.9Å; Y307-H311 AromaticContact CZ-CG 3.67Å; Y307-H311 AromaticContact CZ-ND1 3.6Å; Y307-H311 PolarHBondContact O-N 3.1Å; Y307-H311 PolarHBondContact O-ND1 3.35Å; H311-N313 PolarHBondContact O-N 3.07Å; H311-N313 VanDerWaalsContact O-N 3.08Å; H311-I314 HydrophobicContact CB-CD1 4.13Å; H311-I314 PolarHBondContact O-N 3.07Å; H311-G315 PolarHBondContact O-N 3.25Å; H311-L445 VanDerWaalsContact CE1-C 3.47Å; H311-L445 PolarHBondContact CE1-O 3.39Å; H311-D447 WeakPolarHBondContact CA-OD2 3.41Å; H311-D447 IonicContact CD2-OD1 2.65Å; H311-D447 PolarHBondContact CD2-OD1 3Å
312	P	89.9	Confident	93.4	Very high	55 Å²	55	19.5 Å²	19.5	36%	0.357	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-16.8	-169.5	27.8	-36.9	0	0	0	114.2	H310 I314	H310-P312 VanDerWaalsContact C-CD 3.44Å; P312-I314 VanDerWaalsContact C-N 3.29Å
313	N	86.3	Confident	93.4	Very high	117 Å²	117	19.2 Å²	19.2	63%	0.626	10%	0.102	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-28.6	174.6	-58.3	-48	0	0	0	112.4	H311 D447	H311-N313 PolarHBondContact O-N 3.07Å; H311-N313 VanDerWaalsContact O-N 3.08Å; N313-D447 PolarHBondContact ND2-OD2 2.65Å
314	I	88.4	Confident	93.4	Very high	17 Å²	17	19.2 Å²	19.2	9%	0.087	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-45.4	174.1	-54.9	164.3	0	0	0	108.9	Y307 H311 P312 M345 K349 F352	Y307-I314 HydrophobicContact CE1-CD1 4.19Å; Y307-I314 VanDerWaalsContact OH-CD1 3.22Å; Y307-I314 WeakPolarHBondContact OH-CD1 2.94Å; H311-I314 HydrophobicContact CB-CD1 4.13Å; H311-I314 PolarHBondContact O-N 3.07Å; P312-I314 VanDerWaalsContact C-N 3.29Å; I314-M345 HydrophobicContact CG2-CE 4.15Å; I314-K349 HydrophobicContact CD1-CB 3.63Å; I314-K349 HydrophobicContact CD1-CD 3.87Å; I314-K349 HydrophobicContact CD1-CG 4.4Å; I314-K349 HydrophobicContact CG1-CB 4.27Å; I314-F352 HydrophobicContact CG2-CB 4.15Å
315	G	89.4	Confident	93.4	Very high	2 Å²	2	19.2 Å²	19.2	2%	0.021	10%	0.102	C	C	.	.			trans	66.2	-144.4	-174.7	0	0	0	0	0	111.8	C308 H311	C308-G315 WeakPolarHBondContact CB-O 3.37Å; C308-G315 PolarHBondContact SG-O 3.04Å; H311-G315 PolarHBondContact O-N 3.25Å
316	Y	92.9	Very high	93.4	Very high	20 Å²	20	19.3 Å²	19.3	8%	0.078	10%	0.102	C	C	.	.			trans	-115	131.8	171.2	179	-105.6	0	0	0	110.6	I274 D277 L304 M320	I274-Y316 HydrophobicContact CD1-CD2 4.1Å; I274-Y316 HydrophobicContact CD1-CG 4.15Å; I274-Y316 HydrophobicContact CG1-CD1 3.88Å; I274-Y316 HydrophobicContact CG1-CD2 3.49Å; I274-Y316 VanDerWaalsContact CG1-CD2 3.49Å; I274-Y316 HydrophobicContact CG1-CE1 4.18Å; I274-Y316 HydrophobicContact CG1-CE2 3.8Å; I274-Y316 HydrophobicContact CG1-CG 3.53Å; D277-Y316 VanDerWaalsContact CB-OH 3.25Å; D277-Y316 WeakPolarHBondContact CB-OH 3.45Å; D277-Y316 WeakPolarHBondContact OD2-CE1 3.45Å; D277-Y316 PolarHBondContact OD2-OH 2.82Å; L304-Y316 HydrophobicContact CD1-CE2 4.45Å; L304-Y316 HydrophobicContact CD2-CE2 4.35Å; Y316-M320 HydrophobicContact CD2-CB 4.08Å; Y316-M320 HydrophobicContact CD2-SD 4.21Å; Y316-M320 HydrophobicContact CE2-CB 3.79Å
317	C	89.8	Confident	93.4	Very high	19 Å²	19	19.3 Å²	19.3	13%	0.128	10%	0.103	C	C	.	.			trans	-120.3	145.7	170.9	-64.2	0	0	0	0	109.8	G319 M320 F352	C317-G319 PolarHBondContact O-N 3.2Å; C317-M320 HydrophobicContact CB-CG 4.42Å; C317-M320 HydrophobicContact CB-SD 4.13Å; C317-M320 PolarHBondContact N-SD 3.02Å; C317-M320 WeakPolarHBondContact O-CB 3.44Å; C317-M320 WeakPolarHBondContact O-CG 3.4Å; C317-M320 PolarHBondContact O-N 2.74Å; C317-M320 VanDerWaalsContact O-N 3.11Å; C317-F352 HydrophobicContact CB-CD1 3.58Å; C317-F352 HydrophobicContact CB-CE1 4.25Å; C317-F352 HydrophobicContact CB-CG 4.46Å
318	Q	82.7	Confident	93.4	Very high	139 Å²	139	19.1 Å²	19.1	65%	0.65	10%	0.102	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.2	134.3	177.8	-169.9	176.9	26	0	0	110.7
319	G	87.9	Confident	93.5	Very high	3 Å²	3	20.2 Å²	20.2	3%	0.031	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	90	-4.8	-176.1	0	0	0	0	0	114.9	C317 S321 D322 L323 L399	C317-G319 PolarHBondContact O-N 3.2Å; G319-S321 PolarHBondContact O-N 3.06Å; G319-D322 WeakPolarHBondContact O-CB 3.42Å; G319-D322 PolarHBondContact O-N 3.02Å; G319-D322 VanDerWaalsContact O-N 3.16Å; G319-L323 PolarHBondContact O-N 3.39Å; G319-L399 WeakPolarHBondContact O-CD2 3.47Å
320	M	94.9	Very high	93.6	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-61.5	-29.9	164	-74.5	176.1	64.4	0	0	111.7	L304 Y307 Y316 C317 L323 A324 F341 M345 F352	L304-M320 HydrophobicContact CD2-CB 4.1Å; Y307-M320 HydrophobicContact CD1-CE 3.71Å; Y307-M320 HydrophobicContact CE1-CE 3.93Å; Y316-M320 HydrophobicContact CD2-CB 4.08Å; Y316-M320 HydrophobicContact CD2-SD 4.21Å; Y316-M320 HydrophobicContact CE2-CB 3.79Å; C317-M320 HydrophobicContact CB-CG 4.42Å; C317-M320 HydrophobicContact CB-SD 4.13Å; C317-M320 PolarHBondContact N-SD 3.02Å; C317-M320 WeakPolarHBondContact O-CB 3.44Å; C317-M320 WeakPolarHBondContact O-CG 3.4Å; C317-M320 PolarHBondContact O-N 2.74Å; C317-M320 VanDerWaalsContact O-N 3.11Å; M320-L323 PolarHBondContact O-N 3.14Å; M320-A324 WeakPolarHBondContact O-CB 3.36Å; M320-A324 PolarHBondContact O-N 3.49Å; M320-F341 HydrophobicContact CB-CZ 4.31Å; M320-F341 HydrophobicContact CE-CE1 4.23Å; M320-F341 HydrophobicContact CE-CZ 3.88Å; M320-M345 HydrophobicContact CE-CE 3.79Å; M320-M345 HydrophobicContact CE-SD 4.25Å; M320-M345 HydrophobicContact SD-CE 4.35Å; M320-F352 HydrophobicContact CG-CD1 4.19Å; M320-F352 HydrophobicContact CG-CE1 3.95Å; M320-F352 HydrophobicContact CG-CZ 4.17Å
321	S	96.1	Very high	93.8	Very high	2 Å²	2	21.2 Å²	21.2	1%	0.014	11%	0.114	C	C	.	.	H	α-helix	trans	-65.7	-38.6	172	64.9	0	0	0	0	113.1	T281 G319 L323 A324 S325	T281-S321 VanDerWaalsContact OG1-CB 3.25Å; T281-S321 WeakPolarHBondContact OG1-CB 3.22Å; T281-S321 PolarHBondContact OG1-OG 2.96Å; G319-S321 PolarHBondContact O-N 3.06Å; S321-L323 PolarHBondContact O-N 2.97Å; S321-A324 PolarHBondContact O-N 3.5Å; S321-S325 WeakPolarHBondContact O-CB 3.25Å; S321-S325 PolarHBondContact O-N 3.33Å
322	D	95.7	Very high	93.9	Very high	6 Å²	6	23.9 Å²	23.9	3%	0.032	13%	0.134	C	C	.	.	H	α-helix	trans	-59.9	-32	176.7	-87	-66.7	0	0	0	112.9	G319 P326 L399 K402 R403	G319-D322 WeakPolarHBondContact O-CB 3.42Å; G319-D322 PolarHBondContact O-N 3.02Å; G319-D322 VanDerWaalsContact O-N 3.16Å; D322-P326 WeakPolarHBondContact O-CD 3.48Å; D322-L399 HydrophobicContact CB-CD2 4.34Å; D322-K402 HydrophobicContact CB-CD 4.08Å; D322-K402 PolarHBondContact O-NZ 3.45Å; D322-K402 IonicContact OD1-NZ 2.92Å; D322-K402 PolarHBondContact OD1-NZ 3.29Å; D322-R403 IonicContact OD1-NE 2.83Å; D322-R403 IonicContact OD1-NH2 3.8Å; D322-R403 IonicContact OD2-CZ 3.95Å; D322-R403 IonicContact OD2-NE 3.99Å; D322-R403 PolarHBondContact OD2-NE 2.99Å; D322-R403 IonicContact OD2-NH2 3.32Å; D322-R403 PolarHBondContact OD2-NH2 3.26Å
323	L	97.4	Very high	94.3	Very high	3 Å²	3	24.6 Å²	24.6	2%	0.016	13%	0.134	C	C	.	.	H	α-helix	trans	-82.3	-37.8	174.6	-64.6	177.6	0	0	0	112.7	G319 M320 S321 F341 L344 V348 F352	G319-L323 PolarHBondContact O-N 3.39Å; M320-L323 PolarHBondContact O-N 3.14Å; S321-L323 PolarHBondContact O-N 2.97Å; L323-F341 HydrophobicContact CB-CE2 4.34Å; L323-L344 HydrophobicContact CB-CD2 4.13Å; L323-L344 HydrophobicContact CD2-CD2 4.49Å; L323-V348 HydrophobicContact CD1-CG2 4.09Å; L323-F352 HydrophobicContact CD1-CE2 3.89Å; L323-F352 HydrophobicContact CD1-CZ 3.74Å
324	A	98.6	Very high	94.9	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.008	11%	0.11	C	C	.	.	H	α-helix	trans	-72.6	-32.8	-178.6	0	0	0	0	0	113.5	L300 I303 L304 M320 S321 L327 L328 F341	L300-A324 HydrophobicContact CD1-CB 3.73Å; I303-A324 HydrophobicContact CG2-CB 4.42Å; L304-A324 HydrophobicContact CD2-CB 3.77Å; L304-A324 HydrophobicContact CG-CB 4.17Å; M320-A324 WeakPolarHBondContact O-CB 3.36Å; M320-A324 PolarHBondContact O-N 3.49Å; S321-A324 PolarHBondContact O-N 3.5Å; A324-L327 PolarHBondContact O-N 3.26Å; A324-L328 PolarHBondContact O-N 2.76Å; A324-F341 HydrophobicContact CB-CD2 3.81Å; A324-F341 HydrophobicContact CB-CE2 3.78Å; A324-F341 HydrophobicContact CB-CG 4.36Å; A324-F341 HydrophobicContact CB-CZ 4.31Å
325	S	98.4	Very high	95.4	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-61	-53.6	-177.8	158.5	0	0	0	0	113.5	D282 Y288 S321 L327 L328 V329	D282-S325 WeakPolarHBondContact OD2-CB 3.27Å; D282-S325 PolarHBondContact OD2-OG 3.15Å; Y288-S325 WeakPolarHBondContact CE2-OG 3.4Å; Y288-S325 WeakPolarHBondContact OH-CA 3.11Å; Y288-S325 PolarHBondContact OH-O 2.98Å; Y288-S325 PolarHBondContact OH-OG 2.75Å; S321-S325 WeakPolarHBondContact O-CB 3.25Å; S321-S325 PolarHBondContact O-N 3.33Å; S325-L327 PolarHBondContact O-N 3.16Å; S325-L327 VanDerWaalsContact O-N 3.16Å; S325-L328 PolarHBondContact O-N 2.94Å; S325-V329 PolarHBondContact O-N 2.54Å
326	P	98.3	Very high	95.8	Very high	2 Å²	2	21.5 Å²	21.5	1%	0.013	12%	0.118	C	C	.	.	H	α-helix	trans	-52.9	-37.8	175.1	-30.2	36.8	0	0	0	114.3	W220 D322 V330 F407 L411 F414	W220-P326 HydrophobicContact CH2-CB 4.2Å; W220-P326 HydrophobicContact CZ3-CB 4.28Å; D322-P326 WeakPolarHBondContact O-CD 3.48Å; P326-V330 WeakPolarHBondContact O-CB 3.38Å; P326-V330 WeakPolarHBondContact O-CG2 3.3Å; P326-V330 PolarHBondContact O-N 3.35Å; P326-F407 HydrophobicContact CB-CZ 4.41Å; P326-F407 HydrophobicContact CG-CE2 4.14Å; P326-F407 HydrophobicContact CG-CZ 4.39Å; P326-L411 HydrophobicContact CB-CD2 3.91Å; P326-F414 HydrophobicContact CB-CE2 3.81Å; P326-F414 HydrophobicContact CG-CE2 3.87Å; P326-F414 HydrophobicContact CG-CZ 4.45Å
327	L	98.6	Very high	96	Very high	1 Å²	1	20.6 Å²	20.6	1%	0.005	12%	0.115	C	C	.	.	H	α-helix	trans	-66.8	-42.5	176.3	-57.8	173.4	0	0	0	111.5	W220 L224 A324 S325 Q331 F341 L344 W418	W220-L327 HydrophobicContact CE3-CD2 3.82Å; W220-L327 HydrophobicContact CZ3-CD2 3.84Å; L224-L327 HydrophobicContact CD1-CD2 3.77Å; A324-L327 PolarHBondContact O-N 3.26Å; S325-L327 PolarHBondContact O-N 3.16Å; S325-L327 VanDerWaalsContact O-N 3.16Å; L327-Q331 VanDerWaalsContact O-CB 3.27Å; L327-Q331 WeakPolarHBondContact O-CB 3.39Å; L327-Q331 VanDerWaalsContact O-CG 3.24Å; L327-Q331 WeakPolarHBondContact O-CG 3.44Å; L327-Q331 PolarHBondContact O-N 2.84Å; L327-F341 VanDerWaalsContact CD1-CA 3.49Å; L327-F341 HydrophobicContact CD1-CB 3.8Å; L327-F341 HydrophobicContact CD1-CD2 3.91Å; L327-F341 HydrophobicContact CD1-CG 4.37Å; L327-L344 HydrophobicContact CD1-CB 4.32Å; L327-L344 HydrophobicContact CD1-CD2 3.94Å; L327-W418 HydrophobicContact CD2-CH2 4.02Å
328	L	98.6	Very high	96.5	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-65.1	-41.3	176.1	177.6	57.7	0	0	0	112.2	Y287 Y288 R296 Q299 L300 I303 A324 S325 S332 A337	Y287-L328 HydrophobicContact CE1-CD2 4.41Å; Y287-L328 HydrophobicContact CE1-CG 4.04Å; Y287-L328 PolarHBondContact OH-O 2.84Å; Y288-L328 HydrophobicContact CE1-CD2 4.34Å; R296-L328 WeakPolarHBondContact O-CD2 3.44Å; Q299-L328 HydrophobicContact CB-CD1 4.12Å; Q299-L328 HydrophobicContact CB-CD2 3.72Å; L300-L328 HydrophobicContact CB-CD2 3.95Å; I303-L328 HydrophobicContact CD1-CB 4.18Å; I303-L328 HydrophobicContact CD1-CD1 3.99Å; I303-L328 HydrophobicContact CD1-CD2 4.18Å; I303-L328 HydrophobicContact CD1-CG 4.33Å; A324-L328 PolarHBondContact O-N 2.76Å; S325-L328 PolarHBondContact O-N 2.94Å; L328-S332 VanDerWaalsContact O-CA 3.31Å; L328-S332 WeakPolarHBondContact O-CA 3.32Å; L328-S332 PolarHBondContact O-N 3.11Å; L328-A337 HydrophobicContact CB-CB 4.08Å; L328-A337 HydrophobicContact CD1-CB 4.01Å
329	V	97.7	Very high	97.2	Very high	24 Å²	24	13.1 Å²	13.1	15%	0.145	8%	0.078	C	C	.	.	H	α-helix	trans	-61.6	-53.1	175.2	179	0	0	0	0	110.7	Y287 Y288 S325 S332 F407	Y287-V329 HydrophobicContact CD1-CG2 3.63Å; Y287-V329 HydrophobicContact CD2-CB 4.48Å; Y287-V329 HydrophobicContact CD2-CG1 4.12Å; Y287-V329 HydrophobicContact CD2-CG2 4.26Å; Y287-V329 HydrophobicContact CE1-CG2 3.97Å; Y287-V329 HydrophobicContact CG-CB 4.45Å; Y287-V329 HydrophobicContact CG-CG1 4.3Å; Y287-V329 HydrophobicContact CG-CG2 3.77Å; Y288-V329 HydrophobicContact CE2-CG2 3.87Å; S325-V329 PolarHBondContact O-N 2.54Å; V329-S332 PolarHBondContact O-N 3.31Å; V329-S332 PolarHBondContact O-OG 3.44Å; V329-F407 HydrophobicContact CB-CE1 4.18Å; V329-F407 HydrophobicContact CB-CZ 3.9Å; V329-F407 HydrophobicContact CG1-CE1 3.96Å; V329-F407 HydrophobicContact CG1-CZ 4.18Å; V329-F407 HydrophobicContact CG2-CE1 4.19Å; V329-F407 HydrophobicContact CG2-CE2 4.49Å; V329-F407 HydrophobicContact CG2-CZ 3.6Å
330	V	97.9	Very high	97.6	Very high	18 Å²	18	13 Å²	13	11%	0.109	8%	0.076	C	C	.	.	H	α-helix	trans	-67.2	-39.7	-176	165.4	0	0	0	0	113.1	R216 K217 W220 P326 L411	R216-V330 HydrophobicContact CB-CG1 3.62Å; R216-V330 HydrophobicContact CB-CG2 4.46Å; K217-V330 WeakPolarHBondContact CB-O 3.46Å; W220-V330 HydrophobicContact CD2-CB 4.24Å; W220-V330 HydrophobicContact CD2-CG1 3.69Å; W220-V330 HydrophobicContact CD2-CG2 4.26Å; W220-V330 HydrophobicContact CE3-CB 3.81Å; W220-V330 HydrophobicContact CE3-CG1 3.68Å; W220-V330 HydrophobicContact CE3-CG2 4Å; W220-V330 HydrophobicContact CG-CG1 4.05Å; W220-V330 HydrophobicContact CH2-CB 4.43Å; W220-V330 HydrophobicContact CH2-CG2 3.75Å; W220-V330 HydrophobicContact CZ2-CG2 3.96Å; W220-V330 HydrophobicContact CZ3-CB 3.9Å; W220-V330 HydrophobicContact CZ3-CG1 4.27Å; W220-V330 HydrophobicContact CZ3-CG2 3.73Å; P326-V330 WeakPolarHBondContact O-CB 3.38Å; P326-V330 WeakPolarHBondContact O-CG2 3.3Å; P326-V330 PolarHBondContact O-N 3.35Å; V330-L411 HydrophobicContact CG2-CD1 4.23Å; V330-L411 HydrophobicContact CG2-CD2 4.16Å
331	Q	97.6	Very high	97.8	Very high	11 Å²	11	13 Å²	13	5%	0.051	8%	0.077	C	C	.	.	H	α-helix	trans	-76.6	-30.1	177	-63.2	-60.9	-48.1	0	0	111.8	K217 L327 D333 L336 A337	K217-Q331 PolarHBondContact O-NE2 3.05Å; K217-Q331 PolarHBondContact O-OE1 3.07Å; L327-Q331 VanDerWaalsContact O-CB 3.27Å; L327-Q331 WeakPolarHBondContact O-CB 3.39Å; L327-Q331 VanDerWaalsContact O-CG 3.24Å; L327-Q331 WeakPolarHBondContact O-CG 3.44Å; L327-Q331 PolarHBondContact O-N 2.84Å; Q331-D333 PolarHBondContact O-N 3.11Å; Q331-L336 HydrophobicContact CB-CB 4.09Å; Q331-L336 HydrophobicContact CG-CB 4.33Å; Q331-A337 HydrophobicContact CB-CB 4.17Å; Q331-A337 HydrophobicContact CG-CB 4.48Å
332	S	95.6	Very high	97.8	Very high	62 Å²	62	13 Å²	13	43%	0.434	8%	0.076	S	C	.	.			trans	57.4	-5.2	-175.2	-75.1	0	0	0	0	116.3	R296 L328 V329	R296-S332 PolarHBondContact NH1-O 3.1Å; R296-S332 PolarHBondContact NH2-O 2.95Å; L328-S332 VanDerWaalsContact O-CA 3.31Å; L328-S332 WeakPolarHBondContact O-CA 3.32Å; L328-S332 PolarHBondContact O-N 3.11Å; V329-S332 PolarHBondContact O-N 3.31Å; V329-S332 PolarHBondContact O-OG 3.44Å
333	D	97.5	Very high	97.8	Very high	69 Å²	69	12.8 Å²	12.8	37%	0.369	8%	0.076	S	C	.	.	S	Bend	trans	-114.4	139.8	171.4	173.9	-95.2	0	0	0	110	Q331 A335 L336 A337	Q331-D333 PolarHBondContact O-N 3.11Å; D333-A335 WeakPolarHBondContact OD1-CA 3.29Å; D333-A335 WeakPolarHBondContact OD1-CB 3.38Å; D333-A335 PolarHBondContact OD1-N 2.85Å; D333-L336 HydrophobicContact CB-CB 4.24Å; D333-L336 HydrophobicContact CB-CD1 4.11Å; D333-L336 HydrophobicContact CB-CG 4.25Å; D333-L336 WeakPolarHBondContact OD1-CG 3.37Å; D333-L336 PolarHBondContact OD1-N 2.98Å; D333-A337 WeakPolarHBondContact O-CB 3.16Å; D333-A337 PolarHBondContact O-N 2.82Å
334	E	98.4	Very high	97.7	Very high	25 Å²	25	12.8 Å²	12.8	12%	0.117	8%	0.076	C	C	.	.	H	α-helix	trans	-69.4	-40.8	-173.9	-167.9	-164.2	140.8	0	0	113	Y247 K251 Q299 D302 I303 A337 Y338	Y247-E334 HydrophobicContact CE1-CG 4.04Å; Y247-E334 WeakPolarHBondContact CE1-OE1 3.44Å; Y247-E334 PolarHBondContact OH-OE1 3.08Å; K251-E334 VanDerWaalsContact CD-OE1 3.28Å; K251-E334 WeakPolarHBondContact CD-OE1 3.26Å; K251-E334 WeakPolarHBondContact CE-OE1 3.33Å; K251-E334 IonicContact NZ-OE1 2.68Å; K251-E334 PolarHBondContact NZ-OE1 3.12Å; K251-E334 IonicContact NZ-OE2 2.68Å; K251-E334 PolarHBondContact NZ-OE2 3.32Å; Q299-E334 HydrophobicContact CB-CB 4.36Å; Q299-E334 HydrophobicContact CB-CG 3.9Å; Q299-E334 HydrophobicContact CG-CB 3.96Å; Q299-E334 HydrophobicContact CG-CG 3.82Å; D302-E334 VanDerWaalsContact CB-OE1 3.28Å; D302-E334 WeakPolarHBondContact CB-OE1 3.22Å; I303-E334 HydrophobicContact CD1-CG 4.19Å; I303-E334 HydrophobicContact CG1-CG 4Å; E334-A337 PolarHBondContact O-N 2.89Å; E334-Y338 PolarHBondContact O-N 3.43Å
335	A	98.5	Very high	97.4	Very high	12 Å²	12	12.7 Å²	12.7	10%	0.099	8%	0.075	C	C	.	.	H	α-helix	trans	-72.8	-46.7	-177.7	0	0	0	0	0	110.4	A244 Y247 D333 A337 Y338 L339	A244-A335 HydrophobicContact CB-CB 3.62Å; Y247-A335 HydrophobicContact CD1-CB 3.69Å; Y247-A335 HydrophobicContact CE1-CB 4.34Å; D333-A335 WeakPolarHBondContact OD1-CA 3.29Å; D333-A335 WeakPolarHBondContact OD1-CB 3.38Å; D333-A335 PolarHBondContact OD1-N 2.85Å; A335-A337 PolarHBondContact O-N 3.06Å; A335-Y338 WeakPolarHBondContact O-CB 3.43Å; A335-Y338 PolarHBondContact O-N 3.47Å; A335-Y338 VanDerWaalsContact O-N 3.09Å; A335-L339 WeakPolarHBondContact O-CG 3.18Å; A335-L339 PolarHBondContact O-N 2.86Å
336	L	98.1	Very high	97	Very high	35 Å²	35	16.4 Å²	16.4	18%	0.183	9%	0.092	C	C	.	.	H	α-helix	trans	-62	-33.6	175.7	-62.5	178.6	0	0	0	112	L240 Q331 D333 L339 S340	L240-L336 HydrophobicContact CB-CD2 4.01Å; L240-L336 HydrophobicContact CD1-CD2 4.1Å; L240-L336 HydrophobicContact CD2-CD2 3.87Å; L240-L336 HydrophobicContact CG-CD2 4.21Å; Q331-L336 HydrophobicContact CB-CB 4.09Å; Q331-L336 HydrophobicContact CG-CB 4.33Å; D333-L336 HydrophobicContact CB-CB 4.24Å; D333-L336 HydrophobicContact CB-CD1 4.11Å; D333-L336 HydrophobicContact CB-CG 4.25Å; D333-L336 WeakPolarHBondContact OD1-CG 3.37Å; D333-L336 PolarHBondContact OD1-N 2.98Å; L336-L339 HydrophobicContact CD2-CD1 4.49Å; L336-S340 WeakPolarHBondContact O-CB 3.47Å; L336-S340 PolarHBondContact O-N 2.87Å; L336-S340 PolarHBondContact O-OG 3.5Å
337	A	98.7	Very high	96.6	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.008	10%	0.101	C	C	.	.	H	α-helix	trans	-65.8	-45	170.6	0	0	0	0	0	112.3	I303 L328 Q331 D333 E334 A335 L339 S340 F341	I303-A337 HydrophobicContact CD1-CB 3.62Å; L328-A337 HydrophobicContact CB-CB 4.08Å; L328-A337 HydrophobicContact CD1-CB 4.01Å; Q331-A337 HydrophobicContact CB-CB 4.17Å; Q331-A337 HydrophobicContact CG-CB 4.48Å; D333-A337 WeakPolarHBondContact O-CB 3.16Å; D333-A337 PolarHBondContact O-N 2.82Å; E334-A337 PolarHBondContact O-N 2.89Å; A335-A337 PolarHBondContact O-N 3.06Å; A337-L339 PolarHBondContact O-N 3.36Å; A337-S340 CarbonylContact O-C 3.56Å; A337-S340 PolarHBondContact O-N 2.8Å; A337-F341 WeakPolarHBondContact O-CB 3.08Å; A337-F341 PolarHBondContact O-N 3.33Å
338	Y	98.6	Very high	96.2	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-59.7	-44.7	173.9	178.5	-98.7	0	0	0	112.7	Y247 I303 T306 Y307 E334 A335 S340 F341 C342 L445	Y247-Y338 AromaticContact CD2-CD1 3.15Å; Y247-Y338 HydrophobicContact CD2-CD1 3.15Å; Y247-Y338 AromaticContact CD2-CD2 3.67Å; Y247-Y338 HydrophobicContact CD2-CD2 3.67Å; Y247-Y338 AromaticContact CD2-CE1 3.48Å; Y247-Y338 HydrophobicContact CD2-CE1 3.48Å; Y247-Y338 VanDerWaalsContact CD2-CE1 3.48Å; Y247-Y338 AromaticContact CD2-CE2 3.96Å; Y247-Y338 HydrophobicContact CD2-CE2 3.96Å; Y247-Y338 AromaticContact CD2-CG 3.24Å; Y247-Y338 HydrophobicContact CD2-CG 3.24Å; Y247-Y338 AromaticContact CD2-CZ 3.87Å; Y247-Y338 AromaticContact CE2-CD1 3.74Å; Y247-Y338 HydrophobicContact CE2-CD1 3.74Å; Y247-Y338 AromaticContact CE2-CD2 3.32Å; Y247-Y338 HydrophobicContact CE2-CD2 3.32Å; Y247-Y338 HydrophobicContact CE2-CE1 4.17Å; Y247-Y338 AromaticContact CE2-CE2 3.8Å; Y247-Y338 HydrophobicContact CE2-CE2 3.8Å; Y247-Y338 AromaticContact CE2-CG 3.27Å; Y247-Y338 HydrophobicContact CE2-CG 3.27Å; Y247-Y338 AromaticContact CG-CD1 3.69Å; Y247-Y338 HydrophobicContact CG-CD1 3.69Å; Y247-Y338 HydrophobicContact CG-CE1 4.26Å; Y247-Y338 AromaticContact CG-CG 3.95Å; Y247-Y338 HydrophobicContact CG-CG 3.95Å; I303-Y338 HydrophobicContact CG2-CD2 4.28Å; T306-Y338 HydrophobicContact CG2-CE2 4Å; Y307-Y338 HydrophobicContact CD2-CE2 4.44Å; E334-Y338 PolarHBondContact O-N 3.43Å; A335-Y338 WeakPolarHBondContact O-CB 3.43Å; A335-Y338 PolarHBondContact O-N 3.47Å; A335-Y338 VanDerWaalsContact O-N 3.09Å; Y338-S340 VanDerWaalsContact C-N 3.3Å; Y338-S340 PolarHBondContact O-N 2.93Å; Y338-F341 PolarHBondContact O-N 3.05Å; Y338-F341 VanDerWaalsContact O-N 3.09Å; Y338-C342 VanDerWaalsContact CE1-SG 3.59Å; Y338-C342 VanDerWaalsContact CZ-SG 3.6Å; Y338-C342 PolarHBondContact O-N 2.9Å; Y338-L445 HydrophobicContact CE1-CB 4.33Å; Y338-L445 HydrophobicContact CE1-CD2 4.09Å; Y338-L445 PolarHBondContact OH-O 3.29Å
339	L	97.4	Very high	95.7	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-61.7	-39.9	176.6	-61.7	-176.4	0	0	0	111.8	V226 L240 K243 A335 L336 A337 F341 A343 L443 L445	V226-L339 HydrophobicContact CG1-CB 3.84Å; L240-L339 HydrophobicContact CD2-CD1 3.86Å; K243-L339 HydrophobicContact CB-CD1 3.46Å; K243-L339 VanDerWaalsContact CB-CD1 3.46Å; K243-L339 HydrophobicContact CB-CD2 3.68Å; K243-L339 HydrophobicContact CB-CG 4.21Å; A335-L339 WeakPolarHBondContact O-CG 3.18Å; A335-L339 PolarHBondContact O-N 2.86Å; L336-L339 HydrophobicContact CD2-CD1 4.49Å; A337-L339 PolarHBondContact O-N 3.36Å; L339-F341 VanDerWaalsContact C-N 3.34Å; L339-A343 PolarHBondContact O-N 2.97Å; L339-A343 VanDerWaalsContact O-N 3.15Å; L339-L443 HydrophobicContact CB-CD2 4.02Å; L339-L443 HydrophobicContact CD2-CD2 4.21Å; L339-L445 HydrophobicContact CD2-CD1 3.96Å; L339-L445 HydrophobicContact CD2-CD2 3.57Å; L339-L445 HydrophobicContact CD2-CG 4.43Å
340	S	97.8	Very high	95.2	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-66.6	-35.5	173.8	-53.1	0	0	0	0	111.9	L336 A337 Y338 A343 L344	L336-S340 WeakPolarHBondContact O-CB 3.47Å; L336-S340 PolarHBondContact O-N 2.87Å; L336-S340 PolarHBondContact O-OG 3.5Å; A337-S340 CarbonylContact O-C 3.56Å; A337-S340 PolarHBondContact O-N 2.8Å; Y338-S340 VanDerWaalsContact C-N 3.3Å; Y338-S340 PolarHBondContact O-N 2.93Å; S340-A343 PolarHBondContact O-N 2.84Å; S340-L344 WeakPolarHBondContact O-CB 3.49Å; S340-L344 PolarHBondContact O-N 3.05Å
341	F	98.2	Very high	94.6	Very high	1 Å²	1	24.5 Å²	24.5	0%	0.004	12%	0.123	C	C	.	.	H	α-helix	trans	-71.1	-40.4	177.6	-174.1	-115.3	0	0	0	111.9	I303 L304 Y307 M320 L323 A324 L327 A337 Y338 L339 A343 L344 M345	I303-F341 HydrophobicContact CG2-CB 4.23Å; I303-F341 HydrophobicContact CG2-CD1 4.07Å; I303-F341 HydrophobicContact CG2-CG 4.26Å; L304-F341 HydrophobicContact CD2-CE1 4.02Å; L304-F341 HydrophobicContact CD2-CE2 4.49Å; L304-F341 HydrophobicContact CD2-CZ 3.78Å; Y307-F341 AromaticContact CD1-CE1 3.83Å; Y307-F341 HydrophobicContact CD1-CE1 3.83Å; Y307-F341 AromaticContact CD2-CD1 3.95Å; Y307-F341 HydrophobicContact CD2-CD1 3.95Å; Y307-F341 HydrophobicContact CD2-CE1 4.03Å; Y307-F341 AromaticContact CG-CD1 3.89Å; Y307-F341 HydrophobicContact CG-CD1 3.89Å; Y307-F341 AromaticContact CG-CE1 3.55Å; Y307-F341 HydrophobicContact CG-CE1 3.55Å; M320-F341 HydrophobicContact CB-CZ 4.31Å; M320-F341 HydrophobicContact CE-CE1 4.23Å; M320-F341 HydrophobicContact CE-CZ 3.88Å; L323-F341 HydrophobicContact CB-CE2 4.34Å; A324-F341 HydrophobicContact CB-CD2 3.81Å; A324-F341 HydrophobicContact CB-CE2 3.78Å; A324-F341 HydrophobicContact CB-CG 4.36Å; A324-F341 HydrophobicContact CB-CZ 4.31Å; L327-F341 VanDerWaalsContact CD1-CA 3.49Å; L327-F341 HydrophobicContact CD1-CB 3.8Å; L327-F341 HydrophobicContact CD1-CD2 3.91Å; L327-F341 HydrophobicContact CD1-CG 4.37Å; A337-F341 WeakPolarHBondContact O-CB 3.08Å; A337-F341 PolarHBondContact O-N 3.33Å; Y338-F341 PolarHBondContact O-N 3.05Å; Y338-F341 VanDerWaalsContact O-N 3.09Å; L339-F341 VanDerWaalsContact C-N 3.34Å; F341-A343 VanDerWaalsContact C-N 3.31Å; F341-A343 PolarHBondContact O-N 2.82Å; F341-L344 PolarHBondContact O-N 3.09Å; F341-M345 HydrophobicContact CD1-CG 4.18Å; F341-M345 HydrophobicContact CD2-CG 4.11Å; F341-M345 HydrophobicContact CE1-CG 3.84Å; F341-M345 HydrophobicContact CE2-CG 3.76Å; F341-M345 HydrophobicContact CE2-SD 3.93Å; F341-M345 HydrophobicContact CG-CG 4.31Å; F341-M345 HydrophobicContact CZ-CG 3.62Å; F341-M345 HydrophobicContact CZ-SD 3.82Å; F341-M345 VanDerWaalsContact O-CB 3.28Å; F341-M345 WeakPolarHBondContact O-CB 3.32Å; F341-M345 VanDerWaalsContact O-CG 3.27Å; F341-M345 WeakPolarHBondContact O-CG 3.45Å; F341-M345 PolarHBondContact O-N 2.8Å
342	C	96.3	Very high	93.8	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.007	12%	0.121	C	C	.	.	H	α-helix	trans	-58.2	-43.3	170	-72.7	0	0	0	0	111.8	Y338 M345 Q346 L443 L445	Y338-C342 VanDerWaalsContact CE1-SG 3.59Å; Y338-C342 VanDerWaalsContact CZ-SG 3.6Å; Y338-C342 PolarHBondContact O-N 2.9Å; C342-M345 PolarHBondContact O-N 3.49Å; C342-Q346 WeakPolarHBondContact O-CG 3.37Å; C342-Q346 PolarHBondContact O-N 3.38Å; C342-L443 HydrophobicContact CB-CD1 3.97Å; C342-L445 HydrophobicContact CB-CD2 4.08Å
343	A	94.9	Very high	92.6	Very high	2 Å²	2	22.2 Å²	22.2	2%	0.017	11%	0.11	C	C	.	.	H	α-helix	trans	-68.2	-40.4	178.6	0	0	0	0	0	112.9	L224 V226 L339 S340 F341 L443	L224-A343 HydrophobicContact CB-CB 4.11Å; V226-A343 HydrophobicContact CG2-CB 3.63Å; L339-A343 PolarHBondContact O-N 2.97Å; L339-A343 VanDerWaalsContact O-N 3.15Å; S340-A343 PolarHBondContact O-N 2.84Å; F341-A343 VanDerWaalsContact C-N 3.31Å; F341-A343 PolarHBondContact O-N 2.82Å; A343-L443 HydrophobicContact CB-CD1 3.83Å
344	L	95.7	Very high	90.9	Very high	3 Å²	3	22.6 Å²	22.6	2%	0.016	11%	0.112	C	C	.	.	H	α-helix	trans	-64.4	-48.7	172.4	179.6	59.9	0	0	0	110.9	L224 L323 L327 S340 F341 Q346 R347 V348 W418	L224-L344 HydrophobicContact CD2-CB 4.13Å; L224-L344 HydrophobicContact CD2-CD1 4.04Å; L323-L344 HydrophobicContact CB-CD2 4.13Å; L323-L344 HydrophobicContact CD2-CD2 4.49Å; L327-L344 HydrophobicContact CD1-CB 4.32Å; L327-L344 HydrophobicContact CD1-CD2 3.94Å; S340-L344 WeakPolarHBondContact O-CB 3.49Å; S340-L344 PolarHBondContact O-N 3.05Å; F341-L344 PolarHBondContact O-N 3.09Å; L344-Q346 VanDerWaalsContact C-N 3.25Å; L344-Q346 PolarHBondContact O-N 3.25Å; L344-R347 CarbonylContact O-C 3.54Å; L344-R347 WeakPolarHBondContact O-CA 3.36Å; L344-R347 VanDerWaalsContact O-CB 3.31Å; L344-R347 WeakPolarHBondContact O-CB 3.23Å; L344-R347 PolarHBondContact O-N 3.49Å; L344-V348 HydrophobicContact CD1-CG1 4.18Å; L344-V348 HydrophobicContact CG-CG2 4.31Å; L344-V348 PolarHBondContact O-N 2.86Å; L344-V348 VanDerWaalsContact O-N 3.12Å; L344-W418 HydrophobicContact CD1-CZ2 3.92Å; L344-W418 HydrophobicContact CD2-CZ2 4.28Å
345	M	93.5	Very high	88.9	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-61.9	-29.4	179.5	-72.7	-59.7	-60.3	0	0	112.6	Y307 I314 M320 F341 C342 R347 V348 K349 F352	Y307-M345 HydrophobicContact CE1-CB 4.3Å; Y307-M345 HydrophobicContact CE1-CE 4.06Å; Y307-M345 HydrophobicContact CE1-CG 4.08Å; Y307-M345 HydrophobicContact CE2-CB 3.93Å; Y307-M345 HydrophobicContact CE2-CG 4.16Å; Y307-M345 WeakPolarHBondContact OH-CB 3.45Å; I314-M345 HydrophobicContact CG2-CE 4.15Å; M320-M345 HydrophobicContact CE-CE 3.79Å; M320-M345 HydrophobicContact CE-SD 4.25Å; M320-M345 HydrophobicContact SD-CE 4.35Å; F341-M345 HydrophobicContact CD1-CG 4.18Å; F341-M345 HydrophobicContact CD2-CG 4.11Å; F341-M345 HydrophobicContact CE1-CG 3.84Å; F341-M345 HydrophobicContact CE2-CG 3.76Å; F341-M345 HydrophobicContact CE2-SD 3.93Å; F341-M345 HydrophobicContact CG-CG 4.31Å; F341-M345 HydrophobicContact CZ-CG 3.62Å; F341-M345 HydrophobicContact CZ-SD 3.82Å; F341-M345 VanDerWaalsContact O-CB 3.28Å; F341-M345 WeakPolarHBondContact O-CB 3.32Å; F341-M345 VanDerWaalsContact O-CG 3.27Å; F341-M345 WeakPolarHBondContact O-CG 3.45Å; F341-M345 PolarHBondContact O-N 2.8Å; C342-M345 PolarHBondContact O-N 3.49Å; M345-R347 PolarHBondContact O-N 3.43Å; M345-V348 PolarHBondContact O-N 3.09Å; M345-V348 HydrophobicContact SD-CG2 3.79Å; M345-K349 HydrophobicContact CE-CB 4.23Å; M345-K349 WeakPolarHBondContact O-CA 3.33Å; M345-K349 WeakPolarHBondContact O-CB 3.04Å; M345-K349 WeakPolarHBondContact O-CG 3.31Å; M345-K349 PolarHBondContact O-N 2.84Å; M345-F352 HydrophobicContact CE-CD2 3.85Å; M345-F352 HydrophobicContact CE-CE2 4.3Å; M345-F352 HydrophobicContact SD-CD2 4.46Å; M345-F352 HydrophobicContact SD-CE2 4.32Å
346	Q	89.8	Confident	87.2	Confident	78 Å²	78	30.7 Å²	30.7	36%	0.364	16%	0.157	S	C	.	.	H	α-helix	trans	-60.1	-26.7	169.8	-75.4	169	17.3	0	0	113.2	C342 L344 V444	C342-Q346 WeakPolarHBondContact O-CG 3.37Å; C342-Q346 PolarHBondContact O-N 3.38Å; L344-Q346 VanDerWaalsContact C-N 3.25Å; L344-Q346 PolarHBondContact O-N 3.25Å; Q346-V444 PolarHBondContact NE2-O 3.38Å
347	R	89.7	Confident	85.9	Confident	50 Å²	50	30.5 Å²	30.5	19%	0.189	16%	0.155	C	C	.	.	H	α-helix	trans	-94.9	-14.4	178.6	-54.8	172.3	178.6	-146.5	-8.8	114.6	L223 L224 L344 M345 F350	L223-R347 PolarHBondContact O-NH1 3.27Å; L223-R347 PolarHBondContact O-NH2 2.84Å; L224-R347 VanDerWaalsContact CA-NH2 3.34Å; L224-R347 PolarHBondContact O-NE 3.12Å; L224-R347 PolarHBondContact O-NH2 3.25Å; L344-R347 CarbonylContact O-C 3.54Å; L344-R347 WeakPolarHBondContact O-CA 3.36Å; L344-R347 VanDerWaalsContact O-CB 3.31Å; L344-R347 WeakPolarHBondContact O-CB 3.23Å; L344-R347 PolarHBondContact O-N 3.49Å; M345-R347 PolarHBondContact O-N 3.43Å; R347-F350 WeakPolarHBondContact O-CE2 3.27Å; R347-F350 WeakPolarHBondContact O-CZ 3.24Å
348	V	90.5	Very high	85.2	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-129.4	-7.2	-176.4	-55.1	0	0	0	0	114.8	L323 L344 M345 F350 K351 F352 E400	L323-V348 HydrophobicContact CD1-CG2 4.09Å; L344-V348 HydrophobicContact CD1-CG1 4.18Å; L344-V348 HydrophobicContact CG-CG2 4.31Å; L344-V348 PolarHBondContact O-N 2.86Å; L344-V348 VanDerWaalsContact O-N 3.12Å; M345-V348 PolarHBondContact O-N 3.09Å; M345-V348 HydrophobicContact SD-CG2 3.79Å; V348-F350 PolarHBondContact O-N 3.03Å; V348-F350 VanDerWaalsContact O-N 3.09Å; V348-K351 HydrophobicContact CB-CD 4.14Å; V348-K351 HydrophobicContact CG1-CD 4.44Å; V348-K351 VanDerWaalsContact O-CB 3.24Å; V348-K351 WeakPolarHBondContact O-CB 3.21Å; V348-K351 WeakPolarHBondContact O-CG 3.33Å; V348-K351 PolarHBondContact O-N 3.41Å; V348-F352 HydrophobicContact CB-CE2 4.33Å; V348-F352 HydrophobicContact CG2-CD2 4.45Å; V348-F352 HydrophobicContact CG2-CE2 3.9Å; V348-F352 VanDerWaalsContact O-CD2 3.28Å; V348-F352 WeakPolarHBondContact O-CD2 3.41Å; V348-E400 HydrophobicContact CG1-CG 4.37Å
349	K	88.4	Confident	84.7	Confident	81 Å²	81	35.4 Å²	35.4	35%	0.352	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-54.3	-32.8	179.7	60.7	178.3	179.6	172.7	0	113.3	I314 M345 K351 F352 Q356	I314-K349 HydrophobicContact CD1-CB 3.63Å; I314-K349 HydrophobicContact CD1-CD 3.87Å; I314-K349 HydrophobicContact CD1-CG 4.4Å; I314-K349 HydrophobicContact CG1-CB 4.27Å; M345-K349 HydrophobicContact CE-CB 4.23Å; M345-K349 WeakPolarHBondContact O-CA 3.33Å; M345-K349 WeakPolarHBondContact O-CB 3.04Å; M345-K349 WeakPolarHBondContact O-CG 3.31Å; M345-K349 PolarHBondContact O-N 2.84Å; K349-K351 PolarHBondContact O-N 3.22Å; K349-K351 VanDerWaalsContact O-N 3.09Å; K349-F352 CarbonylContact O-C 3.53Å; K349-F352 WeakPolarHBondContact O-CA 3.5Å; K349-F352 PolarHBondContact O-N 3Å; K349-F352 VanDerWaalsContact O-O 3.06Å; K349-Q356 PolarHBondContact O-OE1 3.41Å
350	F	86.6	Confident	84.3	Confident	73 Å²	73	35.6 Å²	35.6	32%	0.32	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-72.4	5.2	176.8	49.3	-110.4	0	0	0	114.5	R347 V348 I359	R347-F350 WeakPolarHBondContact O-CE2 3.27Å; R347-F350 WeakPolarHBondContact O-CZ 3.24Å; V348-F350 PolarHBondContact O-N 3.03Å; V348-F350 VanDerWaalsContact O-N 3.09Å; F350-I359 HydrophobicContact CB-CD1 3.82Å; F350-I359 HydrophobicContact CD2-CG2 3.97Å; F350-I359 HydrophobicContact CG-CD1 4.47Å
351	K	85.1	Confident	84	Confident	11 Å²	11	36.5 Å²	36.5	5%	0.048	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-100.5	-1.7	165.6	-49.9	179.7	-169.9	171.4	0	112.1	V348 K349 L360 F397 E400	V348-K351 HydrophobicContact CB-CD 4.14Å; V348-K351 HydrophobicContact CG1-CD 4.44Å; V348-K351 VanDerWaalsContact O-CB 3.24Å; V348-K351 WeakPolarHBondContact O-CB 3.21Å; V348-K351 WeakPolarHBondContact O-CG 3.33Å; V348-K351 PolarHBondContact O-N 3.41Å; K349-K351 PolarHBondContact O-N 3.22Å; K349-K351 VanDerWaalsContact O-N 3.09Å; K351-L360 HydrophobicContact CB-CD2 4.09Å; K351-L360 HydrophobicContact CG-CD2 4.22Å; K351-F397 WeakPolarHBondContact CD-O 3.29Å; K351-F397 WeakPolarHBondContact CE-O 3.48Å; K351-F397 PolarHBondContact NZ-O 3.16Å; K351-E400 IonicContact NZ-OE1 3.17Å; K351-E400 PolarHBondContact NZ-OE1 3.43Å
352	F	81.6	Confident	83.7	Confident	5 Å²	5	39.1 Å²	39.1	2%	0.022	21%	0.206	C	C	.	.	S	Bend	trans	-132.5	106.2	-170.3	-64.7	-74.9	0	0	0	111.8	I314 C317 M320 L323 M345 V348 K349 V398	I314-F352 HydrophobicContact CG2-CB 4.15Å; C317-F352 HydrophobicContact CB-CD1 3.58Å; C317-F352 HydrophobicContact CB-CE1 4.25Å; C317-F352 HydrophobicContact CB-CG 4.46Å; M320-F352 HydrophobicContact CG-CD1 4.19Å; M320-F352 HydrophobicContact CG-CE1 3.95Å; M320-F352 HydrophobicContact CG-CZ 4.17Å; L323-F352 HydrophobicContact CD1-CE2 3.89Å; L323-F352 HydrophobicContact CD1-CZ 3.74Å; M345-F352 HydrophobicContact CE-CD2 3.85Å; M345-F352 HydrophobicContact CE-CE2 4.3Å; M345-F352 HydrophobicContact SD-CD2 4.46Å; M345-F352 HydrophobicContact SD-CE2 4.32Å; V348-F352 HydrophobicContact CB-CE2 4.33Å; V348-F352 HydrophobicContact CG2-CD2 4.45Å; V348-F352 HydrophobicContact CG2-CE2 3.9Å; V348-F352 VanDerWaalsContact O-CD2 3.28Å; V348-F352 WeakPolarHBondContact O-CD2 3.41Å; K349-F352 CarbonylContact O-C 3.53Å; K349-F352 WeakPolarHBondContact O-CA 3.5Å; K349-F352 PolarHBondContact O-N 3Å; K349-F352 VanDerWaalsContact O-O 3.06Å; F352-V398 HydrophobicContact CD1-CG1 4.2Å; F352-V398 HydrophobicContact CE1-CG1 3.38Å; F352-V398 HydrophobicContact CZ-CG1 3.59Å
353	G	70.1	Confident	83.7	Confident	19 Å²	19	39.4 Å²	39.4	20%	0.196	21%	0.207	C	C	.	.	S	Bend	trans	146.2	155.8	175.3	0	0	0	0	0	112.3	T355 Q356	G353-T355 PolarHBondContact O-N 3.23Å; G353-Q356 PolarHBondContact O-N 3.35Å
354	D	62.1	Low	83.7	Confident	77 Å²	77	39.4 Å²	39.4	41%	0.412	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-30.7	-169	-47.9	-59.2	0	0	0	113	K577	D354-K577 IonicContact OD2-NZ 2.65Å; D354-K577 PolarHBondContact OD2-NZ 3.09Å
355	T	56	Low	83.7	Confident	132 Å²	132	42.4 Å²	42.4	81%	0.81	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-3.6	-172.9	-31.7	0	0	0	0	114.3	G353	G353-T355 PolarHBondContact O-N 3.23Å
356	Q	61.4	Low	83.9	Confident	76 Å²	76	43.4 Å²	43.4	36%	0.355	23%	0.226	S	C	.	.			trans	-113.5	18.1	-163.2	-69.2	172.2	-10.6	0	0	114.1	K349 G353 S358 I359	K349-Q356 PolarHBondContact O-OE1 3.41Å; G353-Q356 PolarHBondContact O-N 3.35Å; Q356-S358 VanDerWaalsContact C-N 3.27Å; Q356-S358 PolarHBondContact O-N 2.9Å; Q356-I359 PolarHBondContact O-N 2.86Å
357	Q	72.4	Confident	84.3	Confident	30 Å²	30	39.7 Å²	39.7	14%	0.14	21%	0.209	C	C	.	.	H	α-helix	trans	-60.4	-32.8	179.9	-59.1	-164.9	-6.4	0	0	113.7	I359 L360 I361 S580	Q357-I359 PolarHBondContact O-N 2.77Å; Q357-L360 PolarHBondContact O-N 3.21Å; Q357-I361 WeakPolarHBondContact O-CG1 3.5Å; Q357-I361 PolarHBondContact O-N 2.92Å; Q357-S580 PolarHBondContact NE2-O 2.92Å; Q357-S580 PolarHBondContact NE2-OG 3.15Å
358	S	84.2	Confident	84.7	Confident	66 Å²	66	37.5 Å²	37.5	46%	0.462	20%	0.201	S	C	.	.	H	α-helix	trans	-55.4	-37.4	179.9	52.3	0	0	0	0	112.9	Q356 L360 I361 N362	Q356-S358 VanDerWaalsContact C-N 3.27Å; Q356-S358 PolarHBondContact O-N 2.9Å; S358-L360 VanDerWaalsContact C-N 3.32Å; S358-L360 PolarHBondContact O-N 3.01Å; S358-I361 PolarHBondContact O-N 3.12Å; S358-N362 WeakPolarHBondContact O-CB 3.21Å; S358-N362 PolarHBondContact O-N 3.41Å; S358-N362 PolarHBondContact O-OD1 3Å; S358-N362 VanDerWaalsContact O-OD1 3.09Å
359	I	87.1	Confident	85	Confident	39 Å²	39	37.9 Å²	37.9	20%	0.2	20%	0.203	C	C	.	.	H	α-helix	trans	-67.3	-34.2	179.6	-66	173.3	0	0	0	111.2	F350 Q356 Q357 N363 Q606	F350-I359 HydrophobicContact CB-CD1 3.82Å; F350-I359 HydrophobicContact CD2-CG2 3.97Å; F350-I359 HydrophobicContact CG-CD1 4.47Å; Q356-I359 PolarHBondContact O-N 2.86Å; Q357-I359 PolarHBondContact O-N 2.77Å; I359-N363 PolarHBondContact O-N 2.83Å; I359-N363 PolarHBondContact O-ND2 3.42Å; I359-Q606 HydrophobicContact CG2-CG 4.24Å
360	L	89.8	Confident	85.5	Confident	3 Å²	3	34 Å²	34	2%	0.016	19%	0.186	C	C	.	.	H	α-helix	trans	-72.8	-41.4	172.3	-68.3	174.2	0	0	0	111.5	K351 Q357 S358 N362 N363 M364 Q394 F397 V398	K351-L360 HydrophobicContact CB-CD2 4.09Å; K351-L360 HydrophobicContact CG-CD2 4.22Å; Q357-L360 PolarHBondContact O-N 3.21Å; S358-L360 VanDerWaalsContact C-N 3.32Å; S358-L360 PolarHBondContact O-N 3.01Å; L360-N362 VanDerWaalsContact C-N 3.34Å; L360-N362 PolarHBondContact O-N 2.8Å; L360-N363 PolarHBondContact O-N 3.04Å; L360-M364 HydrophobicContact CB-CE 4.49Å; L360-M364 WeakPolarHBondContact O-CB 3.42Å; L360-M364 WeakPolarHBondContact O-CG 3.48Å; L360-M364 PolarHBondContact O-N 3Å; L360-Q394 HydrophobicContact CD1-CG 4.31Å; L360-F397 HydrophobicContact CD2-CB 3.86Å; L360-V398 HydrophobicContact CD1-CG2 3.65Å; L360-V398 HydrophobicContact CD2-CG2 3.77Å; L360-V398 HydrophobicContact CG-CG2 4.4Å
361	I	90.9	Very high	86	Confident	19 Å²	19	30.6 Å²	30.6	10%	0.097	17%	0.171	C	C	.	.	H	α-helix	trans	-59.2	-45.8	175.9	-65	167.2	0	0	0	110.4	Q357 S358 N363 M364 Q365 F582 I584 I589	Q357-I361 WeakPolarHBondContact O-CG1 3.5Å; Q357-I361 PolarHBondContact O-N 2.92Å; S358-I361 PolarHBondContact O-N 3.12Å; I361-N363 PolarHBondContact O-N 3.3Å; I361-M364 HydrophobicContact CG1-CE 4.33Å; I361-M364 CarbonylContact O-C 3.56Å; I361-M364 WeakPolarHBondContact O-CB 3.47Å; I361-M364 PolarHBondContact O-N 3.46Å; I361-M364 VanDerWaalsContact O-N 3.11Å; I361-Q365 HydrophobicContact CG2-CG 4.35Å; I361-Q365 WeakPolarHBondContact O-CG 3.18Å; I361-Q365 PolarHBondContact O-N 3.41Å; I361-F582 HydrophobicContact CD1-CD1 4.13Å; I361-F582 HydrophobicContact CD1-CE1 4.45Å; I361-F582 HydrophobicContact CG1-CD1 4.36Å; I361-F582 HydrophobicContact CG1-CE1 4.19Å; I361-I584 HydrophobicContact CD1-CD1 4.12Å; I361-I589 HydrophobicContact CG2-CD1 4.43Å
362	N	92.6	Very high	86.6	Confident	56 Å²	56	30.3 Å²	30.3	30%	0.299	17%	0.171	S	C	.	.	H	α-helix	trans	-60.8	-42.6	177.6	-66.4	2.1	0	0	0	112.1	S358 L360 M364 Q365 D366	S358-N362 WeakPolarHBondContact O-CB 3.21Å; S358-N362 PolarHBondContact O-N 3.41Å; S358-N362 PolarHBondContact O-OD1 3Å; S358-N362 VanDerWaalsContact O-OD1 3.09Å; L360-N362 VanDerWaalsContact C-N 3.34Å; L360-N362 PolarHBondContact O-N 2.8Å; N362-M364 VanDerWaalsContact C-N 3.31Å; N362-M364 PolarHBondContact O-N 2.75Å; N362-Q365 PolarHBondContact O-N 3.37Å; N362-D366 WeakPolarHBondContact O-CB 3.41Å; N362-D366 PolarHBondContact O-N 2.75Å
363	N	94.4	Very high	87.4	Confident	8 Å²	8	33.4 Å²	33.4	4%	0.043	18%	0.183	C	C	.	.	H	α-helix	trans	-64.3	-34.8	174.8	-83.3	-75.6	0	0	0	112.7	I359 L360 I361 L367 F397 G605 Q606 L612	I359-N363 PolarHBondContact O-N 2.83Å; I359-N363 PolarHBondContact O-ND2 3.42Å; L360-N363 PolarHBondContact O-N 3.04Å; I361-N363 PolarHBondContact O-N 3.3Å; N363-L367 WeakPolarHBondContact O-CB 3.48Å; N363-L367 PolarHBondContact O-N 2.87Å; N363-F397 HydrophobicContact CB-CD1 3.82Å; N363-F397 HydrophobicContact CB-CD2 4.37Å; N363-F397 HydrophobicContact CB-CE1 3.82Å; N363-F397 HydrophobicContact CB-CE2 4.35Å; N363-F397 HydrophobicContact CB-CG 4.11Å; N363-F397 HydrophobicContact CB-CZ 4.08Å; N363-F397 WeakPolarHBondContact O-CZ 3.33Å; N363-G605 VanDerWaalsContact OD1-C 3.31Å; N363-G605 WeakPolarHBondContact OD1-CA 3.38Å; N363-G605 PolarHBondContact OD1-O 2.69Å; N363-Q606 WeakPolarHBondContact ND2-CG 3.49Å; N363-L612 WeakPolarHBondContact O-CD2 3.3Å
364	M	95.9	Very high	88.6	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-73.6	-35.6	177	-72.8	-174.4	-55.7	0	0	112.1	L360 I361 N362 L367 H368 M390 Y391 Q394 F397 F582	L360-M364 HydrophobicContact CB-CE 4.49Å; L360-M364 WeakPolarHBondContact O-CB 3.42Å; L360-M364 WeakPolarHBondContact O-CG 3.48Å; L360-M364 PolarHBondContact O-N 3Å; I361-M364 HydrophobicContact CG1-CE 4.33Å; I361-M364 CarbonylContact O-C 3.56Å; I361-M364 WeakPolarHBondContact O-CB 3.47Å; I361-M364 PolarHBondContact O-N 3.46Å; I361-M364 VanDerWaalsContact O-N 3.11Å; N362-M364 VanDerWaalsContact C-N 3.31Å; N362-M364 PolarHBondContact O-N 2.75Å; M364-L367 PolarHBondContact O-N 3.3Å; M364-H368 PolarHBondContact O-N 2.95Å; M364-H368 VanDerWaalsContact O-N 3.11Å; M364-M390 HydrophobicContact CB-CB 3.91Å; M364-M390 HydrophobicContact CG-CB 4.32Å; M364-M390 WeakPolarHBondContact O-CG 3.31Å; M364-Y391 HydrophobicContact CE-CD1 3.62Å; M364-Y391 HydrophobicContact CE-CE1 3.97Å; M364-Y391 HydrophobicContact SD-CD1 4.07Å; M364-Q394 HydrophobicContact SD-CB 4.01Å; M364-F397 HydrophobicContact CG-CD2 3.89Å; M364-F397 HydrophobicContact CG-CE2 3.79Å; M364-F582 HydrophobicContact CE-CE1 4.48Å; M364-F582 HydrophobicContact CE-CZ 4.44Å
365	Q	95.5	Very high	90.3	Very high	66 Å²	66	32.9 Å²	32.9	31%	0.308	18%	0.177	S	C	.	.	H	α-helix	trans	-65.3	-49.1	169.2	-71	170.3	-14.7	0	0	111.5	I361 N362 L367 H368 D369 I589	I361-Q365 HydrophobicContact CG2-CG 4.35Å; I361-Q365 WeakPolarHBondContact O-CG 3.18Å; I361-Q365 PolarHBondContact O-N 3.41Å; N362-Q365 PolarHBondContact O-N 3.37Å; Q365-L367 PolarHBondContact O-N 3.35Å; Q365-H368 PolarHBondContact O-N 3.13Å; Q365-D369 PolarHBondContact O-N 3.46Å; Q365-I589 HydrophobicContact CG-CG2 4.37Å
366	D	97.2	Very high	92.2	Very high	22 Å²	22	30.5 Å²	30.5	12%	0.118	17%	0.166	C	C	.	.	H	α-helix	trans	-55.2	-38.1	175.6	-84.6	-21.6	0	0	0	111.4	N362 D369 L370 F604 G605 L612	N362-D366 WeakPolarHBondContact O-CB 3.41Å; N362-D366 PolarHBondContact O-N 2.75Å; D366-D369 PolarHBondContact O-N 2.72Å; D366-L370 VanDerWaalsContact O-CB 3.27Å; D366-L370 WeakPolarHBondContact O-CB 3.36Å; D366-L370 PolarHBondContact O-N 2.9Å; D366-F604 HydrophobicContact CB-CD2 3.94Å; D366-F604 HydrophobicContact CB-CE2 3.65Å; D366-F604 WeakPolarHBondContact OD1-CD2 3.35Å; D366-G605 WeakPolarHBondContact OD2-CA 3.41Å; D366-G605 PolarHBondContact OD2-N 3.5Å; D366-L612 HydrophobicContact CB-CD1 3.74Å; D366-L612 HydrophobicContact CB-CD2 3.95Å
367	L	98.3	Very high	93.9	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-70.2	-37.3	175.8	-179.6	59.4	0	0	0	113	N363 M364 Q365 L371 M390 T393 F397 L612 L616 I619	N363-L367 WeakPolarHBondContact O-CB 3.48Å; N363-L367 PolarHBondContact O-N 2.87Å; M364-L367 PolarHBondContact O-N 3.3Å; Q365-L367 PolarHBondContact O-N 3.35Å; L367-L371 WeakPolarHBondContact O-CB 3.41Å; L367-L371 PolarHBondContact O-N 3.46Å; L367-M390 HydrophobicContact CD2-SD 4.44Å; L367-M390 HydrophobicContact CG-CE 4.35Å; L367-M390 HydrophobicContact CG-SD 4.47Å; L367-T393 HydrophobicContact CD2-CG2 3.84Å; L367-F397 HydrophobicContact CB-CZ 4.11Å; L367-F397 HydrophobicContact CD2-CE2 3.97Å; L367-F397 HydrophobicContact CD2-CZ 3.88Å; L367-L612 HydrophobicContact CB-CD2 4.06Å; L367-L616 HydrophobicContact CD1-CB 4.05Å; L367-I619 HydrophobicContact CD2-CD1 4.21Å; L367-I619 HydrophobicContact CG-CD1 4.45Å
368	H	97.8	Very high	95.1	Very high	3 Å²	3	30.7 Å²	30.7	1%	0.014	17%	0.167	C	C	.	.	H	α-helix	trans	-67.9	-37.5	173	171.3	-87.4	0	0	0	112.1	M364 Q365 L371 T372 R383 A388 M390 I591 K592	M364-H368 PolarHBondContact O-N 2.95Å; M364-H368 VanDerWaalsContact O-N 3.11Å; Q365-H368 PolarHBondContact O-N 3.13Å; H368-L371 PolarHBondContact O-N 3.38Å; H368-T372 PolarHBondContact CE1-OG1 2.63Å; H368-T372 VanDerWaalsContact CE1-OG1 3.3Å; H368-T372 WeakPolarHBondContact O-CB 3.4Å; H368-T372 PolarHBondContact O-N 2.86Å; H368-T372 PolarHBondContact O-OG1 2.81Å; H368-R383 PolarHBondContact CE1-NH1 3.34Å; H368-R383 PolarHBondContact NE2-NH1 3.11Å; H368-A388 PolarHBondContact CD2-O 3.28Å; H368-M390 HydrophobicContact CB-CE 4.03Å; H368-M390 HydrophobicContact CB-CG 3.9Å; H368-I591 WeakPolarHBondContact CE1-CG2 3.27Å; H368-K592 PolarHBondContact CE1-O 3Å; H368-K592 VanDerWaalsContact CE1-O 3.27Å
369	D	97.6	Very high	95.8	Very high	9 Å²	9	27.6 Å²	27.6	5%	0.048	15%	0.145	C	C	.	.	H	α-helix	trans	-68.7	-40.3	174.9	-77.5	0.1	0	0	0	111.4	Q365 D366 L371 T372 Y373 K592 V595	Q365-D369 PolarHBondContact O-N 3.46Å; D366-D369 PolarHBondContact O-N 2.72Å; D369-L371 VanDerWaalsContact C-N 3.33Å; D369-L371 PolarHBondContact O-N 3.14Å; D369-T372 PolarHBondContact O-N 3.2Å; D369-Y373 WeakPolarHBondContact O-CB 3.24Å; D369-Y373 PolarHBondContact O-N 2.94Å; D369-K592 WeakPolarHBondContact OD2-CD 3.28Å; D369-K592 VanDerWaalsContact OD2-CE 3.31Å; D369-K592 WeakPolarHBondContact OD2-CE 3.31Å; D369-K592 IonicContact OD2-NZ 3.99Å; D369-K592 PolarHBondContact OD2-NZ 3.14Å; D369-V595 HydrophobicContact CB-CG2 4.05Å
370	L	98.4	Very high	96.2	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-59.6	-42.3	171.8	-174	51.4	0	0	0	112	D366 T374 L598 F604 L612 F613 L616	D366-L370 VanDerWaalsContact O-CB 3.27Å; D366-L370 WeakPolarHBondContact O-CB 3.36Å; D366-L370 PolarHBondContact O-N 2.9Å; L370-T374 WeakPolarHBondContact O-CB 3.33Å; L370-T374 PolarHBondContact O-N 2.88Å; L370-T374 PolarHBondContact O-OG1 2.99Å; L370-L598 HydrophobicContact CD1-CD1 3.63Å; L370-F604 HydrophobicContact CB-CZ 3.94Å; L370-F604 HydrophobicContact CD1-CE1 4.24Å; L370-F604 HydrophobicContact CD1-CZ 4.28Å; L370-F604 HydrophobicContact CD2-CE1 4.41Å; L370-F604 HydrophobicContact CD2-CZ 4.49Å; L370-F604 HydrophobicContact CG-CZ 4.44Å; L370-L612 HydrophobicContact CD2-CB 3.56Å; L370-F613 HydrophobicContact CD1-CD1 4.35Å; L370-F613 HydrophobicContact CD1-CE1 3.64Å; L370-F613 HydrophobicContact CD1-CE2 4.4Å; L370-F613 HydrophobicContact CD1-CZ 3.65Å; L370-F613 HydrophobicContact CD2-CD1 4.14Å; L370-F613 HydrophobicContact CD2-CD2 4.29Å; L370-F613 HydrophobicContact CD2-CE1 4.19Å; L370-F613 HydrophobicContact CD2-CE2 4.3Å; L370-F613 HydrophobicContact CD2-CG 4.2Å; L370-F613 HydrophobicContact CD2-CZ 4.25Å; L370-L616 HydrophobicContact CD1-CD2 4.17Å; L370-L616 HydrophobicContact CD2-CB 4Å; L370-L616 HydrophobicContact CD2-CD2 4.11Å; L370-L616 HydrophobicContact CG-CB 4.31Å; L370-L616 HydrophobicContact CG-CD2 3.69Å; L370-L616 HydrophobicContact CG-CG 4.47Å
371	L	98.4	Very high	96.6	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-64.7	-44.6	173.2	179.8	62.7	0	0	0	111.1	L367 H368 D369 Y373 T374 D375 L378 A379 F382 M390 L616 I619	L367-L371 WeakPolarHBondContact O-CB 3.41Å; L367-L371 PolarHBondContact O-N 3.46Å; H368-L371 PolarHBondContact O-N 3.38Å; D369-L371 VanDerWaalsContact C-N 3.33Å; D369-L371 PolarHBondContact O-N 3.14Å; L371-Y373 VanDerWaalsContact C-N 3.3Å; L371-Y373 PolarHBondContact O-N 3.01Å; L371-T374 PolarHBondContact O-N 3.42Å; L371-T374 VanDerWaalsContact O-N 3.14Å; L371-D375 HydrophobicContact CD1-CB 4.18Å; L371-D375 CarbonylContact O-C 3.55Å; L371-D375 PolarHBondContact O-N 2.92Å; L371-L378 HydrophobicContact CD1-CB 4.18Å; L371-L378 HydrophobicContact CD1-CD2 3.96Å; L371-L378 HydrophobicContact CD1-CG 4.13Å; L371-L378 HydrophobicContact CD2-CG 4.38Å; L371-A379 HydrophobicContact CD2-CB 4.37Å; L371-A379 HydrophobicContact CG-CB 4.04Å; L371-F382 HydrophobicContact CD2-CD1 4.15Å; L371-F382 HydrophobicContact CD2-CD2 3.81Å; L371-F382 HydrophobicContact CD2-CE1 4.29Å; L371-F382 HydrophobicContact CD2-CE2 3.94Å; L371-F382 HydrophobicContact CD2-CG 3.92Å; L371-F382 HydrophobicContact CD2-CZ 4.2Å; L371-M390 HydrophobicContact CB-CE 4.13Å; L371-M390 HydrophobicContact CD2-CE 3.6Å; L371-L616 HydrophobicContact CB-CD1 4.11Å; L371-L616 HydrophobicContact CD1-CD1 3.66Å; L371-I619 HydrophobicContact CD1-CG2 4.49Å
372	T	97.7	Very high	96.9	Very high	6 Å²	6	32.5 Å²	32.5	4%	0.037	17%	0.166	C	C	.	.	H	α-helix	trans	-64.2	-33.9	179.8	-60	0	0	0	0	112.7	H368 D369 A379 R383 V595	H368-T372 PolarHBondContact CE1-OG1 2.63Å; H368-T372 VanDerWaalsContact CE1-OG1 3.3Å; H368-T372 WeakPolarHBondContact O-CB 3.4Å; H368-T372 PolarHBondContact O-N 2.86Å; H368-T372 PolarHBondContact O-OG1 2.81Å; D369-T372 PolarHBondContact O-N 3.2Å; T372-A379 WeakPolarHBondContact OG1-CB 3.08Å; T372-R383 PolarHBondContact OG1-NH1 3.27Å; T372-V595 HydrophobicContact CG2-CB 4.2Å; T372-V595 HydrophobicContact CG2-CG2 3.87Å
373	Y	96.8	Very high	97	Very high	70 Å²	70	32.6 Å²	32.6	28%	0.275	16%	0.162	S	C	.	.	H	α-helix	trans	-72.1	-33.7	172.9	180	-97	0	0	0	113	D369 L371 V595 L598 K662 E666	D369-Y373 WeakPolarHBondContact O-CB 3.24Å; D369-Y373 PolarHBondContact O-N 2.94Å; L371-Y373 VanDerWaalsContact C-N 3.3Å; L371-Y373 PolarHBondContact O-N 3.01Å; Y373-V595 HydrophobicContact CD2-CG1 4.43Å; Y373-V595 WeakPolarHBondContact CD2-O 3.28Å; Y373-L598 HydrophobicContact CD1-CD1 3.64Å; Y373-L598 HydrophobicContact CD1-CG 4.04Å; Y373-L598 HydrophobicContact CD2-CG 4.2Å; Y373-L598 HydrophobicContact CE1-CD1 4.01Å; Y373-L598 HydrophobicContact CE1-CG 4.48Å; Y373-L598 HydrophobicContact CG-CD1 4.02Å; Y373-L598 HydrophobicContact CG-CD2 4.08Å; Y373-L598 HydrophobicContact CG-CG 3.91Å; Y373-K662 PolarHBondContact OH-NZ 3.11Å; Y373-E666 PolarHBondContact OH-OE1 2.81Å; Y373-E666 PolarHBondContact OH-OE2 3.26Å
374	T	97	Very high	96.9	Very high	54 Å²	54	36 Å²	36	33%	0.331	19%	0.192	S	C	.	.	H	α-helix	trans	-95	-39.4	-172.1	-49.6	0	0	0	0	114	L370 L371 L616 L620 L659	L370-T374 WeakPolarHBondContact O-CB 3.33Å; L370-T374 PolarHBondContact O-N 2.88Å; L370-T374 PolarHBondContact O-OG1 2.99Å; L371-T374 PolarHBondContact O-N 3.42Å; L371-T374 VanDerWaalsContact O-N 3.14Å; T374-L616 HydrophobicContact CG2-CD2 3.99Å; T374-L616 WeakPolarHBondContact OG1-CD2 3.21Å; T374-L620 HydrophobicContact CG2-CD1 4.25Å; T374-L659 HydrophobicContact CG2-CD2 4.25Å
375	D	97.1	Very high	96.8	Very high	30 Å²	30	38.6 Å²	38.6	16%	0.16	20%	0.204	C	C	.	.			trans	-147.4	86.1	-175.8	-164.7	-47.9	0	0	0	109.8	L371 E377 L378 A379 L620 K623	L371-D375 HydrophobicContact CD1-CB 4.18Å; L371-D375 CarbonylContact O-C 3.55Å; L371-D375 PolarHBondContact O-N 2.92Å; D375-E377 PolarHBondContact O-N 3.12Å; D375-L378 HydrophobicContact CB-CB 4.16Å; D375-L378 PolarHBondContact O-N 2.88Å; D375-L378 WeakPolarHBondContact OD1-CB 3.21Å; D375-L378 PolarHBondContact OD1-N 2.94Å; D375-A379 WeakPolarHBondContact O-CB 3.45Å; D375-A379 PolarHBondContact O-N 3.37Å; D375-L620 HydrophobicContact CB-CD2 4.18Å; D375-K623 IonicContact OD1-NZ 3Å; D375-K623 PolarHBondContact OD1-NZ 2.79Å; D375-K623 VanDerWaalsContact OD2-CD 3.27Å; D375-K623 WeakPolarHBondContact OD2-CD 3.4Å; D375-K623 WeakPolarHBondContact OD2-CE 3.45Å; D375-K623 IonicContact OD2-NZ 3.15Å; D375-K623 PolarHBondContact OD2-NZ 3.13Å
376	S	95.9	Very high	96.5	Very high	82 Å²	82	38.6 Å²	38.6	57%	0.573	21%	0.206	S	C	*	.	H	α-helix	trans	-66	-25.2	-175.4	56.6	0	0	0	0	113.6	Q380	S376-Q380 VanDerWaalsContact O-CB 3.31Å; S376-Q380 WeakPolarHBondContact O-CB 3.33Å; S376-Q380 PolarHBondContact O-N 3.42Å
377	E	97.4	Very high	96.4	Very high	111 Å²	111	37.7 Å²	37.7	52%	0.519	20%	0.201	S	C	.	.	H	α-helix	trans	-69.1	-50.9	173.9	176.9	-175.5	-138.2	0	0	110.9	D375 A379 Q380 F381 K623 M627	D375-E377 PolarHBondContact O-N 3.12Å; E377-A379 VanDerWaalsContact C-N 3.3Å; E377-A379 PolarHBondContact O-N 3.3Å; E377-Q380 PolarHBondContact O-N 2.88Å; E377-F381 PolarHBondContact O-N 3.19Å; E377-K623 WeakPolarHBondContact OE2-CE 3.25Å; E377-K623 IonicContact OE2-NZ 2.82Å; E377-K623 PolarHBondContact OE2-NZ 3.01Å; E377-M627 HydrophobicContact CG-CE 3.82Å
378	L	97.6	Very high	96.2	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-66.1	-35.7	176.5	-171.9	58.2	0	0	0	111.1	L371 D375 F381 F382 I619 L620 K623 I626 M627	L371-L378 HydrophobicContact CD1-CB 4.18Å; L371-L378 HydrophobicContact CD1-CD2 3.96Å; L371-L378 HydrophobicContact CD1-CG 4.13Å; L371-L378 HydrophobicContact CD2-CG 4.38Å; D375-L378 HydrophobicContact CB-CB 4.16Å; D375-L378 PolarHBondContact O-N 2.88Å; D375-L378 WeakPolarHBondContact OD1-CB 3.21Å; D375-L378 PolarHBondContact OD1-N 2.94Å; L378-F381 WeakPolarHBondContact O-CB 3.36Å; L378-F381 PolarHBondContact O-N 3.29Å; L378-F382 HydrophobicContact CD1-CD1 3.98Å; L378-F382 HydrophobicContact CD1-CE1 3.63Å; L378-F382 HydrophobicContact CD2-CE1 4.4Å; L378-F382 HydrophobicContact CG-CD1 4.08Å; L378-F382 HydrophobicContact CG-CE1 3.78Å; L378-F382 WeakPolarHBondContact O-CD1 3.49Å; L378-F382 PolarHBondContact O-N 3.49Å; L378-I619 HydrophobicContact CD2-CG2 3.78Å; L378-L620 HydrophobicContact CD2-CD2 4.09Å; L378-K623 HydrophobicContact CB-CD 4.4Å; L378-K623 HydrophobicContact CD1-CG 4.19Å; L378-K623 HydrophobicContact CD2-CB 3.99Å; L378-K623 HydrophobicContact CD2-CD 4.25Å; L378-K623 HydrophobicContact CD2-CG 3.93Å; L378-K623 HydrophobicContact CG-CG 4.48Å; L378-I626 HydrophobicContact CD1-CG2 4.25Å; L378-M627 HydrophobicContact CD1-CG 3.7Å; L378-M627 HydrophobicContact CD1-SD 3.91Å
379	A	97.4	Very high	95.9	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62.9	-40.2	171.8	0	0	0	0	0	112.7	L371 T372 D375 E377 F382 R383	L371-A379 HydrophobicContact CD2-CB 4.37Å; L371-A379 HydrophobicContact CG-CB 4.04Å; T372-A379 WeakPolarHBondContact OG1-CB 3.08Å; D375-A379 WeakPolarHBondContact O-CB 3.45Å; D375-A379 PolarHBondContact O-N 3.37Å; E377-A379 VanDerWaalsContact C-N 3.3Å; E377-A379 PolarHBondContact O-N 3.3Å; A379-F382 PolarHBondContact O-N 2.77Å; A379-R383 WeakPolarHBondContact O-CG 3.43Å; A379-R383 PolarHBondContact O-N 2.67Å
380	Q	96.8	Very high	95.8	Very high	137 Å²	137	39 Å²	39	64%	0.64	21%	0.209	S	C	*	.	H	α-helix	trans	-65.5	-40.6	173.4	178.9	174.9	-19.5	0	0	111.6	S376 E377 F382 R383 A384	S376-Q380 VanDerWaalsContact O-CB 3.31Å; S376-Q380 WeakPolarHBondContact O-CB 3.33Å; S376-Q380 PolarHBondContact O-N 3.42Å; E377-Q380 PolarHBondContact O-N 2.88Å; Q380-F382 VanDerWaalsContact C-N 3.33Å; Q380-F382 PolarHBondContact O-N 2.89Å; Q380-R383 PolarHBondContact O-N 3.31Å; Q380-A384 WeakPolarHBondContact O-CB 3.44Å; Q380-A384 PolarHBondContact O-N 3.16Å
381	F	97.2	Very high	95.4	Very high	27 Å²	27	41.3 Å²	41.3	12%	0.118	22%	0.218	C	C	.	.	H	α-helix	trans	-58.8	-44.9	172.5	-178.7	-84.2	0	0	0	111.3	E377 L378 R383 A384 H385 I626 M627 I630	E377-F381 PolarHBondContact O-N 3.19Å; L378-F381 WeakPolarHBondContact O-CB 3.36Å; L378-F381 PolarHBondContact O-N 3.29Å; F381-R383 PolarHBondContact O-N 2.96Å; F381-A384 PolarHBondContact O-N 3.13Å; F381-H385 AromaticContact CD1-ND1 3.73Å; F381-H385 AromaticContact CD2-CE1 3.45Å; F381-H385 VanDerWaalsContact CD2-CE1 3.45Å; F381-H385 WeakPolarHBondContact CD2-CE1 3.47Å; F381-H385 AromaticContact CD2-ND1 3.64Å; F381-H385 HydrophobicContact CE1-CB 4.49Å; F381-H385 AromaticContact CE1-ND1 3.62Å; F381-H385 AromaticContact CE2-CE1 3.15Å; F381-H385 WeakPolarHBondContact CE2-CE1 3.12Å; F381-H385 AromaticContact CE2-ND1 3.54Å; F381-H385 AromaticContact CE2-NE2 3.82Å; F381-H385 AromaticContact CG-ND1 3.73Å; F381-H385 AromaticContact CZ-CE1 3.48Å; F381-H385 VanDerWaalsContact CZ-CE1 3.48Å; F381-H385 WeakPolarHBondContact CZ-CE1 3.25Å; F381-H385 AromaticContact CZ-CG 3.98Å; F381-H385 AromaticContact CZ-ND1 3.52Å; F381-H385 AromaticContact CZ-NE2 3.9Å; F381-H385 PolarHBondContact O-N 2.95Å; F381-H385 PolarHBondContact O-ND1 3.09Å; F381-I626 HydrophobicContact CD1-CG2 4.32Å; F381-I626 HydrophobicContact CE1-CG2 3.96Å; F381-I626 WeakPolarHBondContact CZ-O 3.21Å; F381-M627 HydrophobicContact CB-CG 4.4Å; F381-M627 HydrophobicContact CD1-CG 4.37Å; F381-M627 HydrophobicContact CD2-CB 4.24Å; F381-M627 HydrophobicContact CD2-CG 3.93Å; F381-M627 HydrophobicContact CE2-CB 4.19Å; F381-M627 HydrophobicContact CE2-CG 4.31Å; F381-M627 WeakPolarHBondContact CE2-O 3.41Å; F381-M627 HydrophobicContact CG-CG 3.98Å; F381-I630 HydrophobicContact CE1-CB 4.28Å; F381-I630 HydrophobicContact CE1-CG2 4.5Å; F381-I630 HydrophobicContact CZ-CB 4.28Å
382	F	96.8	Very high	95.1	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.8	-40.8	178.2	-86.6	47.5	0	0	0	112.2	L371 L378 A379 Q380 N386 L387 A388 M390 F392 I619 I626 I636	L371-F382 HydrophobicContact CD2-CD1 4.15Å; L371-F382 HydrophobicContact CD2-CD2 3.81Å; L371-F382 HydrophobicContact CD2-CE1 4.29Å; L371-F382 HydrophobicContact CD2-CE2 3.94Å; L371-F382 HydrophobicContact CD2-CG 3.92Å; L371-F382 HydrophobicContact CD2-CZ 4.2Å; L378-F382 HydrophobicContact CD1-CD1 3.98Å; L378-F382 HydrophobicContact CD1-CE1 3.63Å; L378-F382 HydrophobicContact CD2-CE1 4.4Å; L378-F382 HydrophobicContact CG-CD1 4.08Å; L378-F382 HydrophobicContact CG-CE1 3.78Å; L378-F382 WeakPolarHBondContact O-CD1 3.49Å; L378-F382 PolarHBondContact O-N 3.49Å; A379-F382 PolarHBondContact O-N 2.77Å; Q380-F382 VanDerWaalsContact C-N 3.33Å; Q380-F382 PolarHBondContact O-N 2.89Å; F382-N386 PolarHBondContact O-N 3.04Å; F382-L387 HydrophobicContact CB-CB 4.03Å; F382-L387 HydrophobicContact CD1-CD1 4.35Å; F382-L387 HydrophobicContact CD2-CB 3.79Å; F382-L387 HydrophobicContact CE2-CB 4.45Å; F382-L387 HydrophobicContact CG-CB 3.92Å; F382-L387 HydrophobicContact CG-CD1 4.38Å; F382-L387 PolarHBondContact O-N 3.41Å; F382-A388 PolarHBondContact O-N 3.09Å; F382-M390 HydrophobicContact CD2-CE 3.56Å; F382-M390 HydrophobicContact CD2-SD 3.77Å; F382-M390 HydrophobicContact CE2-CE 3.61Å; F382-M390 HydrophobicContact CE2-SD 3.6Å; F382-F392 HydrophobicContact CD2-CE1 4.38Å; F382-F392 AromaticContact CE2-CE1 3.74Å; F382-F392 HydrophobicContact CE2-CE1 3.74Å; F382-F392 AromaticContact CE2-CZ 3.66Å; F382-F392 HydrophobicContact CE2-CZ 3.66Å; F382-F392 HydrophobicContact CZ-CZ 4.13Å; F382-I619 HydrophobicContact CE1-CG2 4.44Å; F382-I619 HydrophobicContact CE2-CD1 4.35Å; F382-I619 HydrophobicContact CZ-CG2 3.78Å; F382-I626 HydrophobicContact CE1-CG2 3.92Å; F382-I636 HydrophobicContact CZ-CD1 4.23Å
383	R	94.9	Very high	95	Very high	59 Å²	59	42 Å²	42	22%	0.223	22%	0.221	C	C	.	.	H	α-helix	trans	-63.2	-44.6	173.5	-73.3	-177.5	-74.8	-93.7	12.2	111.8	H368 T372 A379 Q380 F381 H385 N386 A388 I591 K592 T593	H368-R383 PolarHBondContact CE1-NH1 3.34Å; H368-R383 PolarHBondContact NE2-NH1 3.11Å; T372-R383 PolarHBondContact OG1-NH1 3.27Å; A379-R383 WeakPolarHBondContact O-CG 3.43Å; A379-R383 PolarHBondContact O-N 2.67Å; Q380-R383 PolarHBondContact O-N 3.31Å; F381-R383 PolarHBondContact O-N 2.96Å; R383-H385 VanDerWaalsContact C-N 3.32Å; R383-H385 PolarHBondContact O-N 3.09Å; R383-N386 PolarHBondContact O-N 3.42Å; R383-A388 HydrophobicContact CB-CB 4.37Å; R383-A388 HydrophobicContact CG-CB 3.62Å; R383-I591 HydrophobicContact CG-CG2 3.91Å; R383-K592 PolarHBondContact NH1-O 2.97Å; R383-T593 PolarHBondContact NH2-O 3.07Å; R383-T593 VanDerWaalsContact NH2-O 3.14Å
384	A	93.7	Very high	94.7	Very high	80 Å²	80	40.3 Å²	40.3	66%	0.661	22%	0.215	S	C	*	.	H	α-helix	trans	-65.7	-29	-179.8	0	0	0	0	0	114.2	Q380 F381	Q380-A384 WeakPolarHBondContact O-CB 3.44Å; Q380-A384 PolarHBondContact O-N 3.16Å; F381-A384 PolarHBondContact O-N 3.13Å
385	H	92.5	Very high	94.4	Very high	54 Å²	54	40.7 Å²	40.7	25%	0.25	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	18.5	-179.1	-60.4	83.9	0	0	0	113.6	F381 R383 L387	F381-H385 AromaticContact CD1-ND1 3.73Å; F381-H385 AromaticContact CD2-CE1 3.45Å; F381-H385 VanDerWaalsContact CD2-CE1 3.45Å; F381-H385 WeakPolarHBondContact CD2-CE1 3.47Å; F381-H385 AromaticContact CD2-ND1 3.64Å; F381-H385 HydrophobicContact CE1-CB 4.49Å; F381-H385 AromaticContact CE1-ND1 3.62Å; F381-H385 AromaticContact CE2-CE1 3.15Å; F381-H385 WeakPolarHBondContact CE2-CE1 3.12Å; F381-H385 AromaticContact CE2-ND1 3.54Å; F381-H385 AromaticContact CE2-NE2 3.82Å; F381-H385 AromaticContact CG-ND1 3.73Å; F381-H385 AromaticContact CZ-CE1 3.48Å; F381-H385 VanDerWaalsContact CZ-CE1 3.48Å; F381-H385 WeakPolarHBondContact CZ-CE1 3.25Å; F381-H385 AromaticContact CZ-CG 3.98Å; F381-H385 AromaticContact CZ-ND1 3.52Å; F381-H385 AromaticContact CZ-NE2 3.9Å; F381-H385 PolarHBondContact O-N 2.95Å; F381-H385 PolarHBondContact O-ND1 3.09Å; R383-H385 VanDerWaalsContact C-N 3.32Å; R383-H385 PolarHBondContact O-N 3.09Å; H385-L387 VanDerWaalsContact C-N 3.25Å; H385-L387 HydrophobicContact CB-CD1 4.38Å; H385-L387 HydrophobicContact CB-CG 4.24Å; H385-L387 PolarHBondContact O-N 2.88Å
386	N	90.1	Very high	94.3	Very high	67 Å²	67	39.3 Å²	39.3	36%	0.358	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	31.7	179	-158.8	16.7	0	0	0	114.9	F382 R383 N389 P633	F382-N386 PolarHBondContact O-N 3.04Å; R383-N386 PolarHBondContact O-N 3.42Å; N386-N389 PolarHBondContact O-ND2 3.29Å; N386-P633 HydrophobicContact CB-CG 4.43Å
387	L	93.8	Very high	94.2	Very high	3 Å²	3	35.5 Å²	35.5	2%	0.016	18%	0.176	C	C	.	.			trans	-98.1	-9.5	177.1	-56.2	179.9	0	0	0	113.4	F382 H385 N389 M390 I630 P633 I636	F382-L387 HydrophobicContact CB-CB 4.03Å; F382-L387 HydrophobicContact CD1-CD1 4.35Å; F382-L387 HydrophobicContact CD2-CB 3.79Å; F382-L387 HydrophobicContact CE2-CB 4.45Å; F382-L387 HydrophobicContact CG-CB 3.92Å; F382-L387 HydrophobicContact CG-CD1 4.38Å; F382-L387 PolarHBondContact O-N 3.41Å; H385-L387 VanDerWaalsContact C-N 3.25Å; H385-L387 HydrophobicContact CB-CD1 4.38Å; H385-L387 HydrophobicContact CB-CG 4.24Å; H385-L387 PolarHBondContact O-N 2.88Å; L387-N389 PolarHBondContact O-N 2.91Å; L387-N389 VanDerWaalsContact O-N 3.17Å; L387-M390 WeakPolarHBondContact O-CA 3.43Å; L387-M390 PolarHBondContact O-N 3.27Å; L387-I630 HydrophobicContact CD1-CG2 4.12Å; L387-P633 HydrophobicContact CD2-CB 3.95Å; L387-P633 HydrophobicContact CD2-CG 4.11Å; L387-I636 HydrophobicContact CD1-CD1 3.98Å; L387-I636 HydrophobicContact CD1-CG2 4.49Å; L387-I636 HydrophobicContact CD2-CG2 3.76Å
388	A	94.4	Very high	93.9	Very high	6 Å²	6	30.6 Å²	30.6	5%	0.05	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-13.6	-172.8	0	0	0	0	0	114.8	H368 F382 R383 M390 I591	H368-A388 PolarHBondContact CD2-O 3.28Å; F382-A388 PolarHBondContact O-N 3.09Å; R383-A388 HydrophobicContact CB-CB 4.37Å; R383-A388 HydrophobicContact CG-CB 3.62Å; A388-M390 PolarHBondContact O-N 2.95Å; A388-I591 HydrophobicContact CB-CD1 4.03Å; A388-I591 HydrophobicContact CB-CG2 3.75Å
389	N	92.1	Very high	93.8	Very high	34 Å²	34	31.2 Å²	31.2	18%	0.182	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-14.4	165.6	55.7	57.1	0	0	0	113.5	N386 L387 Y391	N386-N389 PolarHBondContact O-ND2 3.29Å; L387-N389 PolarHBondContact O-N 2.91Å; L387-N389 VanDerWaalsContact O-N 3.17Å; N389-Y391 HydrophobicContact CB-CD1 3.89Å; N389-Y391 HydrophobicContact CB-CD2 4.16Å; N389-Y391 HydrophobicContact CB-CE1 3.89Å; N389-Y391 HydrophobicContact CB-CE2 4.16Å; N389-Y391 HydrophobicContact CB-CG 4.05Å; N389-Y391 VanDerWaalsContact O-CD1 3.23Å; N389-Y391 WeakPolarHBondContact O-CD1 3.3Å; N389-Y391 PolarHBondContact O-N 3.48Å; N389-Y391 VanDerWaalsContact O-N 3.08Å; N389-Y391 WeakPolarHBondContact OD1-CB 3.46Å; N389-Y391 PolarHBondContact OD1-N 3.35Å
390	M	95.3	Very high	93.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.158	C	C	.	.			trans	55.8	17	-178.2	-65	-68.4	-168.8	0	0	115.5	M364 L367 H368 L371 F382 L387 A388 F392 T393 I619	M364-M390 HydrophobicContact CB-CB 3.91Å; M364-M390 HydrophobicContact CG-CB 4.32Å; M364-M390 WeakPolarHBondContact O-CG 3.31Å; L367-M390 HydrophobicContact CD2-SD 4.44Å; L367-M390 HydrophobicContact CG-CE 4.35Å; L367-M390 HydrophobicContact CG-SD 4.47Å; H368-M390 HydrophobicContact CB-CE 4.03Å; H368-M390 HydrophobicContact CB-CG 3.9Å; L371-M390 HydrophobicContact CB-CE 4.13Å; L371-M390 HydrophobicContact CD2-CE 3.6Å; F382-M390 HydrophobicContact CD2-CE 3.56Å; F382-M390 HydrophobicContact CD2-SD 3.77Å; F382-M390 HydrophobicContact CE2-CE 3.61Å; F382-M390 HydrophobicContact CE2-SD 3.6Å; L387-M390 WeakPolarHBondContact O-CA 3.43Å; L387-M390 PolarHBondContact O-N 3.27Å; A388-M390 PolarHBondContact O-N 2.95Å; M390-F392 PolarHBondContact O-N 2.96Å; M390-F392 HydrophobicContact SD-CE1 3.76Å; M390-F392 HydrophobicContact SD-CZ 4.01Å; M390-T393 HydrophobicContact CB-CG2 4.4Å; M390-T393 WeakPolarHBondContact O-CB 3.33Å; M390-T393 PolarHBondContact O-N 3.42Å; M390-T393 PolarHBondContact O-OG1 3.49Å; M390-T393 HydrophobicContact SD-CG2 4.38Å; M390-I619 HydrophobicContact CE-CD1 4.27Å; M390-I619 HydrophobicContact SD-CD1 4.24Å
391	Y	91.2	Very high	93.6	Very high	48 Å²	48	25 Å²	25	19%	0.188	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-58.5	-28.4	-174	-68.4	-12.3	0	0	0	114.1	M364 N389 T393 Q394 F582 I589	M364-Y391 HydrophobicContact CE-CD1 3.62Å; M364-Y391 HydrophobicContact CE-CE1 3.97Å; M364-Y391 HydrophobicContact SD-CD1 4.07Å; N389-Y391 HydrophobicContact CB-CD1 3.89Å; N389-Y391 HydrophobicContact CB-CD2 4.16Å; N389-Y391 HydrophobicContact CB-CE1 3.89Å; N389-Y391 HydrophobicContact CB-CE2 4.16Å; N389-Y391 HydrophobicContact CB-CG 4.05Å; N389-Y391 VanDerWaalsContact O-CD1 3.23Å; N389-Y391 WeakPolarHBondContact O-CD1 3.3Å; N389-Y391 PolarHBondContact O-N 3.48Å; N389-Y391 VanDerWaalsContact O-N 3.08Å; N389-Y391 WeakPolarHBondContact OD1-CB 3.46Å; N389-Y391 PolarHBondContact OD1-N 3.35Å; Y391-T393 PolarHBondContact O-N 2.98Å; Y391-T393 VanDerWaalsContact O-N 3.11Å; Y391-Q394 WeakPolarHBondContact O-CB 3.5Å; Y391-Q394 PolarHBondContact O-N 3.27Å; Y391-Q394 VanDerWaalsContact O-N 3.1Å; Y391-F582 HydrophobicContact CD1-CZ 4.29Å; Y391-F582 HydrophobicContact CD2-CE2 4.19Å; Y391-F582 HydrophobicContact CE1-CZ 4.32Å; Y391-F582 HydrophobicContact CE2-CD2 4.29Å; Y391-F582 HydrophobicContact CE2-CE2 4.23Å; Y391-F582 HydrophobicContact CG-CE2 4.35Å; Y391-F582 HydrophobicContact CG-CZ 4.46Å; Y391-I589 WeakPolarHBondContact OH-CD1 3.29Å
392	F	91.9	Very high	93.5	Very high	21 Å²	21	24.3 Å²	24.3	9%	0.092	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-59.8	-21.1	173.4	74	-88.6	0	0	0	113.5	F382 M390 W396 I619 I636 I637 Y640	F382-F392 HydrophobicContact CD2-CE1 4.38Å; F382-F392 AromaticContact CE2-CE1 3.74Å; F382-F392 HydrophobicContact CE2-CE1 3.74Å; F382-F392 AromaticContact CE2-CZ 3.66Å; F382-F392 HydrophobicContact CE2-CZ 3.66Å; F382-F392 HydrophobicContact CZ-CZ 4.13Å; M390-F392 PolarHBondContact O-N 2.96Å; M390-F392 HydrophobicContact SD-CE1 3.76Å; M390-F392 HydrophobicContact SD-CZ 4.01Å; F392-W396 AromaticContact CE2-CH2 3.9Å; F392-W396 HydrophobicContact CE2-CH2 3.9Å; F392-W396 HydrophobicContact CE2-CZ2 4.23Å; F392-W396 HydrophobicContact CE2-CZ3 4.5Å; F392-I619 HydrophobicContact CZ-CD1 4.2Å; F392-I619 HydrophobicContact CZ-CG1 4.49Å; F392-I636 HydrophobicContact CB-CG2 4.03Å; F392-I636 HydrophobicContact CD1-CG2 4.05Å; F392-I636 HydrophobicContact CD2-CD1 4.3Å; F392-I636 HydrophobicContact CD2-CG1 4.17Å; F392-I636 HydrophobicContact CD2-CG2 4.26Å; F392-I636 HydrophobicContact CE1-CD1 4.1Å; F392-I636 HydrophobicContact CE2-CD1 3.84Å; F392-I636 HydrophobicContact CE2-CG1 4.12Å; F392-I636 HydrophobicContact CG-CG2 3.86Å; F392-I636 HydrophobicContact CZ-CD1 3.74Å; F392-I636 HydrophobicContact CZ-CG1 4.48Å; F392-I637 HydrophobicContact CB-CD1 4.1Å; F392-I637 HydrophobicContact CB-CG1 3.45Å; F392-I637 VanDerWaalsContact CB-CG1 3.45Å; F392-Y640 HydrophobicContact CD2-CD2 4.08Å; F392-Y640 HydrophobicContact CD2-CE2 4.26Å; F392-Y640 HydrophobicContact CE2-CD2 4.07Å; F392-Y640 AromaticContact CE2-CE2 3.78Å; F392-Y640 HydrophobicContact CE2-CE2 3.78Å
393	T	95.7	Very high	93.3	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-88.9	-4.1	179	72.7	0	0	0	0	113.9	L367 M390 Y391 R395 W396 F397	L367-T393 HydrophobicContact CD2-CG2 3.84Å; M390-T393 HydrophobicContact CB-CG2 4.4Å; M390-T393 WeakPolarHBondContact O-CB 3.33Å; M390-T393 PolarHBondContact O-N 3.42Å; M390-T393 PolarHBondContact O-OG1 3.49Å; M390-T393 HydrophobicContact SD-CG2 4.38Å; Y391-T393 PolarHBondContact O-N 2.98Å; Y391-T393 VanDerWaalsContact O-N 3.11Å; T393-R395 PolarHBondContact O-N 2.62Å; T393-W396 HydrophobicContact CG2-CD2 4.11Å; T393-W396 HydrophobicContact CG2-CE3 3.53Å; T393-W396 HydrophobicContact CG2-CH2 4Å; T393-W396 HydrophobicContact CG2-CZ3 3.48Å; T393-W396 VanDerWaalsContact CG2-CZ3 3.48Å; T393-W396 WeakPolarHBondContact O-CA 3.22Å; T393-W396 WeakPolarHBondContact O-CB 3.47Å; T393-W396 PolarHBondContact O-N 2.84Å; T393-F397 PolarHBondContact O-N 3.13Å; T393-F397 WeakPolarHBondContact OG1-CE2 3.38Å
394	Q	90.7	Very high	93.3	Very high	33 Å²	33	26.9 Å²	26.9	15%	0.154	14%	0.135	C	C	.	.	H	α-helix	trans	-51.9	-39.2	-177.1	-173.3	-176.3	12.3	0	0	112.6	L360 M364 Y391 W396 F397 V398	L360-Q394 HydrophobicContact CD1-CG 4.31Å; M364-Q394 HydrophobicContact SD-CB 4.01Å; Y391-Q394 WeakPolarHBondContact O-CB 3.5Å; Y391-Q394 PolarHBondContact O-N 3.27Å; Y391-Q394 VanDerWaalsContact O-N 3.1Å; Q394-W396 VanDerWaalsContact C-N 3.27Å; Q394-W396 PolarHBondContact O-N 3.08Å; Q394-F397 PolarHBondContact O-N 2.97Å; Q394-V398 HydrophobicContact CG-CG2 4.34Å; Q394-V398 WeakPolarHBondContact O-CG2 3.45Å; Q394-V398 PolarHBondContact O-N 3.45Å; Q394-V398 VanDerWaalsContact O-N 3.11Å
395	R	89.9	Confident	93.4	Very high	63 Å²	63	23.6 Å²	23.6	24%	0.238	11%	0.106	C	C	.	.	H	α-helix	trans	-63.1	-31.7	177.9	85	-177.4	-164.1	174.6	-0.4	113	T393 L399 E404 Y640 S644	T393-R395 PolarHBondContact O-N 2.62Å; R395-L399 WeakPolarHBondContact O-CB 3.45Å; R395-L399 WeakPolarHBondContact O-CG 3.48Å; R395-L399 PolarHBondContact O-N 3.17Å; R395-E404 IonicContact CZ-OE1 3.04Å; R395-E404 VanDerWaalsContact CZ-OE1 3.29Å; R395-E404 IonicContact CZ-OE2 3.53Å; R395-E404 IonicContact NE-OE1 2.61Å; R395-E404 PolarHBondContact NE-OE1 3.29Å; R395-E404 IonicContact NE-OE2 2.62Å; R395-E404 PolarHBondContact NE-OE2 2.93Å; R395-E404 VanDerWaalsContact NH2-CD 3.28Å; R395-E404 IonicContact NH2-OE1 2.96Å; R395-E404 PolarHBondContact NH2-OE1 2.82Å; R395-E404 IonicContact NH2-OE2 3.42Å; R395-E404 PolarHBondContact NH2-OE2 3.41Å; R395-Y640 PolarHBondContact NH2-O 2.95Å; R395-Y640 VanDerWaalsContact NH2-O 3.1Å; R395-S644 PolarHBondContact NH2-OG 2.99Å
396	W	95.8	Very high	93.5	Very high	1 Å²	1	24.5 Å²	24.5	0%	0.004	11%	0.112	C	C	.	.	H	α-helix	trans	-66.8	-42.9	178.7	-56.8	-11.8	0	0	0	111	F392 T393 Q394 E400 L401 E404 S615 L618 I619 Y640	F392-W396 AromaticContact CE2-CH2 3.9Å; F392-W396 HydrophobicContact CE2-CH2 3.9Å; F392-W396 HydrophobicContact CE2-CZ2 4.23Å; F392-W396 HydrophobicContact CE2-CZ3 4.5Å; T393-W396 HydrophobicContact CG2-CD2 4.11Å; T393-W396 HydrophobicContact CG2-CE3 3.53Å; T393-W396 HydrophobicContact CG2-CH2 4Å; T393-W396 HydrophobicContact CG2-CZ3 3.48Å; T393-W396 VanDerWaalsContact CG2-CZ3 3.48Å; T393-W396 WeakPolarHBondContact O-CA 3.22Å; T393-W396 WeakPolarHBondContact O-CB 3.47Å; T393-W396 PolarHBondContact O-N 2.84Å; Q394-W396 VanDerWaalsContact C-N 3.27Å; Q394-W396 PolarHBondContact O-N 3.08Å; W396-E400 CarbonylContact O-C 3.38Å; W396-E400 VanDerWaalsContact O-CA 3.27Å; W396-E400 WeakPolarHBondContact O-CA 3.43Å; W396-E400 PolarHBondContact O-N 3.18Å; W396-L401 HydrophobicContact CB-CD2 3.52Å; W396-L401 HydrophobicContact CB-CG 4.12Å; W396-L401 HydrophobicContact CD2-CD2 3.9Å; W396-L401 HydrophobicContact CE3-CD2 4.33Å; W396-L401 HydrophobicContact CG-CD2 3.54Å; W396-L401 PolarHBondContact O-N 2.79Å; W396-E404 HydrophobicContact CG-CG 4.39Å; W396-E404 PolarHBondContact NE1-OE1 2.61Å; W396-E404 PolarHBondContact NE1-OE2 3.09Å; W396-S615 WeakPolarHBondContact CZ3-O 3.22Å; W396-L618 HydrophobicContact CD2-CD2 4.25Å; W396-L618 HydrophobicContact CE3-CD2 4.48Å; W396-L618 HydrophobicContact CH2-CB 4.47Å; W396-L618 HydrophobicContact CH2-CD2 3.81Å; W396-L618 HydrophobicContact CH2-CG 3.97Å; W396-L618 HydrophobicContact CZ2-CD2 3.53Å; W396-L618 HydrophobicContact CZ2-CG 4.06Å; W396-L618 HydrophobicContact CZ3-CD2 4.28Å; W396-I619 HydrophobicContact CH2-CD1 4.34Å; W396-I619 HydrophobicContact CH2-CG1 3.76Å; W396-I619 HydrophobicContact CZ3-CD1 3.99Å; W396-I619 HydrophobicContact CZ3-CG1 3.82Å; W396-Y640 HydrophobicContact CH2-CD2 4.48Å; W396-Y640 HydrophobicContact CH2-CE1 4.16Å; W396-Y640 HydrophobicContact CH2-CE2 4.1Å; W396-Y640 AromaticContact CH2-CZ 3.94Å; W396-Y640 AromaticContact CZ2-CD1 3.78Å; W396-Y640 HydrophobicContact CZ2-CD1 3.78Å; W396-Y640 AromaticContact CZ2-CD2 3.93Å; W396-Y640 HydrophobicContact CZ2-CD2 3.93Å; W396-Y640 AromaticContact CZ2-CE1 3.86Å; W396-Y640 HydrophobicContact CZ2-CE1 3.86Å; W396-Y640 AromaticContact CZ2-CE2 3.99Å; W396-Y640 HydrophobicContact CZ2-CE2 3.99Å; W396-Y640 AromaticContact CZ2-CG 3.84Å; W396-Y640 HydrophobicContact CZ2-CG 3.84Å; W396-Y640 AromaticContact CZ2-CZ 3.97Å
397	F	93.6	Very high	93.8	Very high	1 Å²	1	22.2 Å²	22.2	0%	0.004	10%	0.099	C	C	.	.	H	α-helix	trans	-71.4	-47.2	179	-69.5	-66.4	0	0	0	112.5	K351 L360 N363 M364 L367 T393 Q394 L611 L612	K351-F397 WeakPolarHBondContact CD-O 3.29Å; K351-F397 WeakPolarHBondContact CE-O 3.48Å; K351-F397 PolarHBondContact NZ-O 3.16Å; L360-F397 HydrophobicContact CD2-CB 3.86Å; N363-F397 HydrophobicContact CB-CD1 3.82Å; N363-F397 HydrophobicContact CB-CD2 4.37Å; N363-F397 HydrophobicContact CB-CE1 3.82Å; N363-F397 HydrophobicContact CB-CE2 4.35Å; N363-F397 HydrophobicContact CB-CG 4.11Å; N363-F397 HydrophobicContact CB-CZ 4.08Å; N363-F397 WeakPolarHBondContact O-CZ 3.33Å; M364-F397 HydrophobicContact CG-CD2 3.89Å; M364-F397 HydrophobicContact CG-CE2 3.79Å; L367-F397 HydrophobicContact CB-CZ 4.11Å; L367-F397 HydrophobicContact CD2-CE2 3.97Å; L367-F397 HydrophobicContact CD2-CZ 3.88Å; T393-F397 PolarHBondContact O-N 3.13Å; T393-F397 WeakPolarHBondContact OG1-CE2 3.38Å; Q394-F397 PolarHBondContact O-N 2.97Å; F397-L611 HydrophobicContact CD1-CD2 3.79Å; F397-L611 HydrophobicContact CD1-CG 4.07Å; F397-L611 HydrophobicContact CE1-CD2 4.35Å; F397-L611 HydrophobicContact CE1-CG 4.18Å; F397-L612 HydrophobicContact CE1-CD2 3.72Å; F397-L612 HydrophobicContact CZ-CD2 3.78Å
398	V	91.4	Very high	93.8	Very high	9 Å²	9	26.5 Å²	26.5	6%	0.055	12%	0.122	C	C	.	.	H	α-helix	trans	-65.5	-40.8	-178.2	177	0	0	0	0	111.8	F352 L360 Q394	F352-V398 HydrophobicContact CD1-CG1 4.2Å; F352-V398 HydrophobicContact CE1-CG1 3.38Å; F352-V398 HydrophobicContact CZ-CG1 3.59Å; L360-V398 HydrophobicContact CD1-CG2 3.65Å; L360-V398 HydrophobicContact CD2-CG2 3.77Å; L360-V398 HydrophobicContact CG-CG2 4.4Å; Q394-V398 HydrophobicContact CG-CG2 4.34Å; Q394-V398 WeakPolarHBondContact O-CG2 3.45Å; Q394-V398 PolarHBondContact O-N 3.45Å; Q394-V398 VanDerWaalsContact O-N 3.11Å
399	L	93.5	Very high	93.8	Very high	12 Å²	12	28 Å²	28	6%	0.063	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.5	12.4	-174.6	-50.1	179.7	0	0	0	113.9	G319 D322 R395 L401 K402 R403	G319-L399 WeakPolarHBondContact O-CD2 3.47Å; D322-L399 HydrophobicContact CB-CD2 4.34Å; R395-L399 WeakPolarHBondContact O-CB 3.45Å; R395-L399 WeakPolarHBondContact O-CG 3.48Å; R395-L399 PolarHBondContact O-N 3.17Å; L399-L401 VanDerWaalsContact C-N 3.28Å; L399-L401 PolarHBondContact O-N 3.47Å; L399-K402 WeakPolarHBondContact O-CB 3.4Å; L399-K402 PolarHBondContact O-N 3.02Å; L399-R403 HydrophobicContact CD1-CG 3.84Å
400	E	95.2	Very high	94	Very high	5 Å²	5	26.5 Å²	26.5	2%	0.023	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.5	48.6	-178.7	-51.3	-135.8	113	0	0	112.7	V348 K351 W396 K402 F414 Q417 W418	V348-E400 HydrophobicContact CG1-CG 4.37Å; K351-E400 IonicContact NZ-OE1 3.17Å; K351-E400 PolarHBondContact NZ-OE1 3.43Å; W396-E400 CarbonylContact O-C 3.38Å; W396-E400 VanDerWaalsContact O-CA 3.27Å; W396-E400 WeakPolarHBondContact O-CA 3.43Å; W396-E400 PolarHBondContact O-N 3.18Å; E400-K402 PolarHBondContact O-N 2.93Å; E400-K402 VanDerWaalsContact O-N 3.09Å; E400-F414 HydrophobicContact CB-CD1 4.33Å; E400-F414 HydrophobicContact CB-CE1 3.96Å; E400-F414 WeakPolarHBondContact O-CE1 3.36Å; E400-Q417 PolarHBondContact OE1-NE2 2.88Å; E400-W418 PolarHBondContact OE2-NE1 2.85Å
401	L	96.5	Very high	94.1	Very high	3 Å²	3	26.7 Å²	26.7	2%	0.016	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	7.2	-176.9	-67.5	160.7	0	0	0	116.8	W396 L399 R403 E404 F405 L611 L614 L618	W396-L401 HydrophobicContact CB-CD2 3.52Å; W396-L401 HydrophobicContact CB-CG 4.12Å; W396-L401 HydrophobicContact CD2-CD2 3.9Å; W396-L401 HydrophobicContact CE3-CD2 4.33Å; W396-L401 HydrophobicContact CG-CD2 3.54Å; W396-L401 PolarHBondContact O-N 2.79Å; L399-L401 VanDerWaalsContact C-N 3.28Å; L399-L401 PolarHBondContact O-N 3.47Å; L401-R403 PolarHBondContact O-N 3.32Å; L401-E404 HydrophobicContact CB-CG 4.23Å; L401-E404 HydrophobicContact CD2-CB 4.43Å; L401-E404 HydrophobicContact CD2-CG 3.54Å; L401-E404 WeakPolarHBondContact O-CB 3.47Å; L401-E404 WeakPolarHBondContact O-CG 3.37Å; L401-E404 PolarHBondContact O-N 3.36Å; L401-F405 HydrophobicContact CB-CD2 4.34Å; L401-F405 HydrophobicContact CB-CE2 4.04Å; L401-L611 HydrophobicContact CD1-CD1 3.82Å; L401-L611 HydrophobicContact CG-CD1 4.11Å; L401-L614 HydrophobicContact CD1-CB 3.46Å; L401-L614 VanDerWaalsContact CD1-CB 3.46Å; L401-L614 HydrophobicContact CD1-CD1 4.1Å; L401-L614 HydrophobicContact CD1-CG 4.38Å; L401-L618 HydrophobicContact CD2-CD2 3.95Å
402	K	95.3	Very high	94.3	Very high	11 Å²	11	26.8 Å²	26.8	5%	0.048	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-35.2	-177.2	-172.7	-93	174	121.2	0	114.9	D282 D322 L399 E400 E404 S410 F414	D282-K402 WeakPolarHBondContact OD1-CE 3.46Å; D282-K402 IonicContact OD1-NZ 2.68Å; D282-K402 PolarHBondContact OD1-NZ 3.43Å; D282-K402 IonicContact OD2-NZ 2.72Å; D282-K402 PolarHBondContact OD2-NZ 2.9Å; D322-K402 HydrophobicContact CB-CD 4.08Å; D322-K402 PolarHBondContact O-NZ 3.45Å; D322-K402 IonicContact OD1-NZ 2.92Å; D322-K402 PolarHBondContact OD1-NZ 3.29Å; L399-K402 WeakPolarHBondContact O-CB 3.4Å; L399-K402 PolarHBondContact O-N 3.02Å; E400-K402 PolarHBondContact O-N 2.93Å; E400-K402 VanDerWaalsContact O-N 3.09Å; K402-E404 VanDerWaalsContact C-N 3.33Å; K402-S410 PolarHBondContact O-OG 3.03Å; K402-F414 HydrophobicContact CB-CE1 4.29Å; K402-F414 HydrophobicContact CB-CZ 3.82Å; K402-F414 HydrophobicContact CG-CZ 3.93Å
403	R	92.7	Very high	94.5	Very high	114 Å²	114	26 Å²	26	43%	0.43	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	1.1	-178	-72.4	-167.3	175.5	-155.3	3.4	114.2	D322 L399 L401 S644	D322-R403 IonicContact OD1-NE 2.83Å; D322-R403 IonicContact OD1-NH2 3.8Å; D322-R403 IonicContact OD2-CZ 3.95Å; D322-R403 IonicContact OD2-NE 3.99Å; D322-R403 PolarHBondContact OD2-NE 2.99Å; D322-R403 IonicContact OD2-NH2 3.32Å; D322-R403 PolarHBondContact OD2-NH2 3.26Å; L399-R403 HydrophobicContact CD1-CG 3.84Å; L401-R403 PolarHBondContact O-N 3.32Å; R403-S644 VanDerWaalsContact O-CB 3.26Å; R403-S644 WeakPolarHBondContact O-CB 3.45Å; R403-S644 PolarHBondContact O-OG 3.27Å
404	E	95.1	Very high	94.6	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-37	176.5	-45.6	-41.4	115.1	0	0	111.2	R395 W396 L401 K402 L618 G645 H647	R395-E404 IonicContact CZ-OE1 3.04Å; R395-E404 VanDerWaalsContact CZ-OE1 3.29Å; R395-E404 IonicContact CZ-OE2 3.53Å; R395-E404 IonicContact NE-OE1 2.61Å; R395-E404 PolarHBondContact NE-OE1 3.29Å; R395-E404 IonicContact NE-OE2 2.62Å; R395-E404 PolarHBondContact NE-OE2 2.93Å; R395-E404 VanDerWaalsContact NH2-CD 3.28Å; R395-E404 IonicContact NH2-OE1 2.96Å; R395-E404 PolarHBondContact NH2-OE1 2.82Å; R395-E404 IonicContact NH2-OE2 3.42Å; R395-E404 PolarHBondContact NH2-OE2 3.41Å; W396-E404 HydrophobicContact CG-CG 4.39Å; W396-E404 PolarHBondContact NE1-OE1 2.61Å; W396-E404 PolarHBondContact NE1-OE2 3.09Å; L401-E404 HydrophobicContact CB-CG 4.23Å; L401-E404 HydrophobicContact CD2-CB 4.43Å; L401-E404 HydrophobicContact CD2-CG 3.54Å; L401-E404 WeakPolarHBondContact O-CB 3.47Å; L401-E404 WeakPolarHBondContact O-CG 3.37Å; L401-E404 PolarHBondContact O-N 3.36Å; K402-E404 VanDerWaalsContact C-N 3.33Å; E404-L618 HydrophobicContact CB-CD2 4.09Å; E404-L618 HydrophobicContact CG-CD2 3.88Å; E404-G645 PolarHBondContact O-N 2.92Å; E404-H647 PolarHBondContact O-CD2 2.9Å; E404-H647 PolarHBondContact O-NE2 2.9Å
405	F	95.8	Very high	94.9	Very high	11 Å²	11	24.7 Å²	24.7	5%	0.048	11%	0.112	C	C	.	.	S	Bend	trans	-101.5	170	-175.9	-59.4	-71.6	0	0	0	112.3	L401 E409 M413 H647 I652	L401-F405 HydrophobicContact CB-CD2 4.34Å; L401-F405 HydrophobicContact CB-CE2 4.04Å; F405-E409 HydrophobicContact CB-CB 3.76Å; F405-E409 HydrophobicContact CG-CB 4.47Å; F405-M413 HydrophobicContact CD1-CE 4.11Å; F405-M413 HydrophobicContact CD2-CE 4.38Å; F405-M413 HydrophobicContact CD2-CG 3.78Å; F405-M413 HydrophobicContact CE1-CE 3.7Å; F405-M413 HydrophobicContact CE2-CE 3.99Å; F405-M413 HydrophobicContact CE2-CG 3.9Å; F405-M413 HydrophobicContact CE2-SD 4.18Å; F405-M413 HydrophobicContact CG-CE 4.44Å; F405-M413 HydrophobicContact CG-CG 4.27Å; F405-M413 HydrophobicContact CZ-CE 3.64Å; F405-M413 HydrophobicContact CZ-SD 4.33Å; F405-H647 HydrophobicContact CD1-CB 4.18Å; F405-H647 HydrophobicContact CE1-CB 3.89Å; F405-I652 HydrophobicContact CE1-CD1 3.94Å; F405-I652 HydrophobicContact CZ-CD1 4.24Å; F405-I652 HydrophobicContact CZ-CG2 4.12Å
406	N	94.2	Very high	95.2	Very high	72 Å²	72	21.7 Å²	21.7	39%	0.385	10%	0.1	S	C	.	.			trans	-73.7	174.9	167.2	76.2	50.6	0	0	0	110.9	D408 E409 S410	N406-D408 PolarHBondContact OD1-N 3.02Å; N406-E409 PolarHBondContact N-OE2 3.02Å; N406-E409 WeakPolarHBondContact ND2-CG 3.47Å; N406-E409 PolarHBondContact ND2-OE2 3.38Å; N406-E409 VanDerWaalsContact ND2-OE2 3.08Å; N406-E409 WeakPolarHBondContact OD1-CG 3.47Å; N406-E409 PolarHBondContact OD1-N 3.06Å; N406-E409 VanDerWaalsContact OD1-N 3.08Å; N406-S410 WeakPolarHBondContact O-CB 3.48Å; N406-S410 PolarHBondContact O-N 2.65Å; N406-S410 PolarHBondContact O-OG 3.31Å
407	F	94.8	Very high	95.3	Very high	19 Å²	19	21.7 Å²	21.7	8%	0.083	10%	0.1	C	C	.	.	H	α-helix	trans	-61.4	-55	-171.7	-168	-89.5	0	0	0	112.9	D282 E285 P326 V329 E409 S410 L411	D282-F407 HydrophobicContact CB-CE2 4.41Å; E285-F407 HydrophobicContact CG-CB 4.23Å; E285-F407 HydrophobicContact CG-CD2 3.85Å; E285-F407 HydrophobicContact CG-CE2 4.42Å; E285-F407 HydrophobicContact CG-CG 3.99Å; P326-F407 HydrophobicContact CB-CZ 4.41Å; P326-F407 HydrophobicContact CG-CE2 4.14Å; P326-F407 HydrophobicContact CG-CZ 4.39Å; V329-F407 HydrophobicContact CB-CE1 4.18Å; V329-F407 HydrophobicContact CB-CZ 3.9Å; V329-F407 HydrophobicContact CG1-CE1 3.96Å; V329-F407 HydrophobicContact CG1-CZ 4.18Å; V329-F407 HydrophobicContact CG2-CE1 4.19Å; V329-F407 HydrophobicContact CG2-CE2 4.49Å; V329-F407 HydrophobicContact CG2-CZ 3.6Å; F407-E409 PolarHBondContact O-N 3.38Å; F407-S410 WeakPolarHBondContact O-CB 3.26Å; F407-S410 PolarHBondContact O-N 3.14Å; F407-S410 VanDerWaalsContact O-N 3.15Å; F407-L411 HydrophobicContact CD1-CD1 4.33Å; F407-L411 HydrophobicContact CD1-CD2 4.46Å; F407-L411 HydrophobicContact CD1-CG 4.42Å; F407-L411 HydrophobicContact CE1-CD1 4.07Å; F407-L411 HydrophobicContact CE1-CD2 3.95Å; F407-L411 HydrophobicContact CE1-CG 4.28Å; F407-L411 HydrophobicContact CZ-CD2 4.3Å; F407-L411 WeakPolarHBondContact O-CG 3.36Å; F407-L411 PolarHBondContact O-N 3.31Å
408	D	93.8	Very high	95.4	Very high	93 Å²	93	21.8 Å²	21.8	50%	0.497	10%	0.101	S	C	.	.	H	α-helix	trans	-64.9	-36.4	179.9	-95.8	-63.3	0	0	0	113.2	R216 N406 S410 L411 R412	R216-D408 IonicContact NH1-OD1 2.67Å; R216-D408 PolarHBondContact NH1-OD1 3Å; N406-D408 PolarHBondContact OD1-N 3.02Å; D408-S410 VanDerWaalsContact C-N 3.33Å; D408-L411 WeakPolarHBondContact O-CB 3.28Å; D408-L411 PolarHBondContact O-N 3.5Å; D408-R412 PolarHBondContact O-N 2.93Å
409	E	95.1	Very high	95.7	Very high	38 Å²	38	21.3 Å²	21.3	18%	0.178	10%	0.098	C	C	.	.	H	α-helix	trans	-61	-42.3	172.2	-72.6	179.1	147.4	0	0	111.7	F405 N406 F407 L411 R412 M413 S649	F405-E409 HydrophobicContact CB-CB 3.76Å; F405-E409 HydrophobicContact CG-CB 4.47Å; N406-E409 PolarHBondContact N-OE2 3.02Å; N406-E409 WeakPolarHBondContact ND2-CG 3.47Å; N406-E409 PolarHBondContact ND2-OE2 3.38Å; N406-E409 VanDerWaalsContact ND2-OE2 3.08Å; N406-E409 WeakPolarHBondContact OD1-CG 3.47Å; N406-E409 PolarHBondContact OD1-N 3.06Å; N406-E409 VanDerWaalsContact OD1-N 3.08Å; F407-E409 PolarHBondContact O-N 3.38Å; E409-L411 VanDerWaalsContact C-N 3.3Å; E409-L411 PolarHBondContact O-N 3.37Å; E409-R412 PolarHBondContact O-N 2.77Å; E409-R412 VanDerWaalsContact O-N 3.09Å; E409-M413 WeakPolarHBondContact O-CG 3.37Å; E409-M413 PolarHBondContact O-N 2.72Å; E409-S649 VanDerWaalsContact CD-CB 3.42Å; E409-S649 WeakPolarHBondContact CG-OG 3.37Å; E409-S649 WeakPolarHBondContact OE1-CB 3.22Å; E409-S649 PolarHBondContact OE1-OG 2.7Å
410	S	96.2	Very high	95.8	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.014	10%	0.095	C	C	.	.	H	α-helix	trans	-60.7	-39.6	177.7	-60	0	0	0	0	111.5	K402 N406 F407 D408 R412 M413 F414	K402-S410 PolarHBondContact O-OG 3.03Å; N406-S410 WeakPolarHBondContact O-CB 3.48Å; N406-S410 PolarHBondContact O-N 2.65Å; N406-S410 PolarHBondContact O-OG 3.31Å; F407-S410 WeakPolarHBondContact O-CB 3.26Å; F407-S410 PolarHBondContact O-N 3.14Å; F407-S410 VanDerWaalsContact O-N 3.15Å; D408-S410 VanDerWaalsContact C-N 3.33Å; S410-R412 VanDerWaalsContact C-N 3.26Å; S410-R412 PolarHBondContact O-N 2.98Å; S410-M413 PolarHBondContact O-N 3.38Å; S410-F414 VanDerWaalsContact O-CD2 3.25Å; S410-F414 WeakPolarHBondContact O-CD2 3.05Å; S410-F414 VanDerWaalsContact O-CG 3.28Å; S410-F414 WeakPolarHBondContact O-CG 3.37Å; S410-F414 PolarHBondContact O-N 3.45Å
411	L	97.1	Very high	95.7	Very high	4 Å²	4	22 Å²	22	2%	0.021	10%	0.102	C	C	.	.	H	α-helix	trans	-57.4	-41.2	174.7	-52.4	-176.6	0	0	0	111.5	R216 W220 P326 V330 F407 D408 E409 E415	R216-L411 VanDerWaalsContact NH1-CD1 3.27Å; W220-L411 HydrophobicContact CH2-CB 4.38Å; W220-L411 HydrophobicContact CH2-CD2 3.51Å; W220-L411 HydrophobicContact CH2-CG 4.49Å; W220-L411 HydrophobicContact CZ2-CB 3.94Å; W220-L411 HydrophobicContact CZ2-CD2 3.94Å; W220-L411 HydrophobicContact CZ2-CG 4.48Å; P326-L411 HydrophobicContact CB-CD2 3.91Å; V330-L411 HydrophobicContact CG2-CD1 4.23Å; V330-L411 HydrophobicContact CG2-CD2 4.16Å; F407-L411 HydrophobicContact CD1-CD1 4.33Å; F407-L411 HydrophobicContact CD1-CD2 4.46Å; F407-L411 HydrophobicContact CD1-CG 4.42Å; F407-L411 HydrophobicContact CE1-CD1 4.07Å; F407-L411 HydrophobicContact CE1-CD2 3.95Å; F407-L411 HydrophobicContact CE1-CG 4.28Å; F407-L411 HydrophobicContact CZ-CD2 4.3Å; F407-L411 WeakPolarHBondContact O-CG 3.36Å; F407-L411 PolarHBondContact O-N 3.31Å; D408-L411 WeakPolarHBondContact O-CB 3.28Å; D408-L411 PolarHBondContact O-N 3.5Å; E409-L411 VanDerWaalsContact C-N 3.3Å; E409-L411 PolarHBondContact O-N 3.37Å; L411-E415 WeakPolarHBondContact O-CG 3.44Å; L411-E415 PolarHBondContact O-N 2.88Å; L411-E415 VanDerWaalsContact O-N 3.07Å
412	R	95.1	Very high	95.5	Very high	50 Å²	50	22.2 Å²	22.2	19%	0.189	10%	0.103	C	C	.	.	H	α-helix	trans	-75.5	-30.4	178.9	-179.4	53.5	-177.7	-97.2	-1	113.3	L208 N209 D408 E409 S410 S416 L653	L208-R412 PolarHBondContact O-NH2 2.84Å; N209-R412 PolarHBondContact O-NH1 3.44Å; N209-R412 PolarHBondContact O-NH2 2.83Å; D408-R412 PolarHBondContact O-N 2.93Å; E409-R412 PolarHBondContact O-N 2.77Å; E409-R412 VanDerWaalsContact O-N 3.09Å; S410-R412 VanDerWaalsContact C-N 3.26Å; S410-R412 PolarHBondContact O-N 2.98Å; R412-S416 PolarHBondContact O-N 3.38Å; R412-S416 VanDerWaalsContact O-N 3.15Å; R412-S416 PolarHBondContact O-OG 2.96Å; R412-L653 HydrophobicContact CG-CD2 4.39Å
413	M	96.2	Very high	95.4	Very high	6 Å²	6	22 Å²	22	3%	0.03	10%	0.103	C	C	.	.	H	α-helix	trans	-65.6	-47.5	171.5	-68.5	-65.9	175.8	0	0	110.7	F405 E409 S410 E415 S416 Q417 L614 S649 L653	F405-M413 HydrophobicContact CD1-CE 4.11Å; F405-M413 HydrophobicContact CD2-CE 4.38Å; F405-M413 HydrophobicContact CD2-CG 3.78Å; F405-M413 HydrophobicContact CE1-CE 3.7Å; F405-M413 HydrophobicContact CE2-CE 3.99Å; F405-M413 HydrophobicContact CE2-CG 3.9Å; F405-M413 HydrophobicContact CE2-SD 4.18Å; F405-M413 HydrophobicContact CG-CE 4.44Å; F405-M413 HydrophobicContact CG-CG 4.27Å; F405-M413 HydrophobicContact CZ-CE 3.64Å; F405-M413 HydrophobicContact CZ-SD 4.33Å; E409-M413 WeakPolarHBondContact O-CG 3.37Å; E409-M413 PolarHBondContact O-N 2.72Å; S410-M413 PolarHBondContact O-N 3.38Å; M413-E415 PolarHBondContact O-N 2.94Å; M413-S416 PolarHBondContact O-N 2.92Å; M413-Q417 VanDerWaalsContact O-CB 3.3Å; M413-Q417 WeakPolarHBondContact O-CB 3.45Å; M413-Q417 PolarHBondContact O-N 2.61Å; M413-L614 HydrophobicContact SD-CD2 3.85Å; M413-S649 WeakPolarHBondContact CE-O 3.46Å; M413-L653 HydrophobicContact CE-CB 3.98Å; M413-L653 HydrophobicContact SD-CB 4.31Å; M413-L653 HydrophobicContact SD-CD1 4.1Å
414	F	97.9	Very high	95.3	Very high	4 Å²	4	16.7 Å²	16.7	2%	0.018	8%	0.083	C	C	.	.	H	α-helix	trans	-58.5	-46.6	174.5	-61.7	-36	0	0	0	112.6	W220 P326 E400 K402 S410 S416 Q417 W418	W220-F414 AromaticContact CH2-CD2 3.83Å; W220-F414 HydrophobicContact CH2-CD2 3.83Å; W220-F414 HydrophobicContact CZ2-CB 4.47Å; W220-F414 HydrophobicContact CZ2-CD2 4.32Å; P326-F414 HydrophobicContact CB-CE2 3.81Å; P326-F414 HydrophobicContact CG-CE2 3.87Å; P326-F414 HydrophobicContact CG-CZ 4.45Å; E400-F414 HydrophobicContact CB-CD1 4.33Å; E400-F414 HydrophobicContact CB-CE1 3.96Å; E400-F414 WeakPolarHBondContact O-CE1 3.36Å; K402-F414 HydrophobicContact CB-CE1 4.29Å; K402-F414 HydrophobicContact CB-CZ 3.82Å; K402-F414 HydrophobicContact CG-CZ 3.93Å; S410-F414 VanDerWaalsContact O-CD2 3.25Å; S410-F414 WeakPolarHBondContact O-CD2 3.05Å; S410-F414 VanDerWaalsContact O-CG 3.28Å; S410-F414 WeakPolarHBondContact O-CG 3.37Å; S410-F414 PolarHBondContact O-N 3.45Å; F414-S416 VanDerWaalsContact C-N 3.3Å; F414-S416 PolarHBondContact O-N 2.98Å; F414-Q417 PolarHBondContact O-N 3.24Å; F414-W418 HydrophobicContact CB-CD2 4.1Å; F414-W418 HydrophobicContact CB-CE3 4.18Å; F414-W418 HydrophobicContact CB-CH2 3.83Å; F414-W418 HydrophobicContact CB-CZ2 3.73Å; F414-W418 HydrophobicContact CB-CZ3 4.05Å; F414-W418 HydrophobicContact CD1-CZ2 4.11Å; F414-W418 HydrophobicContact CD2-CH2 4.21Å; F414-W418 HydrophobicContact CD2-CZ2 4.28Å; F414-W418 HydrophobicContact CG-CH2 4.08Å; F414-W418 AromaticContact CG-CZ2 3.81Å; F414-W418 HydrophobicContact CG-CZ2 3.81Å; F414-W418 WeakPolarHBondContact O-CB 3.28Å; F414-W418 VanDerWaalsContact O-CG 3.26Å; F414-W418 PolarHBondContact O-N 3.28Å
415	E	97.3	Very high	95	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-53.1	-49.2	175.6	-78.5	168.3	-162.6	0	0	111.5	V206 G210 L211 R216 W220 L411 M413 A419	V206-E415 HydrophobicContact CG1-CB 4.08Å; V206-E415 WeakPolarHBondContact CG1-O 3.35Å; G210-E415 WeakPolarHBondContact CA-OE2 3.48Å; L211-E415 HydrophobicContact CD1-CG 4.11Å; L211-E415 HydrophobicContact CG-CG 4.41Å; L211-E415 PolarHBondContact N-OE2 3.02Å; R216-E415 WeakPolarHBondContact CD-OE1 3.46Å; R216-E415 WeakPolarHBondContact CG-OE1 3.39Å; R216-E415 IonicContact CZ-OE1 3.25Å; R216-E415 IonicContact NE-OE1 2.72Å; R216-E415 PolarHBondContact NE-OE1 2.83Å; R216-E415 IonicContact NH2-OE1 2.72Å; W220-E415 PolarHBondContact NE1-OE1 2.72Å; L411-E415 WeakPolarHBondContact O-CG 3.44Å; L411-E415 PolarHBondContact O-N 2.88Å; L411-E415 VanDerWaalsContact O-N 3.07Å; M413-E415 PolarHBondContact O-N 2.94Å; E415-A419 WeakPolarHBondContact O-CB 3.48Å; E415-A419 PolarHBondContact O-N 3.45Å
416	S	96.5	Very high	94.4	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-66.6	-42.4	-179.4	-51.3	0	0	0	0	111.7	R412 M413 F414 A420	R412-S416 PolarHBondContact O-N 3.38Å; R412-S416 VanDerWaalsContact O-N 3.15Å; R412-S416 PolarHBondContact O-OG 2.96Å; M413-S416 PolarHBondContact O-N 2.92Å; F414-S416 VanDerWaalsContact C-N 3.3Å; F414-S416 PolarHBondContact O-N 2.98Å; S416-A420 WeakPolarHBondContact O-CB 3.5Å; S416-A420 PolarHBondContact O-N 3.04Å
417	Q	97.2	Very high	93.7	Very high	2 Å²	2	21 Å²	21	1%	0.009	10%	0.102	C	C	.	.	H	α-helix	trans	-71.7	-47.7	-176.6	-170.1	-150	-11.3	0	0	112.7	E400 M413 F414 A419 A420 L421 N608 F610 L614	E400-Q417 PolarHBondContact OE1-NE2 2.88Å; M413-Q417 VanDerWaalsContact O-CB 3.3Å; M413-Q417 WeakPolarHBondContact O-CB 3.45Å; M413-Q417 PolarHBondContact O-N 2.61Å; F414-Q417 PolarHBondContact O-N 3.24Å; Q417-A419 VanDerWaalsContact C-N 3.29Å; Q417-A419 PolarHBondContact O-N 3.02Å; Q417-A420 PolarHBondContact O-N 3.19Å; Q417-L421 WeakPolarHBondContact O-CB 3.46Å; Q417-L421 PolarHBondContact O-N 3.32Å; Q417-N608 PolarHBondContact NE2-ND2 3.33Å; Q417-N608 PolarHBondContact NE2-OD1 3.23Å; Q417-F610 HydrophobicContact CB-CD1 4.23Å; Q417-F610 HydrophobicContact CG-CD1 4.35Å; Q417-L614 HydrophobicContact CB-CD1 4.29Å; Q417-L614 HydrophobicContact CG-CD1 4.39Å
418	W	97.5	Very high	92.6	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.008	11%	0.112	C	C	.	.	H	α-helix	trans	-67.2	-32.6	179.1	-59.5	-19.7	0	0	0	111.6	W220 L223 L224 L327 L344 E400 F414 C422	W220-W418 HydrophobicContact CD2-CH2 4.42Å; W220-W418 AromaticContact CD2-CZ3 3.73Å; W220-W418 HydrophobicContact CD2-CZ3 3.73Å; W220-W418 HydrophobicContact CE3-CH2 4.05Å; W220-W418 AromaticContact CE3-CZ3 3.77Å; W220-W418 HydrophobicContact CE3-CZ3 3.77Å; W220-W418 HydrophobicContact CG-CZ3 4.14Å; W220-W418 HydrophobicContact CH2-CH2 4.23Å; W220-W418 HydrophobicContact CH2-CZ3 4.34Å; W220-W418 HydrophobicContact CZ2-CZ3 4.35Å; W220-W418 AromaticContact CZ3-CH2 3.96Å; W220-W418 HydrophobicContact CZ3-CH2 3.96Å; W220-W418 HydrophobicContact CZ3-CZ3 4.1Å; L223-W418 HydrophobicContact CB-CB 4.22Å; L223-W418 HydrophobicContact CB-CE3 4.47Å; L224-W418 HydrophobicContact CD1-CE3 4.48Å; L224-W418 HydrophobicContact CD1-CH2 4.23Å; L224-W418 HydrophobicContact CD1-CZ3 3.99Å; L224-W418 HydrophobicContact CD2-CD2 3.78Å; L224-W418 HydrophobicContact CD2-CE3 3.8Å; L224-W418 HydrophobicContact CD2-CG 4.39Å; L224-W418 HydrophobicContact CD2-CH2 4.15Å; L224-W418 HydrophobicContact CD2-CZ2 4.13Å; L224-W418 HydrophobicContact CD2-CZ3 3.98Å; L224-W418 HydrophobicContact CG-CD2 4.44Å; L224-W418 HydrophobicContact CG-CE3 3.95Å; L224-W418 HydrophobicContact CG-CH2 4.46Å; L224-W418 HydrophobicContact CG-CZ3 3.97Å; L327-W418 HydrophobicContact CD2-CH2 4.02Å; L344-W418 HydrophobicContact CD1-CZ2 3.92Å; L344-W418 HydrophobicContact CD2-CZ2 4.28Å; E400-W418 PolarHBondContact OE2-NE1 2.85Å; F414-W418 HydrophobicContact CB-CD2 4.1Å; F414-W418 HydrophobicContact CB-CE3 4.18Å; F414-W418 HydrophobicContact CB-CH2 3.83Å; F414-W418 HydrophobicContact CB-CZ2 3.73Å; F414-W418 HydrophobicContact CB-CZ3 4.05Å; F414-W418 HydrophobicContact CD1-CZ2 4.11Å; F414-W418 HydrophobicContact CD2-CH2 4.21Å; F414-W418 HydrophobicContact CD2-CZ2 4.28Å; F414-W418 HydrophobicContact CG-CH2 4.08Å; F414-W418 AromaticContact CG-CZ2 3.81Å; F414-W418 HydrophobicContact CG-CZ2 3.81Å; F414-W418 WeakPolarHBondContact O-CB 3.28Å; F414-W418 VanDerWaalsContact O-CG 3.26Å; F414-W418 PolarHBondContact O-N 3.28Å; W418-C422 WeakPolarHBondContact O-CB 3.33Å; W418-C422 PolarHBondContact O-N 3.09Å; W418-C422 PolarHBondContact O-SG 3.48Å; W418-C422 VanDerWaalsContact O-SG 3.35Å
419	A	96.3	Very high	90.9	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-65.1	-47	171.2	0	0	0	0	0	112.3	Y203 V206 L223 E415 Q417 L421 C422 L423	Y203-A419 WeakPolarHBondContact O-CB 3.3Å; V206-A419 HydrophobicContact CB-CB 4.08Å; V206-A419 HydrophobicContact CG1-CB 3.89Å; L223-A419 HydrophobicContact CD2-CB 3.89Å; E415-A419 WeakPolarHBondContact O-CB 3.48Å; E415-A419 PolarHBondContact O-N 3.45Å; Q417-A419 VanDerWaalsContact C-N 3.29Å; Q417-A419 PolarHBondContact O-N 3.02Å; A419-L421 PolarHBondContact O-N 3.11Å; A419-C422 PolarHBondContact O-N 2.62Å; A419-L423 WeakPolarHBondContact O-CG 3.41Å; A419-L423 PolarHBondContact O-N 3.08Å
420	A	95.6	Very high	88.9	Confident	1 Å²	1	24.8 Å²	24.8	1%	0.008	13%	0.126	C	C	.	.	H	α-helix	trans	-59.1	-44	175	0	0	0	0	0	112.4	Y207 S416 Q417 C422 L423 V424 F610 F660	Y207-A420 HydrophobicContact CD2-CB 3.84Å; Y207-A420 HydrophobicContact CE2-CB 4Å; S416-A420 WeakPolarHBondContact O-CB 3.5Å; S416-A420 PolarHBondContact O-N 3.04Å; Q417-A420 PolarHBondContact O-N 3.19Å; A420-C422 PolarHBondContact O-N 2.9Å; A420-L423 PolarHBondContact O-N 3.19Å; A420-V424 WeakPolarHBondContact O-CG2 3.4Å; A420-V424 PolarHBondContact O-N 3.18Å; A420-F610 HydrophobicContact CB-CB 3.63Å; A420-F610 HydrophobicContact CB-CD1 3.98Å; A420-F610 HydrophobicContact CB-CD2 4.42Å; A420-F610 HydrophobicContact CB-CG 3.75Å; A420-F660 HydrophobicContact CB-CE1 4.06Å
421	L	93.9	Very high	86.3	Confident	31 Å²	31	33.5 Å²	33.5	16%	0.162	17%	0.166	C	C	.	.	H	α-helix	trans	-59.4	-43.9	174.9	174.8	61.8	0	0	0	111.9	Q417 A419 K425 G607 N608	Q417-L421 WeakPolarHBondContact O-CB 3.46Å; Q417-L421 PolarHBondContact O-N 3.32Å; A419-L421 PolarHBondContact O-N 3.11Å; L421-K425 WeakPolarHBondContact O-CB 3.25Å; L421-K425 PolarHBondContact O-N 3.14Å; L421-G607 WeakPolarHBondContact CD1-O 3.27Å; L421-N608 HydrophobicContact CD1-CB 4.06Å
422	C	92.9	Very high	83.5	Confident	6 Å²	6	39 Å²	39	4%	0.041	20%	0.195	C	C	.	.	H	α-helix	trans	-65.5	-39.2	176.3	-79	0	0	0	0	113	Y203 L223 W418 A419 A420 N426	Y203-C422 HydrophobicContact CD1-CB 4.09Å; Y203-C422 HydrophobicContact CD2-CB 3.68Å; Y203-C422 HydrophobicContact CE1-CB 4.02Å; Y203-C422 HydrophobicContact CE2-CB 3.6Å; Y203-C422 HydrophobicContact CG-CB 3.93Å; L223-C422 PolarHBondContact O-SG 2.85Å; W418-C422 WeakPolarHBondContact O-CB 3.33Å; W418-C422 PolarHBondContact O-N 3.09Å; W418-C422 PolarHBondContact O-SG 3.48Å; W418-C422 VanDerWaalsContact O-SG 3.35Å; A419-C422 PolarHBondContact O-N 2.62Å; A420-C422 PolarHBondContact O-N 2.9Å; C422-N426 WeakPolarHBondContact O-CB 3.47Å; C422-N426 PolarHBondContact O-N 2.93Å; C422-N426 PolarHBondContact O-OD1 3.43Å
423	L	92.1	Very high	80.5	Confident	7 Å²	7	45.1 Å²	45.1	4%	0.037	23%	0.225	C	C	.	.	H	α-helix	trans	-64.7	-48.2	175.6	-71.8	165.7	0	0	0	111.9	L204 Y207 A419 A420 K425 N426 N427 F671	L204-L423 HydrophobicContact CD1-CD1 4.32Å; Y207-L423 HydrophobicContact CG-CD1 4.47Å; A419-L423 WeakPolarHBondContact O-CG 3.41Å; A419-L423 PolarHBondContact O-N 3.08Å; A420-L423 PolarHBondContact O-N 3.19Å; L423-K425 PolarHBondContact O-N 3.42Å; L423-N426 PolarHBondContact O-N 3.47Å; L423-N427 PolarHBondContact O-N 3.41Å; L423-F671 HydrophobicContact CB-CD1 4.11Å; L423-F671 HydrophobicContact CB-CD2 4.37Å; L423-F671 HydrophobicContact CB-CE1 3.67Å; L423-F671 HydrophobicContact CB-CE2 3.96Å; L423-F671 HydrophobicContact CB-CG 4.46Å; L423-F671 HydrophobicContact CB-CZ 3.6Å; L423-F671 HydrophobicContact CD1-CD2 4.42Å; L423-F671 HydrophobicContact CD2-CD1 4.5Å; L423-F671 WeakPolarHBondContact O-CE1 3.45Å
424	V	91	Very high	77.6	Confident	3 Å²	3	49.4 Å²	49.4	2%	0.018	25%	0.252	C	S	.	.	H	α-helix	trans	-58.4	-48.6	175.7	168.7	0	0	0	0	110.8	A420 N426 N427 S428 P601 P609 F660 F671	A420-V424 WeakPolarHBondContact O-CG2 3.4Å; A420-V424 PolarHBondContact O-N 3.18Å; V424-N426 PolarHBondContact O-N 3.21Å; V424-N427 PolarHBondContact O-N 3.35Å; V424-S428 PolarHBondContact O-N 3.03Å; V424-S428 VanDerWaalsContact O-N 3.1Å; V424-S428 PolarHBondContact O-OG 2.85Å; V424-P601 HydrophobicContact CG1-CB 3.91Å; V424-P601 VanDerWaalsContact CG1-O 3.28Å; V424-P601 WeakPolarHBondContact CG1-O 3.25Å; V424-P601 HydrophobicContact CG2-CB 4.18Å; V424-P609 HydrophobicContact CG2-CG 4.14Å; V424-F660 HydrophobicContact CG2-CZ 3.91Å; V424-F671 HydrophobicContact CG2-CE2 4.3Å; V424-F671 HydrophobicContact CG2-CZ 3.87Å
425	K	87.5	Confident	75	Confident	98 Å²	98	51.7 Å²	51.7	43%	0.426	27%	0.268	S	S	.	.	H	α-helix	trans	-60	-47.2	178.8	-168.8	-171.5	-178.4	-165.3	0	111.4	L421 L423 N427 S428 L429 C435	L421-K425 WeakPolarHBondContact O-CB 3.25Å; L421-K425 PolarHBondContact O-N 3.14Å; L423-K425 PolarHBondContact O-N 3.42Å; K425-N427 PolarHBondContact O-N 2.87Å; K425-S428 PolarHBondContact O-N 3.39Å; K425-S428 PolarHBondContact O-OG 2.95Å; K425-L429 HydrophobicContact CD-CD1 4.41Å; K425-L429 HydrophobicContact CG-CD1 3.99Å; K425-L429 WeakPolarHBondContact O-CG 3.46Å; K425-L429 PolarHBondContact O-N 3.02Å; K425-C435 PolarHBondContact NZ-SG 3.11Å
426	N	84.6	Confident	72.9	Confident	34 Å²	34	53.3 Å²	53.3	18%	0.182	28%	0.276	C	S	.	.	H	α-helix	trans	-64.3	-41.2	-177.7	-80.7	15	0	0	0	112.4	N200 C422 L423 V424 S428 L429	N200-N426 PolarHBondContact OD1-ND2 2.98Å; C422-N426 WeakPolarHBondContact O-CB 3.47Å; C422-N426 PolarHBondContact O-N 2.93Å; C422-N426 PolarHBondContact O-OD1 3.43Å; L423-N426 PolarHBondContact O-N 3.47Å; V424-N426 PolarHBondContact O-N 3.21Å; N426-S428 VanDerWaalsContact C-N 3.34Å; N426-S428 PolarHBondContact O-N 3.27Å; N426-L429 PolarHBondContact O-N 3.45Å; N426-L429 VanDerWaalsContact O-N 3.16Å
427	N	78.5	Confident	70.8	Confident	41 Å²	41	54.2 Å²	54.2	22%	0.219	28%	0.283	C	S	.	.	H	α-helix	trans	-64.9	-37.2	174.5	-85	14.2	0	0	0	112.1	L423 V424 K425 L429 I430 F669 Q670 F671	L423-N427 PolarHBondContact O-N 3.41Å; V424-N427 PolarHBondContact O-N 3.35Å; K425-N427 PolarHBondContact O-N 2.87Å; N427-L429 PolarHBondContact O-N 2.98Å; N427-I430 PolarHBondContact O-N 3.18Å; N427-F669 HydrophobicContact CB-CD1 4.06Å; N427-F669 HydrophobicContact CB-CE1 3.75Å; N427-Q670 PolarHBondContact ND2-O 3.35Å; N427-F671 HydrophobicContact CB-CE1 4.32Å; N427-F671 VanDerWaalsContact ND2-CE1 3.33Å; N427-F671 WeakPolarHBondContact ND2-CE1 3.25Å
428	S	71.4	Confident	68.8	Low	43 Å²	43	58.3 Å²	58.3	30%	0.301	30%	0.301	S	S	.	.	H	α-helix	trans	-68.6	-13.4	175.1	71.5	0	0	0	0	114.6	V424 K425 N426	V424-S428 PolarHBondContact O-N 3.03Å; V424-S428 VanDerWaalsContact O-N 3.1Å; V424-S428 PolarHBondContact O-OG 2.85Å; K425-S428 PolarHBondContact O-N 3.39Å; K425-S428 PolarHBondContact O-OG 2.95Å; N426-S428 VanDerWaalsContact C-N 3.34Å; N426-S428 PolarHBondContact O-N 3.27Å
429	L	58.8	Low	66.3	Low	49 Å²	49	63 Å²	63	26%	0.257	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	8	-179.8	-72.6	173.6	0	0	0	113.9	K425 N426 N427 E431 I432 C435	K425-L429 HydrophobicContact CD-CD1 4.41Å; K425-L429 HydrophobicContact CG-CD1 3.99Å; K425-L429 WeakPolarHBondContact O-CG 3.46Å; K425-L429 PolarHBondContact O-N 3.02Å; N426-L429 PolarHBondContact O-N 3.45Å; N426-L429 VanDerWaalsContact O-N 3.16Å; N427-L429 PolarHBondContact O-N 2.98Å; L429-E431 PolarHBondContact O-N 3.08Å; L429-E431 VanDerWaalsContact O-N 3.17Å; L429-I432 CarbonylContact O-C 3.52Å; L429-I432 VanDerWaalsContact O-C 3.29Å; L429-I432 PolarHBondContact O-N 3.09Å; L429-C435 HydrophobicContact CD1-CB 3.67Å; L429-C435 WeakPolarHBondContact CD1-SG 3.41Å
430	I	52.8	Low	64	Low	138 Å²	138	69.5 Å²	69.5	71%	0.708	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-15.9	172.1	-65	174.6	0	0	0	111.3	N427	N427-I430 PolarHBondContact O-N 3.18Å
431	E	43.1	Very low	62.2	Low	185 Å²	185	72.8 Å²	72.8	86%	0.864	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-18.7	171.2	-60.1	-172.1	157.7	0	0	114.4	L429	L429-E431 PolarHBondContact O-N 3.08Å; L429-E431 VanDerWaalsContact O-N 3.17Å
432	I	37.5	Very low	61	Low	119 Å²	119	73.6 Å²	73.6	61%	0.61	40%	0.4	S	S	*	.	S	Bend	trans	-144.1	108.1	-177.6	-54	-179.1	0	0	0	110.6	L429	L429-I432 CarbonylContact O-C 3.52Å; L429-I432 VanDerWaalsContact O-C 3.29Å; L429-I432 PolarHBondContact O-N 3.09Å
433	E	32.1	Very low	60.4	Low	178 Å²	178	73.7 Å²	73.7	83%	0.832	40%	0.4	S	S	*	.			trans	-60.7	150.7	174.5	-65.9	-170.4	130.8	0	0	112.8
434	T	35.4	Very low	60	Low	97 Å²	97	76.8 Å²	76.8	60%	0.595	42%	0.419	S	S	*	.			trans	71.7	113.4	177.3	72.8	0	0	0	0	116.9
435	C	42.7	Very low	59.9	Low	51 Å²	51	77.2 Å²	77.2	35%	0.345	42%	0.421	S	S	.	.	S	Bend	trans	-141.1	14.4	157.6	79.5	0	0	0	0	113.3	K425 L429	K425-C435 PolarHBondContact NZ-SG 3.11Å; L429-C435 HydrophobicContact CD1-CB 3.67Å; L429-C435 WeakPolarHBondContact CD1-SG 3.41Å
436	N	52.9	Low	59.6	Low	34 Å²	34	74.3 Å²	74.3	18%	0.182	41%	0.412	C	S	.	.	S	Bend	trans	-159.6	37.1	-173.2	-142.7	16.8	0	0	0	111.2	S225 P228	S225-N436 PolarHBondContact OG-ND2 3.27Å; P228-N436 WeakPolarHBondContact CB-O 3.25Å
437	S	53	Low	59.4	Low	20 Å²	20	75 Å²	75	14%	0.14	42%	0.415	C	S	.	.			trans	-95	159.4	179.9	52.7	0	0	0	0	111.8	S439	S437-S439 PolarHBondContact O-N 2.99Å; S437-S439 PolarHBondContact OG-OG 2.95Å; S437-S439 VanDerWaalsContact OG-OG 3.06Å
438	K	54.6	Low	58.7	Low	87 Å²	87	75.6 Å²	75.6	38%	0.378	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-10.1	176.2	-67.5	162.3	-173	174.6	0	115.1	P228 D230 T231 E235	P228-K438 HydrophobicContact CB-CG 4.45Å; P228-K438 HydrophobicContact CG-CG 4.48Å; D230-K438 VanDerWaalsContact CG-CE 3.48Å; D230-K438 PolarHBondContact O-NZ 3.24Å; D230-K438 WeakPolarHBondContact OD1-CE 3.34Å; D230-K438 VanDerWaalsContact OD2-CD 3.3Å; D230-K438 WeakPolarHBondContact OD2-CD 3.34Å; D230-K438 WeakPolarHBondContact OD2-CE 3.47Å; D230-K438 WeakPolarHBondContact OD2-CG 3.38Å; D230-K438 IonicContact OD2-NZ 3.19Å; T231-K438 VanDerWaalsContact CG2-CE 3.49Å; T231-K438 HydrophobicContact CG2-CG 4.38Å; E235-K438 WeakPolarHBondContact OE1-CE 3.44Å; E235-K438 IonicContact OE1-NZ 2.76Å; E235-K438 PolarHBondContact OE1-NZ 3.01Å; E235-K438 IonicContact OE2-NZ 2.89Å; E235-K438 PolarHBondContact OE2-NZ 2.87Å
439	S	46.6	Very low	57.9	Low	101 Å²	101	76.2 Å²	76.2	71%	0.706	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-11	-168.4	52.7	0	0	0	0	115.2	S437	S437-S439 PolarHBondContact O-N 2.99Å; S437-S439 PolarHBondContact OG-OG 2.95Å; S437-S439 VanDerWaalsContact OG-OG 3.06Å
440	E	47	Very low	57.5	Low	136 Å²	136	74.9 Å²	74.9	64%	0.636	43%	0.428	S	S	*	.	S	Bend	trans	-114	177.8	-176.4	-63.3	-157.8	131.7	0	0	113.3	Y442	E440-Y442 PolarHBondContact O-N 2.91Å
441	G	58	Low	56.8	Low	71 Å²	71	75.6 Å²	75.6	73%	0.732	43%	0.433	S	S	*	.			trans	-66.2	67.7	-175.1	0	0	0	0	0	114.5	L443	G441-L443 PolarHBondContact O-N 3.39Å
442	Y	68.4	Low	56.7	Low	47 Å²	47	73.7 Å²	73.7	18%	0.184	43%	0.428	C	S	.	.			trans	-70	125	-162.4	-169.9	-96.2	0	0	0	114.1	S225 V226 C227 P228 K243 E440	S225-Y442 PolarHBondContact O-OH 3.08Å; V226-Y442 WeakPolarHBondContact CA-OH 3.13Å; V226-Y442 PolarHBondContact N-OH 3.3Å; V226-Y442 PolarHBondContact O-OH 3.27Å; C227-Y442 WeakPolarHBondContact CA-OH 3.15Å; C227-Y442 PolarHBondContact N-OH 3.03Å; C227-Y442 PolarHBondContact O-OH 3.24Å; P228-Y442 HydrophobicContact CB-CE2 4.4Å; P228-Y442 HydrophobicContact CG-CD1 4.01Å; P228-Y442 HydrophobicContact CG-CD2 3.74Å; P228-Y442 HydrophobicContact CG-CE1 4.02Å; P228-Y442 HydrophobicContact CG-CE2 3.75Å; P228-Y442 HydrophobicContact CG-CG 3.89Å; K243-Y442 WeakPolarHBondContact CE-O 3.24Å; K243-Y442 PolarHBondContact NZ-O 3.31Å; E440-Y442 PolarHBondContact O-N 2.91Å
443	L	80.7	Confident	57.2	Low	8 Å²	8	72.6 Å²	72.6	4%	0.042	42%	0.417	C	S	.	.	S	Bend	trans	48.4	82.5	-178.2	-172.8	61.9	0	0	0	113.6	V226 K243 L339 C342 A343 G441 L445	V226-L443 HydrophobicContact CG1-CD2 4.08Å; K243-L443 PolarHBondContact NZ-O 3.09Å; L339-L443 HydrophobicContact CB-CD2 4.02Å; L339-L443 HydrophobicContact CD2-CD2 4.21Å; C342-L443 HydrophobicContact CB-CD1 3.97Å; A343-L443 HydrophobicContact CB-CD1 3.83Å; G441-L443 PolarHBondContact O-N 3.39Å; L443-L445 HydrophobicContact CD2-CD2 4.35Å; L443-L445 HydrophobicContact CG-CD2 4.01Å; L443-L445 PolarHBondContact O-N 2.89Å
444	V	84.4	Confident	57.3	Low	73 Å²	73	71.8 Å²	71.8	44%	0.442	42%	0.415	S	S	.	.			trans	-58.2	129.4	171.1	179.6	0	0	0	0	110.8	Q346 T446	Q346-V444 PolarHBondContact NE2-O 3.38Å; V444-T446 WeakPolarHBondContact CG1-O 3.49Å
445	L	87.5	Confident	57.3	Low	12 Å²	12	71.1 Å²	71.1	6%	0.063	41%	0.412	C	S	.	.			trans	-110.1	-8	178.1	-55.9	-173.6	0	0	0	113.9	K243 Q246 L250 H311 Y338 L339 C342 L443	K243-L445 HydrophobicContact CD-CD1 3.85Å; K243-L445 HydrophobicContact CD-CG 4.29Å; Q246-L445 HydrophobicContact CB-CD1 4Å; L250-L445 HydrophobicContact CD1-CB 4.01Å; H311-L445 VanDerWaalsContact CE1-C 3.47Å; H311-L445 PolarHBondContact CE1-O 3.39Å; Y338-L445 HydrophobicContact CE1-CB 4.33Å; Y338-L445 HydrophobicContact CE1-CD2 4.09Å; Y338-L445 PolarHBondContact OH-O 3.29Å; L339-L445 HydrophobicContact CD2-CD1 3.96Å; L339-L445 HydrophobicContact CD2-CD2 3.57Å; L339-L445 HydrophobicContact CD2-CG 4.43Å; C342-L445 HydrophobicContact CB-CD2 4.08Å; L443-L445 HydrophobicContact CD2-CD2 4.35Å; L443-L445 HydrophobicContact CG-CD2 4.01Å; L443-L445 PolarHBondContact O-N 2.89Å
446	T	82.4	Confident	56.8	Low	37 Å²	37	74.5 Å²	74.5	23%	0.227	43%	0.427	C	S	.	.	S	Bend	trans	-151.4	150.2	176.1	74.9	0	0	0	0	108.8	L250 H310 V444 G448	L250-T446 HydrophobicContact CD1-CG2 3.72Å; L250-T446 HydrophobicContact CD2-CG2 3.5Å; L250-T446 HydrophobicContact CG-CG2 4.28Å; H310-T446 HydrophobicContact CB-CG2 3.82Å; V444-T446 WeakPolarHBondContact CG1-O 3.49Å; T446-G448 PolarHBondContact O-N 3.18Å; T446-G448 PolarHBondContact OG1-N 3.39Å
447	D	79.6	Confident	55.9	Low	49 Å²	49	79.7 Å²	79.7	26%	0.262	46%	0.46	S	S	.	.			trans	-69	7.2	174.2	-82.4	-18.2	0	0	0	114.2	H310 H311 N313 T449	H310-D447 PolarHBondContact O-N 3.34Å; H311-D447 WeakPolarHBondContact CA-OD2 3.41Å; H311-D447 IonicContact CD2-OD1 2.65Å; H311-D447 PolarHBondContact CD2-OD1 3Å; N313-D447 PolarHBondContact ND2-OD2 2.65Å; D447-T449 PolarHBondContact O-N 2.69Å
448	G	64.6	Low	54.7	Low	52 Å²	52	83.1 Å²	83.1	54%	0.536	48%	0.484	S	S	.	.	S	Bend	trans	72.8	-22.7	-177.2	0	0	0	0	0	114.7	T446 S450	T446-G448 PolarHBondContact O-N 3.18Å; T446-G448 PolarHBondContact OG1-N 3.39Å; G448-S450 PolarHBondContact O-N 2.9Å
449	T	54.9	Low	53.6	Low	56 Å²	56	86.5 Å²	86.5	34%	0.344	50%	0.499	S	S	.	.	G	3₁₀ helix	trans	-62.6	-6.8	175.4	52.7	0	0	0	0	114.8	D447 N451 L452	D447-T449 PolarHBondContact O-N 2.69Å; T449-N451 PolarHBondContact O-N 2.74Å; T449-L452 PolarHBondContact O-N 2.81Å
450	S	48.4	Very low	52.7	Low	22 Å²	22	87 Å²	87	15%	0.154	50%	0.497	C	S	.	.	G	3₁₀ helix	trans	-61.6	-13.8	-179	-65.1	0	0	0	0	114.5	H310 G448 L452 Y453	H310-S450 PolarHBondContact ND1-OG 3.07Å; G448-S450 PolarHBondContact O-N 2.9Å; S450-L452 PolarHBondContact O-N 3.49Å; S450-Y453 WeakPolarHBondContact O-CD2 3.4Å; S450-Y453 WeakPolarHBondContact O-CE2 3.35Å
451	N	39.4	Very low	52.2	Low	153 Å²	153	84.9 Å²	84.9	82%	0.818	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-74.8	0.7	175.1	-78	-14.7	0	0	0	114.7	T449 Y453	T449-N451 PolarHBondContact O-N 2.74Å; N451-Y453 PolarHBondContact O-N 3.06Å
452	L	41	Very low	50.7	Low	145 Å²	145	86.4 Å²	86.4	76%	0.759	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-82.9	25.5	174.7	-68.6	173	0	0	0	114.2	T449 S450 M454	T449-L452 PolarHBondContact O-N 2.81Å; S450-L452 PolarHBondContact O-N 3.49Å; L452-M454 PolarHBondContact O-N 2.9Å
453	Y	48.6	Very low	48.9	Very low	95 Å²	95	90.8 Å²	90.8	37%	0.373	52%	0.52	S	S	.	.			trans	-72.9	46.3	167.7	-60.2	-54.5	0	0	0	113	L257 H310 S450 N451 P455	L257-Y453 HydrophobicContact CD1-CD1 3.87Å; L257-Y453 HydrophobicContact CD1-CE1 3.47Å; L257-Y453 VanDerWaalsContact CD1-CE1 3.47Å; L257-Y453 HydrophobicContact CD1-CE2 4.47Å; H310-Y453 PolarHBondContact CE1-OH 3.08Å; H310-Y453 VanDerWaalsContact CE1-OH 3.29Å; S450-Y453 WeakPolarHBondContact O-CD2 3.4Å; S450-Y453 WeakPolarHBondContact O-CE2 3.35Å; N451-Y453 PolarHBondContact O-N 3.06Å; Y453-P455 VanDerWaalsContact O-CD 3.29Å; Y453-P455 WeakPolarHBondContact O-CD 3.05Å
454	M	33.1	Very low	46.9	Very low	162 Å²	162	95 Å²	95	80%	0.798	55%	0.55	S	S	*	.			trans	-80.1	112.7	161.6	-79.8	-68.1	171.8	0	0	107.9	L452 N456	L452-M454 PolarHBondContact O-N 2.9Å; M454-N456 PolarHBondContact O-N 3.24Å
455	P	36.1	Very low	44.7	Very low	82 Å²	82	95 Å²	95	53%	0.532	55%	0.547	S	S	.	.			trans	-63.2	135	166.7	28.7	-32.9	0	0	0	107.8	Y453 T457	Y453-P455 VanDerWaalsContact O-CD 3.29Å; Y453-P455 WeakPolarHBondContact O-CD 3.05Å; P455-T457 PolarHBondContact O-N 2.82Å
456	N	31.2	Very low	42.1	Very low	122 Å²	122	99.4 Å²	99.4	65%	0.652	57%	0.571	S	S	*	*			trans	-61.3	100.9	171.8	-77.7	-19.4	0	0	0	108.7	M454 S458	M454-N456 PolarHBondContact O-N 3.24Å; N456-S458 PolarHBondContact O-N 3.34Å
457	T	34	Very low	40.6	Very low	143 Å²	143	102.2 Å²	102.2	88%	0.877	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	11.4	-179.2	44.1	0	0	0	0	113.4	P455	P455-T457 PolarHBondContact O-N 2.82Å
458	S	28.9	Very low	39.2	Very low	92 Å²	92	106.8 Å²	106.8	64%	0.643	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.5	27.2	179.3	49.6	0	0	0	0	113.3	N456 T460	N456-S458 PolarHBondContact O-N 3.34Å; S458-T460 VanDerWaalsContact C-N 3.28Å; S458-T460 PolarHBondContact O-N 2.9Å
459	F	30.5	Very low	38.9	Very low	159 Å²	159	108.4 Å²	108.4	70%	0.697	59%	0.59	S	S	*	*			trans	-70.1	83.9	165.3	-94.1	-77.5	0	0	0	111.2	L465	F459-L465 HydrophobicContact CE1-CD1 4.46Å
460	T	28.2	Very low	39.9	Very low	110 Å²	110	107.5 Å²	107.5	68%	0.675	58%	0.581	S	S	*	*			trans	-60.4	139.6	161.8	46	0	0	0	0	109.7	S458 T462	S458-T460 VanDerWaalsContact C-N 3.28Å; S458-T460 PolarHBondContact O-N 2.9Å; T460-T462 PolarHBondContact O-N 2.94Å
461	S	35.6	Very low	41.6	Very low	93 Å²	93	109.4 Å²	109.4	65%	0.65	59%	0.592	S	S	*	*	S	Bend	trans	-77.2	39.4	-170	-47.6	0	0	0	0	114.3
462	T	27.8	Very low	43.7	Very low	103 Å²	103	105.4 Å²	105.4	63%	0.632	58%	0.579	S	S	*	*			trans	-141.7	74	-172.3	54	0	0	0	0	111.9	T460	T460-T462 PolarHBondContact O-N 2.94Å
463	N	30.4	Very low	45.8	Very low	139 Å²	139	106.5 Å²	106.5	74%	0.743	57%	0.574	S	S	*	*			trans	-173.6	147.6	130.6	-94.6	-26.8	0	0	0	111.6	L465	N463-L465 VanDerWaalsContact C-N 3.34Å; N463-L465 HydrophobicContact CB-CD1 4.49Å; N463-L465 PolarHBondContact O-N 2.79Å; N463-L465 VanDerWaalsContact O-N 3.08Å
464	S	37.2	Very low	47.7	Very low	95 Å²	95	103.1 Å²	103.1	66%	0.664	56%	0.562	S	S	*	*			trans	-69.5	95.9	155.8	173.4	0	0	0	0	107	N466	S464-N466 PolarHBondContact O-N 2.96Å
465	L	38.3	Very low	50.4	Low	75 Å²	75	95.6 Å²	95.6	39%	0.393	53%	0.525	S	S	.	.			trans	-60.8	111.1	169.8	-87.7	78.1	0	0	0	107.6	F459 N463 W467	F459-L465 HydrophobicContact CE1-CD1 4.46Å; N463-L465 VanDerWaalsContact C-N 3.34Å; N463-L465 HydrophobicContact CB-CD1 4.49Å; N463-L465 PolarHBondContact O-N 2.79Å; N463-L465 VanDerWaalsContact O-N 3.08Å; L465-W467 VanDerWaalsContact C-N 3.32Å; L465-W467 HydrophobicContact CB-CZ2 4.36Å; L465-W467 HydrophobicContact CD2-CH2 4.31Å; L465-W467 HydrophobicContact CD2-CZ2 3.95Å; L465-W467 PolarHBondContact O-N 3.43Å; L465-W467 PolarHBondContact O-NE1 3.24Å
466	N	34.5	Very low	53	Low	104 Å²	104	95.3 Å²	95.3	56%	0.556	53%	0.525	S	S	*	.			trans	-76.1	90.6	172	-69.4	-13.6	0	0	0	107.9	S464 H468	S464-N466 PolarHBondContact O-N 2.96Å; N466-H468 VanDerWaalsContact CB-NE2 3.25Å; N466-H468 WeakPolarHBondContact CB-NE2 3.28Å; N466-H468 PolarHBondContact O-CD2 2.76Å; N466-H468 VanDerWaalsContact O-CD2 3.27Å; N466-H468 PolarHBondContact O-N 2.9Å
467	W	50.6	Low	55.9	Low	96 Å²	96	91 Å²	91	36%	0.364	50%	0.502	S	S	.	.			trans	-66.7	67	172	-55.5	91.4	0	0	0	110.4	E265 L268 L465 H469 Y470	E265-W467 HydrophobicContact CB-CE3 4.29Å; E265-W467 HydrophobicContact CB-CZ3 3.73Å; E265-W467 HydrophobicContact CG-CE3 3.98Å; E265-W467 HydrophobicContact CG-CZ3 3.95Å; L268-W467 HydrophobicContact CD1-CZ3 4.34Å; L465-W467 VanDerWaalsContact C-N 3.32Å; L465-W467 HydrophobicContact CB-CZ2 4.36Å; L465-W467 HydrophobicContact CD2-CH2 4.31Å; L465-W467 HydrophobicContact CD2-CZ2 3.95Å; L465-W467 PolarHBondContact O-N 3.43Å; L465-W467 PolarHBondContact O-NE1 3.24Å; W467-H469 PolarHBondContact O-N 3.18Å; W467-Y470 PolarHBondContact O-N 3.23Å
468	H	49.3	Very low	58.7	Low	144 Å²	144	84.2 Å²	84.2	67%	0.667	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-16.9	-171.1	-77.9	-68	0	0	0	113.6	N466	N466-H468 VanDerWaalsContact CB-NE2 3.25Å; N466-H468 WeakPolarHBondContact CB-NE2 3.28Å; N466-H468 PolarHBondContact O-CD2 2.76Å; N466-H468 VanDerWaalsContact O-CD2 3.27Å; N466-H468 PolarHBondContact O-N 2.9Å
469	H	59.4	Low	61.8	Low	87 Å²	87	81.5 Å²	81.5	40%	0.403	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.9	-7.5	-177.9	-59	113	0	0	0	115.2	W467	W467-H469 PolarHBondContact O-N 3.18Å
470	Y	75.8	Confident	64.7	Low	37 Å²	37	76.1 Å²	76.1	15%	0.145	42%	0.421	C	S	.	.			trans	-117.8	103.6	179.1	-176.1	-111	0	0	0	110.3	Y258 L268 A272 W467 D474 V475 I478	Y258-Y470 WeakPolarHBondContact CE2-OH 3.28Å; Y258-Y470 PolarHBondContact OH-OH 3.2Å; L268-Y470 HydrophobicContact CB-CD1 4.4Å; L268-Y470 HydrophobicContact CB-CD2 3.9Å; L268-Y470 HydrophobicContact CB-CE1 4.43Å; L268-Y470 HydrophobicContact CB-CE2 3.94Å; L268-Y470 HydrophobicContact CB-CG 4.13Å; L268-Y470 HydrophobicContact CD1-CD1 4.09Å; L268-Y470 HydrophobicContact CD1-CE1 4Å; L268-Y470 HydrophobicContact CD2-CE1 4.32Å; L268-Y470 HydrophobicContact CD2-CE2 4.43Å; L268-Y470 HydrophobicContact CG-CE1 4.49Å; A272-Y470 HydrophobicContact CB-CD2 4.4Å; W467-Y470 PolarHBondContact O-N 3.23Å; Y470-D474 HydrophobicContact CD2-CB 4.08Å; Y470-D474 HydrophobicContact CE2-CB 4.02Å; Y470-V475 HydrophobicContact CD1-CG2 4.41Å; Y470-V475 HydrophobicContact CE1-CG2 3.52Å; Y470-V475 HydrophobicContact CE2-CG2 4.33Å; Y470-V475 VanDerWaalsContact CZ-CG2 3.48Å; Y470-V475 WeakPolarHBondContact OH-CG2 3.39Å; Y470-I478 HydrophobicContact CE2-CD1 3.85Å
471	T	83.1	Confident	67.9	Low	62 Å²	62	71 Å²	71	38%	0.38	39%	0.389	S	S	.	.			trans	-108	169.2	-165	82.3	0	0	0	0	112.9	R473 D474 V475	T471-R473 PolarHBondContact O-N 3.34Å; T471-R473 PolarHBondContact OG1-N 3.18Å; T471-R473 VanDerWaalsContact OG1-N 3.11Å; T471-D474 WeakPolarHBondContact CA-OD2 3.5Å; T471-D474 WeakPolarHBondContact CB-OD2 3.27Å; T471-D474 WeakPolarHBondContact CG2-OD2 3.44Å; T471-D474 PolarHBondContact N-OD2 3.18Å; T471-D474 PolarHBondContact O-N 3.45Å; T471-D474 PolarHBondContact OG1-OD2 2.92Å; T471-V475 WeakPolarHBondContact O-CG2 3.42Å; T471-V475 PolarHBondContact O-N 3.03Å; T471-V475 VanDerWaalsContact O-N 3.12Å
472	A	84	Confident	70.8	Confident	68 Å²	68	66.6 Å²	66.6	56%	0.562	36%	0.358	S	S	*	.	H	α-helix	trans	-62.4	-18.5	172.1	0	0	0	0	0	113.8	S476 L490	A472-S476 WeakPolarHBondContact O-CB 3.33Å; A472-S476 PolarHBondContact O-N 3.33Å; A472-L490 HydrophobicContact CB-CD1 3.8Å
473	R	85	Confident	73.8	Confident	169 Å²	169	63.2 Å²	63.2	64%	0.638	34%	0.344	S	S	*	.	H	α-helix	trans	-75	-44.2	173.5	-68.3	-178.5	171.9	140.8	-4.9	110.9	D79 T471 S476 L477	D79-R473 IonicContact OD2-CZ 3.66Å; D79-R473 IonicContact OD2-NE 3.66Å; D79-R473 IonicContact OD2-NH2 2.8Å; D79-R473 PolarHBondContact OD2-NH2 2.86Å; T471-R473 PolarHBondContact O-N 3.34Å; T471-R473 PolarHBondContact OG1-N 3.18Å; T471-R473 VanDerWaalsContact OG1-N 3.11Å; R473-S476 WeakPolarHBondContact O-CA 3.46Å; R473-S476 WeakPolarHBondContact O-CB 3.46Å; R473-S476 PolarHBondContact O-N 3.42Å; R473-S476 VanDerWaalsContact O-N 3.08Å; R473-L477 PolarHBondContact O-N 2.8Å
474	D	88.5	Confident	76.7	Confident	23 Å²	23	61.3 Å²	61.3	12%	0.123	34%	0.342	C	S	.	.	H	α-helix	trans	-63.1	-45.1	178.1	-48.6	-68.3	0	0	0	110.7	A272 Y470 T471 S476 L477 I478	A272-D474 HydrophobicContact CB-CB 3.78Å; Y470-D474 HydrophobicContact CD2-CB 4.08Å; Y470-D474 HydrophobicContact CE2-CB 4.02Å; T471-D474 WeakPolarHBondContact CA-OD2 3.5Å; T471-D474 WeakPolarHBondContact CB-OD2 3.27Å; T471-D474 WeakPolarHBondContact CG2-OD2 3.44Å; T471-D474 PolarHBondContact N-OD2 3.18Å; T471-D474 PolarHBondContact O-N 3.45Å; T471-D474 PolarHBondContact OG1-OD2 2.92Å; D474-S476 VanDerWaalsContact C-N 3.27Å; D474-S476 PolarHBondContact O-N 2.78Å; D474-L477 PolarHBondContact O-N 2.72Å; D474-L477 VanDerWaalsContact O-N 3.16Å; D474-I478 WeakPolarHBondContact O-CB 3.36Å; D474-I478 VanDerWaalsContact O-CG1 3.29Å; D474-I478 WeakPolarHBondContact O-CG1 3.47Å; D474-I478 PolarHBondContact O-N 3.39Å
475	V	90.1	Very high	79.3	Confident	5 Å²	5	63.2 Å²	63.2	3%	0.03	34%	0.344	C	S	.	.	H	α-helix	trans	-57.1	-41.1	172.2	177.9	0	0	0	0	111.3	Y470 T471 N479 L490	Y470-V475 HydrophobicContact CD1-CG2 4.41Å; Y470-V475 HydrophobicContact CE1-CG2 3.52Å; Y470-V475 HydrophobicContact CE2-CG2 4.33Å; Y470-V475 VanDerWaalsContact CZ-CG2 3.48Å; Y470-V475 WeakPolarHBondContact OH-CG2 3.39Å; T471-V475 WeakPolarHBondContact O-CG2 3.42Å; T471-V475 PolarHBondContact O-N 3.03Å; T471-V475 VanDerWaalsContact O-N 3.12Å; V475-N479 WeakPolarHBondContact O-CB 3.38Å; V475-N479 PolarHBondContact O-N 3.08Å; V475-N479 PolarHBondContact O-ND2 3.49Å; V475-L490 HydrophobicContact CB-CD1 4.04Å; V475-L490 HydrophobicContact CB-CG 4.49Å; V475-L490 HydrophobicContact CG1-CD1 3.93Å; V475-L490 HydrophobicContact CG1-CD2 4.33Å; V475-L490 HydrophobicContact CG1-CG 3.92Å; V475-L490 HydrophobicContact CG2-CD1 4.15Å; V475-L490 HydrophobicContact CG2-CD2 4.18Å; V475-L490 HydrophobicContact CG2-CG 4.46Å
476	S	90.5	Very high	82	Confident	75 Å²	75	62.1 Å²	62.1	52%	0.524	34%	0.335	S	S	.	.	H	α-helix	trans	-68.2	-36	178.3	-168.1	0	0	0	0	112.8	A472 R473 D474 S480	A472-S476 WeakPolarHBondContact O-CB 3.33Å; A472-S476 PolarHBondContact O-N 3.33Å; R473-S476 WeakPolarHBondContact O-CA 3.46Å; R473-S476 WeakPolarHBondContact O-CB 3.46Å; R473-S476 PolarHBondContact O-N 3.42Å; R473-S476 VanDerWaalsContact O-N 3.08Å; D474-S476 VanDerWaalsContact C-N 3.27Å; D474-S476 PolarHBondContact O-N 2.78Å; S476-S480 PolarHBondContact O-N 3.42Å
477	L	91.2	Very high	84.7	Confident	33 Å²	33	60.8 Å²	60.8	17%	0.173	33%	0.331	C	S	.	.	H	α-helix	trans	-75.7	-44.7	179.4	-169.9	54.4	0	0	0	111.1	S275 I276 V279 R473 D474 N479 S480 L481	S275-L477 WeakPolarHBondContact O-CD2 3.1Å; I276-L477 HydrophobicContact CG1-CD2 3.84Å; V279-L477 HydrophobicContact CG1-CD1 4.31Å; R473-L477 PolarHBondContact O-N 2.8Å; D474-L477 PolarHBondContact O-N 2.72Å; D474-L477 VanDerWaalsContact O-N 3.16Å; L477-N479 VanDerWaalsContact C-N 3.35Å; L477-N479 PolarHBondContact O-N 2.68Å; L477-S480 PolarHBondContact O-N 3.33Å; L477-S480 PolarHBondContact O-OG 3.33Å; L477-L481 PolarHBondContact O-N 3.41Å
478	I	93.7	Very high	86.4	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-58.6	-46.4	171.7	-64.9	162.6	0	0	0	110.4	Y258 L271 F301 Y470 D474 S480 L481 I482	Y258-I478 HydrophobicContact CE1-CG2 3.99Å; Y258-I478 HydrophobicContact CE2-CD1 4.26Å; Y258-I478 HydrophobicContact CE2-CG2 3.76Å; Y258-I478 VanDerWaalsContact CZ-CG2 3.47Å; Y258-I478 WeakPolarHBondContact OH-CG2 3.36Å; L271-I478 HydrophobicContact CB-CD1 3.75Å; L271-I478 HydrophobicContact CB-CG1 4.26Å; F301-I478 HydrophobicContact CZ-CG1 4.34Å; F301-I478 HydrophobicContact CZ-CG2 4Å; Y470-I478 HydrophobicContact CE2-CD1 3.85Å; D474-I478 WeakPolarHBondContact O-CB 3.36Å; D474-I478 VanDerWaalsContact O-CG1 3.29Å; D474-I478 WeakPolarHBondContact O-CG1 3.47Å; D474-I478 PolarHBondContact O-N 3.39Å; I478-S480 PolarHBondContact O-N 3.41Å; I478-S480 VanDerWaalsContact O-N 3.16Å; I478-L481 PolarHBondContact O-N 2.68Å; I478-I482 HydrophobicContact CG2-CB 4.21Å; I478-I482 HydrophobicContact CG2-CD1 4.21Å; I478-I482 HydrophobicContact CG2-CG2 4.48Å; I478-I482 WeakPolarHBondContact O-CB 3.11Å; I478-I482 VanDerWaalsContact O-CG2 3.29Å; I478-I482 WeakPolarHBondContact O-CG2 3.43Å; I478-I482 PolarHBondContact O-N 3.22Å
479	N	93.1	Very high	87.9	Confident	34 Å²	34	53.3 Å²	53.3	18%	0.182	30%	0.304	C	S	.	.	H	α-helix	trans	-60.3	-23.7	176.8	-76.9	-14.4	0	0	0	113.5	Y258 V475 L477 V487 V488	Y258-N479 PolarHBondContact OH-OD1 2.68Å; V475-N479 WeakPolarHBondContact O-CB 3.38Å; V475-N479 PolarHBondContact O-N 3.08Å; V475-N479 PolarHBondContact O-ND2 3.49Å; L477-N479 VanDerWaalsContact C-N 3.35Å; L477-N479 PolarHBondContact O-N 2.68Å; N479-V487 HydrophobicContact CB-CG1 4.19Å; N479-V487 HydrophobicContact CB-CG2 4.45Å; N479-V488 PolarHBondContact ND2-O 2.72Å; N479-V488 PolarHBondContact OD1-N 3.25Å
480	S	92.9	Very high	88.6	Confident	47 Å²	47	53.7 Å²	53.7	33%	0.329	31%	0.308	S	S	.	.	H	α-helix	trans	-83	-15.4	176.2	90	0	0	0	0	113.5	H294 S476 L477 I478	H294-S480 PolarHBondContact NE2-O 3.41Å; S476-S480 PolarHBondContact O-N 3.42Å; L477-S480 PolarHBondContact O-N 3.33Å; L477-S480 PolarHBondContact O-OG 3.33Å; I478-S480 PolarHBondContact O-N 3.41Å; I478-S480 VanDerWaalsContact O-N 3.16Å
481	L	95.3	Very high	87.8	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.005	34%	0.34	C	S	.	.	H	α-helix	trans	-110	-39.1	-176.1	-64.1	171.3	0	0	0	113.4	V278 V297 C298 F301 L477 I478 G483	V278-L481 HydrophobicContact CG2-CD1 3.74Å; V297-L481 HydrophobicContact CB-CD2 4.39Å; V297-L481 HydrophobicContact CG1-CD2 3.86Å; C298-L481 WeakPolarHBondContact CB-O 3.48Å; C298-L481 PolarHBondContact SG-O 3.14Å; F301-L481 HydrophobicContact CB-CB 4.12Å; F301-L481 HydrophobicContact CB-CD1 4.24Å; F301-L481 HydrophobicContact CD1-CB 3.71Å; F301-L481 HydrophobicContact CD2-CB 4.21Å; F301-L481 HydrophobicContact CD2-CD1 3.72Å; F301-L481 HydrophobicContact CE1-CB 4.15Å; F301-L481 HydrophobicContact CE2-CD1 4.28Å; F301-L481 HydrophobicContact CG-CB 3.75Å; F301-L481 HydrophobicContact CG-CD1 3.98Å; F301-L481 HydrophobicContact CG-CG 4.45Å; L477-L481 PolarHBondContact O-N 3.41Å; I478-L481 PolarHBondContact O-N 2.68Å; L481-G483 PolarHBondContact O-N 2.76Å
482	I	95.3	Very high	86.4	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.005	36%	0.358	C	S	.	.	S	Bend	trans	-67.2	-18.2	-171	-159.3	174.7	0	0	0	114.4	W254 K255 Y258 F301 I478	W254-I482 HydrophobicContact CH2-CD1 4.39Å; W254-I482 HydrophobicContact CH2-CG1 4.12Å; W254-I482 HydrophobicContact CZ3-CD1 3.82Å; W254-I482 HydrophobicContact CZ3-CG1 4.05Å; K255-I482 HydrophobicContact CD-CG1 3.93Å; K255-I482 HydrophobicContact CG-CD1 4.12Å; K255-I482 HydrophobicContact CG-CG1 3.89Å; K255-I482 PolarHBondContact NZ-O 3.04Å; Y258-I482 HydrophobicContact CD1-CD1 3.34Å; Y258-I482 HydrophobicContact CE1-CD1 3.83Å; Y258-I482 HydrophobicContact CG-CD1 3.77Å; F301-I482 HydrophobicContact CE1-CB 4.12Å; F301-I482 HydrophobicContact CE1-CG1 4.36Å; I478-I482 HydrophobicContact CG2-CB 4.21Å; I478-I482 HydrophobicContact CG2-CD1 4.21Å; I478-I482 HydrophobicContact CG2-CG2 4.48Å; I478-I482 WeakPolarHBondContact O-CB 3.11Å; I478-I482 VanDerWaalsContact O-CG2 3.29Å; I478-I482 WeakPolarHBondContact O-CG2 3.43Å; I478-I482 PolarHBondContact O-N 3.22Å
483	G	92.6	Very high	84.6	Confident	33 Å²	33	68 Å²	68	34%	0.34	35%	0.353	S	S	.	.			trans	97.3	151.2	-179.3	0	0	0	0	0	113.7	L481 N485 Y486	L481-G483 PolarHBondContact O-N 2.76Å; G483-N485 PolarHBondContact O-N 3.29Å; G483-N485 VanDerWaalsContact O-N 3.09Å; G483-Y486 PolarHBondContact O-N 2.93Å
484	S	90	Very high	82.3	Confident	99 Å²	99	62.4 Å²	62.4	69%	0.692	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-50.7	-38.7	-170.9	49.4	0	0	0	0	114.7	Y486	S484-Y486 PolarHBondContact O-N 3.05Å
485	N	92.3	Very high	79.4	Confident	134 Å²	134	69.8 Å²	69.8	72%	0.717	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-75.8	-7.2	-173.3	-57.2	6.2	0	0	0	112.6	G483	G483-N485 PolarHBondContact O-N 3.29Å; G483-N485 VanDerWaalsContact O-N 3.09Å
486	Y	93.9	Very high	76.2	Confident	53 Å²	53	75.5 Å²	75.5	21%	0.208	41%	0.414	C	S	.	.	G	3₁₀ helix	trans	-124.6	16	-173.9	-53	-74.9	0	0	0	113.8	K255 V259 G483 S484	K255-Y486 HydrophobicContact CB-CD1 3.58Å; K255-Y486 HydrophobicContact CB-CD2 4.25Å; K255-Y486 HydrophobicContact CB-CE1 3.76Å; K255-Y486 HydrophobicContact CB-CE2 4.42Å; K255-Y486 HydrophobicContact CB-CG 3.83Å; K255-Y486 HydrophobicContact CD-CD2 3.72Å; K255-Y486 HydrophobicContact CD-CE2 3.84Å; K255-Y486 HydrophobicContact CD-CG 4.1Å; K255-Y486 HydrophobicContact CG-CG 4.42Å; V259-Y486 VanDerWaalsContact CG2-CA 3.44Å; V259-Y486 HydrophobicContact CG2-CD1 4.02Å; V259-Y486 HydrophobicContact CG2-CG 4.46Å; V259-Y486 WeakPolarHBondContact CG2-O 3.04Å; G483-Y486 PolarHBondContact O-N 2.93Å; S484-Y486 PolarHBondContact O-N 3.05Å
487	V	91.5	Very high	73	Confident	75 Å²	75	77.5 Å²	77.5	46%	0.455	42%	0.424	S	S	.	.			trans	-73.2	129.1	-179.8	172.4	0	0	0	0	111.6	N479	N479-V487 HydrophobicContact CB-CG1 4.19Å; N479-V487 HydrophobicContact CB-CG2 4.45Å
488	V	87.2	Confident	69.7	Low	19 Å²	19	80.8 Å²	80.8	12%	0.115	45%	0.445	C	S	.	.			trans	-99.3	118.3	176.4	172.2	0	0	0	0	111.1	Y258 N479	Y258-V488 HydrophobicContact CD1-CG2 3.71Å; Y258-V488 HydrophobicContact CE1-CB 4.01Å; Y258-V488 HydrophobicContact CE1-CG2 3.43Å; Y258-V488 VanDerWaalsContact CE1-CG2 3.43Å; N479-V488 PolarHBondContact ND2-O 2.72Å; N479-V488 PolarHBondContact OD1-N 3.25Å
489	D	81.3	Confident	66.3	Low	65 Å²	65	85.7 Å²	85.7	35%	0.348	48%	0.479	S	S	.	.			trans	-89	106	171.7	-176.3	3.1	0	0	0	111.3	K491 K492	D489-K491 PolarHBondContact O-N 3.04Å; D489-K491 VanDerWaalsContact O-N 3.11Å; D489-K491 VanDerWaalsContact OD1-CB 3.31Å; D489-K491 WeakPolarHBondContact OD1-CB 3.43Å; D489-K491 PolarHBondContact OD1-N 3.21Å; D489-K492 HydrophobicContact CB-CB 4.44Å; D489-K492 HydrophobicContact CB-CD 4.15Å; D489-K492 HydrophobicContact CB-CG 4.2Å; D489-K492 PolarHBondContact O-N 3.46Å; D489-K492 WeakPolarHBondContact OD2-CE 3.43Å
490	L	73.3	Confident	62.9	Low	95 Å²	95	90.5 Å²	90.5	50%	0.497	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-24.4	175.6	-71.2	169.9	0	0	0	113.8	A472 V475 K492	A472-L490 HydrophobicContact CB-CD1 3.8Å; V475-L490 HydrophobicContact CB-CD1 4.04Å; V475-L490 HydrophobicContact CB-CG 4.49Å; V475-L490 HydrophobicContact CG1-CD1 3.93Å; V475-L490 HydrophobicContact CG1-CD2 4.33Å; V475-L490 HydrophobicContact CG1-CG 3.92Å; V475-L490 HydrophobicContact CG2-CD1 4.15Å; V475-L490 HydrophobicContact CG2-CD2 4.18Å; V475-L490 HydrophobicContact CG2-CG 4.46Å; L490-K492 VanDerWaalsContact C-N 3.34Å
491	K	59	Low	59.7	Low	188 Å²	188	93.6 Å²	93.6	82%	0.817	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-22.5	178.8	-58.1	172	-172.5	163.8	0	112.9	D489	D489-K491 PolarHBondContact O-N 3.04Å; D489-K491 VanDerWaalsContact O-N 3.11Å; D489-K491 VanDerWaalsContact OD1-CB 3.31Å; D489-K491 WeakPolarHBondContact OD1-CB 3.43Å; D489-K491 PolarHBondContact OD1-N 3.21Å
492	K	54.1	Low	56.3	Low	174 Å²	174	99.4 Å²	99.4	76%	0.757	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-29.7	-179.8	-70.1	-179.7	-174.5	-179	0	112.5	D489 L490 G494	D489-K492 HydrophobicContact CB-CB 4.44Å; D489-K492 HydrophobicContact CB-CD 4.15Å; D489-K492 HydrophobicContact CB-CG 4.2Å; D489-K492 PolarHBondContact O-N 3.46Å; D489-K492 WeakPolarHBondContact OD2-CE 3.43Å; L490-K492 VanDerWaalsContact C-N 3.34Å; K492-G494 PolarHBondContact O-N 2.65Å
493	K	46	Very low	52.8	Low	104 Å²	104	106.2 Å²	106.2	45%	0.452	60%	0.597	S	S	.	*			trans	-80.2	61.5	172.1	-68.7	-168.8	-178.8	-178	0	111.3	V259 M260	V259-K493 PolarHBondContact O-NZ 3.34Å; M260-K493 PolarHBondContact O-NZ 2.92Å; M260-K493 VanDerWaalsContact O-NZ 3.14Å
494	G	36.7	Very low	49.6	Very low	53 Å²	53	111.8 Å²	111.8	55%	0.546	62%	0.617	S	S	.	*			trans	-66.2	134.2	162.2	0	0	0	0	0	109.8	K492 T496	K492-G494 PolarHBondContact O-N 2.65Å; G494-T496 VanDerWaalsContact C-N 3.3Å; G494-T496 PolarHBondContact O-N 2.95Å
495	F	28	Very low	46.2	Very low	178 Å²	178	115.6 Å²	115.6	78%	0.781	62%	0.621	S	S	*	*			trans	-69.1	85	176.2	-82.7	-101.5	0	0	0	110.5	T497	F495-T497 PolarHBondContact O-N 3.07Å
496	T	23.1	Very low	42.9	Very low	124 Å²	124	119.1 Å²	119.1	76%	0.761	63%	0.63	S	S	*	*			trans	-69.4	98.5	164.5	49.9	0	0	0	0	108.5	G494 V498	G494-T496 VanDerWaalsContact C-N 3.3Å; G494-T496 PolarHBondContact O-N 2.95Å; T496-V498 PolarHBondContact O-N 3.12Å
497	T	21.9	Very low	39.4	Very low	118 Å²	118	122.8 Å²	122.8	72%	0.724	65%	0.654	S	S	*	*			trans	-55.7	107.9	165.4	48.3	0	0	0	0	108.3	F495 S499	F495-T497 PolarHBondContact O-N 3.07Å; T497-S499 PolarHBondContact O-N 3.2Å
498	V	23.3	Very low	36.2	Very low	102 Å²	102	127.6 Å²	127.6	62%	0.618	67%	0.671	S	S	*	*			trans	-69.1	97.7	179.4	179.4	0	0	0	0	108.1	T496 N500	T496-V498 PolarHBondContact O-N 3.12Å; V498-N500 VanDerWaalsContact C-N 3.33Å; V498-N500 PolarHBondContact O-N 3.08Å
499	S	20.6	Very low	33.5	Very low	103 Å²	103	132 Å²	132	72%	0.72	70%	0.7	S	S	*	*			trans	-66.2	94	169.9	53.5	0	0	0	0	108.2	T497 P501	T497-S499 PolarHBondContact O-N 3.2Å; S499-P501 WeakPolarHBondContact O-CD 3.46Å; S499-P501 VanDerWaalsContact O-N 3.08Å
500	N	22.1	Very low	30.6	Very low	134 Å²	134	134.3 Å²	134.3	72%	0.717	72%	0.721	S	S	*	*			trans	-56.5	107.8	-169.9	-166.9	24.3	0	0	0	111.5	V498 D502	V498-N500 VanDerWaalsContact C-N 3.33Å; V498-N500 PolarHBondContact O-N 3.08Å; N500-D502 PolarHBondContact O-N 2.98Å
501	P	26.3	Very low	28.3	Very low	112 Å²	112	134.9 Å²	134.9	73%	0.727	73%	0.733	S	S	*	*			trans	-100.1	53.4	-165.4	39.4	-33.1	0	0	0	111.8	S499	S499-P501 WeakPolarHBondContact O-CD 3.46Å; S499-P501 VanDerWaalsContact O-N 3.08Å
502	D	23.3	Very low	26.6	Very low	123 Å²	123	131.6 Å²	131.6	66%	0.658	73%	0.733	S	S	*	*			trans	-150.1	104.8	169.8	-112.6	-37.4	0	0	0	112.1	N500	N500-D502 PolarHBondContact O-N 2.98Å
503	T	23	Very low	25.5	Very low	144 Å²	144	128.7 Å²	128.7	88%	0.883	73%	0.732	S	S	*	*			trans	-154.6	94.7	158.3	-24.3	0	0	0	0	108.7	K505	T503-K505 PolarHBondContact O-N 2.89Å
504	I	24.2	Very low	24.3	Very low	150 Å²	150	128.8 Å²	128.8	77%	0.769	75%	0.746	S	S	*	*			trans	-69.1	124.5	-174.4	-65.2	172.8	0	0	0	110.5	K506	I504-K506 PolarHBondContact O-N 3.24Å
505	K	19.9	Very low	23.7	Very low	179 Å²	179	132.2 Å²	132.2	78%	0.778	76%	0.759	S	S	*	*			trans	-11.9	117.3	165.9	-60.3	176.2	178.3	-179.7	0	116.2	T503	T503-K505 PolarHBondContact O-N 2.89Å
506	K	22.6	Very low	23.3	Very low	209 Å²	209	132.4 Å²	132.4	91%	0.909	76%	0.76	S	S	*	*			trans	-140.7	123.9	139.4	-77.9	-165.1	176.2	177.4	0	109.6	I504	I504-K506 PolarHBondContact O-N 3.24Å
507	D	19.8	Very low	23.3	Very low	130 Å²	130	134.4 Å²	134.4	70%	0.695	76%	0.764	S	S	*	*			trans	-92.9	149.7	-178.9	-59.2	-75.8	0	0	0	112.1
508	H	24	Very low	23.1	Very low	176 Å²	176	134.6 Å²	134.6	82%	0.815	77%	0.765	S	S	*	*			trans	67.5	155	162.2	-58.6	-53.6	0	0	0	119.3
509	P	31.1	Very low	23.1	Very low	112 Å²	112	134.9 Å²	134.9	73%	0.727	77%	0.772	S	S	*	*			cis	-134.4	166.5	-31.4	35.5	-18.4	0	0	0	115.2
510	S	20.3	Very low	23.1	Very low	112 Å²	112	137.2 Å²	137.2	78%	0.783	78%	0.776	S	S	*	*			trans	-14.7	131.9	162.8	56.1	0	0	0	0	121.1
511	S	25.4	Very low	23.3	Very low	108 Å²	108	135.2 Å²	135.2	76%	0.755	78%	0.778	S	S	*	*				-176.2	115.5	128.9	51.1	0	0	0	0	116
512	S	22.7	Very low	23	Very low	118 Å²	118	138.1 Å²	138.1	83%	0.825	78%	0.782	S	S	*	*			trans	53.6	160.2	140.6	42.9	0	0	0	0	122.9
513	P	31.1	Very low	22.8	Very low	113 Å²	113	141.9 Å²	141.9	73%	0.734	79%	0.793	S	S	*	*			trans	-125.3	167.7	-146.5	42	-29.1	0	0	0	118.1
514	S	20.8	Very low	22.5	Very low	106 Å²	106	139.9 Å²	139.9	74%	0.741	79%	0.785	S	S	*	*			trans	69.6	152.9	158.9	78.8	0	0	0	0	117.3
515	P	23.9	Very low	22.3	Very low	125 Å²	125	137.9 Å²	137.9	81%	0.812	78%	0.782	S	S	*	*				-136	179.2	74.3	40.2	-26.9	0	0	0	115.8
516	F	19.6	Very low	22.1	Very low	182 Å²	182	138.3 Å²	138.3	80%	0.798	79%	0.787	S	S	*	*			trans	-73.9	150.2	174.1	-67.1	-115.4	0	0	0	112.5
517	I	23.3	Very low	22	Very low	167 Å²	167	135.7 Å²	135.7	86%	0.856	78%	0.782	S	S	*	*			trans	-135.1	134.4	140.6	-62.8	-175	0	0	0	108.3
518	T	18.2	Very low	21.9	Very low	122 Å²	122	134.4 Å²	134.4	75%	0.748	78%	0.784	S	S	*	*			trans	-121.8	139.4	172.2	49.4	0	0	0	0	109
519	S	23.8	Very low	21.9	Very low	108 Å²	108	132.7 Å²	132.7	76%	0.755	78%	0.781	S	S	*	*			trans	-157.8	123	166.3	57	0	0	0	0	111.1
520	D	20.3	Very low	21.5	Very low	151 Å²	151	135 Å²	135	81%	0.807	78%	0.781	S	S	*	*			trans	-70.6	156.1	176.7	-53.5	-87.4	0	0	0	112.9
521	A	25.1	Very low	21.4	Very low	92 Å²	92	137.1 Å²	137.1	76%	0.76	78%	0.784	S	S	*	*			trans	-141	62.1	171.4	0	0	0	0	0	110.8	F523	A521-F523 PolarHBondContact O-N 2.84Å; A521-F523 VanDerWaalsContact O-N 3.16Å
522	H	20	Very low	21.3	Very low	174 Å²	174	142.3 Å²	142.3	81%	0.806	79%	0.793	S	S	*	*			trans	-66.4	107.8	168.2	-102.8	-87.3	0	0	0	109.8
523	F	20.3	Very low	21.1	Very low	202 Å²	202	143.6 Å²	143.6	89%	0.886	79%	0.791	S	S	*	*			trans	-101.1	87.4	170.7	-113.8	-87.4	0	0	0	110.2	A521	A521-F523 PolarHBondContact O-N 2.84Å; A521-F523 VanDerWaalsContact O-N 3.16Å
524	S	16.9	Very low	20.6	Very low	102 Å²	102	143.3 Å²	143.3	71%	0.713	79%	0.792	S	S	*	*			trans	-93.6	128.5	164.1	-61.7	0	0	0	0	108.7
525	C	19.2	Very low	20.6	Very low	107 Å²	107	142.3 Å²	142.3	72%	0.723	80%	0.798	S	S	*	*			trans	-129.8	95.6	173.4	-167.3	0	0	0	0	109.3
526	E	15.8	Very low	20.3	Very low	188 Å²	188	143.8 Å²	143.8	88%	0.879	80%	0.799	S	S	*	*			trans	-79.9	133.2	166.4	-62.9	180	136	0	0	108.7
527	L	21.3	Very low	20.5	Very low	155 Å²	155	140.4 Å²	140.4	81%	0.812	80%	0.796	S	S	*	*			trans	-132.9	103.8	167.2	-99.4	169	0	0	0	109.2
528	S	17.1	Very low	20.3	Very low	103 Å²	103	140.9 Å²	140.9	72%	0.72	79%	0.794	S	S	*	*			trans	-97.4	133.8	176.4	46.5	0	0	0	0	110.9
529	N	23.9	Very low	20.5	Very low	140 Å²	140	144.3 Å²	144.3	75%	0.749	80%	0.802	S	S	*	*			trans	-155	100.1	161.1	-82.2	-53.8	0	0	0	105.6
530	Q	21.6	Very low	20.2	Very low	160 Å²	160	146 Å²	146	75%	0.748	81%	0.808	S	S	*	*				70.5	88.6	81.3	-71.3	-162.8	-12.7	0	0	114
531	D	19.2	Very low	20.2	Very low	156 Å²	156	143.5 Å²	143.5	83%	0.834	80%	0.802	S	S	*	*				27.6	105.2	128.6	-51.1	-18.8	0	0	0	118.2
532	F	22.2	Very low	20	Very low	217 Å²	217	145.6 Å²	145.6	95%	0.952	81%	0.811	S	S	*	*			trans	-104	118.4	148.7	-91.3	-86.7	0	0	0	109.5
533	N	19.3	Very low	20.2	Very low	146 Å²	146	145.6 Å²	145.6	78%	0.781	81%	0.811	S	S	*	*			trans	-111.2	140.3	-168.2	-160.6	-3.3	0	0	0	112.2
534	S	19.8	Very low	20.3	Very low	107 Å²	107	142.1 Å²	142.1	75%	0.748	81%	0.807	S	S	*	*			trans	46.2	102.4	158.2	62.9	0	0	0	0	119
535	G	21.2	Very low	20.4	Very low	85 Å²	85	144.4 Å²	144.4	88%	0.876	81%	0.81	S	S	*	*			trans	-136.2	88.9	166.2	0	0	0	0	0	112.8
536	N	19	Very low	20.5	Very low	155 Å²	155	146 Å²	146	83%	0.829	81%	0.81	S	S	*	*			trans	-91.4	145	164.9	-117.4	-43.7	0	0	0	107.9
537	P	23	Very low	20.8	Very low	112 Å²	112	142 Å²	142	73%	0.727	80%	0.799	S	S	*	*				-148.5	159.1	66.5	40.3	-22.6	0	0	0	117.7
538	Q	18.8	Very low	20.8	Very low	176 Å²	176	141.8 Å²	141.8	82%	0.822	79%	0.794	S	S	*	*			trans	17.5	111	142.6	-61.9	177.9	-18.1	0	0	119
539	Q	21.7	Very low	21.1	Very low	194 Å²	194	140.9 Å²	140.9	91%	0.907	78%	0.784	S	S	*	*			trans	-144.8	147	133.1	-116.2	173.3	20.8	0	0	110.6
540	T	17.7	Very low	21	Very low	145 Å²	145	143.1 Å²	143.1	89%	0.89	79%	0.79	S	S	*	*			trans	-115.3	108.3	-172.4	52.2	0	0	0	0	111.1
541	S	21.7	Very low	21.3	Very low	97 Å²	97	141 Å²	141	68%	0.678	78%	0.778	S	S	*	*			trans	-146.4	132.4	169.7	41.5	0	0	0	0	109.6	E543	S541-E543 PolarHBondContact O-N 3.36Å; S541-E543 VanDerWaalsContact O-N 3.13Å
542	S	19.9	Very low	21.4	Very low	136 Å²	136	142.8 Å²	142.8	95%	0.951	78%	0.782	S	S	*	*			trans	-81.2	91.2	-174.4	-55.9	0	0	0	0	111
543	E	24.3	Very low	21.6	Very low	174 Å²	174	135.2 Å²	135.2	81%	0.813	75%	0.751	S	S	*	*			trans	-106.1	145	170.6	-63.8	-166.7	149.1	0	0	111.2	S541	S541-E543 PolarHBondContact O-N 3.36Å; S541-E543 VanDerWaalsContact O-N 3.13Å
544	T	21.9	Very low	21.9	Very low	129 Å²	129	132.9 Å²	132.9	79%	0.791	74%	0.737	S	S	*	*			trans	-57.9	136	-165.1	-50.8	0	0	0	0	112.5	I546	T544-I546 PolarHBondContact O-N 2.74Å
545	L	19.9	Very low	22.2	Very low	151 Å²	151	130.7 Å²	130.7	79%	0.791	72%	0.722	S	S	*	*			trans	-58.4	102.1	168.6	-109.2	75.8	0	0	0	110	T547	L545-T547 HydrophobicContact CB-CG2 4.48Å; L545-T547 HydrophobicContact CD2-CG2 4.41Å; L545-T547 PolarHBondContact O-N 3.05Å; L545-T547 VanDerWaalsContact O-N 3.15Å
546	I	20.6	Very low	22.7	Very low	139 Å²	139	128 Å²	128	71%	0.713	69%	0.687	S	S	*	*			trans	-73.7	98.3	158.7	-58.3	178.5	0	0	0	105.4	T544 E548	T544-I546 PolarHBondContact O-N 2.74Å; I546-E548 VanDerWaalsContact C-N 3.29Å; I546-E548 HydrophobicContact CG2-CG 4Å; I546-E548 PolarHBondContact O-N 2.87Å
547	T	22.7	Very low	23.3	Very low	105 Å²	105	126.6 Å²	126.6	64%	0.644	68%	0.676	S	S	*	*			trans	-74.4	87.2	173.8	49.1	0	0	0	0	109.1	L545 T549	L545-T547 HydrophobicContact CB-CG2 4.48Å; L545-T547 HydrophobicContact CD2-CG2 4.41Å; L545-T547 PolarHBondContact O-N 3.05Å; L545-T547 VanDerWaalsContact O-N 3.15Å; T547-T549 PolarHBondContact O-N 3.22Å
548	E	22	Very low	23.7	Very low	150 Å²	150	124.7 Å²	124.7	70%	0.701	67%	0.665	S	S	*	*			trans	-65.7	82.8	170.7	-64.6	-174.4	158.5	0	0	110	I546 Q550	I546-E548 VanDerWaalsContact C-N 3.29Å; I546-E548 HydrophobicContact CG2-CG 4Å; I546-E548 PolarHBondContact O-N 2.87Å; E548-Q550 PolarHBondContact O-N 2.88Å; E548-Q550 VanDerWaalsContact O-N 3.13Å
549	T	23.4	Very low	24.4	Very low	85 Å²	85	119.5 Å²	119.5	52%	0.521	64%	0.643	S	S	.	*			trans	-71.3	105.2	171.7	-51.5	0	0	0	0	108.6	T547 F551	T547-T549 PolarHBondContact O-N 3.22Å; T549-F551 HydrophobicContact CG2-CD1 4.17Å; T549-F551 HydrophobicContact CG2-CD2 4.32Å; T549-F551 HydrophobicContact CG2-CE1 3.76Å; T549-F551 HydrophobicContact CG2-CE2 3.91Å; T549-F551 HydrophobicContact CG2-CG 4.44Å; T549-F551 HydrophobicContact CG2-CZ 3.62Å; T549-F551 WeakPolarHBondContact O-CD2 3.41Å; T549-F551 WeakPolarHBondContact O-CE2 3.43Å; T549-F551 PolarHBondContact O-N 2.96Å
550	Q	20.3	Very low	25.1	Very low	187 Å²	187	115 Å²	115	87%	0.874	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-67.8	118.7	167.8	-68	-179.4	-13.9	0	0	108.5	E548	E548-Q550 PolarHBondContact O-N 2.88Å; E548-Q550 VanDerWaalsContact O-N 3.13Å
551	F	28.5	Very low	25.6	Very low	115 Å²	115	112.1 Å²	112.1	50%	0.504	60%	0.604	S	S	.	*	P	Polyproline II helix	trans	-102.9	119.5	-178	-70.3	-80.6	0	0	0	110.7	T549	T549-F551 HydrophobicContact CG2-CD1 4.17Å; T549-F551 HydrophobicContact CG2-CD2 4.32Å; T549-F551 HydrophobicContact CG2-CE1 3.76Å; T549-F551 HydrophobicContact CG2-CE2 3.91Å; T549-F551 HydrophobicContact CG2-CG 4.44Å; T549-F551 HydrophobicContact CG2-CZ 3.62Å; T549-F551 WeakPolarHBondContact O-CD2 3.41Å; T549-F551 WeakPolarHBondContact O-CE2 3.43Å; T549-F551 PolarHBondContact O-N 2.96Å
552	E	22	Very low	25.9	Very low	193 Å²	193	116.1 Å²	116.1	90%	0.902	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-69.8	137.2	162	-70.2	-171.5	135.9	0	0	110
553	I	26.6	Very low	26.4	Very low	58 Å²	58	113.6 Å²	113.6	30%	0.297	59%	0.588	S	S	.	*	P	Polyproline II helix	trans	-86	124.6	-175.8	-71.1	170.9	0	0	0	109.4	S555 F582 I584	I553-S555 PolarHBondContact O-N 2.83Å; I553-F582 HydrophobicContact CD1-CB 4.08Å; I553-F582 WeakPolarHBondContact CD1-O 3.18Å; I553-F582 HydrophobicContact CG2-CB 3.91Å; I553-F582 HydrophobicContact CG2-CD2 4.46Å; I553-I584 HydrophobicContact CD1-CB 4.04Å; I553-I584 HydrophobicContact CD1-CD1 3.77Å; I553-I584 HydrophobicContact CD1-CG1 3.75Å
554	I	25.6	Very low	26.7	Very low	97 Å²	97	110.9 Å²	110.9	50%	0.497	58%	0.579	S	S	.	*			trans	-66.6	104.6	171.5	-61.1	177.7	0	0	0	108.4	S558	I554-S558 VanDerWaalsContact CG2-CB 3.49Å
555	S	25.7	Very low	26.8	Very low	62 Å²	62	109.6 Å²	109.6	43%	0.434	58%	0.576	S	S	.	*			trans	-54.3	141.7	174.5	-70	0	0	0	0	111.7	I553 E557 S558	I553-S555 PolarHBondContact O-N 2.83Å; S555-E557 PolarHBondContact O-N 2.77Å; S555-S558 PolarHBondContact O-N 2.79Å
556	N	32.1	Very low	27.2	Very low	28 Å²	28	109.3 Å²	109.3	15%	0.15	57%	0.573	C	S	.	*	H	α-helix	trans	-56.8	-16	-175.6	-83	-24.3	0	0	0	114.9	L559 L560 L579	N556-L559 PolarHBondContact O-N 3.17Å; N556-L560 HydrophobicContact CB-CD1 4.44Å; N556-L560 WeakPolarHBondContact O-CB 3.23Å; N556-L560 WeakPolarHBondContact O-CG 3.05Å; N556-L560 PolarHBondContact O-N 3.32Å; N556-L579 PolarHBondContact ND2-O 2.9Å; N556-L579 VanDerWaalsContact ND2-O 3.14Å
557	E	31.7	Very low	27.5	Very low	125 Å²	125	110.2 Å²	110.2	58%	0.584	57%	0.572	S	S	*	*	H	α-helix	trans	-56.6	-47	167.6	-64.3	-171.4	144.8	0	0	111.5	S555 L559 L560 D561	S555-E557 PolarHBondContact O-N 2.77Å; E557-L559 VanDerWaalsContact C-N 3.3Å; E557-L559 PolarHBondContact O-N 2.71Å; E557-L560 PolarHBondContact O-N 3.17Å; E557-D561 WeakPolarHBondContact O-CB 3.46Å; E557-D561 PolarHBondContact O-N 3.4Å
558	S	30.7	Very low	27.6	Very low	73 Å²	73	111.8 Å²	111.8	51%	0.51	58%	0.577	S	S	.	*	H	α-helix	trans	-64	-31.7	179.1	171.8	0	0	0	0	113.6	I554 S555	I554-S558 VanDerWaalsContact CG2-CB 3.49Å; S555-S558 PolarHBondContact O-N 2.79Å
559	L	33.9	Very low	27.7	Very low	67 Å²	67	114 Å²	114	35%	0.351	59%	0.587	S	S	.	*	H	α-helix	trans	-83.9	-26	179.8	-80.3	172.6	0	0	0	113.3	N556 E557 I637	N556-L559 PolarHBondContact O-N 3.17Å; E557-L559 VanDerWaalsContact C-N 3.3Å; E557-L559 PolarHBondContact O-N 2.71Å; L559-I637 HydrophobicContact CD2-CD1 3.53Å
560	L	36.7	Very low	27.7	Very low	98 Å²	98	115 Å²	115	51%	0.513	60%	0.597	S	S	.	*	H	α-helix	trans	-106.2	-27.4	-176.3	-63.7	175	0	0	0	113.6	N556 E557 F562 T563	N556-L560 HydrophobicContact CB-CD1 4.44Å; N556-L560 WeakPolarHBondContact O-CB 3.23Å; N556-L560 WeakPolarHBondContact O-CG 3.05Å; N556-L560 PolarHBondContact O-N 3.32Å; E557-L560 PolarHBondContact O-N 3.17Å; L560-F562 VanDerWaalsContact C-N 3.26Å; L560-F562 PolarHBondContact O-N 2.85Å; L560-T563 WeakPolarHBondContact O-CA 3.33Å; L560-T563 WeakPolarHBondContact O-CB 3.39Å; L560-T563 PolarHBondContact O-N 3.45Å; L560-T563 PolarHBondContact O-OG1 2.94Å
561	D	28	Very low	27.8	Very low	86 Å²	86	113.4 Å²	113.4	46%	0.46	59%	0.594	S	S	.	*	G	3₁₀ helix	trans	-71.4	-23.9	173.1	-70.5	-26.1	0	0	0	111.7	E557 T563 N564 S565	E557-D561 WeakPolarHBondContact O-CB 3.46Å; E557-D561 PolarHBondContact O-N 3.4Å; D561-T563 PolarHBondContact O-N 3.4Å; D561-T563 VanDerWaalsContact O-N 3.13Å; D561-N564 PolarHBondContact O-N 3.01Å; D561-S565 VanDerWaalsContact O-CB 3.26Å; D561-S565 WeakPolarHBondContact O-CB 3.26Å; D561-S565 PolarHBondContact O-N 2.86Å
562	F	26.6	Very low	27.6	Very low	181 Å²	181	117.5 Å²	117.5	79%	0.794	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-59.7	-21.7	166.8	-136.4	-80.2	0	0	0	112.4	L560	L560-F562 VanDerWaalsContact C-N 3.26Å; L560-F562 PolarHBondContact O-N 2.85Å
563	T	30.6	Very low	27.8	Very low	82 Å²	82	114.9 Å²	114.9	50%	0.503	61%	0.606	S	S	.	*	G	3₁₀ helix	trans	-85.3	-14.2	174	77.8	0	0	0	0	114	L560 D561	L560-T563 WeakPolarHBondContact O-CA 3.33Å; L560-T563 WeakPolarHBondContact O-CB 3.39Å; L560-T563 PolarHBondContact O-N 3.45Å; L560-T563 PolarHBondContact O-OG1 2.94Å; D561-T563 PolarHBondContact O-N 3.4Å; D561-T563 VanDerWaalsContact O-N 3.13Å
564	N	31	Very low	28	Very low	118 Å²	118	115.3 Å²	115.3	63%	0.631	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125	-14.9	-174.7	-72	-66.5	0	0	0	115.5	D561 I566	D561-N564 PolarHBondContact O-N 3.01Å; N564-I566 PolarHBondContact O-N 3.1Å
565	S	24.9	Very low	28	Very low	102 Å²	102	115.2 Å²	115.2	71%	0.713	62%	0.619	S	S	*	*			trans	-71.7	7.7	-174.2	-157.4	0	0	0	0	114.8	D561	D561-S565 VanDerWaalsContact O-CB 3.26Å; D561-S565 WeakPolarHBondContact O-CB 3.26Å; D561-S565 PolarHBondContact O-N 2.86Å
566	I	27	Very low	28.3	Very low	144 Å²	144	115.3 Å²	115.3	74%	0.738	62%	0.617	S	S	*	*	S	Bend	trans	-107.1	58.5	171.8	-46.5	-176.9	0	0	0	111	N564	N564-I566 PolarHBondContact O-N 3.1Å
567	K	27.5	Very low	28.5	Very low	159 Å²	159	119.3 Å²	119.3	69%	0.691	63%	0.633	S	S	*	*	S	Bend	trans	153.8	125.5	138.6	-82.5	152.8	-171.7	168.3	0	112.2
568	N	25.1	Very low	28.5	Very low	138 Å²	138	119.4 Å²	119.4	74%	0.738	63%	0.628	S	S	*	*			trans	75.8	102.8	164.9	-49.8	-38.9	0	0	0	117.3	S570	N568-S570 PolarHBondContact O-N 3.24Å
569	Q	23.2	Very low	28.6	Very low	195 Å²	195	119.7 Å²	119.7	91%	0.911	62%	0.624	S	S	*	*			trans	-62.2	124.8	157.2	-64.5	167.4	-24.1	0	0	110.5
570	S	23.5	Very low	28.3	Very low	107 Å²	107	118.5 Å²	118.5	75%	0.748	62%	0.621	S	S	*	*			trans	164.3	157	136.9	47.4	0	0	0	0	111.8	N568	N568-S570 PolarHBondContact O-N 3.24Å
571	L	23.9	Very low	28	Very low	153 Å²	153	116 Å²	116	80%	0.801	61%	0.612	S	S	*	*	S	Bend	trans	70.4	69.6	170.4	-56.4	172.4	0	0	0	117.6	L573	L571-L573 PolarHBondContact O-N 2.87Å
572	H	23.9	Very low	28.4	Very low	201 Å²	201	112.4 Å²	112.4	93%	0.931	59%	0.592	S	S	*	*			trans	33.2	81.5	130.8	-146.7	-78.1	0	0	0	117.2
573	L	25.7	Very low	28.6	Very low	138 Å²	138	108.4 Å²	108.4	72%	0.723	59%	0.587	S	S	*	*			trans	-97.5	114.6	-172.4	-87	161	0	0	0	114.8	L571 R578	L571-L573 PolarHBondContact O-N 2.87Å; L573-R578 PolarHBondContact O-NH2 2.93Å
574	T	29.7	Very low	28.7	Very low	67 Å²	67	107.5 Å²	107.5	41%	0.411	58%	0.578	S	S	.	*			trans	34.4	109.7	149.8	51	0	0	0	0	118.6	T576 R578	T574-T576 VanDerWaalsContact C-N 3.28Å; T574-T576 PolarHBondContact O-N 3.47Å; T574-T576 VanDerWaalsContact O-N 3.1Å; T574-R578 PolarHBondContact O-NH2 2.85Å
575	S	26	Very low	28.7	Very low	96 Å²	96	110.6 Å²	110.6	67%	0.671	59%	0.588	S	S	*	*			trans	-78.5	71.6	158.5	59.4	0	0	0	0	111.2
576	T	33.3	Very low	29.4	Very low	63 Å²	63	113.2 Å²	113.2	39%	0.387	59%	0.594	S	S	.	*			trans	-60.6	161.2	157.8	30.7	0	0	0	0	110.2	T574 R578	T574-T576 VanDerWaalsContact C-N 3.28Å; T574-T576 PolarHBondContact O-N 3.47Å; T574-T576 VanDerWaalsContact O-N 3.1Å; T576-R578 PolarHBondContact O-N 2.86Å
577	K	35.8	Very low	30.1	Very low	113 Å²	113	113.9 Å²	113.9	49%	0.491	60%	0.595	S	S	.	*			trans	-67.6	76.5	158.9	-76.2	-156	176.5	-159.1	0	109.5	D354	D354-K577 IonicContact OD2-NZ 2.65Å; D354-K577 PolarHBondContact OD2-NZ 3.09Å
578	R	30.8	Very low	31.3	Very low	127 Å²	127	110.5 Å²	110.5	48%	0.479	59%	0.589	S	S	.	*			trans	-62.6	154.2	165.6	-56.8	178.7	-169.4	-173.6	4.6	107.5	L573 T574 T576 S580	L573-R578 PolarHBondContact O-NH2 2.93Å; T574-R578 PolarHBondContact O-NH2 2.85Å; T576-R578 PolarHBondContact O-N 2.86Å; R578-S580 PolarHBondContact O-N 3.26Å
579	L	34.1	Very low	33.1	Very low	78 Å²	78	106.1 Å²	106.1	41%	0.408	57%	0.565	S	S	.	*			trans	-56.3	110.3	158	-79.1	159.2	0	0	0	106.6	N556	N556-L579 PolarHBondContact ND2-O 2.9Å; N556-L579 VanDerWaalsContact ND2-O 3.14Å
580	S	27.5	Very low	35.4	Very low	43 Å²	43	103.1 Å²	103.1	30%	0.301	55%	0.551	S	S	.	*			trans	-53	146.6	-178.3	24.4	0	0	0	0	109.7	Q357 R578 F582	Q357-S580 PolarHBondContact NE2-O 2.92Å; Q357-S580 PolarHBondContact NE2-OG 3.15Å; R578-S580 PolarHBondContact O-N 3.26Å; S580-F582 PolarHBondContact O-N 2.79Å
581	S	30.1	Very low	38.3	Very low	45 Å²	45	100.5 Å²	100.5	32%	0.315	53%	0.528	S	S	.	.			trans	-45.9	142.2	162.9	45.8	0	0	0	0	109	S583	S581-S583 PolarHBondContact O-N 2.67Å
582	F	36.4	Very low	41.1	Very low	11 Å²	11	98.3 Å²	98.3	5%	0.048	51%	0.512	C	S	.	.			trans	-66.8	82.5	177.6	-59.1	-89.6	0	0	0	109.5	I361 M364 Y391 I553 S580 I584	I361-F582 HydrophobicContact CD1-CD1 4.13Å; I361-F582 HydrophobicContact CD1-CE1 4.45Å; I361-F582 HydrophobicContact CG1-CD1 4.36Å; I361-F582 HydrophobicContact CG1-CE1 4.19Å; M364-F582 HydrophobicContact CE-CE1 4.48Å; M364-F582 HydrophobicContact CE-CZ 4.44Å; Y391-F582 HydrophobicContact CD1-CZ 4.29Å; Y391-F582 HydrophobicContact CD2-CE2 4.19Å; Y391-F582 HydrophobicContact CE1-CZ 4.32Å; Y391-F582 HydrophobicContact CE2-CD2 4.29Å; Y391-F582 HydrophobicContact CE2-CE2 4.23Å; Y391-F582 HydrophobicContact CG-CE2 4.35Å; Y391-F582 HydrophobicContact CG-CZ 4.46Å; I553-F582 HydrophobicContact CD1-CB 4.08Å; I553-F582 WeakPolarHBondContact CD1-O 3.18Å; I553-F582 HydrophobicContact CG2-CB 3.91Å; I553-F582 HydrophobicContact CG2-CD2 4.46Å; S580-F582 PolarHBondContact O-N 2.79Å; F582-I584 HydrophobicContact CB-CG1 4.26Å; F582-I584 PolarHBondContact O-N 3.23Å
583	S	29.7	Very low	44.2	Very low	97 Å²	97	94 Å²	94	68%	0.678	50%	0.499	S	S	*	.			trans	-80.8	72.8	175.1	-61.3	0	0	0	0	108.2	S581 E585	S581-S583 PolarHBondContact O-N 2.67Å; S583-E585 PolarHBondContact O-N 3.28Å; S583-E585 VanDerWaalsContact O-N 3.11Å
584	I	34.5	Very low	47.3	Very low	63 Å²	63	93 Å²	93	32%	0.323	50%	0.495	S	S	.	.			trans	-72.7	103.3	-179.6	-60.3	-175.6	0	0	0	108.8	I361 I553 F582 N586 I589	I361-I584 HydrophobicContact CD1-CD1 4.12Å; I553-I584 HydrophobicContact CD1-CB 4.04Å; I553-I584 HydrophobicContact CD1-CD1 3.77Å; I553-I584 HydrophobicContact CD1-CG1 3.75Å; F582-I584 HydrophobicContact CB-CG1 4.26Å; F582-I584 PolarHBondContact O-N 3.23Å; I584-N586 PolarHBondContact O-N 3.34Å; I584-N586 VanDerWaalsContact O-N 3.14Å; I584-I589 HydrophobicContact CD1-CD1 4.04Å
585	E	31.1	Very low	50.3	Low	182 Å²	182	90.5 Å²	90.5	85%	0.85	48%	0.48	S	S	*	.			trans	-71.9	98.1	159.8	-68.7	-171.4	148.7	0	0	109.1	S583	S583-E585 PolarHBondContact O-N 3.28Å; S583-E585 VanDerWaalsContact O-N 3.11Å
586	N	38.4	Very low	53.3	Low	157 Å²	157	91.5 Å²	91.5	84%	0.84	48%	0.482	S	S	*	.	S	Bend	trans	55.4	66.8	153.3	-57.8	-31.9	0	0	0	119	I584	I584-N586 PolarHBondContact O-N 3.34Å; I584-N586 VanDerWaalsContact O-N 3.14Å
587	E	42.4	Very low	56.1	Low	159 Å²	159	94.9 Å²	94.9	74%	0.743	49%	0.493	S	S	*	.			trans	-151.2	136.8	134.3	-120.6	180	-159.7	0	0	110
588	P	52	Low	58.9	Low	87 Å²	87	89.9 Å²	89.9	57%	0.565	47%	0.472	S	S	*	.			trans	-72.1	137.5	179.5	28.9	-33.9	0	0	0	111.5	H590	P588-H590 PolarHBondContact O-CD2 3.39Å; P588-H590 VanDerWaalsContact O-CD2 3.3Å; P588-H590 PolarHBondContact O-N 2.89Å
589	I	63	Low	61.9	Low	47 Å²	47	85.8 Å²	85.8	24%	0.241	46%	0.461	C	S	.	.			trans	-69.2	101.7	177	-66.5	170.8	0	0	0	109.2	I361 Q365 Y391 I584 I591	I361-I589 HydrophobicContact CG2-CD1 4.43Å; Q365-I589 HydrophobicContact CG-CG2 4.37Å; Y391-I589 WeakPolarHBondContact OH-CD1 3.29Å; I584-I589 HydrophobicContact CD1-CD1 4.04Å; I589-I591 HydrophobicContact CG2-CG1 4.02Å; I589-I591 PolarHBondContact O-N 3.39Å
590	H	71.8	Confident	64.6	Low	132 Å²	132	84 Å²	84	61%	0.611	45%	0.454	S	S	*	.			trans	-73.5	85.2	-179.6	-76.2	-74.5	0	0	0	112.4	P588 K592	P588-H590 PolarHBondContact O-CD2 3.39Å; P588-H590 VanDerWaalsContact O-CD2 3.3Å; P588-H590 PolarHBondContact O-N 2.89Å; H590-K592 PolarHBondContact O-N 3.38Å
591	I	83.4	Confident	67.7	Low	52 Å²	52	82 Å²	82	27%	0.267	44%	0.44	S	S	.	.			trans	-70.9	107.4	176.4	-60.4	171.4	0	0	0	110	H368 R383 A388 I589	H368-I591 WeakPolarHBondContact CE1-CG2 3.27Å; R383-I591 HydrophobicContact CG-CG2 3.91Å; A388-I591 HydrophobicContact CB-CD1 4.03Å; A388-I591 HydrophobicContact CB-CG2 3.75Å; I589-I591 HydrophobicContact CG2-CG1 4.02Å; I589-I591 PolarHBondContact O-N 3.39Å
592	K	84.2	Confident	70.4	Confident	106 Å²	106	83.6 Å²	83.6	46%	0.461	45%	0.445	S	S	.	.			trans	-71.8	128.2	-178.3	-60	178.8	-164.6	152.1	0	111.8	H368 D369 R383 H590 V595	H368-K592 PolarHBondContact CE1-O 3Å; H368-K592 VanDerWaalsContact CE1-O 3.27Å; D369-K592 WeakPolarHBondContact OD2-CD 3.28Å; D369-K592 VanDerWaalsContact OD2-CE 3.31Å; D369-K592 WeakPolarHBondContact OD2-CE 3.31Å; D369-K592 IonicContact OD2-NZ 3.99Å; D369-K592 PolarHBondContact OD2-NZ 3.14Å; R383-K592 PolarHBondContact NH1-O 2.97Å; H590-K592 PolarHBondContact O-N 3.38Å; K592-V595 HydrophobicContact CB-CG2 3.92Å; K592-V595 HydrophobicContact CD-CG2 4.1Å
593	T	88.3	Confident	73	Confident	110 Å²	110	88.7 Å²	88.7	68%	0.675	47%	0.469	S	S	*	.	S	Bend	trans	-82.6	-20.6	178.3	51.4	0	0	0	0	113.7	R383	R383-T593 PolarHBondContact NH2-O 3.07Å; R383-T593 VanDerWaalsContact NH2-O 3.14Å
594	N	89.9	Confident	76.1	Confident	118 Å²	118	84.1 Å²	84.1	63%	0.631	44%	0.437	S	S	*	.			trans	-142.9	139.6	178.2	-174.9	9.3	0	0	0	109
595	V	92.7	Very high	78.8	Confident	14 Å²	14	81.1 Å²	81.1	9%	0.085	42%	0.422	C	S	.	.			trans	-137.6	118	179.2	177.3	0	0	0	0	107.7	D369 T372 Y373 K592 L598	D369-V595 HydrophobicContact CB-CG2 4.05Å; T372-V595 HydrophobicContact CG2-CB 4.2Å; T372-V595 HydrophobicContact CG2-CG2 3.87Å; Y373-V595 HydrophobicContact CD2-CG1 4.43Å; Y373-V595 WeakPolarHBondContact CD2-O 3.28Å; K592-V595 HydrophobicContact CB-CG2 3.92Å; K592-V595 HydrophobicContact CD-CG2 4.1Å; V595-L598 HydrophobicContact CG1-CD2 3.97Å
596	T	90.5	Very high	81.7	Confident	117 Å²	117	76.5 Å²	76.5	72%	0.718	40%	0.401	S	S	*	.	S	Bend	trans	-106.8	-14.5	-176	51.8	0	0	0	0	113.8
597	H	91.9	Very high	84	Confident	135 Å²	135	69.8 Å²	69.8	63%	0.625	37%	0.368	S	S	*	.			trans	-148.7	140.4	179.3	-167.7	-73.8	0	0	0	108.7
598	L	94.4	Very high	86.5	Confident	8 Å²	8	63 Å²	63	4%	0.042	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-99.3	149.7	177	-64.9	175.5	0	0	0	110.5	L370 Y373 V595 F604 Y663	L370-L598 HydrophobicContact CD1-CD1 3.63Å; Y373-L598 HydrophobicContact CD1-CD1 3.64Å; Y373-L598 HydrophobicContact CD1-CG 4.04Å; Y373-L598 HydrophobicContact CD2-CG 4.2Å; Y373-L598 HydrophobicContact CE1-CD1 4.01Å; Y373-L598 HydrophobicContact CE1-CG 4.48Å; Y373-L598 HydrophobicContact CG-CD1 4.02Å; Y373-L598 HydrophobicContact CG-CD2 4.08Å; Y373-L598 HydrophobicContact CG-CG 3.91Å; V595-L598 HydrophobicContact CG1-CD2 3.97Å; L598-F604 HydrophobicContact CB-CE1 4.42Å; L598-F604 HydrophobicContact CB-CZ 4.42Å; L598-F604 HydrophobicContact CD1-CE1 4.14Å; L598-F604 HydrophobicContact CD1-CZ 4.29Å; L598-F604 HydrophobicContact CD2-CE1 4.49Å; L598-F604 HydrophobicContact CD2-CE2 4.39Å; L598-F604 HydrophobicContact CD2-CZ 3.85Å; L598-F604 HydrophobicContact CG-CZ 4.41Å; L598-Y663 HydrophobicContact CB-CD2 4.09Å; L598-Y663 HydrophobicContact CB-CE2 3.75Å; L598-Y663 HydrophobicContact CD1-CD2 3.82Å; L598-Y663 HydrophobicContact CD1-CE2 4.19Å
599	P	93.2	Very high	88.6	Confident	40 Å²	40	59 Å²	59	26%	0.26	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-59	156.4	175.3	-20.3	31.3	0	0	0	112.4	Q603 F604 Y663	P599-Q603 HydrophobicContact CB-CB 4.43Å; P599-F604 HydrophobicContact CB-CB 4.05Å; P599-F604 HydrophobicContact CB-CD2 4.22Å; P599-F604 HydrophobicContact CB-CG 4.44Å; P599-F604 HydrophobicContact CG-CD2 3.84Å; P599-F604 HydrophobicContact CG-CE2 4.39Å; P599-Y663 WeakPolarHBondContact O-CE2 3.28Å; P599-Y663 PolarHBondContact O-OH 3.45Å
600	P	91.7	Very high	90.2	Very high	41 Å²	41	56.8 Å²	56.8	27%	0.266	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-66.8	156.7	-179.3	28.1	-35.6	0	0	0	112.5	N602 Q603 F604 Y663 N667	P600-N602 WeakPolarHBondContact CG-OD1 3.38Å; P600-N602 PolarHBondContact O-N 3.45Å; P600-Q603 HydrophobicContact CG-CB 4.24Å; P600-Q603 HydrophobicContact CG-CG 4.09Å; P600-Q603 PolarHBondContact O-N 3.27Å; P600-F604 PolarHBondContact O-N 3.16Å; P600-Y663 VanDerWaalsContact C-OH 3.27Å; P600-N667 WeakPolarHBondContact CA-OD1 3.31Å
601	P	91.7	Very high	91.5	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-26.2	-170.2	-28.7	35.5	0	0	0	116	V424 Q603 P609 Y663 L664 N667 F669	V424-P601 HydrophobicContact CG1-CB 3.91Å; V424-P601 VanDerWaalsContact CG1-O 3.28Å; V424-P601 WeakPolarHBondContact CG1-O 3.25Å; V424-P601 HydrophobicContact CG2-CB 4.18Å; P601-Q603 VanDerWaalsContact C-N 3.34Å; P601-P609 HydrophobicContact CB-CG 4.23Å; P601-P609 WeakPolarHBondContact O-CD 3.42Å; P601-Y663 VanDerWaalsContact CA-OH 3.28Å; P601-Y663 WeakPolarHBondContact CA-OH 3.46Å; P601-Y663 HydrophobicContact CB-CE1 4.3Å; P601-Y663 HydrophobicContact CG-CE1 3.81Å; P601-Y663 VanDerWaalsContact N-OH 3.14Å; P601-L664 HydrophobicContact CB-CD2 4.4Å; P601-L664 HydrophobicContact CG-CD2 3.95Å; P601-N667 HydrophobicContact CG-CB 4.28Å; P601-F669 HydrophobicContact CB-CD1 4.27Å; P601-F669 HydrophobicContact CB-CE1 3.99Å; P601-F669 HydrophobicContact CB-CE2 4.4Å; P601-F669 HydrophobicContact CB-CZ 4.06Å; P601-F669 HydrophobicContact CG-CD1 4.06Å; P601-F669 HydrophobicContact CG-CD2 3.78Å; P601-F669 HydrophobicContact CG-CE1 4.11Å; P601-F669 HydrophobicContact CG-CE2 3.84Å; P601-F669 HydrophobicContact CG-CG 3.9Å; P601-F669 HydrophobicContact CG-CZ 4Å
602	N	88.4	Confident	92.2	Very high	79 Å²	79	48.1 Å²	48.1	42%	0.422	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-14.5	177	61.9	-18.3	0	0	0	113.9	P600	P600-N602 WeakPolarHBondContact CG-OD1 3.38Å; P600-N602 PolarHBondContact O-N 3.45Å
603	Q	90.1	Very high	92.9	Very high	118 Å²	118	43.3 Å²	43.3	55%	0.551	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.9	-42.4	177.8	-65.5	177	-3.8	0	0	111.6	P599 P600 P601 Q606	P599-Q603 HydrophobicContact CB-CB 4.43Å; P600-Q603 HydrophobicContact CG-CB 4.24Å; P600-Q603 HydrophobicContact CG-CG 4.09Å; P600-Q603 PolarHBondContact O-N 3.27Å; P601-Q603 VanDerWaalsContact C-N 3.34Å; Q603-Q606 WeakPolarHBondContact O-CA 3.46Å; Q603-Q606 PolarHBondContact O-N 3.44Å; Q603-Q606 VanDerWaalsContact O-N 3.13Å
604	F	93.9	Very high	93.3	Very high	1 Å²	1	38.1 Å²	38.1	0%	0.004	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-66.4	135.3	-174.1	-163.9	-140.9	0	0	0	112.5	D366 L370 L598 P599 P600 Q606 G607 P609 L612 F613 Y663	D366-F604 HydrophobicContact CB-CD2 3.94Å; D366-F604 HydrophobicContact CB-CE2 3.65Å; D366-F604 WeakPolarHBondContact OD1-CD2 3.35Å; L370-F604 HydrophobicContact CB-CZ 3.94Å; L370-F604 HydrophobicContact CD1-CE1 4.24Å; L370-F604 HydrophobicContact CD1-CZ 4.28Å; L370-F604 HydrophobicContact CD2-CE1 4.41Å; L370-F604 HydrophobicContact CD2-CZ 4.49Å; L370-F604 HydrophobicContact CG-CZ 4.44Å; L598-F604 HydrophobicContact CB-CE1 4.42Å; L598-F604 HydrophobicContact CB-CZ 4.42Å; L598-F604 HydrophobicContact CD1-CE1 4.14Å; L598-F604 HydrophobicContact CD1-CZ 4.29Å; L598-F604 HydrophobicContact CD2-CE1 4.49Å; L598-F604 HydrophobicContact CD2-CE2 4.39Å; L598-F604 HydrophobicContact CD2-CZ 3.85Å; L598-F604 HydrophobicContact CG-CZ 4.41Å; P599-F604 HydrophobicContact CB-CB 4.05Å; P599-F604 HydrophobicContact CB-CD2 4.22Å; P599-F604 HydrophobicContact CB-CG 4.44Å; P599-F604 HydrophobicContact CG-CD2 3.84Å; P599-F604 HydrophobicContact CG-CE2 4.39Å; P600-F604 PolarHBondContact O-N 3.16Å; F604-Q606 PolarHBondContact O-N 3.1Å; F604-G607 PolarHBondContact O-N 2.85Å; F604-G607 VanDerWaalsContact O-N 3.17Å; F604-P609 HydrophobicContact CB-CB 4.3Å; F604-P609 HydrophobicContact CD1-CB 3.97Å; F604-P609 WeakPolarHBondContact O-CD 3.05Å; F604-L612 HydrophobicContact CD1-CD1 3.7Å; F604-L612 HydrophobicContact CD2-CD1 3.8Å; F604-L612 HydrophobicContact CE1-CD1 3.62Å; F604-L612 HydrophobicContact CE2-CD1 3.72Å; F604-L612 HydrophobicContact CG-CD1 3.81Å; F604-L612 HydrophobicContact CZ-CD1 3.65Å; F604-F613 HydrophobicContact CD1-CE2 4.48Å; F604-F613 HydrophobicContact CE1-CE2 4.13Å; F604-F613 HydrophobicContact CE1-CZ 4.46Å; F604-Y663 WeakPolarHBondContact CB-OH 3.17Å; F604-Y663 HydrophobicContact CD1-CE1 4.36Å; F604-Y663 HydrophobicContact CD1-CE2 4.03Å; F604-Y663 AromaticContact CD1-CZ 3.7Å; F604-Y663 WeakPolarHBondContact CD1-OH 3.27Å; F604-Y663 HydrophobicContact CE1-CE2 4.36Å
605	G	93	Very high	93.8	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.01	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	62	28.8	-174.2	0	0	0	0	0	112.1	N363 D366 G607 N608	N363-G605 VanDerWaalsContact OD1-C 3.31Å; N363-G605 WeakPolarHBondContact OD1-CA 3.38Å; N363-G605 PolarHBondContact OD1-O 2.69Å; D366-G605 WeakPolarHBondContact OD2-CA 3.41Å; D366-G605 PolarHBondContact OD2-N 3.5Å; G605-G607 PolarHBondContact O-N 3.14Å; G605-N608 PolarHBondContact O-N 2.89Å
606	Q	90	Very high	94	Very high	85 Å²	85	31.8 Å²	31.8	40%	0.397	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	54	39.2	-174.6	-50.1	-62.8	-70.8	0	0	112.3	I359 N363 Q603 F604	I359-Q606 HydrophobicContact CG2-CG 4.24Å; N363-Q606 WeakPolarHBondContact ND2-CG 3.49Å; Q603-Q606 WeakPolarHBondContact O-CA 3.46Å; Q603-Q606 PolarHBondContact O-N 3.44Å; Q603-Q606 VanDerWaalsContact O-N 3.13Å; F604-Q606 PolarHBondContact O-N 3.1Å
607	G	88.6	Confident	94.4	Very high	15 Å²	15	26.2 Å²	26.2	16%	0.155	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	84.7	2.3	-176.9	0	0	0	0	0	115.1	L421 F604 G605 P609	L421-G607 WeakPolarHBondContact CD1-O 3.27Å; F604-G607 PolarHBondContact O-N 2.85Å; F604-G607 VanDerWaalsContact O-N 3.17Å; G605-G607 PolarHBondContact O-N 3.14Å; G607-P609 WeakPolarHBondContact O-CD 3.3Å
608	N	93.3	Very high	94.7	Very high	18 Å²	18	19.8 Å²	19.8	10%	0.096	11%	0.107	C	C	.	.			trans	-118	56.8	174	-164.1	-12.9	0	0	0	111.4	Q417 L421 G605 F610 L611	Q417-N608 PolarHBondContact NE2-ND2 3.33Å; Q417-N608 PolarHBondContact NE2-OD1 3.23Å; L421-N608 HydrophobicContact CD1-CB 4.06Å; G605-N608 PolarHBondContact O-N 2.89Å; N608-F610 VanDerWaalsContact C-N 3.26Å; N608-F610 PolarHBondContact O-N 3Å; N608-L611 WeakPolarHBondContact O-CB 3.16Å; N608-L611 PolarHBondContact O-N 2.84Å; N608-L611 VanDerWaalsContact O-N 3.15Å
609	P	96.1	Very high	94.9	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.006	11%	0.105	C	C	.	.	H	α-helix	trans	-61.4	-31.3	-171.4	25	-35.7	0	0	0	113	V424 P601 F604 G607 L611 L612 F613 F660 Y663	V424-P609 HydrophobicContact CG2-CG 4.14Å; P601-P609 HydrophobicContact CB-CG 4.23Å; P601-P609 WeakPolarHBondContact O-CD 3.42Å; F604-P609 HydrophobicContact CB-CB 4.3Å; F604-P609 HydrophobicContact CD1-CB 3.97Å; F604-P609 WeakPolarHBondContact O-CD 3.05Å; G607-P609 WeakPolarHBondContact O-CD 3.3Å; P609-L611 PolarHBondContact O-N 2.92Å; P609-L612 WeakPolarHBondContact O-CA 3.34Å; P609-L612 VanDerWaalsContact O-CB 3.23Å; P609-L612 WeakPolarHBondContact O-CB 3.4Å; P609-L612 PolarHBondContact O-N 2.95Å; P609-F613 VanDerWaalsContact O-CD2 3.3Å; P609-F613 WeakPolarHBondContact O-CD2 3.05Å; P609-F613 PolarHBondContact O-N 2.91Å; P609-F660 HydrophobicContact CB-CE2 4Å; P609-F660 HydrophobicContact CG-CE2 3.72Å; P609-F660 HydrophobicContact CG-CZ 4.08Å; P609-Y663 HydrophobicContact CB-CE1 4.2Å
610	F	97.7	Very high	95.1	Very high	1 Å²	1	19 Å²	19	0%	0.004	10%	0.101	C	C	.	.	H	α-helix	trans	-62.5	-26.5	-179.7	-171.2	-108	0	0	0	113.5	Y207 Q417 A420 N608 L612 F613 L614 L653 A656 K657 F660	Y207-F610 HydrophobicContact CE2-CD2 4.06Å; Y207-F610 HydrophobicContact CE2-CE1 4.35Å; Y207-F610 AromaticContact CE2-CE2 3.67Å; Y207-F610 HydrophobicContact CE2-CE2 3.67Å; Y207-F610 AromaticContact CE2-CZ 3.82Å; Y207-F610 HydrophobicContact CE2-CZ 3.82Å; Q417-F610 HydrophobicContact CB-CD1 4.23Å; Q417-F610 HydrophobicContact CG-CD1 4.35Å; A420-F610 HydrophobicContact CB-CB 3.63Å; A420-F610 HydrophobicContact CB-CD1 3.98Å; A420-F610 HydrophobicContact CB-CD2 4.42Å; A420-F610 HydrophobicContact CB-CG 3.75Å; N608-F610 VanDerWaalsContact C-N 3.26Å; N608-F610 PolarHBondContact O-N 3Å; F610-L612 VanDerWaalsContact C-N 3.29Å; F610-L612 PolarHBondContact O-N 3.02Å; F610-F613 HydrophobicContact CD2-CB 4.44Å; F610-F613 PolarHBondContact O-N 3.09Å; F610-L614 HydrophobicContact CD1-CD1 3.77Å; F610-L614 HydrophobicContact CD1-CG 3.96Å; F610-L614 HydrophobicContact CE1-CD1 3.62Å; F610-L614 HydrophobicContact CE1-CD2 3.93Å; F610-L614 HydrophobicContact CE1-CG 3.66Å; F610-L614 HydrophobicContact CZ-CD2 4.07Å; F610-L614 HydrophobicContact CZ-CG 4.11Å; F610-L614 WeakPolarHBondContact O-CG 3.01Å; F610-L614 PolarHBondContact O-N 3.44Å; F610-L653 HydrophobicContact CE1-CD1 4.3Å; F610-L653 HydrophobicContact CZ-CD1 3.93Å; F610-A656 HydrophobicContact CE2-CB 4.18Å; F610-A656 HydrophobicContact CZ-CB 4.29Å; F610-K657 HydrophobicContact CE2-CG 4.06Å; F610-K657 HydrophobicContact CZ-CG 4Å; F610-F660 HydrophobicContact CB-CD1 4.32Å; F610-F660 HydrophobicContact CB-CE1 4.07Å; F610-F660 HydrophobicContact CB-CE2 4.5Å; F610-F660 HydrophobicContact CB-CZ 4.18Å; F610-F660 HydrophobicContact CD2-CB 3.88Å; F610-F660 AromaticContact CD2-CD1 3.4Å; F610-F660 HydrophobicContact CD2-CD1 3.4Å; F610-F660 HydrophobicContact CD2-CD2 4.45Å; F610-F660 AromaticContact CD2-CE1 3.95Å; F610-F660 HydrophobicContact CD2-CE1 3.95Å; F610-F660 AromaticContact CD2-CG 3.68Å; F610-F660 HydrophobicContact CD2-CG 3.68Å; F610-F660 HydrophobicContact CE2-CB 4.23Å; F610-F660 HydrophobicContact CE2-CD1 4.1Å; F610-F660 HydrophobicContact CE2-CG 4.43Å; F610-F660 HydrophobicContact CG-CD1 4.24Å; F610-F660 HydrophobicContact CG-CE1 4.36Å
611	L	97.8	Very high	95.4	Very high	2 Å²	2	18 Å²	18	1%	0.01	9%	0.092	C	C	.	.	H	α-helix	trans	-65.5	-33.3	172.2	-176.5	57.4	0	0	0	111.9	F397 L401 N608 P609 S615	F397-L611 HydrophobicContact CD1-CD2 3.79Å; F397-L611 HydrophobicContact CD1-CG 4.07Å; F397-L611 HydrophobicContact CE1-CD2 4.35Å; F397-L611 HydrophobicContact CE1-CG 4.18Å; L401-L611 HydrophobicContact CD1-CD1 3.82Å; L401-L611 HydrophobicContact CG-CD1 4.11Å; N608-L611 WeakPolarHBondContact O-CB 3.16Å; N608-L611 PolarHBondContact O-N 2.84Å; N608-L611 VanDerWaalsContact O-N 3.15Å; P609-L611 PolarHBondContact O-N 2.92Å; L611-S615 VanDerWaalsContact O-CB 3.31Å; L611-S615 WeakPolarHBondContact O-CB 3.38Å; L611-S615 PolarHBondContact O-N 3.31Å; L611-S615 PolarHBondContact O-OG 2.8Å
612	L	98.4	Very high	95.6	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-66.8	-43.3	170.8	-53.8	171	0	0	0	110.9	N363 D366 L367 L370 F397 F604 P609 F610 S615 L616	N363-L612 WeakPolarHBondContact O-CD2 3.3Å; D366-L612 HydrophobicContact CB-CD1 3.74Å; D366-L612 HydrophobicContact CB-CD2 3.95Å; L367-L612 HydrophobicContact CB-CD2 4.06Å; L370-L612 HydrophobicContact CD2-CB 3.56Å; F397-L612 HydrophobicContact CE1-CD2 3.72Å; F397-L612 HydrophobicContact CZ-CD2 3.78Å; F604-L612 HydrophobicContact CD1-CD1 3.7Å; F604-L612 HydrophobicContact CD2-CD1 3.8Å; F604-L612 HydrophobicContact CE1-CD1 3.62Å; F604-L612 HydrophobicContact CE2-CD1 3.72Å; F604-L612 HydrophobicContact CG-CD1 3.81Å; F604-L612 HydrophobicContact CZ-CD1 3.65Å; P609-L612 WeakPolarHBondContact O-CA 3.34Å; P609-L612 VanDerWaalsContact O-CB 3.23Å; P609-L612 WeakPolarHBondContact O-CB 3.4Å; P609-L612 PolarHBondContact O-N 2.95Å; F610-L612 VanDerWaalsContact C-N 3.29Å; F610-L612 PolarHBondContact O-N 3.02Å; L612-S615 PolarHBondContact O-N 3.49Å; L612-L616 WeakPolarHBondContact O-CB 3.44Å; L612-L616 PolarHBondContact O-N 2.98Å
613	F	98.5	Very high	96	Very high	5 Å²	5	15.9 Å²	15.9	2%	0.022	8%	0.079	C	C	.	.	H	α-helix	trans	-67.6	-34.5	178.9	-75.3	-82.6	0	0	0	113.2	L370 F604 P609 F610 S617 A656 L659 F660 Y663	L370-F613 HydrophobicContact CD1-CD1 4.35Å; L370-F613 HydrophobicContact CD1-CE1 3.64Å; L370-F613 HydrophobicContact CD1-CE2 4.4Å; L370-F613 HydrophobicContact CD1-CZ 3.65Å; L370-F613 HydrophobicContact CD2-CD1 4.14Å; L370-F613 HydrophobicContact CD2-CD2 4.29Å; L370-F613 HydrophobicContact CD2-CE1 4.19Å; L370-F613 HydrophobicContact CD2-CE2 4.3Å; L370-F613 HydrophobicContact CD2-CG 4.2Å; L370-F613 HydrophobicContact CD2-CZ 4.25Å; F604-F613 HydrophobicContact CD1-CE2 4.48Å; F604-F613 HydrophobicContact CE1-CE2 4.13Å; F604-F613 HydrophobicContact CE1-CZ 4.46Å; P609-F613 VanDerWaalsContact O-CD2 3.3Å; P609-F613 WeakPolarHBondContact O-CD2 3.05Å; P609-F613 PolarHBondContact O-N 2.91Å; F610-F613 HydrophobicContact CD2-CB 4.44Å; F610-F613 PolarHBondContact O-N 3.09Å; F613-S617 WeakPolarHBondContact O-CB 3.22Å; F613-S617 PolarHBondContact O-N 2.86Å; F613-A656 HydrophobicContact CB-CB 4.45Å; F613-A656 WeakPolarHBondContact O-CB 3.34Å; F613-L659 HydrophobicContact CD1-CB 3.6Å; F613-L659 HydrophobicContact CE1-CB 3.91Å; F613-F660 HydrophobicContact CB-CB 4.18Å; F613-F660 HydrophobicContact CD1-CB 4.27Å; F613-F660 HydrophobicContact CD2-CB 4.06Å; F613-F660 AromaticContact CD2-CD2 3.47Å; F613-F660 HydrophobicContact CD2-CD2 3.47Å; F613-F660 VanDerWaalsContact CD2-CD2 3.47Å; F613-F660 HydrophobicContact CD2-CE2 4.3Å; F613-F660 HydrophobicContact CD2-CG 4.14Å; F613-F660 AromaticContact CE2-CD2 3.66Å; F613-F660 HydrophobicContact CE2-CD2 3.66Å; F613-F660 HydrophobicContact CE2-CE2 4.4Å; F613-F660 HydrophobicContact CG-CB 3.89Å; F613-F660 HydrophobicContact CG-CD2 4.2Å; F613-F660 HydrophobicContact CG-CG 4.45Å; F613-F660 HydrophobicContact CZ-CD2 4.48Å; F613-Y663 AromaticContact CE2-CD1 3.59Å; F613-Y663 HydrophobicContact CE2-CD1 3.59Å; F613-Y663 HydrophobicContact CE2-CE1 4.01Å; F613-Y663 AromaticContact CE2-CG 3.86Å; F613-Y663 HydrophobicContact CE2-CG 3.86Å; F613-Y663 VanDerWaalsContact CZ-CB 3.49Å; F613-Y663 AromaticContact CZ-CD1 3.74Å; F613-Y663 HydrophobicContact CZ-CD1 3.74Å; F613-Y663 HydrophobicContact CZ-CD2 4.1Å; F613-Y663 HydrophobicContact CZ-CE1 4.48Å; F613-Y663 AromaticContact CZ-CG 3.5Å; F613-Y663 HydrophobicContact CZ-CG 3.5Å
614	L	98.4	Very high	96.3	Very high	1 Å²	1	14.3 Å²	14.3	1%	0.005	7%	0.072	C	C	.	.	H	α-helix	trans	-64.1	-45.7	168.6	-73.4	170.6	0	0	0	111.4	L401 M413 Q417 F610 S617 L618 L653 A656	L401-L614 HydrophobicContact CD1-CB 3.46Å; L401-L614 VanDerWaalsContact CD1-CB 3.46Å; L401-L614 HydrophobicContact CD1-CD1 4.1Å; L401-L614 HydrophobicContact CD1-CG 4.38Å; M413-L614 HydrophobicContact SD-CD2 3.85Å; Q417-L614 HydrophobicContact CB-CD1 4.29Å; Q417-L614 HydrophobicContact CG-CD1 4.39Å; F610-L614 HydrophobicContact CD1-CD1 3.77Å; F610-L614 HydrophobicContact CD1-CG 3.96Å; F610-L614 HydrophobicContact CE1-CD1 3.62Å; F610-L614 HydrophobicContact CE1-CD2 3.93Å; F610-L614 HydrophobicContact CE1-CG 3.66Å; F610-L614 HydrophobicContact CZ-CD2 4.07Å; F610-L614 HydrophobicContact CZ-CG 4.11Å; F610-L614 WeakPolarHBondContact O-CG 3.01Å; F610-L614 PolarHBondContact O-N 3.44Å; L614-S617 WeakPolarHBondContact O-CB 3.39Å; L614-S617 PolarHBondContact O-N 2.93Å; L614-L618 PolarHBondContact O-N 2.89Å; L614-L653 HydrophobicContact CD2-CD1 3.96Å; L614-A656 HydrophobicContact CD2-CB 3.75Å; L614-A656 HydrophobicContact CG-CB 4.22Å
615	S	98.6	Very high	96.3	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-64.3	-45.4	179.5	-60.6	0	0	0	0	112.5	W396 L611 L612 S617 L618 I619	W396-S615 WeakPolarHBondContact CZ3-O 3.22Å; L611-S615 VanDerWaalsContact O-CB 3.31Å; L611-S615 WeakPolarHBondContact O-CB 3.38Å; L611-S615 PolarHBondContact O-N 3.31Å; L611-S615 PolarHBondContact O-OG 2.8Å; L612-S615 PolarHBondContact O-N 3.49Å; S615-S617 VanDerWaalsContact C-N 3.33Å; S615-S617 PolarHBondContact O-N 3.3Å; S615-L618 PolarHBondContact O-N 3.41Å; S615-I619 WeakPolarHBondContact O-CG1 3.36Å; S615-I619 PolarHBondContact O-N 3.08Å
616	L	98.7	Very high	96.3	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-61.1	-43.6	172.2	174.1	66.8	0	0	0	110.4	L367 L370 L371 T374 L612 L618 I619 L620 L659	L367-L616 HydrophobicContact CD1-CB 4.05Å; L370-L616 HydrophobicContact CD1-CD2 4.17Å; L370-L616 HydrophobicContact CD2-CB 4Å; L370-L616 HydrophobicContact CD2-CD2 4.11Å; L370-L616 HydrophobicContact CG-CB 4.31Å; L370-L616 HydrophobicContact CG-CD2 3.69Å; L370-L616 HydrophobicContact CG-CG 4.47Å; L371-L616 HydrophobicContact CB-CD1 4.11Å; L371-L616 HydrophobicContact CD1-CD1 3.66Å; T374-L616 HydrophobicContact CG2-CD2 3.99Å; T374-L616 WeakPolarHBondContact OG1-CD2 3.21Å; L612-L616 WeakPolarHBondContact O-CB 3.44Å; L612-L616 PolarHBondContact O-N 2.98Å; L616-L618 VanDerWaalsContact C-N 3.26Å; L616-L618 PolarHBondContact O-N 3.42Å; L616-I619 WeakPolarHBondContact O-CB 3.37Å; L616-I619 PolarHBondContact O-N 3.3Å; L616-I619 VanDerWaalsContact O-N 3.08Å; L616-L620 HydrophobicContact CD1-CD1 3.96Å; L616-L620 HydrophobicContact CD1-CD2 4.38Å; L616-L620 HydrophobicContact CD1-CG 3.89Å; L616-L620 HydrophobicContact CD2-CD1 4.07Å; L616-L620 HydrophobicContact CG-CD1 3.76Å; L616-L620 HydrophobicContact CG-CG 4.1Å; L616-L620 WeakPolarHBondContact O-CG 3.42Å; L616-L620 PolarHBondContact O-N 3.3Å; L616-L659 HydrophobicContact CD2-CD1 4.03Å
617	S	98.5	Very high	96.6	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-63	-34.1	-179.7	-177.6	0	0	0	0	112.7	F613 L614 S615 E621 I652 R655 A656	F613-S617 WeakPolarHBondContact O-CB 3.22Å; F613-S617 PolarHBondContact O-N 2.86Å; L614-S617 WeakPolarHBondContact O-CB 3.39Å; L614-S617 PolarHBondContact O-N 2.93Å; S615-S617 VanDerWaalsContact C-N 3.33Å; S615-S617 PolarHBondContact O-N 3.3Å; S617-E621 WeakPolarHBondContact O-CB 3.31Å; S617-E621 PolarHBondContact O-N 3.41Å; S617-I652 WeakPolarHBondContact CB-O 3.48Å; S617-I652 WeakPolarHBondContact OG-CA 3.4Å; S617-I652 PolarHBondContact OG-O 3.48Å; S617-R655 PolarHBondContact O-NH1 3.1Å; S617-R655 WeakPolarHBondContact OG-CB 3.34Å; S617-R655 WeakPolarHBondContact OG-CD 3.49Å; S617-R655 PolarHBondContact OG-NH1 2.87Å; S617-A656 PolarHBondContact OG-N 3.38Å
618	L	98.2	Very high	96.9	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-68.9	-37.4	171.3	176.5	58	0	0	0	112.3	W396 L401 E404 L614 S615 L616 E621 Y622 Y640 I652	W396-L618 HydrophobicContact CD2-CD2 4.25Å; W396-L618 HydrophobicContact CE3-CD2 4.48Å; W396-L618 HydrophobicContact CH2-CB 4.47Å; W396-L618 HydrophobicContact CH2-CD2 3.81Å; W396-L618 HydrophobicContact CH2-CG 3.97Å; W396-L618 HydrophobicContact CZ2-CD2 3.53Å; W396-L618 HydrophobicContact CZ2-CG 4.06Å; W396-L618 HydrophobicContact CZ3-CD2 4.28Å; L401-L618 HydrophobicContact CD2-CD2 3.95Å; E404-L618 HydrophobicContact CB-CD2 4.09Å; E404-L618 HydrophobicContact CG-CD2 3.88Å; L614-L618 PolarHBondContact O-N 2.89Å; S615-L618 PolarHBondContact O-N 3.41Å; L616-L618 VanDerWaalsContact C-N 3.26Å; L616-L618 PolarHBondContact O-N 3.42Å; L618-E621 WeakPolarHBondContact O-CB 3.35Å; L618-Y622 HydrophobicContact CD1-CE2 4.11Å; L618-Y640 HydrophobicContact CD1-CD1 4.43Å; L618-Y640 HydrophobicContact CD1-CE1 3.87Å; L618-Y640 HydrophobicContact CD2-CE1 4.33Å; L618-Y640 HydrophobicContact CG-CD1 4.42Å; L618-Y640 HydrophobicContact CG-CE1 3.8Å; L618-Y640 PolarHBondContact O-OH 3.04Å; L618-I652 HydrophobicContact CD1-CD1 3.82Å
619	I	98.4	Very high	96.7	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-63.8	-49.5	171.9	-69.8	168.7	0	0	0	111.2	L367 L371 L378 F382 M390 F392 W396 S615 L616 E621 Y622 K623 I626 Y640	L367-I619 HydrophobicContact CD2-CD1 4.21Å; L367-I619 HydrophobicContact CG-CD1 4.45Å; L371-I619 HydrophobicContact CD1-CG2 4.49Å; L378-I619 HydrophobicContact CD2-CG2 3.78Å; F382-I619 HydrophobicContact CE1-CG2 4.44Å; F382-I619 HydrophobicContact CE2-CD1 4.35Å; F382-I619 HydrophobicContact CZ-CG2 3.78Å; M390-I619 HydrophobicContact CE-CD1 4.27Å; M390-I619 HydrophobicContact SD-CD1 4.24Å; F392-I619 HydrophobicContact CZ-CD1 4.2Å; F392-I619 HydrophobicContact CZ-CG1 4.49Å; W396-I619 HydrophobicContact CH2-CD1 4.34Å; W396-I619 HydrophobicContact CH2-CG1 3.76Å; W396-I619 HydrophobicContact CZ3-CD1 3.99Å; W396-I619 HydrophobicContact CZ3-CG1 3.82Å; S615-I619 WeakPolarHBondContact O-CG1 3.36Å; S615-I619 PolarHBondContact O-N 3.08Å; L616-I619 WeakPolarHBondContact O-CB 3.37Å; L616-I619 PolarHBondContact O-N 3.3Å; L616-I619 VanDerWaalsContact O-N 3.08Å; I619-E621 VanDerWaalsContact C-N 3.28Å; I619-E621 PolarHBondContact O-N 3.41Å; I619-Y622 PolarHBondContact O-N 2.94Å; I619-Y622 VanDerWaalsContact O-N 3.14Å; I619-K623 PolarHBondContact O-N 2.92Å; I619-I626 HydrophobicContact CG2-CD1 4.47Å; I619-Y640 WeakPolarHBondContact CA-OH 3.44Å
620	L	98	Very high	96.4	Very high	32 Å²	32	17.7 Å²	17.7	17%	0.168	9%	0.086	C	C	.	.	H	α-helix	trans	-67.9	-24.3	-178.5	-66.5	176.1	0	0	0	113.2	T374 D375 L378 L616 Y622 L659	T374-L620 HydrophobicContact CG2-CD1 4.25Å; D375-L620 HydrophobicContact CB-CD2 4.18Å; L378-L620 HydrophobicContact CD2-CD2 4.09Å; L616-L620 HydrophobicContact CD1-CD1 3.96Å; L616-L620 HydrophobicContact CD1-CD2 4.38Å; L616-L620 HydrophobicContact CD1-CG 3.89Å; L616-L620 HydrophobicContact CD2-CD1 4.07Å; L616-L620 HydrophobicContact CG-CD1 3.76Å; L616-L620 HydrophobicContact CG-CG 4.1Å; L616-L620 WeakPolarHBondContact O-CG 3.42Å; L616-L620 PolarHBondContact O-N 3.3Å; L620-Y622 PolarHBondContact O-N 3.22Å; L620-Y622 VanDerWaalsContact O-N 3.16Å; L620-L659 HydrophobicContact CD1-CD1 4.08Å
621	E	96.8	Very high	95.8	Very high	19 Å²	19	23.1 Å²	23.1	9%	0.089	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-24.1	171.9	-174.6	66.3	-169.1	0	0	112.6	S617 L618 I619 R651 I652 R655	S617-E621 WeakPolarHBondContact O-CB 3.31Å; S617-E621 PolarHBondContact O-N 3.41Å; L618-E621 WeakPolarHBondContact O-CB 3.35Å; I619-E621 VanDerWaalsContact C-N 3.28Å; I619-E621 PolarHBondContact O-N 3.41Å; E621-R651 IonicContact OE1-CZ 2.81Å; E621-R651 VanDerWaalsContact OE1-CZ 3.26Å; E621-R651 IonicContact OE1-NE 2.69Å; E621-R651 PolarHBondContact OE1-NE 3.1Å; E621-R651 IonicContact OE1-NH2 3.96Å; E621-R651 PolarHBondContact OE1-NH2 2.72Å; E621-R651 IonicContact OE2-CZ 2.62Å; E621-R651 IonicContact OE2-NE 3.91Å; E621-R651 PolarHBondContact OE2-NE 3.39Å; E621-R651 VanDerWaalsContact OE2-NE 3.15Å; E621-R651 IonicContact OE2-NH2 3.89Å; E621-I652 HydrophobicContact CB-CD1 4.33Å; E621-I652 HydrophobicContact CB-CG1 4.06Å; E621-I652 HydrophobicContact CG-CD1 4.07Å; E621-I652 HydrophobicContact CG-CG1 4.03Å; E621-R655 IonicContact OE2-CZ 2.76Å; E621-R655 VanDerWaalsContact OE2-CZ 3.25Å; E621-R655 IonicContact OE2-NH1 3.26Å; E621-R655 PolarHBondContact OE2-NH1 3.49Å; E621-R655 IonicContact OE2-NH2 2.77Å; E621-R655 PolarHBondContact OE2-NH2 3.43Å
622	Y	96.4	Very high	95.2	Very high	7 Å²	7	29.6 Å²	29.6	3%	0.027	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.8	14.9	-174.9	-61.7	-69.9	0	0	0	114.5	V157 L618 I619 L620 E624 V625 I626 F639 Y640 Q643 H647	V157-Y622 HydrophobicContact CG2-CE1 4.44Å; L618-Y622 HydrophobicContact CD1-CE2 4.11Å; I619-Y622 PolarHBondContact O-N 2.94Å; I619-Y622 VanDerWaalsContact O-N 3.14Å; L620-Y622 PolarHBondContact O-N 3.22Å; L620-Y622 VanDerWaalsContact O-N 3.16Å; Y622-E624 PolarHBondContact O-N 2.96Å; Y622-V625 WeakPolarHBondContact O-CB 3.31Å; Y622-V625 PolarHBondContact O-N 2.8Å; Y622-I626 WeakPolarHBondContact O-CG1 3.16Å; Y622-I626 PolarHBondContact O-N 2.9Å; Y622-F639 HydrophobicContact CD1-CE1 4.07Å; Y622-F639 AromaticContact CD1-CZ 3.54Å; Y622-F639 HydrophobicContact CD1-CZ 3.54Å; Y622-F639 AromaticContact CD2-CE1 3.85Å; Y622-F639 HydrophobicContact CD2-CE1 3.85Å; Y622-F639 HydrophobicContact CD2-CZ 4.15Å; Y622-F639 AromaticContact CE1-CZ 3.96Å; Y622-F639 HydrophobicContact CE1-CZ 3.96Å; Y622-F639 HydrophobicContact CE2-CE1 4.43Å; Y622-F639 AromaticContact CG-CE1 3.63Å; Y622-F639 HydrophobicContact CG-CE1 3.63Å; Y622-F639 AromaticContact CG-CZ 3.61Å; Y622-F639 HydrophobicContact CG-CZ 3.61Å; Y622-Y640 AromaticContact CD2-CE1 3.98Å; Y622-Y640 HydrophobicContact CD2-CE1 3.98Å; Y622-Y640 HydrophobicContact CE2-CE1 4.29Å; Y622-Q643 PolarHBondContact OH-NE2 3.24Å; Y622-H647 AromaticContact CE2-CE1 3.84Å; Y622-H647 AromaticContact CE2-ND1 3.46Å; Y622-H647 WeakPolarHBondContact CE2-ND1 3.46Å; Y622-H647 AromaticContact CZ-ND1 3.63Å; Y622-H647 PolarHBondContact OH-ND1 2.87Å
623	K	96.6	Very high	94.4	Very high	28 Å²	28	31.8 Å²	31.8	12%	0.122	16%	0.155	C	C	.	.	H	α-helix	trans	-39.8	-59.1	-177.9	171.6	170.4	174.8	170.2	0	113.5	D375 E377 L378 I619 V625 I626 M627	D375-K623 IonicContact OD1-NZ 3Å; D375-K623 PolarHBondContact OD1-NZ 2.79Å; D375-K623 VanDerWaalsContact OD2-CD 3.27Å; D375-K623 WeakPolarHBondContact OD2-CD 3.4Å; D375-K623 WeakPolarHBondContact OD2-CE 3.45Å; D375-K623 IonicContact OD2-NZ 3.15Å; D375-K623 PolarHBondContact OD2-NZ 3.13Å; E377-K623 WeakPolarHBondContact OE2-CE 3.25Å; E377-K623 IonicContact OE2-NZ 2.82Å; E377-K623 PolarHBondContact OE2-NZ 3.01Å; L378-K623 HydrophobicContact CB-CD 4.4Å; L378-K623 HydrophobicContact CD1-CG 4.19Å; L378-K623 HydrophobicContact CD2-CB 3.99Å; L378-K623 HydrophobicContact CD2-CD 4.25Å; L378-K623 HydrophobicContact CD2-CG 3.93Å; L378-K623 HydrophobicContact CG-CG 4.48Å; I619-K623 PolarHBondContact O-N 2.92Å; K623-V625 VanDerWaalsContact C-N 3.34Å; K623-V625 PolarHBondContact O-N 3.34Å; K623-I626 WeakPolarHBondContact O-CB 3.28Å; K623-I626 PolarHBondContact O-N 3.45Å; K623-M627 HydrophobicContact CD-SD 4.28Å; K623-M627 WeakPolarHBondContact CE-SD 3.31Å; K623-M627 HydrophobicContact CG-SD 3.79Å; K623-M627 WeakPolarHBondContact O-CG 3.41Å; K623-M627 PolarHBondContact O-N 2.91Å
624	E	95.6	Very high	93.8	Very high	84 Å²	84	33.6 Å²	33.6	39%	0.393	18%	0.175	S	C	.	.	H	α-helix	trans	-63.3	-38.7	-176.5	-53.7	-48.4	128.1	0	0	112.5	V160 I164 Y622 I626 M627 L628	V160-E624 HydrophobicContact CG1-CB 4.08Å; V160-E624 HydrophobicContact CG2-CB 4.29Å; I164-E624 HydrophobicContact CD1-CG 3.91Å; Y622-E624 PolarHBondContact O-N 2.96Å; E624-I626 VanDerWaalsContact C-N 3.34Å; E624-M627 PolarHBondContact O-N 2.8Å; E624-L628 VanDerWaalsContact O-CB 3.27Å; E624-L628 WeakPolarHBondContact O-CB 3.39Å; E624-L628 WeakPolarHBondContact O-CD1 3.41Å; E624-L628 WeakPolarHBondContact O-CG 3.3Å; E624-L628 PolarHBondContact O-N 3.08Å
625	V	94.6	Very high	93.3	Very high	3 Å²	3	34.7 Å²	34.7	2%	0.018	18%	0.181	C	C	.	.	H	α-helix	trans	-66.8	-40.1	177.5	-177.3	0	0	0	0	110.3	F153 T156 V157 V160 Y622 K623 E629 F639	F153-V625 HydrophobicContact CD1-CG1 4.04Å; T156-V625 HydrophobicContact CG2-CG1 4.36Å; T156-V625 HydrophobicContact CG2-CG2 4.47Å; V157-V625 HydrophobicContact CG2-CG1 3.88Å; V157-V625 HydrophobicContact CG2-CG2 3.94Å; V160-V625 HydrophobicContact CB-CG2 4.11Å; V160-V625 HydrophobicContact CG1-CG2 4.18Å; V160-V625 HydrophobicContact CG2-CG2 4.04Å; Y622-V625 WeakPolarHBondContact O-CB 3.31Å; Y622-V625 PolarHBondContact O-N 2.8Å; K623-V625 VanDerWaalsContact C-N 3.34Å; K623-V625 PolarHBondContact O-N 3.34Å; V625-E629 HydrophobicContact CG1-CG 4.49Å; V625-E629 WeakPolarHBondContact O-CB 3.29Å; V625-E629 PolarHBondContact O-N 3.15Å; V625-F639 HydrophobicContact CB-CZ 4.47Å; V625-F639 HydrophobicContact CG1-CE2 3.82Å; V625-F639 HydrophobicContact CG1-CZ 3.93Å
626	I	94.2	Very high	92.9	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-62.7	-51.3	177	-70.6	164.9	0	0	0	109.9	L378 F381 F382 I619 Y622 K623 E624 L628 I630 I636	L378-I626 HydrophobicContact CD1-CG2 4.25Å; F381-I626 HydrophobicContact CD1-CG2 4.32Å; F381-I626 HydrophobicContact CE1-CG2 3.96Å; F381-I626 WeakPolarHBondContact CZ-O 3.21Å; F382-I626 HydrophobicContact CE1-CG2 3.92Å; I619-I626 HydrophobicContact CG2-CD1 4.47Å; Y622-I626 WeakPolarHBondContact O-CG1 3.16Å; Y622-I626 PolarHBondContact O-N 2.9Å; K623-I626 WeakPolarHBondContact O-CB 3.28Å; K623-I626 PolarHBondContact O-N 3.45Å; E624-I626 VanDerWaalsContact C-N 3.34Å; I626-L628 VanDerWaalsContact C-N 3.33Å; I626-L628 PolarHBondContact O-N 3.28Å; I626-I630 HydrophobicContact CB-CG1 4.28Å; I626-I630 HydrophobicContact CG2-CG1 3.99Å; I626-I630 VanDerWaalsContact O-CB 3.22Å; I626-I630 WeakPolarHBondContact O-CB 3.34Å; I626-I630 VanDerWaalsContact O-CG1 3.24Å; I626-I630 WeakPolarHBondContact O-CG1 3.44Å; I626-I630 PolarHBondContact O-N 3.36Å; I626-I630 VanDerWaalsContact O-N 3.09Å; I626-I636 HydrophobicContact CD1-CD1 4.41Å; I626-I636 HydrophobicContact CG1-CD1 4.46Å; I626-I636 HydrophobicContact CG2-CD1 4.33Å
627	M	95.5	Very high	92.3	Very high	47 Å²	47	36.7 Å²	36.7	23%	0.232	19%	0.191	C	C	.	.	H	α-helix	trans	-66.3	-33.1	-178.1	-68.9	175	65.9	0	0	113	E377 L378 F381 K623 E624	E377-M627 HydrophobicContact CG-CE 3.82Å; L378-M627 HydrophobicContact CD1-CG 3.7Å; L378-M627 HydrophobicContact CD1-SD 3.91Å; F381-M627 HydrophobicContact CB-CG 4.4Å; F381-M627 HydrophobicContact CD1-CG 4.37Å; F381-M627 HydrophobicContact CD2-CB 4.24Å; F381-M627 HydrophobicContact CD2-CG 3.93Å; F381-M627 HydrophobicContact CE2-CB 4.19Å; F381-M627 HydrophobicContact CE2-CG 4.31Å; F381-M627 WeakPolarHBondContact CE2-O 3.41Å; F381-M627 HydrophobicContact CG-CG 3.98Å; K623-M627 HydrophobicContact CD-SD 4.28Å; K623-M627 WeakPolarHBondContact CE-SD 3.31Å; K623-M627 HydrophobicContact CG-SD 3.79Å; K623-M627 WeakPolarHBondContact O-CG 3.41Å; K623-M627 PolarHBondContact O-N 2.91Å; E624-M627 PolarHBondContact O-N 2.8Å
628	L	94.3	Very high	91.7	Very high	102 Å²	102	38.1 Å²	38.1	53%	0.534	20%	0.197	S	C	.	.	H	α-helix	trans	-77.2	-50.3	178	-71.4	170.2	0	0	0	113.1	T156 V160 E624 I626 K631	T156-L628 HydrophobicContact CG2-CB 4.4Å; T156-L628 HydrophobicContact CG2-CD1 4.09Å; V160-L628 HydrophobicContact CG2-CD1 4.32Å; E624-L628 VanDerWaalsContact O-CB 3.27Å; E624-L628 WeakPolarHBondContact O-CB 3.39Å; E624-L628 WeakPolarHBondContact O-CD1 3.41Å; E624-L628 WeakPolarHBondContact O-CG 3.3Å; E624-L628 PolarHBondContact O-N 3.08Å; I626-L628 VanDerWaalsContact C-N 3.33Å; I626-L628 PolarHBondContact O-N 3.28Å; L628-K631 WeakPolarHBondContact O-CE 3.45Å; L628-K631 PolarHBondContact O-NZ 2.91Å
629	E	90	Very high	91.3	Very high	39 Å²	39	38.1 Å²	38.1	18%	0.182	20%	0.197	C	C	.	.	H	α-helix	trans	-95.6	-34.9	-167.8	-63.6	-63.6	159.9	0	0	114.3	R152 F153 T156 V625 K631	R152-E629 WeakPolarHBondContact CB-OE2 3.46Å; F153-E629 HydrophobicContact CD1-CB 3.77Å; F153-E629 HydrophobicContact CD1-CG 3.99Å; F153-E629 HydrophobicContact CE1-CB 3.43Å; F153-E629 VanDerWaalsContact CE1-CB 3.43Å; F153-E629 HydrophobicContact CE1-CG 4.18Å; F153-E629 HydrophobicContact CZ-CB 4.21Å; T156-E629 VanDerWaalsContact CB-OE1 3.28Å; T156-E629 WeakPolarHBondContact CB-OE1 3.49Å; T156-E629 HydrophobicContact CG2-CG 3.93Å; T156-E629 PolarHBondContact OG1-OE1 2.8Å; V625-E629 HydrophobicContact CG1-CG 4.49Å; V625-E629 WeakPolarHBondContact O-CB 3.29Å; V625-E629 PolarHBondContact O-N 3.15Å; E629-K631 WeakPolarHBondContact O-CE 3.47Å; E629-K631 PolarHBondContact O-N 2.71Å
630	I	88.6	Confident	90.9	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.198	C	C	.	.			trans	-68.6	130.9	-174.6	-56	-58.8	0	0	0	110.8	F153 F381 L387 I626 D635 I636	F153-I630 HydrophobicContact CE1-CD1 3.81Å; F153-I630 HydrophobicContact CZ-CD1 3.67Å; F381-I630 HydrophobicContact CE1-CB 4.28Å; F381-I630 HydrophobicContact CE1-CG2 4.5Å; F381-I630 HydrophobicContact CZ-CB 4.28Å; L387-I630 HydrophobicContact CD1-CG2 4.12Å; I626-I630 HydrophobicContact CB-CG1 4.28Å; I626-I630 HydrophobicContact CG2-CG1 3.99Å; I626-I630 VanDerWaalsContact O-CB 3.22Å; I626-I630 WeakPolarHBondContact O-CB 3.34Å; I626-I630 VanDerWaalsContact O-CG1 3.24Å; I626-I630 WeakPolarHBondContact O-CG1 3.44Å; I626-I630 PolarHBondContact O-N 3.36Å; I626-I630 VanDerWaalsContact O-N 3.09Å; I630-D635 HydrophobicContact CD1-CB 3.56Å; I630-D635 HydrophobicContact CG2-CB 4.24Å; I630-I636 HydrophobicContact CD1-CB 3.81Å; I630-I636 HydrophobicContact CD1-CG1 4.32Å; I630-I636 HydrophobicContact CG1-CB 4.33Å; I630-I636 HydrophobicContact CG2-CB 4.48Å
631	K	86.8	Confident	90.4	Very high	116 Å²	116	41.5 Å²	41.5	50%	0.504	21%	0.212	S	C	.	.			trans	-123.4	-34.8	173.7	-51.4	-60	145.9	-126.4	0	111.6	L628 E629 D635	L628-K631 WeakPolarHBondContact O-CE 3.45Å; L628-K631 PolarHBondContact O-NZ 2.91Å; E629-K631 WeakPolarHBondContact O-CE 3.47Å; E629-K631 PolarHBondContact O-N 2.71Å; K631-D635 PolarHBondContact N-OD2 2.91Å
632	E	84.6	Confident	89.9	Confident	137 Å²	137	42.1 Å²	42.1	64%	0.64	22%	0.215	S	C	*	.	S	Bend	trans	-131.7	157.6	-178.8	-62.4	-176	173.3	0	0	111.9	G634 D635	E632-G634 PolarHBondContact O-N 3.35Å; E632-D635 PolarHBondContact N-OD2 3.33Å; E632-D635 WeakPolarHBondContact O-CB 3.49Å; E632-D635 PolarHBondContact O-N 3.35Å
633	P	81.1	Confident	89.6	Confident	47 Å²	47	42.6 Å²	42.6	31%	0.305	22%	0.218	S	C	.	.	H	α-helix	trans	-57.4	-21.5	178.8	-27.6	35.6	0	0	0	116.2	N386 L387	N386-P633 HydrophobicContact CB-CG 4.43Å; L387-P633 HydrophobicContact CD2-CB 3.95Å; L387-P633 HydrophobicContact CD2-CG 4.11Å
634	G	85.3	Confident	89.3	Confident	43 Å²	43	43.1 Å²	43.1	44%	0.443	22%	0.224	S	C	.	.	H	α-helix	trans	-67.3	-35.5	172.7	0	0	0	0	0	113.3	E632 I636 I637 Q638	E632-G634 PolarHBondContact O-N 3.35Å; G634-I636 PolarHBondContact O-N 3.08Å; G634-I637 PolarHBondContact O-N 3.2Å; G634-Q638 PolarHBondContact O-N 3.12Å
635	D	88.4	Confident	89.1	Confident	24 Å²	24	40.9 Å²	40.9	13%	0.128	22%	0.224	C	C	.	.	H	α-helix	trans	-62.5	-41.6	-175.1	-64	-40.2	0	0	0	111.7	F153 I630 K631 E632 Q638 F639	F153-D635 HydrophobicContact CZ-CB 4.25Å; I630-D635 HydrophobicContact CD1-CB 3.56Å; I630-D635 HydrophobicContact CG2-CB 4.24Å; K631-D635 PolarHBondContact N-OD2 2.91Å; E632-D635 PolarHBondContact N-OD2 3.33Å; E632-D635 WeakPolarHBondContact O-CB 3.49Å; E632-D635 PolarHBondContact O-N 3.35Å; D635-Q638 PolarHBondContact O-N 3.16Å; D635-F639 VanDerWaalsContact O-CB 3.29Å; D635-F639 WeakPolarHBondContact O-CB 3.41Å; D635-F639 PolarHBondContact O-N 3.18Å
636	I	90.1	Very high	89	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-74.4	-32.2	-175.2	-163.1	164.9	0	0	0	111.4	F382 L387 F392 I626 I630 G634 F639 Y640	F382-I636 HydrophobicContact CZ-CD1 4.23Å; L387-I636 HydrophobicContact CD1-CD1 3.98Å; L387-I636 HydrophobicContact CD1-CG2 4.49Å; L387-I636 HydrophobicContact CD2-CG2 3.76Å; F392-I636 HydrophobicContact CB-CG2 4.03Å; F392-I636 HydrophobicContact CD1-CG2 4.05Å; F392-I636 HydrophobicContact CD2-CD1 4.3Å; F392-I636 HydrophobicContact CD2-CG1 4.17Å; F392-I636 HydrophobicContact CD2-CG2 4.26Å; F392-I636 HydrophobicContact CE1-CD1 4.1Å; F392-I636 HydrophobicContact CE2-CD1 3.84Å; F392-I636 HydrophobicContact CE2-CG1 4.12Å; F392-I636 HydrophobicContact CG-CG2 3.86Å; F392-I636 HydrophobicContact CZ-CD1 3.74Å; F392-I636 HydrophobicContact CZ-CG1 4.48Å; I626-I636 HydrophobicContact CD1-CD1 4.41Å; I626-I636 HydrophobicContact CG1-CD1 4.46Å; I626-I636 HydrophobicContact CG2-CD1 4.33Å; I630-I636 HydrophobicContact CD1-CB 3.81Å; I630-I636 HydrophobicContact CD1-CG1 4.32Å; I630-I636 HydrophobicContact CG1-CB 4.33Å; I630-I636 HydrophobicContact CG2-CB 4.48Å; G634-I636 PolarHBondContact O-N 3.08Å; I636-F639 PolarHBondContact O-N 2.57Å; I636-Y640 HydrophobicContact CD1-CE2 4.1Å; I636-Y640 HydrophobicContact CG1-CD2 3.87Å; I636-Y640 HydrophobicContact CG1-CE2 3.68Å; I636-Y640 VanDerWaalsContact O-CD2 3.29Å; I636-Y640 WeakPolarHBondContact O-CD2 3.45Å; I636-Y640 PolarHBondContact O-N 3.23Å; I636-Y640 VanDerWaalsContact O-N 3.07Å
637	I	86.5	Confident	88.9	Confident	42 Å²	42	46.3 Å²	46.3	22%	0.215	25%	0.248	C	C	.	.	H	α-helix	trans	-67.2	-46.8	173.3	-67.8	171.6	0	0	0	109.7	F392 L559 G634 F639 Q641	F392-I637 HydrophobicContact CB-CD1 4.1Å; F392-I637 HydrophobicContact CB-CG1 3.45Å; F392-I637 VanDerWaalsContact CB-CG1 3.45Å; L559-I637 HydrophobicContact CD2-CD1 3.53Å; G634-I637 PolarHBondContact O-N 3.2Å; I637-F639 VanDerWaalsContact C-N 3.33Å; I637-F639 PolarHBondContact O-N 2.79Å; I637-Q641 VanDerWaalsContact CG2-NE2 3.31Å; I637-Q641 WeakPolarHBondContact O-CB 3.3Å; I637-Q641 WeakPolarHBondContact O-CG 3.37Å; I637-Q641 PolarHBondContact O-N 3.41Å
638	Q	86.4	Confident	88.8	Confident	29 Å²	29	46.7 Å²	46.7	14%	0.136	25%	0.251	C	S	.	.	H	α-helix	trans	-60.9	-43.1	174.3	-176.1	-179.5	-32.2	0	0	111.2	F146 G634 D635 Q641 Q642	F146-Q638 HydrophobicContact CE2-CG 4.46Å; G634-Q638 PolarHBondContact O-N 3.12Å; D635-Q638 PolarHBondContact O-N 3.16Å; Q638-Q641 PolarHBondContact O-N 3.11Å; Q638-Q642 HydrophobicContact CG-CG 4.38Å; Q638-Q642 VanDerWaalsContact O-CG 3.32Å; Q638-Q642 WeakPolarHBondContact O-CG 3.06Å; Q638-Q642 PolarHBondContact O-N 2.86Å
639	F	89.8	Confident	88.7	Confident	1 Å²	1	42.7 Å²	42.7	0%	0.004	23%	0.231	C	C	.	.	H	α-helix	trans	-58	-52.9	179.4	177.1	-110.4	0	0	0	112.6	F153 V157 Y622 V625 D635 I636 I637 Q641 Q642 Q643	F153-F639 HydrophobicContact CB-CD2 4.06Å; F153-F639 HydrophobicContact CB-CE2 4.31Å; F153-F639 HydrophobicContact CD1-CB 4.45Å; F153-F639 AromaticContact CD1-CD2 3.3Å; F153-F639 HydrophobicContact CD1-CD2 3.3Å; F153-F639 AromaticContact CD1-CE2 3.76Å; F153-F639 HydrophobicContact CD1-CE2 3.76Å; F153-F639 HydrophobicContact CD1-CG 4.13Å; F153-F639 HydrophobicContact CD2-CD2 4.19Å; F153-F639 HydrophobicContact CE1-CB 4Å; F153-F639 AromaticContact CE1-CD2 3.62Å; F153-F639 HydrophobicContact CE1-CD2 3.62Å; F153-F639 HydrophobicContact CE1-CE2 4.33Å; F153-F639 AromaticContact CE1-CG 3.97Å; F153-F639 HydrophobicContact CE1-CG 3.97Å; F153-F639 HydrophobicContact CE2-CB 4.11Å; F153-F639 HydrophobicContact CE2-CD2 4.44Å; F153-F639 AromaticContact CG-CD2 3.62Å; F153-F639 HydrophobicContact CG-CD2 3.62Å; F153-F639 HydrophobicContact CG-CE2 4.22Å; F153-F639 HydrophobicContact CZ-CB 3.82Å; F153-F639 HydrophobicContact CZ-CD2 4.19Å; F153-F639 HydrophobicContact CZ-CG 4.31Å; V157-F639 HydrophobicContact CG2-CE2 3.92Å; V157-F639 HydrophobicContact CG2-CZ 4.24Å; Y622-F639 HydrophobicContact CD1-CE1 4.07Å; Y622-F639 AromaticContact CD1-CZ 3.54Å; Y622-F639 HydrophobicContact CD1-CZ 3.54Å; Y622-F639 AromaticContact CD2-CE1 3.85Å; Y622-F639 HydrophobicContact CD2-CE1 3.85Å; Y622-F639 HydrophobicContact CD2-CZ 4.15Å; Y622-F639 AromaticContact CE1-CZ 3.96Å; Y622-F639 HydrophobicContact CE1-CZ 3.96Å; Y622-F639 HydrophobicContact CE2-CE1 4.43Å; Y622-F639 AromaticContact CG-CE1 3.63Å; Y622-F639 HydrophobicContact CG-CE1 3.63Å; Y622-F639 AromaticContact CG-CZ 3.61Å; Y622-F639 HydrophobicContact CG-CZ 3.61Å; V625-F639 HydrophobicContact CB-CZ 4.47Å; V625-F639 HydrophobicContact CG1-CE2 3.82Å; V625-F639 HydrophobicContact CG1-CZ 3.93Å; D635-F639 VanDerWaalsContact O-CB 3.29Å; D635-F639 WeakPolarHBondContact O-CB 3.41Å; D635-F639 PolarHBondContact O-N 3.18Å; I636-F639 PolarHBondContact O-N 2.57Å; I637-F639 VanDerWaalsContact C-N 3.33Å; I637-F639 PolarHBondContact O-N 2.79Å; F639-Q641 VanDerWaalsContact C-N 3.33Å; F639-Q641 PolarHBondContact O-N 3.19Å; F639-Q642 PolarHBondContact O-N 3.25Å; F639-Q642 VanDerWaalsContact O-N 3.13Å; F639-Q643 HydrophobicContact CD2-CG 4.09Å; F639-Q643 HydrophobicContact CE1-CG 4.42Å; F639-Q643 HydrophobicContact CE2-CG 3.79Å; F639-Q643 HydrophobicContact CZ-CG 3.98Å; F639-Q643 WeakPolarHBondContact O-CB 3.25Å; F639-Q643 VanDerWaalsContact O-CG 3.27Å; F639-Q643 WeakPolarHBondContact O-CG 3.47Å; F639-Q643 PolarHBondContact O-N 3.47Å
640	Y	90.5	Very high	88.8	Confident	4 Å²	4	44 Å²	44	2%	0.016	24%	0.244	C	C	.	.	H	α-helix	trans	-68.1	-31.3	178.6	-77	-68.5	0	0	0	112.9	F392 R395 W396 L618 I619 Y622 I636 Q642 Q643 S644	F392-Y640 HydrophobicContact CD2-CD2 4.08Å; F392-Y640 HydrophobicContact CD2-CE2 4.26Å; F392-Y640 HydrophobicContact CE2-CD2 4.07Å; F392-Y640 AromaticContact CE2-CE2 3.78Å; F392-Y640 HydrophobicContact CE2-CE2 3.78Å; R395-Y640 PolarHBondContact NH2-O 2.95Å; R395-Y640 VanDerWaalsContact NH2-O 3.1Å; W396-Y640 HydrophobicContact CH2-CD2 4.48Å; W396-Y640 HydrophobicContact CH2-CE1 4.16Å; W396-Y640 HydrophobicContact CH2-CE2 4.1Å; W396-Y640 AromaticContact CH2-CZ 3.94Å; W396-Y640 AromaticContact CZ2-CD1 3.78Å; W396-Y640 HydrophobicContact CZ2-CD1 3.78Å; W396-Y640 AromaticContact CZ2-CD2 3.93Å; W396-Y640 HydrophobicContact CZ2-CD2 3.93Å; W396-Y640 AromaticContact CZ2-CE1 3.86Å; W396-Y640 HydrophobicContact CZ2-CE1 3.86Å; W396-Y640 AromaticContact CZ2-CE2 3.99Å; W396-Y640 HydrophobicContact CZ2-CE2 3.99Å; W396-Y640 AromaticContact CZ2-CG 3.84Å; W396-Y640 HydrophobicContact CZ2-CG 3.84Å; W396-Y640 AromaticContact CZ2-CZ 3.97Å; L618-Y640 HydrophobicContact CD1-CD1 4.43Å; L618-Y640 HydrophobicContact CD1-CE1 3.87Å; L618-Y640 HydrophobicContact CD2-CE1 4.33Å; L618-Y640 HydrophobicContact CG-CD1 4.42Å; L618-Y640 HydrophobicContact CG-CE1 3.8Å; L618-Y640 PolarHBondContact O-OH 3.04Å; I619-Y640 WeakPolarHBondContact CA-OH 3.44Å; Y622-Y640 AromaticContact CD2-CE1 3.98Å; Y622-Y640 HydrophobicContact CD2-CE1 3.98Å; Y622-Y640 HydrophobicContact CE2-CE1 4.29Å; I636-Y640 HydrophobicContact CD1-CE2 4.1Å; I636-Y640 HydrophobicContact CG1-CD2 3.87Å; I636-Y640 HydrophobicContact CG1-CE2 3.68Å; I636-Y640 VanDerWaalsContact O-CD2 3.29Å; I636-Y640 WeakPolarHBondContact O-CD2 3.45Å; I636-Y640 PolarHBondContact O-N 3.23Å; I636-Y640 VanDerWaalsContact O-N 3.07Å; Y640-Q642 VanDerWaalsContact C-N 3.32Å; Y640-Q642 PolarHBondContact O-N 3.45Å; Y640-Q643 PolarHBondContact O-N 3.07Å; Y640-S644 PolarHBondContact O-N 3.31Å; Y640-S644 PolarHBondContact O-OG 3.35Å
641	Q	85.9	Confident	89.1	Confident	99 Å²	99	47.1 Å²	47.1	46%	0.463	26%	0.256	S	S	.	.	H	α-helix	trans	-62.6	-37.4	169.7	-73.3	173.8	15.8	0	0	112.7	I637 Q638 F639	I637-Q641 VanDerWaalsContact CG2-NE2 3.31Å; I637-Q641 WeakPolarHBondContact O-CB 3.3Å; I637-Q641 WeakPolarHBondContact O-CG 3.37Å; I637-Q641 PolarHBondContact O-N 3.41Å; Q638-Q641 PolarHBondContact O-N 3.11Å; F639-Q641 VanDerWaalsContact C-N 3.33Å; F639-Q641 PolarHBondContact O-N 3.19Å
642	Q	87.4	Confident	89.5	Confident	31 Å²	31	41.6 Å²	41.6	15%	0.145	23%	0.232	C	C	.	.	H	α-helix	trans	-77.2	-23.3	178.2	-71.7	-177.8	-11.3	0	0	113.6	T150 Q638 F639 Y640 K646	T150-Q642 PolarHBondContact OG1-NE2 3.24Å; Q638-Q642 HydrophobicContact CG-CG 4.38Å; Q638-Q642 VanDerWaalsContact O-CG 3.32Å; Q638-Q642 WeakPolarHBondContact O-CG 3.06Å; Q638-Q642 PolarHBondContact O-N 2.86Å; F639-Q642 PolarHBondContact O-N 3.25Å; F639-Q642 VanDerWaalsContact O-N 3.13Å; Y640-Q642 VanDerWaalsContact C-N 3.32Å; Y640-Q642 PolarHBondContact O-N 3.45Å; Q642-K646 WeakPolarHBondContact O-CD 3.27Å; Q642-K646 VanDerWaalsContact O-CE 3.3Å; Q642-K646 WeakPolarHBondContact O-CE 3.44Å; Q642-K646 PolarHBondContact O-NZ 2.88Å
643	Q	89.9	Confident	90	Very high	18 Å²	18	35.8 Å²	35.8	8%	0.084	21%	0.205	C	C	.	.	H	α-helix	trans	-97.4	-9	-178.3	-64.5	-74.3	72.3	0	0	114.1	Y622 F639 Y640 G645 K646 H647	Y622-Q643 PolarHBondContact OH-NE2 3.24Å; F639-Q643 HydrophobicContact CD2-CG 4.09Å; F639-Q643 HydrophobicContact CE1-CG 4.42Å; F639-Q643 HydrophobicContact CE2-CG 3.79Å; F639-Q643 HydrophobicContact CZ-CG 3.98Å; F639-Q643 WeakPolarHBondContact O-CB 3.25Å; F639-Q643 VanDerWaalsContact O-CG 3.27Å; F639-Q643 WeakPolarHBondContact O-CG 3.47Å; F639-Q643 PolarHBondContact O-N 3.47Å; Y640-Q643 PolarHBondContact O-N 3.07Å; Q643-G645 PolarHBondContact O-N 2.92Å; Q643-K646 WeakPolarHBondContact O-CA 3.28Å; Q643-K646 WeakPolarHBondContact O-CB 3.41Å; Q643-K646 PolarHBondContact O-N 3.42Å; Q643-H647 VanDerWaalsContact CB-CE1 3.43Å; Q643-H647 WeakPolarHBondContact CB-CE1 3.29Å; Q643-H647 PolarHBondContact O-CE1 2.75Å; Q643-H647 PolarHBondContact O-ND1 2.83Å
644	S	89.7	Confident	90.7	Very high	38 Å²	38	39.1 Å²	39.1	27%	0.266	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-44.4	125.3	167.3	-78.8	0	0	0	0	111.9	R395 R403 Y640 K646	R395-S644 PolarHBondContact NH2-OG 2.99Å; R403-S644 VanDerWaalsContact O-CB 3.26Å; R403-S644 WeakPolarHBondContact O-CB 3.45Å; R403-S644 PolarHBondContact O-OG 3.27Å; Y640-S644 PolarHBondContact O-N 3.31Å; Y640-S644 PolarHBondContact O-OG 3.35Å; S644-K646 VanDerWaalsContact C-N 3.28Å; S644-K646 PolarHBondContact O-N 3.04Å
645	G	91.8	Very high	91.2	Very high	37 Å²	37	39.8 Å²	39.8	38%	0.381	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.7	3.5	-177.8	0	0	0	0	0	115.5	E404 Q643	E404-G645 PolarHBondContact O-N 2.92Å; Q643-G645 PolarHBondContact O-N 2.92Å
646	K	91.9	Very high	91.7	Very high	111 Å²	111	38.7 Å²	38.7	48%	0.483	20%	0.196	S	C	.	.			trans	-121.6	5.4	-175.4	-51.7	176.2	-172.7	164.9	0	114	Q642 Q643 S644	Q642-K646 WeakPolarHBondContact O-CD 3.27Å; Q642-K646 VanDerWaalsContact O-CE 3.3Å; Q642-K646 WeakPolarHBondContact O-CE 3.44Å; Q642-K646 PolarHBondContact O-NZ 2.88Å; Q643-K646 WeakPolarHBondContact O-CA 3.28Å; Q643-K646 WeakPolarHBondContact O-CB 3.41Å; Q643-K646 PolarHBondContact O-N 3.42Å; S644-K646 VanDerWaalsContact C-N 3.28Å; S644-K646 PolarHBondContact O-N 3.04Å
647	H	92.4	Very high	91.9	Very high	8 Å²	8	40 Å²	40	4%	0.037	20%	0.202	C	C	.	.	S	Bend	trans	-73.8	153.5	178.6	-57.4	-39.7	0	0	0	111.7	E404 F405 Y622 Q643 S649 I652	E404-H647 PolarHBondContact O-CD2 2.9Å; E404-H647 PolarHBondContact O-NE2 2.9Å; F405-H647 HydrophobicContact CD1-CB 4.18Å; F405-H647 HydrophobicContact CE1-CB 3.89Å; Y622-H647 AromaticContact CE2-CE1 3.84Å; Y622-H647 AromaticContact CE2-ND1 3.46Å; Y622-H647 WeakPolarHBondContact CE2-ND1 3.46Å; Y622-H647 AromaticContact CZ-ND1 3.63Å; Y622-H647 PolarHBondContact OH-ND1 2.87Å; Q643-H647 VanDerWaalsContact CB-CE1 3.43Å; Q643-H647 WeakPolarHBondContact CB-CE1 3.29Å; Q643-H647 PolarHBondContact O-CE1 2.75Å; Q643-H647 PolarHBondContact O-ND1 2.83Å; H647-S649 PolarHBondContact O-N 3.39Å; H647-S649 VanDerWaalsContact O-N 3.13Å; H647-I652 HydrophobicContact CB-CD1 3.72Å
648	N	93	Very high	92.3	Very high	55 Å²	55	44.4 Å²	44.4	29%	0.294	22%	0.219	S	C	.	.			trans	-82.9	88.3	168.4	-174.9	-27.9	0	0	0	109	S650 R651 I652	N648-S650 VanDerWaalsContact C-N 3.35Å; N648-S650 PolarHBondContact O-N 2.66Å; N648-S650 PolarHBondContact OD1-N 2.77Å; N648-R651 HydrophobicContact CB-CB 4.06Å; N648-R651 VanDerWaalsContact CG-CB 3.47Å; N648-R651 PolarHBondContact O-N 3.31Å; N648-R651 WeakPolarHBondContact OD1-CB 3.5Å; N648-R651 PolarHBondContact OD1-N 3.26Å; N648-I652 WeakPolarHBondContact O-CG1 2.95Å; N648-I652 PolarHBondContact O-N 3.31Å
649	S	93.5	Very high	92.8	Very high	18 Å²	18	45 Å²	45	13%	0.126	22%	0.223	C	C	.	.	H	α-helix	trans	-52.7	-47	-179.7	55.2	0	0	0	0	113.1	E409 M413 H647 R651 I652 L653	E409-S649 VanDerWaalsContact CD-CB 3.42Å; E409-S649 WeakPolarHBondContact CG-OG 3.37Å; E409-S649 WeakPolarHBondContact OE1-CB 3.22Å; E409-S649 PolarHBondContact OE1-OG 2.7Å; M413-S649 WeakPolarHBondContact CE-O 3.46Å; H647-S649 PolarHBondContact O-N 3.39Å; H647-S649 VanDerWaalsContact O-N 3.13Å; S649-R651 PolarHBondContact O-N 3.39Å; S649-I652 PolarHBondContact O-N 3.46Å; S649-L653 VanDerWaalsContact O-CB 3.25Å; S649-L653 WeakPolarHBondContact O-CB 3.46Å; S649-L653 PolarHBondContact O-N 3.39Å
650	S	92	Very high	93.1	Very high	66 Å²	66	45 Å²	45	46%	0.462	22%	0.223	S	C	.	.	H	α-helix	trans	-59.2	-46.9	178.5	-61.3	0	0	0	0	112.5	N648 L653 Y654	N648-S650 VanDerWaalsContact C-N 3.35Å; N648-S650 PolarHBondContact O-N 2.66Å; N648-S650 PolarHBondContact OD1-N 2.77Å; S650-L653 PolarHBondContact O-N 3.09Å; S650-Y654 WeakPolarHBondContact O-CB 3.21Å; S650-Y654 PolarHBondContact O-N 2.83Å
651	R	93.8	Very high	93.2	Very high	66 Å²	66	46.5 Å²	46.5	25%	0.249	23%	0.231	C	C	.	.	H	α-helix	trans	-68.1	-40.7	179.3	-175.5	161.3	69.8	-172.5	6.6	112.2	F174 E621 N648 S649 R655	F174-R651 HydrophobicContact CZ-CG 4.4Å; E621-R651 IonicContact OE1-CZ 2.81Å; E621-R651 VanDerWaalsContact OE1-CZ 3.26Å; E621-R651 IonicContact OE1-NE 2.69Å; E621-R651 PolarHBondContact OE1-NE 3.1Å; E621-R651 IonicContact OE1-NH2 3.96Å; E621-R651 PolarHBondContact OE1-NH2 2.72Å; E621-R651 IonicContact OE2-CZ 2.62Å; E621-R651 IonicContact OE2-NE 3.91Å; E621-R651 PolarHBondContact OE2-NE 3.39Å; E621-R651 VanDerWaalsContact OE2-NE 3.15Å; E621-R651 IonicContact OE2-NH2 3.89Å; N648-R651 HydrophobicContact CB-CB 4.06Å; N648-R651 VanDerWaalsContact CG-CB 3.47Å; N648-R651 PolarHBondContact O-N 3.31Å; N648-R651 WeakPolarHBondContact OD1-CB 3.5Å; N648-R651 PolarHBondContact OD1-N 3.26Å; S649-R651 PolarHBondContact O-N 3.39Å; R651-R655 WeakPolarHBondContact O-CB 3.4Å; R651-R655 PolarHBondContact O-N 2.85Å
652	I	96.5	Very high	93.5	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-63.7	-46.2	175.5	-70.9	163	0	0	0	110.5	F405 S617 L618 E621 H647 N648 S649 R655 A656	F405-I652 HydrophobicContact CE1-CD1 3.94Å; F405-I652 HydrophobicContact CZ-CD1 4.24Å; F405-I652 HydrophobicContact CZ-CG2 4.12Å; S617-I652 WeakPolarHBondContact CB-O 3.48Å; S617-I652 WeakPolarHBondContact OG-CA 3.4Å; S617-I652 PolarHBondContact OG-O 3.48Å; L618-I652 HydrophobicContact CD1-CD1 3.82Å; E621-I652 HydrophobicContact CB-CD1 4.33Å; E621-I652 HydrophobicContact CB-CG1 4.06Å; E621-I652 HydrophobicContact CG-CD1 4.07Å; E621-I652 HydrophobicContact CG-CG1 4.03Å; H647-I652 HydrophobicContact CB-CD1 3.72Å; N648-I652 WeakPolarHBondContact O-CG1 2.95Å; N648-I652 PolarHBondContact O-N 3.31Å; S649-I652 PolarHBondContact O-N 3.46Å; I652-R655 PolarHBondContact O-N 3.35Å; I652-A656 VanDerWaalsContact O-CB 3.29Å; I652-A656 WeakPolarHBondContact O-CB 3.29Å; I652-A656 PolarHBondContact O-N 3.07Å
653	L	95.2	Very high	93.9	Very high	15 Å²	15	45 Å²	45	8%	0.079	22%	0.223	C	C	.	.	H	α-helix	trans	-64.7	-42.4	178.9	-176	59.6	0	0	0	111.5	R412 M413 F610 L614 S649 S650 A656 K657	R412-L653 HydrophobicContact CG-CD2 4.39Å; M413-L653 HydrophobicContact CE-CB 3.98Å; M413-L653 HydrophobicContact SD-CB 4.31Å; M413-L653 HydrophobicContact SD-CD1 4.1Å; F610-L653 HydrophobicContact CE1-CD1 4.3Å; F610-L653 HydrophobicContact CZ-CD1 3.93Å; L614-L653 HydrophobicContact CD2-CD1 3.96Å; S649-L653 VanDerWaalsContact O-CB 3.25Å; S649-L653 WeakPolarHBondContact O-CB 3.46Å; S649-L653 PolarHBondContact O-N 3.39Å; S650-L653 PolarHBondContact O-N 3.09Å; L653-A656 PolarHBondContact O-N 2.92Å; L653-K657 HydrophobicContact CD1-CD 4.36Å; L653-K657 HydrophobicContact CD1-CG 4.42Å; L653-K657 HydrophobicContact CG-CD 4.2Å; L653-K657 WeakPolarHBondContact O-CB 3.45Å; L653-K657 VanDerWaalsContact O-CG 3.22Å; L653-K657 WeakPolarHBondContact O-CG 3.21Å; L653-K657 PolarHBondContact O-N 3.37Å
654	Y	94.4	Very high	94	Very high	117 Å²	117	44.2 Å²	44.2	46%	0.459	22%	0.219	S	C	.	.	H	α-helix	trans	-60.1	-49.9	174.7	174.4	-89.2	0	0	0	112	F174 S650 A656 K657 K658	F174-Y654 HydrophobicContact CD1-CD1 4.16Å; F174-Y654 HydrophobicContact CD1-CD2 4.08Å; F174-Y654 AromaticContact CD1-CG 3.81Å; F174-Y654 HydrophobicContact CD1-CG 3.81Å; F174-Y654 AromaticContact CE1-CD1 3.63Å; F174-Y654 HydrophobicContact CE1-CD1 3.63Å; F174-Y654 HydrophobicContact CE1-CD2 4.32Å; F174-Y654 HydrophobicContact CE1-CE1 4.08Å; F174-Y654 AromaticContact CE1-CG 3.78Å; F174-Y654 HydrophobicContact CE1-CG 3.78Å; S650-Y654 WeakPolarHBondContact O-CB 3.21Å; S650-Y654 PolarHBondContact O-N 2.83Å; Y654-A656 PolarHBondContact O-N 3.15Å; Y654-K657 PolarHBondContact O-N 3.2Å; Y654-K658 HydrophobicContact CE1-CD 4.09Å; Y654-K658 WeakPolarHBondContact O-CB 3.29Å; Y654-K658 PolarHBondContact O-N 2.8Å
655	R	97	Very high	94	Very high	57 Å²	57	48.5 Å²	48.5	22%	0.215	24%	0.235	C	C	.	.	H	α-helix	trans	-62.7	-41.8	178.9	177.5	-165.2	-57.2	109.5	-0.2	111.3	S617 E621 R651 I652 K658 L659	S617-R655 PolarHBondContact O-NH1 3.1Å; S617-R655 WeakPolarHBondContact OG-CB 3.34Å; S617-R655 WeakPolarHBondContact OG-CD 3.49Å; S617-R655 PolarHBondContact OG-NH1 2.87Å; E621-R655 IonicContact OE2-CZ 2.76Å; E621-R655 VanDerWaalsContact OE2-CZ 3.25Å; E621-R655 IonicContact OE2-NH1 3.26Å; E621-R655 PolarHBondContact OE2-NH1 3.49Å; E621-R655 IonicContact OE2-NH2 2.77Å; E621-R655 PolarHBondContact OE2-NH2 3.43Å; R651-R655 WeakPolarHBondContact O-CB 3.4Å; R651-R655 PolarHBondContact O-N 2.85Å; I652-R655 PolarHBondContact O-N 3.35Å; R655-K658 PolarHBondContact O-N 2.98Å; R655-L659 HydrophobicContact CG-CD1 4.02Å; R655-L659 WeakPolarHBondContact O-CG 3.13Å; R655-L659 PolarHBondContact O-N 3.03Å
656	A	97.7	Very high	93.8	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-60.6	-47.3	176.2	0	0	0	0	0	111.6	F610 F613 L614 S617 I652 L653 Y654 L659 F660	F610-A656 HydrophobicContact CE2-CB 4.18Å; F610-A656 HydrophobicContact CZ-CB 4.29Å; F613-A656 HydrophobicContact CB-CB 4.45Å; F613-A656 WeakPolarHBondContact O-CB 3.34Å; L614-A656 HydrophobicContact CD2-CB 3.75Å; L614-A656 HydrophobicContact CG-CB 4.22Å; S617-A656 PolarHBondContact OG-N 3.38Å; I652-A656 VanDerWaalsContact O-CB 3.29Å; I652-A656 WeakPolarHBondContact O-CB 3.29Å; I652-A656 PolarHBondContact O-N 3.07Å; L653-A656 PolarHBondContact O-N 2.92Å; Y654-A656 PolarHBondContact O-N 3.15Å; A656-L659 PolarHBondContact O-N 2.93Å; A656-F660 VanDerWaalsContact O-CB 3.25Å; A656-F660 WeakPolarHBondContact O-CB 3.37Å; A656-F660 PolarHBondContact O-N 3.35Å
657	K	95.4	Very high	93.5	Very high	29 Å²	29	47 Å²	47	13%	0.126	22%	0.221	C	C	.	.	H	α-helix	trans	-60	-46.9	175.3	-72.2	174.9	167.8	173.6	0	112.1	Y207 L208 F610 L653 Y654 L659 F660 N661	Y207-K657 HydrophobicContact CE1-CG 4.39Å; Y207-K657 HydrophobicContact CE2-CG 4.13Å; Y207-K657 WeakPolarHBondContact O-CE 3.44Å; Y207-K657 PolarHBondContact O-NZ 2.85Å; Y207-K657 WeakPolarHBondContact OH-CG 3.45Å; L208-K657 PolarHBondContact O-NZ 2.94Å; F610-K657 HydrophobicContact CE2-CG 4.06Å; F610-K657 HydrophobicContact CZ-CG 4Å; L653-K657 HydrophobicContact CD1-CD 4.36Å; L653-K657 HydrophobicContact CD1-CG 4.42Å; L653-K657 HydrophobicContact CG-CD 4.2Å; L653-K657 WeakPolarHBondContact O-CB 3.45Å; L653-K657 VanDerWaalsContact O-CG 3.22Å; L653-K657 WeakPolarHBondContact O-CG 3.21Å; L653-K657 PolarHBondContact O-N 3.37Å; Y654-K657 PolarHBondContact O-N 3.2Å; K657-L659 PolarHBondContact O-N 2.74Å; K657-F660 PolarHBondContact O-N 3.2Å; K657-N661 WeakPolarHBondContact O-CB 3.46Å; K657-N661 VanDerWaalsContact O-CG 3.26Å; K657-N661 PolarHBondContact O-N 3.16Å; K657-N661 PolarHBondContact O-OD1 2.83Å; K657-N661 VanDerWaalsContact O-OD1 3.05Å
658	K	94.9	Very high	93	Very high	134 Å²	134	53.5 Å²	53.5	58%	0.583	26%	0.256	S	S	*	.	H	α-helix	trans	-60.6	-43.1	179.5	-175.8	173.6	-178.8	173.5	0	112.5	Y654 R655 K662	Y654-K658 HydrophobicContact CE1-CD 4.09Å; Y654-K658 WeakPolarHBondContact O-CB 3.29Å; Y654-K658 PolarHBondContact O-N 2.8Å; R655-K658 PolarHBondContact O-N 2.98Å; K658-K662 PolarHBondContact O-N 2.74Å
659	L	96.5	Very high	92.2	Very high	41 Å²	41	52.8 Å²	52.8	22%	0.215	25%	0.25	C	C	.	.	H	α-helix	trans	-70.9	-41.6	177.3	-68.3	172.1	0	0	0	112.1	T374 F613 L616 L620 R655 A656 K657 K662 Y663	T374-L659 HydrophobicContact CG2-CD2 4.25Å; F613-L659 HydrophobicContact CD1-CB 3.6Å; F613-L659 HydrophobicContact CE1-CB 3.91Å; L616-L659 HydrophobicContact CD2-CD1 4.03Å; L620-L659 HydrophobicContact CD1-CD1 4.08Å; R655-L659 HydrophobicContact CG-CD1 4.02Å; R655-L659 WeakPolarHBondContact O-CG 3.13Å; R655-L659 PolarHBondContact O-N 3.03Å; A656-L659 PolarHBondContact O-N 2.93Å; K657-L659 PolarHBondContact O-N 2.74Å; L659-K662 PolarHBondContact O-N 2.96Å; L659-Y663 PolarHBondContact O-N 3Å; L659-Y663 VanDerWaalsContact O-N 3.09Å
660	F	96.2	Very high	90.8	Very high	0 Å²	0	59 Å²	59	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-65.7	-43.1	178.7	-175	-130.5	0	0	0	112.2	Y207 A420 V424 P609 F610 F613 A656 K657 K662 Y663 L664 F671	Y207-F660 HydrophobicContact CE2-CD1 4.32Å; A420-F660 HydrophobicContact CB-CE1 4.06Å; V424-F660 HydrophobicContact CG2-CZ 3.91Å; P609-F660 HydrophobicContact CB-CE2 4Å; P609-F660 HydrophobicContact CG-CE2 3.72Å; P609-F660 HydrophobicContact CG-CZ 4.08Å; F610-F660 HydrophobicContact CB-CD1 4.32Å; F610-F660 HydrophobicContact CB-CE1 4.07Å; F610-F660 HydrophobicContact CB-CE2 4.5Å; F610-F660 HydrophobicContact CB-CZ 4.18Å; F610-F660 HydrophobicContact CD2-CB 3.88Å; F610-F660 AromaticContact CD2-CD1 3.4Å; F610-F660 HydrophobicContact CD2-CD1 3.4Å; F610-F660 HydrophobicContact CD2-CD2 4.45Å; F610-F660 AromaticContact CD2-CE1 3.95Å; F610-F660 HydrophobicContact CD2-CE1 3.95Å; F610-F660 AromaticContact CD2-CG 3.68Å; F610-F660 HydrophobicContact CD2-CG 3.68Å; F610-F660 HydrophobicContact CE2-CB 4.23Å; F610-F660 HydrophobicContact CE2-CD1 4.1Å; F610-F660 HydrophobicContact CE2-CG 4.43Å; F610-F660 HydrophobicContact CG-CD1 4.24Å; F610-F660 HydrophobicContact CG-CE1 4.36Å; F613-F660 HydrophobicContact CB-CB 4.18Å; F613-F660 HydrophobicContact CD1-CB 4.27Å; F613-F660 HydrophobicContact CD2-CB 4.06Å; F613-F660 AromaticContact CD2-CD2 3.47Å; F613-F660 HydrophobicContact CD2-CD2 3.47Å; F613-F660 VanDerWaalsContact CD2-CD2 3.47Å; F613-F660 HydrophobicContact CD2-CE2 4.3Å; F613-F660 HydrophobicContact CD2-CG 4.14Å; F613-F660 AromaticContact CE2-CD2 3.66Å; F613-F660 HydrophobicContact CE2-CD2 3.66Å; F613-F660 HydrophobicContact CE2-CE2 4.4Å; F613-F660 HydrophobicContact CG-CB 3.89Å; F613-F660 HydrophobicContact CG-CD2 4.2Å; F613-F660 HydrophobicContact CG-CG 4.45Å; F613-F660 HydrophobicContact CZ-CD2 4.48Å; A656-F660 VanDerWaalsContact O-CB 3.25Å; A656-F660 WeakPolarHBondContact O-CB 3.37Å; A656-F660 PolarHBondContact O-N 3.35Å; K657-F660 PolarHBondContact O-N 3.2Å; F660-K662 PolarHBondContact O-N 2.88Å; F660-Y663 AromaticContact CD2-CD1 3.72Å; F660-Y663 HydrophobicContact CD2-CD1 3.72Å; F660-Y663 HydrophobicContact CD2-CE1 4.21Å; F660-Y663 AromaticContact CE2-CD1 3.9Å; F660-Y663 HydrophobicContact CE2-CD1 3.9Å; F660-Y663 AromaticContact CE2-CE1 3.95Å; F660-Y663 HydrophobicContact CE2-CE1 3.95Å; F660-Y663 PolarHBondContact O-N 3.27Å; F660-L664 HydrophobicContact CD1-CD1 3.69Å; F660-L664 HydrophobicContact CD1-CG 4.48Å; F660-L664 HydrophobicContact CD2-CD1 4.3Å; F660-L664 HydrophobicContact CD2-CG 4.23Å; F660-L664 HydrophobicContact CE1-CD1 3.62Å; F660-L664 HydrophobicContact CE1-CD2 4.49Å; F660-L664 HydrophobicContact CE1-CG 4.34Å; F660-L664 HydrophobicContact CE2-CD1 4.2Å; F660-L664 HydrophobicContact CE2-CD2 4.01Å; F660-L664 HydrophobicContact CE2-CG 4.04Å; F660-L664 HydrophobicContact CG-CD1 4.06Å; F660-L664 HydrophobicContact CG-CG 4.45Å; F660-L664 HydrophobicContact CZ-CD1 3.88Å; F660-L664 HydrophobicContact CZ-CD2 3.92Å; F660-L664 HydrophobicContact CZ-CG 4.11Å; F660-L664 VanDerWaalsContact O-CG 3.25Å; F660-L664 WeakPolarHBondContact O-CG 3.18Å; F660-L664 PolarHBondContact O-N 3.44Å; F660-F671 HydrophobicContact CE1-CE2 4.29Å; F660-F671 HydrophobicContact CZ-CE2 4.48Å
661	N	92.5	Very high	89.4	Confident	36 Å²	36	56.8 Å²	56.8	19%	0.193	26%	0.259	C	S	.	.	H	α-helix	trans	-57.1	-47.3	175.8	-76.3	27.9	0	0	0	111.6	Y207 K657 Y663 L664 E665 F672	Y207-N661 PolarHBondContact OH-OD1 2.84Å; K657-N661 WeakPolarHBondContact O-CB 3.46Å; K657-N661 VanDerWaalsContact O-CG 3.26Å; K657-N661 PolarHBondContact O-N 3.16Å; K657-N661 PolarHBondContact O-OD1 2.83Å; K657-N661 VanDerWaalsContact O-OD1 3.05Å; N661-Y663 PolarHBondContact O-N 3.14Å; N661-L664 WeakPolarHBondContact O-CB 3.4Å; N661-L664 PolarHBondContact O-N 2.86Å; N661-E665 WeakPolarHBondContact O-CG 3.22Å; N661-E665 PolarHBondContact O-N 3.23Å; N661-F672 HydrophobicContact CB-CE2 4.34Å; N661-F672 VanDerWaalsContact CG-CE2 3.42Å; N661-F672 VanDerWaalsContact ND2-CE2 3.27Å; N661-F672 WeakPolarHBondContact ND2-CE2 3.21Å; N661-F672 WeakPolarHBondContact ND2-CZ 3.4Å; N661-F672 WeakPolarHBondContact OD1-CE2 3.41Å; N661-F672 WeakPolarHBondContact OD1-CZ 3.16Å
662	K	92.8	Very high	87.4	Confident	94 Å²	94	57.5 Å²	57.5	41%	0.409	26%	0.264	S	S	.	.	H	α-helix	trans	-58.4	-45.7	175	-170.7	-151	166.9	-126.9	0	111.9	Y373 K658 L659 F660 L664 E665 E666	Y373-K662 PolarHBondContact OH-NZ 3.11Å; K658-K662 PolarHBondContact O-N 2.74Å; L659-K662 PolarHBondContact O-N 2.96Å; F660-K662 PolarHBondContact O-N 2.88Å; K662-L664 VanDerWaalsContact C-N 3.31Å; K662-L664 PolarHBondContact O-N 3.25Å; K662-E665 WeakPolarHBondContact O-CB 3.22Å; K662-E665 PolarHBondContact O-N 3.04Å; K662-E666 VanDerWaalsContact CE-CD 3.5Å; K662-E666 WeakPolarHBondContact CE-OE1 3.31Å; K662-E666 WeakPolarHBondContact CE-OE2 3.31Å; K662-E666 IonicContact NZ-OE1 2.74Å; K662-E666 PolarHBondContact NZ-OE1 3.47Å; K662-E666 IonicContact NZ-OE2 3.2Å; K662-E666 PolarHBondContact NZ-OE2 3.05Å; K662-E666 WeakPolarHBondContact O-CG 3.49Å; K662-E666 PolarHBondContact O-N 2.91Å
663	Y	94.9	Very high	84.7	Confident	5 Å²	5	65.5 Å²	65.5	2%	0.02	32%	0.32	C	S	.	.	H	α-helix	trans	-62.6	-35.5	177.5	157.8	-99.7	0	0	0	112.9	L598 P599 P600 P601 F604 P609 F613 L659 F660 N661 N667	L598-Y663 HydrophobicContact CB-CD2 4.09Å; L598-Y663 HydrophobicContact CB-CE2 3.75Å; L598-Y663 HydrophobicContact CD1-CD2 3.82Å; L598-Y663 HydrophobicContact CD1-CE2 4.19Å; P599-Y663 WeakPolarHBondContact O-CE2 3.28Å; P599-Y663 PolarHBondContact O-OH 3.45Å; P600-Y663 VanDerWaalsContact C-OH 3.27Å; P601-Y663 VanDerWaalsContact CA-OH 3.28Å; P601-Y663 WeakPolarHBondContact CA-OH 3.46Å; P601-Y663 HydrophobicContact CB-CE1 4.3Å; P601-Y663 HydrophobicContact CG-CE1 3.81Å; P601-Y663 VanDerWaalsContact N-OH 3.14Å; F604-Y663 WeakPolarHBondContact CB-OH 3.17Å; F604-Y663 HydrophobicContact CD1-CE1 4.36Å; F604-Y663 HydrophobicContact CD1-CE2 4.03Å; F604-Y663 AromaticContact CD1-CZ 3.7Å; F604-Y663 WeakPolarHBondContact CD1-OH 3.27Å; F604-Y663 HydrophobicContact CE1-CE2 4.36Å; P609-Y663 HydrophobicContact CB-CE1 4.2Å; F613-Y663 AromaticContact CE2-CD1 3.59Å; F613-Y663 HydrophobicContact CE2-CD1 3.59Å; F613-Y663 HydrophobicContact CE2-CE1 4.01Å; F613-Y663 AromaticContact CE2-CG 3.86Å; F613-Y663 HydrophobicContact CE2-CG 3.86Å; F613-Y663 VanDerWaalsContact CZ-CB 3.49Å; F613-Y663 AromaticContact CZ-CD1 3.74Å; F613-Y663 HydrophobicContact CZ-CD1 3.74Å; F613-Y663 HydrophobicContact CZ-CD2 4.1Å; F613-Y663 HydrophobicContact CZ-CE1 4.48Å; F613-Y663 AromaticContact CZ-CG 3.5Å; F613-Y663 HydrophobicContact CZ-CG 3.5Å; L659-Y663 PolarHBondContact O-N 3Å; L659-Y663 VanDerWaalsContact O-N 3.09Å; F660-Y663 AromaticContact CD2-CD1 3.72Å; F660-Y663 HydrophobicContact CD2-CD1 3.72Å; F660-Y663 HydrophobicContact CD2-CE1 4.21Å; F660-Y663 AromaticContact CE2-CD1 3.9Å; F660-Y663 HydrophobicContact CE2-CD1 3.9Å; F660-Y663 AromaticContact CE2-CE1 3.95Å; F660-Y663 HydrophobicContact CE2-CE1 3.95Å; F660-Y663 PolarHBondContact O-N 3.27Å; N661-Y663 PolarHBondContact O-N 3.14Å; Y663-N667 WeakPolarHBondContact CD2-ND2 3.49Å; Y663-N667 VanDerWaalsContact CE2-ND2 3.31Å; Y663-N667 WeakPolarHBondContact CE2-ND2 3.5Å; Y663-N667 PolarHBondContact O-N 2.91Å; Y663-N667 VanDerWaalsContact O-N 3.12Å; Y663-N667 PolarHBondContact O-ND2 2.96Å
664	L	91.5	Very high	84.2	Confident	1 Å²	1	68 Å²	68	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-68.6	-44	174.7	-68.3	162.1	0	0	0	111.4	P601 F660 N661 K662 E666 N667 N668 F669 F671	P601-L664 HydrophobicContact CB-CD2 4.4Å; P601-L664 HydrophobicContact CG-CD2 3.95Å; F660-L664 HydrophobicContact CD1-CD1 3.69Å; F660-L664 HydrophobicContact CD1-CG 4.48Å; F660-L664 HydrophobicContact CD2-CD1 4.3Å; F660-L664 HydrophobicContact CD2-CG 4.23Å; F660-L664 HydrophobicContact CE1-CD1 3.62Å; F660-L664 HydrophobicContact CE1-CD2 4.49Å; F660-L664 HydrophobicContact CE1-CG 4.34Å; F660-L664 HydrophobicContact CE2-CD1 4.2Å; F660-L664 HydrophobicContact CE2-CD2 4.01Å; F660-L664 HydrophobicContact CE2-CG 4.04Å; F660-L664 HydrophobicContact CG-CD1 4.06Å; F660-L664 HydrophobicContact CG-CG 4.45Å; F660-L664 HydrophobicContact CZ-CD1 3.88Å; F660-L664 HydrophobicContact CZ-CD2 3.92Å; F660-L664 HydrophobicContact CZ-CG 4.11Å; F660-L664 VanDerWaalsContact O-CG 3.25Å; F660-L664 WeakPolarHBondContact O-CG 3.18Å; F660-L664 PolarHBondContact O-N 3.44Å; N661-L664 WeakPolarHBondContact O-CB 3.4Å; N661-L664 PolarHBondContact O-N 2.86Å; K662-L664 VanDerWaalsContact C-N 3.31Å; K662-L664 PolarHBondContact O-N 3.25Å; L664-E666 VanDerWaalsContact C-N 3.33Å; L664-E666 PolarHBondContact O-N 3.01Å; L664-N667 CarbonylContact O-C 3.36Å; L664-N667 PolarHBondContact O-N 3.08Å; L664-N667 VanDerWaalsContact O-N 3.07Å; L664-N668 PolarHBondContact O-N 2.9Å; L664-N668 VanDerWaalsContact O-N 3.07Å; L664-F669 HydrophobicContact CB-CB 3.97Å; L664-F669 HydrophobicContact CD2-CB 3.61Å; L664-F669 HydrophobicContact CD2-CD1 4.15Å; L664-F669 HydrophobicContact CD2-CG 4.1Å; L664-F669 HydrophobicContact CG-CB 4.41Å; L664-F669 PolarHBondContact O-N 3.16Å; L664-F671 HydrophobicContact CD1-CD2 3.5Å; L664-F671 VanDerWaalsContact CD1-CD2 3.5Å; L664-F671 HydrophobicContact CD1-CE2 3.47Å; L664-F671 VanDerWaalsContact CD1-CE2 3.47Å; L664-F671 HydrophobicContact CD2-CD2 4.37Å; L664-F671 HydrophobicContact CD2-CE2 3.68Å; L664-F671 HydrophobicContact CD2-CZ 4.08Å; L664-F671 HydrophobicContact CG-CE2 4.23Å
665	E	89.2	Confident	83.6	Confident	129 Å²	129	65.4 Å²	65.4	60%	0.603	33%	0.326	S	S	*	.	H	α-helix	trans	-56.4	-46.6	173	-69.8	160.9	-155.9	0	0	111	N661 K662 N667 N668	N661-E665 WeakPolarHBondContact O-CG 3.22Å; N661-E665 PolarHBondContact O-N 3.23Å; K662-E665 WeakPolarHBondContact O-CB 3.22Å; K662-E665 PolarHBondContact O-N 3.04Å; E665-N667 PolarHBondContact O-N 2.85Å; E665-N668 PolarHBondContact O-N 3Å
666	E	89.4	Confident	82.9	Confident	86 Å²	86	65.9 Å²	65.9	40%	0.402	33%	0.332	S	S	.	.	H	α-helix	trans	-62.3	-26.6	176.2	-71.9	175.1	138.2	0	0	113.1	Y373 K662 L664	Y373-E666 PolarHBondContact OH-OE1 2.81Å; Y373-E666 PolarHBondContact OH-OE2 3.26Å; K662-E666 VanDerWaalsContact CE-CD 3.5Å; K662-E666 WeakPolarHBondContact CE-OE1 3.31Å; K662-E666 WeakPolarHBondContact CE-OE2 3.31Å; K662-E666 IonicContact NZ-OE1 2.74Å; K662-E666 PolarHBondContact NZ-OE1 3.47Å; K662-E666 IonicContact NZ-OE2 3.2Å; K662-E666 PolarHBondContact NZ-OE2 3.05Å; K662-E666 WeakPolarHBondContact O-CG 3.49Å; K662-E666 PolarHBondContact O-N 2.91Å; L664-E666 VanDerWaalsContact C-N 3.33Å; L664-E666 PolarHBondContact O-N 3.01Å
667	N	85.6	Confident	82	Confident	30 Å²	30	69.8 Å²	69.8	16%	0.16	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	6.9	175.1	-78.7	-94.7	0	0	0	113.8	P600 P601 Y663 L664 E665 F669	P600-N667 WeakPolarHBondContact CA-OD1 3.31Å; P601-N667 HydrophobicContact CG-CB 4.28Å; Y663-N667 WeakPolarHBondContact CD2-ND2 3.49Å; Y663-N667 VanDerWaalsContact CE2-ND2 3.31Å; Y663-N667 WeakPolarHBondContact CE2-ND2 3.5Å; Y663-N667 PolarHBondContact O-N 2.91Å; Y663-N667 VanDerWaalsContact O-N 3.12Å; Y663-N667 PolarHBondContact O-ND2 2.96Å; L664-N667 CarbonylContact O-C 3.36Å; L664-N667 PolarHBondContact O-N 3.08Å; L664-N667 VanDerWaalsContact O-N 3.07Å; E665-N667 PolarHBondContact O-N 2.85Å; N667-F669 HydrophobicContact CB-CD2 4.18Å; N667-F669 PolarHBondContact O-N 2.93Å
668	N	81.4	Confident	81.2	Confident	144 Å²	144	72.3 Å²	72.3	77%	0.77	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	19.3	-173.2	-54.3	-88.7	0	0	0	114.8	L664 E665 Q670	L664-N668 PolarHBondContact O-N 2.9Å; L664-N668 VanDerWaalsContact O-N 3.07Å; E665-N668 PolarHBondContact O-N 3Å; N668-Q670 PolarHBondContact O-N 3.3Å
669	F	75.9	Confident	80.2	Confident	40 Å²	40	68.2 Å²	68.2	18%	0.175	35%	0.351	C	S	.	.			trans	-80	98	173.7	-93.2	-116	0	0	0	110.4	N427 P601 L664 N667 F671	N427-F669 HydrophobicContact CB-CD1 4.06Å; N427-F669 HydrophobicContact CB-CE1 3.75Å; P601-F669 HydrophobicContact CB-CD1 4.27Å; P601-F669 HydrophobicContact CB-CE1 3.99Å; P601-F669 HydrophobicContact CB-CE2 4.4Å; P601-F669 HydrophobicContact CB-CZ 4.06Å; P601-F669 HydrophobicContact CG-CD1 4.06Å; P601-F669 HydrophobicContact CG-CD2 3.78Å; P601-F669 HydrophobicContact CG-CE1 4.11Å; P601-F669 HydrophobicContact CG-CE2 3.84Å; P601-F669 HydrophobicContact CG-CG 3.9Å; P601-F669 HydrophobicContact CG-CZ 4Å; L664-F669 HydrophobicContact CB-CB 3.97Å; L664-F669 HydrophobicContact CD2-CB 3.61Å; L664-F669 HydrophobicContact CD2-CD1 4.15Å; L664-F669 HydrophobicContact CD2-CG 4.1Å; L664-F669 HydrophobicContact CG-CB 4.41Å; L664-F669 PolarHBondContact O-N 3.16Å; N667-F669 HydrophobicContact CB-CD2 4.18Å; N667-F669 PolarHBondContact O-N 2.93Å; F669-F671 HydrophobicContact CD1-CE1 4.22Å; F669-F671 HydrophobicContact CD1-CZ 4.14Å; F669-F671 PolarHBondContact O-N 3.48Å
670	Q	64	Low	79.1	Confident	150 Å²	150	70.1 Å²	70.1	70%	0.701	36%	0.36	S	S	*	.			trans	-83	111.9	172.1	-65.8	-173.9	-7	0	0	110.8	N427 N668	N427-Q670 PolarHBondContact ND2-O 3.35Å; N668-Q670 PolarHBondContact O-N 3.3Å
671	F	62.9	Low	77.8	Confident	18 Å²	18	75.5 Å²	75.5	8%	0.079	39%	0.388	C	S	.	.	S	Bend	trans	-104	-18.4	159.4	-61	-33.6	0	0	0	112.4	L204 L423 V424 N427 F660 L664 F669	L204-F671 HydrophobicContact CD1-CB 4.08Å; L204-F671 WeakPolarHBondContact CD2-O 3.17Å; L423-F671 HydrophobicContact CB-CD1 4.11Å; L423-F671 HydrophobicContact CB-CD2 4.37Å; L423-F671 HydrophobicContact CB-CE1 3.67Å; L423-F671 HydrophobicContact CB-CE2 3.96Å; L423-F671 HydrophobicContact CB-CG 4.46Å; L423-F671 HydrophobicContact CB-CZ 3.6Å; L423-F671 HydrophobicContact CD1-CD2 4.42Å; L423-F671 HydrophobicContact CD2-CD1 4.5Å; L423-F671 WeakPolarHBondContact O-CE1 3.45Å; V424-F671 HydrophobicContact CG2-CE2 4.3Å; V424-F671 HydrophobicContact CG2-CZ 3.87Å; N427-F671 HydrophobicContact CB-CE1 4.32Å; N427-F671 VanDerWaalsContact ND2-CE1 3.33Å; N427-F671 WeakPolarHBondContact ND2-CE1 3.25Å; F660-F671 HydrophobicContact CE1-CE2 4.29Å; F660-F671 HydrophobicContact CZ-CE2 4.48Å; L664-F671 HydrophobicContact CD1-CD2 3.5Å; L664-F671 VanDerWaalsContact CD1-CD2 3.5Å; L664-F671 HydrophobicContact CD1-CE2 3.47Å; L664-F671 VanDerWaalsContact CD1-CE2 3.47Å; L664-F671 HydrophobicContact CD2-CD2 4.37Å; L664-F671 HydrophobicContact CD2-CE2 3.68Å; L664-F671 HydrophobicContact CD2-CZ 4.08Å; L664-F671 HydrophobicContact CG-CE2 4.23Å; F669-F671 HydrophobicContact CD1-CE1 4.22Å; F669-F671 HydrophobicContact CD1-CZ 4.14Å; F669-F671 PolarHBondContact O-N 3.48Å
672	F	52.1	Low	76.5	Confident	81 Å²	81	78.8 Å²	78.8	36%	0.355	41%	0.405	S	S	.	.			trans	-123	80.5	-172.4	-41.8	-82.9	0	0	0	109.3	L204 Y207 L208 N661	L204-F672 HydrophobicContact CD1-CD1 3.78Å; L204-F672 HydrophobicContact CD1-CE1 3.45Å; L204-F672 VanDerWaalsContact CD1-CE1 3.45Å; L204-F672 HydrophobicContact CD1-CZ 4.21Å; Y207-F672 HydrophobicContact CD1-CE1 4.35Å; Y207-F672 HydrophobicContact CD1-CZ 4.25Å; Y207-F672 HydrophobicContact CE1-CE1 4.11Å; Y207-F672 AromaticContact CE1-CZ 3.68Å; Y207-F672 HydrophobicContact CE1-CZ 3.68Å; L208-F672 HydrophobicContact CD2-CE1 4.1Å; N661-F672 HydrophobicContact CB-CE2 4.34Å; N661-F672 VanDerWaalsContact CG-CE2 3.42Å; N661-F672 VanDerWaalsContact ND2-CE2 3.27Å; N661-F672 WeakPolarHBondContact ND2-CE2 3.21Å; N661-F672 WeakPolarHBondContact ND2-CZ 3.4Å; N661-F672 WeakPolarHBondContact OD1-CE2 3.41Å; N661-F672 WeakPolarHBondContact OD1-CZ 3.16Å
673	S	38.6	Very low	75	Confident	168 Å²	168	77.5 Å²	77.5	100%	1.175	40%	0.404	S	S	*	.			trans	-109.9	0	176.9	63.5	0	0	0	0	111.2

Retrieved 673 of 673 residues in 408.9 ms (Link to these results)

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